A0A087XFW5_POEFO Loading...

Opioid receptor, kappa 1

AlphaFold DB , UniProt , Accession A0A087XFW5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 317 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
1I77.5Confident85.6Confident183 Ų18360.5 Ų60.594%0.93836%0.358SS*.  0-56.80-61.6173.3000111V3 A4 V5I1-V3 PolarHBondContact O-N 3.43Å; I1-A4 WeakPolarHBondContact O-CB 3.26Å; I1-A4 PolarHBondContact O-N 3.49Å; I1-V5 HydrophobicContact CG2-CG2 4.46Å; I1-V5 PolarHBondContact O-N 3Å
2I79.3Confident85.9Confident18 Ų1860.4 Ų60.49%0.09236%0.358CS..Hα-helixtrans-53.8-49.2-179.1-69.1163.5000112.6A4 V5 Y6 Y59 F251I2-A4 VanDerWaalsContact C-N 3.29Å; I2-A4 PolarHBondContact O-N 3.27Å; I2-V5 WeakPolarHBondContact O-CA 3.4Å; I2-V5 WeakPolarHBondContact O-CB 3.43Å; I2-V5 PolarHBondContact O-N 3.35Å; I2-Y6 HydrophobicContact CG2-CD1 4.47Å; I2-Y6 HydrophobicContact CG2-CD2 4.21Å; I2-Y6 HydrophobicContact CG2-CE1 4.17Å; I2-Y6 HydrophobicContact CG2-CE2 3.88Å; I2-Y6 HydrophobicContact CG2-CG 4.5Å; I2-Y6 PolarHBondContact O-N 3.14Å; I2-Y59 HydrophobicContact CB-CE1 4.16Å; I2-Y59 HydrophobicContact CD1-CE1 4.34Å; I2-Y59 HydrophobicContact CD1-CE2 3.71Å; I2-Y59 HydrophobicContact CG2-CD1 4.43Å; I2-Y59 HydrophobicContact CG2-CG 4.5Å; I2-F251 HydrophobicContact CD1-CB 3.9Å; I2-F251 HydrophobicContact CG2-CB 4.43Å
3V84.4Confident86.1Confident38 Ų3855.8 Ų55.823%0.2333%0.331CS..Hα-helixtrans-58.4-39176.4178.30000112.7I1 V5 Y6 S7 Y59 L60I1-V3 PolarHBondContact O-N 3.43Å; V3-V5 VanDerWaalsContact C-N 3.35Å; V3-Y6 PolarHBondContact O-N 2.75Å; V3-S7 WeakPolarHBondContact O-CB 3.41Å; V3-S7 PolarHBondContact O-N 3.27Å; V3-S7 PolarHBondContact O-OG 3.07Å; V3-S7 VanDerWaalsContact O-OG 3.04Å; V3-Y59 HydrophobicContact CG2-CD1 3.98Å; V3-Y59 HydrophobicContact CG2-CE1 4.5Å; V3-L60 HydrophobicContact CG1-CD1 4.44Å; V3-L60 HydrophobicContact CG2-CD1 4Å; V3-L60 HydrophobicContact CG2-CD2 3.84Å; V3-L60 HydrophobicContact CG2-CG 3.73Å
4A86.3Confident86.4Confident62 Ų6255.3 Ų55.351%0.51233%0.325SS..Hα-helixtrans-66-39.6176.800000111.3I1 I2 S7 V8I1-A4 WeakPolarHBondContact O-CB 3.26Å; I1-A4 PolarHBondContact O-N 3.49Å; I2-A4 VanDerWaalsContact C-N 3.29Å; I2-A4 PolarHBondContact O-N 3.27Å; A4-S7 PolarHBondContact O-N 3.02Å; A4-V8 WeakPolarHBondContact O-CG2 3.45Å; A4-V8 PolarHBondContact O-N 3.43Å; A4-V8 VanDerWaalsContact O-N 3.08Å
5V85.3Confident86.7Confident56 Ų5657.9 Ų57.934%0.33934%0.342SS..Hα-helixtrans-63.2-47.6174.1176.30000110.4I1 I2 V3 S7 V8 V9 A255I1-V5 HydrophobicContact CG2-CG2 4.46Å; I1-V5 PolarHBondContact O-N 3Å; I2-V5 WeakPolarHBondContact O-CA 3.4Å; I2-V5 WeakPolarHBondContact O-CB 3.43Å; I2-V5 PolarHBondContact O-N 3.35Å; V3-V5 VanDerWaalsContact C-N 3.35Å; V5-S7 PolarHBondContact O-N 3.22Å; V5-V8 PolarHBondContact O-N 3.44Å; V5-V9 HydrophobicContact CG1-CG2 4.19Å; V5-V9 WeakPolarHBondContact O-CB 3.35Å; V5-V9 VanDerWaalsContact O-CG2 3.26Å; V5-V9 WeakPolarHBondContact O-CG2 3.5Å; V5-V9 PolarHBondContact O-N 3.2Å; V5-A255 HydrophobicContact CG1-CB 4.3Å
6Y86.6Confident86.8Confident1 Ų154.9 Ų54.90%0.00433%0.327CS..Hα-helixtrans-60.6-41.6177.7-73.8-0.6000112.5I2 V3 V8 V9 F10 M52 Q55 S56 F251 A255I2-Y6 HydrophobicContact CG2-CD1 4.47Å; I2-Y6 HydrophobicContact CG2-CD2 4.21Å; I2-Y6 HydrophobicContact CG2-CE1 4.17Å; I2-Y6 HydrophobicContact CG2-CE2 3.88Å; I2-Y6 HydrophobicContact CG2-CG 4.5Å; I2-Y6 PolarHBondContact O-N 3.14Å; V3-Y6 PolarHBondContact O-N 2.75Å; Y6-V8 PolarHBondContact O-N 3.19Å; Y6-V9 PolarHBondContact O-N 3.26Å; Y6-F10 WeakPolarHBondContact O-CB 3.41Å; Y6-F10 PolarHBondContact O-N 3.22Å; Y6-M52 HydrophobicContact CD1-SD 4.42Å; Y6-M52 HydrophobicContact CG-SD 4.45Å; Y6-Q55 HydrophobicContact CD2-CB 4.31Å; Y6-Q55 HydrophobicContact CE2-CB 3.98Å; Y6-S56 WeakPolarHBondContact CB-OG 3.29Å; Y6-S56 WeakPolarHBondContact CD2-OG 3.36Å; Y6-F251 PolarHBondContact OH-O 3.05Å; Y6-A255 HydrophobicContact CD1-CB 4.19Å; Y6-A255 HydrophobicContact CE1-CB 3.46Å; Y6-A255 VanDerWaalsContact CE1-CB 3.46Å
7S87.6Confident87Confident60 Ų6051.8 Ų51.842%0.4231%0.308SS..Hα-helixtrans-62.2-42.1175.3-66.30000112.6V3 A4 V5 V11V3-S7 WeakPolarHBondContact O-CB 3.41Å; V3-S7 PolarHBondContact O-N 3.27Å; V3-S7 PolarHBondContact O-OG 3.07Å; V3-S7 VanDerWaalsContact O-OG 3.04Å; A4-S7 PolarHBondContact O-N 3.02Å; V5-S7 PolarHBondContact O-N 3.22Å; S7-V11 WeakPolarHBondContact O-CG2 3.4Å; S7-V11 PolarHBondContact O-N 3.39Å
8V88.1Confident87.3Confident94 Ų9451.9 Ų51.957%0.5731%0.312SS*.Hα-helixtrans-66.7-46.8176.4172.10000110.8A4 V5 Y6 F10 V11 V12A4-V8 WeakPolarHBondContact O-CG2 3.45Å; A4-V8 PolarHBondContact O-N 3.43Å; A4-V8 VanDerWaalsContact O-N 3.08Å; V5-V8 PolarHBondContact O-N 3.44Å; Y6-V8 PolarHBondContact O-N 3.19Å; V8-F10 VanDerWaalsContact C-N 3.29Å; V8-F10 PolarHBondContact O-N 3.22Å; V8-V11 PolarHBondContact O-N 2.89Å; V8-V12 HydrophobicContact CG1-CG2 4.17Å; V8-V12 WeakPolarHBondContact O-CB 3.46Å; V8-V12 VanDerWaalsContact O-CG2 3.3Å; V8-V12 WeakPolarHBondContact O-CG2 3.4Å; V8-V12 PolarHBondContact O-N 3.42Å
9V87.1Confident87.3Confident10 Ų1050.3 Ų50.36%0.06130%0.301CS..Hα-helixtrans-59.5-41.7177.8169.40000110.6V5 Y6 G13 S262V5-V9 HydrophobicContact CG1-CG2 4.19Å; V5-V9 WeakPolarHBondContact O-CB 3.35Å; V5-V9 VanDerWaalsContact O-CG2 3.26Å; V5-V9 WeakPolarHBondContact O-CG2 3.5Å; V5-V9 PolarHBondContact O-N 3.2Å; Y6-V9 PolarHBondContact O-N 3.26Å; V9-G13 VanDerWaalsContact O-CA 3.31Å; V9-G13 WeakPolarHBondContact O-CA 3.35Å; V9-G13 PolarHBondContact O-N 2.96Å; V9-S262 VanDerWaalsContact CG1-OG 3.29Å; V9-S262 WeakPolarHBondContact CG1-OG 3.13Å; V9-S262 PolarHBondContact O-OG 3.04Å
10F89.6Confident87.3Confident59 Ų5947.9 Ų47.926%0.25929%0.287SS..Hα-helixtrans-59.7-55.7175.1170.7-118.4000112Y6 V8 G13 L14 T49 M52 P53Y6-F10 WeakPolarHBondContact O-CB 3.41Å; Y6-F10 PolarHBondContact O-N 3.22Å; V8-F10 VanDerWaalsContact C-N 3.29Å; V8-F10 PolarHBondContact O-N 3.22Å; F10-G13 PolarHBondContact O-N 3.16Å; F10-L14 HydrophobicContact CE2-CB 4.4Å; F10-L14 HydrophobicContact CE2-CD2 3.78Å; F10-L14 HydrophobicContact CZ-CD2 3.86Å; F10-L14 WeakPolarHBondContact O-CB 3.42Å; F10-L14 PolarHBondContact O-N 2.97Å; F10-T49 WeakPolarHBondContact CD2-O 3.32Å; F10-M52 HydrophobicContact CB-CB 4.09Å; F10-M52 HydrophobicContact CB-CG 4.42Å; F10-P53 HydrophobicContact CD2-CG 4.42Å; F10-P53 HydrophobicContact CE2-CG 4.31Å; F10-P53 HydrophobicContact CZ-CG 4.37Å
11V90.4Very high87.5Confident84 Ų8447.3 Ų47.351%0.50928%0.281SS..Hα-helixtrans-63.4-49.4-176.5172.90000110.8S7 V8 V15S7-V11 WeakPolarHBondContact O-CG2 3.4Å; S7-V11 PolarHBondContact O-N 3.39Å; V8-V11 PolarHBondContact O-N 2.89Å; V11-V15 VanDerWaalsContact O-CB 3.3Å; V11-V15 WeakPolarHBondContact O-CB 3.31Å; V11-V15 VanDerWaalsContact O-CG2 3.24Å; V11-V15 WeakPolarHBondContact O-CG2 3.25Å; V11-V15 PolarHBondContact O-N 3.47Å; V11-V15 VanDerWaalsContact O-N 3.07Å
12V88.8Confident87.9Confident60 Ų6043.9 Ų43.936%0.36426%0.257SS..Hα-helixtrans-65.1-44.3-179.1174.90000110.8V8 G16 I266V8-V12 HydrophobicContact CG1-CG2 4.17Å; V8-V12 WeakPolarHBondContact O-CB 3.46Å; V8-V12 VanDerWaalsContact O-CG2 3.3Å; V8-V12 WeakPolarHBondContact O-CG2 3.4Å; V8-V12 PolarHBondContact O-N 3.42Å; V12-G16 WeakPolarHBondContact O-CA 3.42Å; V12-G16 PolarHBondContact O-N 3.17Å; V12-I266 HydrophobicContact CG1-CD1 4.21Å
13G88.3Confident88.2Confident0 Ų043.1 Ų43.10%025%0.254CS..Hα-helixtrans-66.5-48.1-178.200000112.2V9 F10 N17 S262V9-G13 VanDerWaalsContact O-CA 3.31Å; V9-G13 WeakPolarHBondContact O-CA 3.35Å; V9-G13 PolarHBondContact O-N 2.96Å; F10-G13 PolarHBondContact O-N 3.16Å; G13-N17 WeakPolarHBondContact O-CB 3.25Å; G13-N17 PolarHBondContact O-N 2.93Å; G13-N17 PolarHBondContact O-ND2 3.05Å; G13-S262 VanDerWaalsContact CA-OG 3.3Å; G13-S262 WeakPolarHBondContact CA-OG 3.3Å
14L91Very high88.2Confident49 Ų4941.7 Ų41.726%0.25725%0.245SC..Hα-helixtrans-66.6-50.9-179.1-17366.6000111.1F10 G16 C18 T50F10-L14 HydrophobicContact CE2-CB 4.4Å; F10-L14 HydrophobicContact CE2-CD2 3.78Å; F10-L14 HydrophobicContact CZ-CD2 3.86Å; F10-L14 WeakPolarHBondContact O-CB 3.42Å; F10-L14 PolarHBondContact O-N 2.97Å; L14-G16 PolarHBondContact O-N 2.93Å; L14-C18 WeakPolarHBondContact O-CB 3.46Å; L14-C18 PolarHBondContact O-N 3.18Å; L14-C18 PolarHBondContact O-SG 3.27Å; L14-T50 HydrophobicContact CD1-CG2 3.94Å
15V90.4Very high88.3Confident94 Ų9443.8 Ų43.857%0.5725%0.246SC*.Hα-helixtrans-63.4-46.1-179.5175.60000110.7V11 L19V11-V15 VanDerWaalsContact O-CB 3.3Å; V11-V15 WeakPolarHBondContact O-CB 3.31Å; V11-V15 VanDerWaalsContact O-CG2 3.24Å; V11-V15 WeakPolarHBondContact O-CG2 3.25Å; V11-V15 PolarHBondContact O-N 3.47Å; V11-V15 VanDerWaalsContact O-N 3.07Å; V15-L19 VanDerWaalsContact O-CB 3.3Å; V15-L19 WeakPolarHBondContact O-CB 3.34Å; V15-L19 PolarHBondContact O-N 2.63Å
16G88.4Confident88.3Confident11 Ų1146.8 Ų46.811%0.11325%0.251CS..Hα-helixtrans-63.1-49.7-178.800000112.7V12 L14 L19 V20V12-G16 WeakPolarHBondContact O-CA 3.42Å; V12-G16 PolarHBondContact O-N 3.17Å; L14-G16 PolarHBondContact O-N 2.93Å; G16-L19 PolarHBondContact O-N 2.96Å; G16-V20 WeakPolarHBondContact O-CG2 3.22Å; G16-V20 PolarHBondContact O-N 3Å
17N90.9Very high88Confident1 Ų148.5 Ų48.51%0.00526%0.258CS..Hα-helixtrans-70.5-37.7-178.3-73.1-61.9000112.2G13 L19 V20 M21 A42 D45 A46 S261 P265G13-N17 WeakPolarHBondContact O-CB 3.25Å; G13-N17 PolarHBondContact O-N 2.93Å; G13-N17 PolarHBondContact O-ND2 3.05Å; N17-L19 VanDerWaalsContact C-N 3.32Å; N17-L19 PolarHBondContact O-N 2.79Å; N17-V20 PolarHBondContact O-N 3.35Å; N17-M21 WeakPolarHBondContact O-CG 3.39Å; N17-M21 PolarHBondContact O-N 3.28Å; N17-A42 HydrophobicContact CB-CB 4.18Å; N17-D45 WeakPolarHBondContact ND2-CB 3.48Å; N17-A46 HydrophobicContact CB-CB 4.24Å; N17-S261 PolarHBondContact ND2-O 3.08Å; N17-S261 VanDerWaalsContact ND2-O 3.14Å; N17-P265 WeakPolarHBondContact OD1-CG 3.3Å
18C91Very high87.4Confident55 Ų5550.2 Ų50.237%0.37227%0.266SS..Hα-helixtrans-60.2-41.6172.1-74.70000112.3L14 M21 Y22L14-C18 WeakPolarHBondContact O-CB 3.46Å; L14-C18 PolarHBondContact O-N 3.18Å; L14-C18 PolarHBondContact O-SG 3.27Å; C18-M21 HydrophobicContact CB-CE 4.43Å; C18-M21 PolarHBondContact O-N 2.94Å; C18-Y22 WeakPolarHBondContact O-CB 3.49Å; C18-Y22 PolarHBondContact O-N 3.36Å
19L88.1Confident86.8Confident20 Ų2050.6 Ų50.611%0.10526%0.26CS..Hα-helixtrans-67.1-40177.3-176.952.2000112.1V15 G16 N17 Y22 V23 F279 F282V15-L19 VanDerWaalsContact O-CB 3.3Å; V15-L19 WeakPolarHBondContact O-CB 3.34Å; V15-L19 PolarHBondContact O-N 2.63Å; G16-L19 PolarHBondContact O-N 2.96Å; N17-L19 VanDerWaalsContact C-N 3.32Å; N17-L19 PolarHBondContact O-N 2.79Å; L19-Y22 HydrophobicContact CD1-CD1 4.28Å; L19-Y22 PolarHBondContact O-N 3.48Å; L19-V23 HydrophobicContact CD1-CG2 4.1Å; L19-V23 WeakPolarHBondContact O-CG2 2.93Å; L19-V23 PolarHBondContact O-N 3.17Å; L19-F279 HydrophobicContact CB-CE2 4.48Å; L19-F279 HydrophobicContact CD2-CD1 4.25Å; L19-F279 HydrophobicContact CD2-CD2 3.91Å; L19-F279 HydrophobicContact CD2-CE1 3.61Å; L19-F279 HydrophobicContact CD2-CE2 3.22Å; L19-F279 HydrophobicContact CD2-CG 4.4Å; L19-F279 HydrophobicContact CD2-CZ 3.07Å; L19-F279 HydrophobicContact CG-CD2 4.2Å; L19-F279 HydrophobicContact CG-CE2 3.65Å; L19-F279 HydrophobicContact CG-CZ 4.03Å; L19-F282 HydrophobicContact CD1-CD1 3.8Å; L19-F282 HydrophobicContact CD1-CD2 4.39Å; L19-F282 HydrophobicContact CD1-CE1 3.82Å; L19-F282 HydrophobicContact CD1-CE2 4.4Å; L19-F282 HydrophobicContact CD1-CG 4.09Å; L19-F282 HydrophobicContact CD1-CZ 4.13Å; L19-F282 HydrophobicContact CD2-CD1 4.31Å; L19-F282 HydrophobicContact CD2-CE1 4.4Å
20V87.8Confident86.2Confident3 Ų350.5 Ų50.52%0.01826%0.259CS..Hα-helixtrans-58.2-48.3172.7168.90000110.8G16 N17 Y22 V23 I24 I38 A42 P265 Y268 F275G16-V20 WeakPolarHBondContact O-CG2 3.22Å; G16-V20 PolarHBondContact O-N 3Å; N17-V20 PolarHBondContact O-N 3.35Å; V20-Y22 PolarHBondContact O-N 3.38Å; V20-V23 PolarHBondContact O-N 3.22Å; V20-I24 HydrophobicContact CG1-CD1 3.76Å; V20-I24 WeakPolarHBondContact O-CD1 3.44Å; V20-I24 VanDerWaalsContact O-CG1 3.29Å; V20-I24 WeakPolarHBondContact O-CG1 3.32Å; V20-I24 PolarHBondContact O-N 2.97Å; V20-I24 VanDerWaalsContact O-N 3.15Å; V20-I38 HydrophobicContact CG1-CG2 3.57Å; V20-A42 HydrophobicContact CB-CB 4.25Å; V20-A42 HydrophobicContact CG1-CB 3.89Å; V20-P265 HydrophobicContact CG2-CB 4.04Å; V20-P265 HydrophobicContact CG2-CG 4.36Å; V20-Y268 HydrophobicContact CG2-CD2 4.36Å; V20-F275 HydrophobicContact CG1-CE1 4.27Å
21M90Very high85.8Confident35 Ų3552.7 Ų52.717%0.17227%0.269CS..Hα-helixtrans-58.5-47.6176.3-71.4-171.1-69.700111.6N17 C18 I24 I25 F39 A42 V43 A46N17-M21 WeakPolarHBondContact O-CG 3.39Å; N17-M21 PolarHBondContact O-N 3.28Å; C18-M21 HydrophobicContact CB-CE 4.43Å; C18-M21 PolarHBondContact O-N 2.94Å; M21-I24 PolarHBondContact O-N 3.01Å; M21-I25 VanDerWaalsContact O-CG1 3.31Å; M21-I25 WeakPolarHBondContact O-CG1 3.34Å; M21-I25 PolarHBondContact O-N 2.69Å; M21-F39 HydrophobicContact CB-CD2 4.2Å; M21-F39 HydrophobicContact CB-CE2 3.78Å; M21-F39 HydrophobicContact CG-CD2 4.05Å; M21-F39 HydrophobicContact CG-CE2 3.81Å; M21-F39 HydrophobicContact CG-CZ 4.44Å; M21-F39 HydrophobicContact SD-CE2 4.45Å; M21-A42 HydrophobicContact CG-CB 3.75Å; M21-V43 HydrophobicContact CG-CG2 4.42Å; M21-V43 HydrophobicContact SD-CB 4.33Å; M21-V43 HydrophobicContact SD-CG2 3.5Å; M21-V43 VanDerWaalsContact SD-CG2 3.5Å; M21-A46 HydrophobicContact CE-CB 3.91Å
22Y87.8Confident85.5Confident111 Ų11151.7 Ų51.744%0.43526%0.263SS..Hα-helixtrans-58.8-49.8179.7174.5-101000112.5C18 L19 V20 I24 I25 R26 F282C18-Y22 WeakPolarHBondContact O-CB 3.49Å; C18-Y22 PolarHBondContact O-N 3.36Å; L19-Y22 HydrophobicContact CD1-CD1 4.28Å; L19-Y22 PolarHBondContact O-N 3.48Å; V20-Y22 PolarHBondContact O-N 3.38Å; Y22-I24 VanDerWaalsContact C-N 3.33Å; Y22-I24 PolarHBondContact O-N 3.29Å; Y22-I25 PolarHBondContact O-N 2.86Å; Y22-R26 HydrophobicContact CE1-CB 4.48Å; Y22-R26 VanDerWaalsContact O-CB 3.23Å; Y22-R26 WeakPolarHBondContact O-CB 3.39Å; Y22-R26 PolarHBondContact O-N 3.26Å; Y22-F282 HydrophobicContact CD1-CD2 4.4Å; Y22-F282 HydrophobicContact CD1-CE2 4.24Å; Y22-F282 AromaticContact CE1-CD2 3.87Å; Y22-F282 HydrophobicContact CE1-CD2 3.87Å; Y22-F282 AromaticContact CE1-CE2 3.79Å; Y22-F282 HydrophobicContact CE1-CE2 3.79Å
23V84.4Confident85.1Confident2 Ų249.1 Ų49.11%0.01225%0.248CC..Hα-helixtrans-59.2-43.9179.81680000110.9L19 V20 I25 R26 Y27 M30 F275 C278L19-V23 HydrophobicContact CD1-CG2 4.1Å; L19-V23 WeakPolarHBondContact O-CG2 2.93Å; L19-V23 PolarHBondContact O-N 3.17Å; V20-V23 PolarHBondContact O-N 3.22Å; V23-I25 PolarHBondContact O-N 3.38Å; V23-R26 PolarHBondContact O-N 3.01Å; V23-Y27 HydrophobicContact CB-CD2 4.47Å; V23-Y27 HydrophobicContact CG1-CD2 3.91Å; V23-Y27 HydrophobicContact CG1-CE2 4.34Å; V23-Y27 VanDerWaalsContact O-CD2 3.28Å; V23-Y27 WeakPolarHBondContact O-CD2 3.34Å; V23-Y27 PolarHBondContact O-N 3.41Å; V23-Y27 VanDerWaalsContact O-N 3.09Å; V23-M30 HydrophobicContact CG1-CE 4.22Å; V23-M30 HydrophobicContact CG1-CG 4.4Å; V23-F275 HydrophobicContact CG1-CE1 4.42Å; V23-C278 HydrophobicContact CG1-CB 3.73Å
24I85.6Confident84.9Confident8 Ų849.3 Ų49.34%0.04125%0.249CC..Hα-helixtrans-66.8-39.2-179-65.5164.8000111.6V20 M21 Y22 N35 I38 F39 F275V20-I24 HydrophobicContact CG1-CD1 3.76Å; V20-I24 WeakPolarHBondContact O-CD1 3.44Å; V20-I24 VanDerWaalsContact O-CG1 3.29Å; V20-I24 WeakPolarHBondContact O-CG1 3.32Å; V20-I24 PolarHBondContact O-N 2.97Å; V20-I24 VanDerWaalsContact O-N 3.15Å; M21-I24 PolarHBondContact O-N 3.01Å; Y22-I24 VanDerWaalsContact C-N 3.33Å; Y22-I24 PolarHBondContact O-N 3.29Å; I24-N35 HydrophobicContact CG1-CB 4.49Å; I24-I38 HydrophobicContact CD1-CB 4.38Å; I24-I38 HydrophobicContact CD1-CG2 3.97Å; I24-F39 HydrophobicContact CB-CD2 4.27Å; I24-F39 HydrophobicContact CD1-CB 3.99Å; I24-F39 HydrophobicContact CD1-CD2 4.43Å; I24-F39 HydrophobicContact CG2-CB 4.35Å; I24-F39 HydrophobicContact CG2-CD2 4.19Å; I24-F275 HydrophobicContact CD1-CZ 4.15Å; I24-F275 HydrophobicContact CG1-CE1 4.45Å; I24-F275 HydrophobicContact CG1-CZ 4.12Å
25I87.7Confident84.6Confident107 Ų10747.4 Ų47.455%0.54924%0.239SC..Hα-helixtrans-67.6-45.3177.6-68.4168.7000110.6M21 Y22 V23 K31 F39M21-I25 VanDerWaalsContact O-CG1 3.31Å; M21-I25 WeakPolarHBondContact O-CG1 3.34Å; M21-I25 PolarHBondContact O-N 2.69Å; Y22-I25 PolarHBondContact O-N 2.86Å; V23-I25 PolarHBondContact O-N 3.38Å; I25-K31 WeakPolarHBondContact O-CE 3.14Å; I25-F39 HydrophobicContact CD1-CE2 3.73Å; I25-F39 HydrophobicContact CD1-CZ 4.14Å; I25-F39 HydrophobicContact CG1-CE2 3.81Å; I25-F39 HydrophobicContact CG1-CZ 4.45Å
26R84.4Confident84.5Confident118 Ų11843.8 Ų43.845%0.44522%0.216SC..Hα-helixtrans-72.6-35.6-171.3-178.759.7-176.981.1-1.3113.9Y22 V23Y22-R26 HydrophobicContact CE1-CB 4.48Å; Y22-R26 VanDerWaalsContact O-CB 3.23Å; Y22-R26 WeakPolarHBondContact O-CB 3.39Å; Y22-R26 PolarHBondContact O-N 3.26Å; V23-R26 PolarHBondContact O-N 3.01Å
27Y80.2Confident84.5Confident38 Ų3843.5 Ų43.515%0.14921%0.212CC..  trans-105.5114.2-175.3-64.1-77000111.4V23 K29 M30 C278 C293V23-Y27 HydrophobicContact CB-CD2 4.47Å; V23-Y27 HydrophobicContact CG1-CD2 3.91Å; V23-Y27 HydrophobicContact CG1-CE2 4.34Å; V23-Y27 VanDerWaalsContact O-CD2 3.28Å; V23-Y27 WeakPolarHBondContact O-CD2 3.34Å; V23-Y27 PolarHBondContact O-N 3.41Å; V23-Y27 VanDerWaalsContact O-N 3.09Å; Y27-K29 VanDerWaalsContact C-N 3.27Å; Y27-K29 PolarHBondContact O-N 3.44Å; Y27-M30 WeakPolarHBondContact O-CB 3.41Å; Y27-M30 PolarHBondContact O-N 3.11Å; Y27-C278 HydrophobicContact CD2-CB 4.38Å; Y27-C278 HydrophobicContact CE2-CB 4.13Å; Y27-C293 HydrophobicContact CD1-CB 4.33Å
28T76.3Confident84.4Confident96 Ų9643.8 Ų43.859%0.58921%0.213SC*.G310 helixtrans-59.9-35.3-18047.40000113.1M30 K31T28-M30 PolarHBondContact O-N 2.88Å; T28-K31 WeakPolarHBondContact O-CB 3.2Å; T28-K31 PolarHBondContact O-N 3.38Å; T28-K31 VanDerWaalsContact O-N 3.08Å
29K74.9Confident84.3Confident101 Ų10144.1 Ų44.144%0.43921%0.209SC..G310 helixtrans-61.1-21.7174.2-66.8-169.1174.8-171.40113.4Y27 K31 D292 C293Y27-K29 VanDerWaalsContact C-N 3.27Å; Y27-K29 PolarHBondContact O-N 3.44Å; K29-K31 VanDerWaalsContact C-N 3.35Å; K29-D292 PolarHBondContact NZ-O 2.88Å; K29-C293 VanDerWaalsContact CE-O 3.25Å; K29-C293 WeakPolarHBondContact CE-O 3.33Å
30M74.8Confident84.5Confident8 Ų843.6 Ų43.64%0.03921%0.206CC..G310 helixtrans-86.7-1.9178.5-60.9-63.4-7800112.7V23 Y27 T28 T32 N35 N274 F275V23-M30 HydrophobicContact CG1-CE 4.22Å; V23-M30 HydrophobicContact CG1-CG 4.4Å; Y27-M30 WeakPolarHBondContact O-CB 3.41Å; Y27-M30 PolarHBondContact O-N 3.11Å; T28-M30 PolarHBondContact O-N 2.88Å; M30-T32 PolarHBondContact O-N 3.46Å; M30-N35 WeakPolarHBondContact O-CB 3.45Å; M30-N35 PolarHBondContact O-ND2 3.2Å; M30-N274 HydrophobicContact SD-CB 4.2Å; M30-F275 HydrophobicContact CE-CD1 4.04Å; M30-F275 HydrophobicContact CE-CD2 3.53Å; M30-F275 HydrophobicContact CE-CE1 3.87Å; M30-F275 HydrophobicContact CE-CE2 3.35Å; M30-F275 HydrophobicContact CE-CG 3.89Å; M30-F275 HydrophobicContact CE-CZ 3.54Å
31K80.3Confident84.6Confident106 Ų10643.4 Ų43.446%0.46121%0.205SC..  trans-83.949.5-179.7-61.1-178.3-178.8178.20112.7I25 T28 K29I25-K31 WeakPolarHBondContact O-CE 3.14Å; T28-K31 WeakPolarHBondContact O-CB 3.2Å; T28-K31 PolarHBondContact O-N 3.38Å; T28-K31 VanDerWaalsContact O-N 3.08Å; K29-K31 VanDerWaalsContact C-N 3.35Å
32T83.8Confident84.6Confident62 Ų6241.8 Ų41.838%0.3820%0.197SC..SBendtrans-87.4162.2176.669.10000111.3M30 T34 N35 I36M30-T32 PolarHBondContact O-N 3.46Å; T32-T34 VanDerWaalsContact C-N 3.31Å; T32-T34 PolarHBondContact O-N 2.79Å; T32-N35 PolarHBondContact O-N 2.95Å; T32-N35 WeakPolarHBondContact OG1-CB 3.5Å; T32-N35 PolarHBondContact OG1-N 2.85Å; T32-N35 PolarHBondContact OG1-ND2 2.77Å; T32-I36 WeakPolarHBondContact O-CG1 3.34Å; T32-I36 PolarHBondContact O-N 2.85Å
33A82.1Confident84.9Confident6 Ų638.3 Ų38.35%0.0519%0.187CC..Hα-helixtrans-55.7-43.8176.700000112.6N35 I36 Y37 R110 A115A33-N35 PolarHBondContact O-N 2.8Å; A33-I36 WeakPolarHBondContact O-CB 3.34Å; A33-I36 PolarHBondContact O-N 3.47Å; A33-Y37 VanDerWaalsContact O-CD2 3.32Å; A33-Y37 WeakPolarHBondContact O-CD2 3.31Å; A33-Y37 PolarHBondContact O-N 3.32Å; A33-R110 HydrophobicContact CB-CB 4.23Å; A33-R110 WeakPolarHBondContact CB-O 3.4Å; A33-A115 HydrophobicContact CB-CB 3.95Å
34T82.3Confident85.3Confident5 Ų538.3 Ų38.33%0.03119%0.187CC..Hα-helixtrans-64.6-41.1177-530000112.6T32 I36 Y37 I38 M92 D95 R110T32-T34 VanDerWaalsContact C-N 3.31Å; T32-T34 PolarHBondContact O-N 2.79Å; T34-I36 PolarHBondContact O-N 3.34Å; T34-Y37 WeakPolarHBondContact O-CB 3.47Å; T34-Y37 PolarHBondContact O-N 3.49Å; T34-Y37 VanDerWaalsContact O-N 3.11Å; T34-I38 HydrophobicContact CG2-CD1 4.24Å; T34-I38 WeakPolarHBondContact O-CG1 3.37Å; T34-I38 PolarHBondContact O-N 3.48Å; T34-M92 HydrophobicContact CG2-CE 4.35Å; T34-D95 PolarHBondContact OG1-OD2 3.46Å; T34-R110 PolarHBondContact OG1-NH2 2.9Å
35N85.4Confident85.5Confident8 Ų837.9 Ų37.94%0.04319%0.185CC..Hα-helixtrans-70.6-22.6-179.5-68.7-7.8000112.2I24 M30 T32 A33 I38 F39I24-N35 HydrophobicContact CG1-CB 4.49Å; M30-N35 WeakPolarHBondContact O-CB 3.45Å; M30-N35 PolarHBondContact O-ND2 3.2Å; T32-N35 PolarHBondContact O-N 2.95Å; T32-N35 WeakPolarHBondContact OG1-CB 3.5Å; T32-N35 PolarHBondContact OG1-N 2.85Å; T32-N35 PolarHBondContact OG1-ND2 2.77Å; A33-N35 PolarHBondContact O-N 2.8Å; N35-I38 PolarHBondContact O-N 2.8Å; N35-F39 WeakPolarHBondContact O-CB 3.43Å; N35-F39 PolarHBondContact O-N 3.34Å
36I89.4Confident85.7Confident19 Ų1933.3 Ų33.310%0.09716%0.163CC..Hα-helixtrans-68.7-36170.4-73162.4000111.4T32 A33 T34 N40 P112 A115 K116 N119T32-I36 WeakPolarHBondContact O-CG1 3.34Å; T32-I36 PolarHBondContact O-N 2.85Å; A33-I36 WeakPolarHBondContact O-CB 3.34Å; A33-I36 PolarHBondContact O-N 3.47Å; T34-I36 PolarHBondContact O-N 3.34Å; I36-N40 PolarHBondContact O-N 3.32Å; I36-N40 VanDerWaalsContact O-N 3.13Å; I36-P112 HydrophobicContact CD1-CB 3.59Å; I36-A115 HydrophobicContact CB-CB 4.04Å; I36-A115 HydrophobicContact CD1-CB 4.32Å; I36-A115 HydrophobicContact CG2-CB 3.81Å; I36-K116 HydrophobicContact CD1-CG 4.32Å; I36-K116 HydrophobicContact CG2-CG 4.11Å; I36-N119 WeakPolarHBondContact CG2-ND2 3.23Å; I36-N119 PolarHBondContact O-ND2 3.43Å
37Y88.1Confident86.1Confident4 Ų431.4 Ų31.42%0.01616%0.161CC..Hα-helixtrans-68-43170.1-62.5-56.4000111.7A33 T34 F39 N40 L41 T88 M91 M92 D95 A115 I118 N119A33-Y37 VanDerWaalsContact O-CD2 3.32Å; A33-Y37 WeakPolarHBondContact O-CD2 3.31Å; A33-Y37 PolarHBondContact O-N 3.32Å; T34-Y37 WeakPolarHBondContact O-CB 3.47Å; T34-Y37 PolarHBondContact O-N 3.49Å; T34-Y37 VanDerWaalsContact O-N 3.11Å; Y37-F39 VanDerWaalsContact C-N 3.28Å; Y37-F39 PolarHBondContact O-N 3.19Å; Y37-N40 VanDerWaalsContact O-CB 3.32Å; Y37-N40 WeakPolarHBondContact O-CB 3.26Å; Y37-N40 PolarHBondContact O-N 3.36Å; Y37-N40 VanDerWaalsContact O-N 3.11Å; Y37-L41 PolarHBondContact O-N 2.97Å; Y37-T88 WeakPolarHBondContact O-CG2 3.48Å; Y37-M91 HydrophobicContact CE1-CB 4.31Å; Y37-M92 HydrophobicContact CD2-CG 4.35Å; Y37-M92 HydrophobicContact CG-CG 4.17Å; Y37-D95 HydrophobicContact CE2-CB 4.26Å; Y37-A115 HydrophobicContact CE1-CB 4.4Å; Y37-A115 HydrophobicContact CE2-CB 4.29Å; Y37-I118 HydrophobicContact CE1-CB 4.1Å; Y37-I118 HydrophobicContact CE1-CG2 3.72Å; Y37-I118 WeakPolarHBondContact OH-CD1 3.38Å; Y37-N119 WeakPolarHBondContact CD1-OD1 3.08Å
38I87.4Confident86.6Confident7 Ų729.6 Ų29.64%0.03615%0.154CC..Hα-helixtrans-59.8-41.1175.9-67.6173.1000111V20 I24 T34 N35 N40 L41 A42 M92 Y268 F275V20-I38 HydrophobicContact CG1-CG2 3.57Å; I24-I38 HydrophobicContact CD1-CB 4.38Å; I24-I38 HydrophobicContact CD1-CG2 3.97Å; T34-I38 HydrophobicContact CG2-CD1 4.24Å; T34-I38 WeakPolarHBondContact O-CG1 3.37Å; T34-I38 PolarHBondContact O-N 3.48Å; N35-I38 PolarHBondContact O-N 2.8Å; I38-N40 VanDerWaalsContact C-N 3.34Å; I38-N40 PolarHBondContact O-N 3.49Å; I38-L41 PolarHBondContact O-N 2.83Å; I38-A42 WeakPolarHBondContact O-CB 3.31Å; I38-A42 PolarHBondContact O-N 3Å; I38-M92 HydrophobicContact CD1-CE 4.29Å; I38-M92 HydrophobicContact CG1-CE 3.66Å; I38-M92 HydrophobicContact CG1-SD 4.43Å; I38-Y268 HydrophobicContact CB-CE2 4.41Å; I38-Y268 HydrophobicContact CD1-CD1 4.09Å; I38-Y268 HydrophobicContact CD1-CE1 3.98Å; I38-Y268 HydrophobicContact CG1-CE1 3.96Å; I38-Y268 HydrophobicContact CG1-CE2 4.33Å; I38-Y268 HydrophobicContact CG2-CD2 3.79Å; I38-Y268 HydrophobicContact CG2-CE2 3.47Å; I38-Y268 VanDerWaalsContact CG2-CE2 3.47Å; I38-Y268 HydrophobicContact CG2-CG 4.45Å; I38-F275 HydrophobicContact CD1-CE2 4.17Å; I38-F275 HydrophobicContact CD1-CZ 4.48Å; I38-F275 HydrophobicContact CG2-CZ 4.25Å
39F90.8Very high87.3Confident62 Ų6225 Ų2527%0.27213%0.127SC..Hα-helixtrans-60.3-44.3174.9-176.4-91.4000111.6M21 I24 I25 N35 Y37 L41 A42 V43M21-F39 HydrophobicContact CB-CD2 4.2Å; M21-F39 HydrophobicContact CB-CE2 3.78Å; M21-F39 HydrophobicContact CG-CD2 4.05Å; M21-F39 HydrophobicContact CG-CE2 3.81Å; M21-F39 HydrophobicContact CG-CZ 4.44Å; M21-F39 HydrophobicContact SD-CE2 4.45Å; I24-F39 HydrophobicContact CB-CD2 4.27Å; I24-F39 HydrophobicContact CD1-CB 3.99Å; I24-F39 HydrophobicContact CD1-CD2 4.43Å; I24-F39 HydrophobicContact CG2-CB 4.35Å; I24-F39 HydrophobicContact CG2-CD2 4.19Å; I25-F39 HydrophobicContact CD1-CE2 3.73Å; I25-F39 HydrophobicContact CD1-CZ 4.14Å; I25-F39 HydrophobicContact CG1-CE2 3.81Å; I25-F39 HydrophobicContact CG1-CZ 4.45Å; N35-F39 WeakPolarHBondContact O-CB 3.43Å; N35-F39 PolarHBondContact O-N 3.34Å; Y37-F39 VanDerWaalsContact C-N 3.28Å; Y37-F39 PolarHBondContact O-N 3.19Å; F39-L41 VanDerWaalsContact C-N 3.34Å; F39-L41 PolarHBondContact O-N 2.88Å; F39-A42 PolarHBondContact O-N 3.25Å; F39-V43 HydrophobicContact CD1-CG2 4.09Å; F39-V43 HydrophobicContact CE1-CG2 3.67Å; F39-V43 HydrophobicContact CZ-CG2 4.03Å; F39-V43 WeakPolarHBondContact O-CG2 3.39Å; F39-V43 PolarHBondContact O-N 3.11Å
40N91.6Very high88Confident9 Ų923 Ų235%0.04812%0.123CC..Hα-helixtrans-59.2-45.5177-164.360.5000112.3I36 Y37 I38 V43 A44 T84 T88 W123I36-N40 PolarHBondContact O-N 3.32Å; I36-N40 VanDerWaalsContact O-N 3.13Å; Y37-N40 VanDerWaalsContact O-CB 3.32Å; Y37-N40 WeakPolarHBondContact O-CB 3.26Å; Y37-N40 PolarHBondContact O-N 3.36Å; Y37-N40 VanDerWaalsContact O-N 3.11Å; I38-N40 VanDerWaalsContact C-N 3.34Å; I38-N40 PolarHBondContact O-N 3.49Å; N40-V43 PolarHBondContact O-N 3.42Å; N40-A44 PolarHBondContact O-N 2.94Å; N40-A44 VanDerWaalsContact O-N 3.08Å; N40-T84 VanDerWaalsContact ND2-CG2 3.34Å; N40-T84 WeakPolarHBondContact ND2-CG2 3.41Å; N40-T88 HydrophobicContact CB-CG2 4.44Å; N40-T88 PolarHBondContact ND2-OG1 3.25Å; N40-W123 PolarHBondContact OD1-NE1 3.45Å
41L88.9Confident88.7Confident0 Ų022.9 Ų22.90%012%0.122CC..Hα-helixtrans-63.3-43.7177.5-16765.6000111.1Y37 I38 F39 V43 A44 D45 S85 T88 L89 N264 Y268Y37-L41 PolarHBondContact O-N 2.97Å; I38-L41 PolarHBondContact O-N 2.83Å; F39-L41 VanDerWaalsContact C-N 3.34Å; F39-L41 PolarHBondContact O-N 2.88Å; L41-V43 VanDerWaalsContact C-N 3.31Å; L41-V43 PolarHBondContact O-N 3.27Å; L41-A44 PolarHBondContact O-N 3.35Å; L41-D45 WeakPolarHBondContact O-CB 3.29Å; L41-D45 VanDerWaalsContact O-CG 3.31Å; L41-D45 PolarHBondContact O-N 3.09Å; L41-S85 VanDerWaalsContact CD1-CA 3.47Å; L41-T88 HydrophobicContact CB-CG2 4.15Å; L41-L89 HydrophobicContact CD2-CD2 4.19Å; L41-N264 HydrophobicContact CD2-CB 4.24Å; L41-N264 WeakPolarHBondContact CD2-ND2 3.23Å; L41-Y268 WeakPolarHBondContact CD2-OH 3.49Å
42A91.1Very high89.1Confident1 Ų117.9 Ų17.91%0.00810%0.101CC..Hα-helixtrans-63-35.6177.700000112.8N17 V20 M21 I38 F39 A46N17-A42 HydrophobicContact CB-CB 4.18Å; V20-A42 HydrophobicContact CB-CB 4.25Å; V20-A42 HydrophobicContact CG1-CB 3.89Å; M21-A42 HydrophobicContact CG-CB 3.75Å; I38-A42 WeakPolarHBondContact O-CB 3.31Å; I38-A42 PolarHBondContact O-N 3Å; F39-A42 PolarHBondContact O-N 3.25Å; A42-A46 WeakPolarHBondContact O-CB 3.28Å; A42-A46 PolarHBondContact O-N 2.89Å
43V92.9Very high89.4Confident38 Ų3817.5 Ų17.523%0.2310%0.099CC..Hα-helixtrans-64.2-50.5172.6171.50000110.4M21 F39 N40 L41 D45 A46 L47 W123M21-V43 HydrophobicContact CG-CG2 4.42Å; M21-V43 HydrophobicContact SD-CB 4.33Å; M21-V43 HydrophobicContact SD-CG2 3.5Å; M21-V43 VanDerWaalsContact SD-CG2 3.5Å; F39-V43 HydrophobicContact CD1-CG2 4.09Å; F39-V43 HydrophobicContact CE1-CG2 3.67Å; F39-V43 HydrophobicContact CZ-CG2 4.03Å; F39-V43 WeakPolarHBondContact O-CG2 3.39Å; F39-V43 PolarHBondContact O-N 3.11Å; N40-V43 PolarHBondContact O-N 3.42Å; L41-V43 VanDerWaalsContact C-N 3.31Å; L41-V43 PolarHBondContact O-N 3.27Å; V43-D45 VanDerWaalsContact C-N 3.33Å; V43-D45 PolarHBondContact O-N 3.05Å; V43-A46 PolarHBondContact O-N 3.48Å; V43-L47 HydrophobicContact CG1-CD1 4.17Å; V43-L47 WeakPolarHBondContact O-CG 3.43Å; V43-L47 PolarHBondContact O-N 3.38Å; V43-W123 HydrophobicContact CG1-CZ2 4.21Å
44A92.5Very high89.8Confident1 Ų121.1 Ų21.11%0.00811%0.114CC..Hα-helixtrans-60.5-43.4179.800000111.8N40 L41 L47 V48 N81 T84N40-A44 PolarHBondContact O-N 2.94Å; N40-A44 VanDerWaalsContact O-N 3.08Å; L41-A44 PolarHBondContact O-N 3.35Å; A44-L47 PolarHBondContact O-N 3.3Å; A44-V48 PolarHBondContact O-N 3.49Å; A44-N81 PolarHBondContact O-ND2 3Å; A44-T84 HydrophobicContact CB-CG2 3.95Å
45D91.6Very high90Very high0 Ų021.4 Ų21.40%012%0.115CC..Hα-helixtrans-71.4-35.7-179.6-71.9-21.3000112.5N17 L41 V43 L47 V48 T49 N81 S85 S261 N264N17-D45 WeakPolarHBondContact ND2-CB 3.48Å; L41-D45 WeakPolarHBondContact O-CB 3.29Å; L41-D45 VanDerWaalsContact O-CG 3.31Å; L41-D45 PolarHBondContact O-N 3.09Å; V43-D45 VanDerWaalsContact C-N 3.33Å; V43-D45 PolarHBondContact O-N 3.05Å; D45-L47 VanDerWaalsContact C-N 3.35Å; D45-V48 WeakPolarHBondContact O-CG1 3.29Å; D45-T49 WeakPolarHBondContact O-CB 3.24Å; D45-T49 WeakPolarHBondContact O-CG2 3.33Å; D45-T49 PolarHBondContact O-N 3.11Å; D45-T49 PolarHBondContact O-OG1 3.13Å; D45-N81 PolarHBondContact N-ND2 3.15Å; D45-N81 PolarHBondContact OD1-ND2 3.2Å; D45-N81 VanDerWaalsContact OD1-ND2 3.15Å; D45-S85 PolarHBondContact OD1-OG 3.17Å; D45-S261 WeakPolarHBondContact OD1-CB 3.49Å; D45-S261 PolarHBondContact OD1-OG 2.97Å; D45-N264 PolarHBondContact OD2-ND2 3.27Å
46A91.4Very high90.1Very high11 Ų1121.6 Ų21.69%0.09112%0.117CC..Hα-helixtrans-62.7-43.8171.500000110.9N17 M21 A42 V43 T49 T50N17-A46 HydrophobicContact CB-CB 4.24Å; M21-A46 HydrophobicContact CE-CB 3.91Å; A42-A46 WeakPolarHBondContact O-CB 3.28Å; A42-A46 PolarHBondContact O-N 2.89Å; V43-A46 PolarHBondContact O-N 3.48Å; A46-T49 WeakPolarHBondContact CA-OG1 3.45Å; A46-T49 PolarHBondContact O-N 3.46Å; A46-T49 PolarHBondContact O-OG1 3.38Å; A46-T50 WeakPolarHBondContact O-CG2 3.45Å; A46-T50 PolarHBondContact O-N 3.29Å
47L92.4Very high90Very high77 Ų7722.9 Ų22.940%0.40313%0.126SC..Hα-helixtrans-61.7-49.1178.1-70.1170.7000111.8V43 A44 D45 T49 T50 I77 W123V43-L47 HydrophobicContact CG1-CD1 4.17Å; V43-L47 WeakPolarHBondContact O-CG 3.43Å; V43-L47 PolarHBondContact O-N 3.38Å; A44-L47 PolarHBondContact O-N 3.3Å; D45-L47 VanDerWaalsContact C-N 3.35Å; L47-T49 VanDerWaalsContact C-N 3.33Å; L47-T49 PolarHBondContact O-N 2.74Å; L47-T50 PolarHBondContact O-N 3.08Å; L47-T50 PolarHBondContact O-OG1 3.42Å; L47-I77 HydrophobicContact CB-CG2 4.16Å; L47-W123 HydrophobicContact CD1-CH2 4.19Å
48V90.7Very high90Very high0 Ų024.5 Ų24.50%013%0.134CC..Hα-helixtrans-66.3-36-179.981.40000112.2A44 D45 T50 T51 M52 I77 N81 Y258A44-V48 PolarHBondContact O-N 3.49Å; D45-V48 WeakPolarHBondContact O-CG1 3.29Å; V48-T50 VanDerWaalsContact C-N 3.26Å; V48-T50 PolarHBondContact O-N 2.84Å; V48-T51 PolarHBondContact O-N 3.01Å; V48-T51 PolarHBondContact O-OG1 3.11Å; V48-M52 HydrophobicContact CG2-CE 4.32Å; V48-I77 HydrophobicContact CB-CG2 4.42Å; V48-N81 HydrophobicContact CB-CB 3.71Å; V48-N81 HydrophobicContact CG1-CB 4.31Å; V48-N81 VanDerWaalsContact CG1-ND2 3.32Å; V48-N81 WeakPolarHBondContact CG1-ND2 3.17Å; V48-N81 HydrophobicContact CG2-CB 3.93Å; V48-Y258 HydrophobicContact CG2-CD1 3.94Å; V48-Y258 HydrophobicContact CG2-CE1 3.54Å
49T90.3Very high89.8Confident1 Ų127.7 Ų27.71%0.00615%0.147CC..Hα-helixtrans-64.7-33.9179.150.60000111.3F10 D45 A46 L47 T51 M52F10-T49 WeakPolarHBondContact CD2-O 3.32Å; D45-T49 WeakPolarHBondContact O-CB 3.24Å; D45-T49 WeakPolarHBondContact O-CG2 3.33Å; D45-T49 PolarHBondContact O-N 3.11Å; D45-T49 PolarHBondContact O-OG1 3.13Å; A46-T49 WeakPolarHBondContact CA-OG1 3.45Å; A46-T49 PolarHBondContact O-N 3.46Å; A46-T49 PolarHBondContact O-OG1 3.38Å; L47-T49 VanDerWaalsContact C-N 3.33Å; L47-T49 PolarHBondContact O-N 2.74Å; T49-T51 PolarHBondContact O-N 2.99Å; T49-T51 VanDerWaalsContact O-N 3.12Å; T49-M52 WeakPolarHBondContact O-CB 3.32Å; T49-M52 VanDerWaalsContact O-CG 3.28Å; T49-M52 WeakPolarHBondContact O-CG 3.49Å; T49-M52 PolarHBondContact O-N 3.34Å; T49-M52 VanDerWaalsContact O-N 3.14Å
50T90.6Very high89.7Confident58 Ų5830.3 Ų30.336%0.35616%0.163SC..THydrogen-bonded Turntrans-62.4-17.1173.165.20000114.6L14 A46 L47 V48 P53L14-T50 HydrophobicContact CD1-CG2 3.94Å; A46-T50 WeakPolarHBondContact O-CG2 3.45Å; A46-T50 PolarHBondContact O-N 3.29Å; L47-T50 PolarHBondContact O-N 3.08Å; L47-T50 PolarHBondContact O-OG1 3.42Å; V48-T50 VanDerWaalsContact C-N 3.26Å; V48-T50 PolarHBondContact O-N 2.84Å; T50-P53 WeakPolarHBondContact O-CD 3.35Å
51T90.1Very high89.4Confident5 Ų534.8 Ų34.83%0.03119%0.186CC..THydrogen-bonded Turntrans-85.4-14.7177.276.90000113.9V48 T49 P53 F54 Q55 F74 I77V48-T51 PolarHBondContact O-N 3.01Å; V48-T51 PolarHBondContact O-OG1 3.11Å; T49-T51 PolarHBondContact O-N 2.99Å; T49-T51 VanDerWaalsContact O-N 3.12Å; T51-P53 VanDerWaalsContact C-CD 3.45Å; T51-F54 WeakPolarHBondContact O-CB 3.2Å; T51-F54 PolarHBondContact O-N 3.11Å; T51-F54 VanDerWaalsContact O-N 3.08Å; T51-Q55 PolarHBondContact O-N 3Å; T51-F74 HydrophobicContact CG2-CD2 4.18Å; T51-I77 HydrophobicContact CG2-CB 4.07Å; T51-I77 HydrophobicContact CG2-CD1 3.99Å; T51-I77 HydrophobicContact CG2-CG2 3.65Å
52M88.4Confident89.2Confident1 Ų138.4 Ų38.41%0.00521%0.211CC..Hα-helixtrans-56.5-38.6-177.9-63.5-64.2137.600114.8Y6 F10 V48 T49 F54 Q55 S56 Y258Y6-M52 HydrophobicContact CD1-SD 4.42Å; Y6-M52 HydrophobicContact CG-SD 4.45Å; F10-M52 HydrophobicContact CB-CB 4.09Å; F10-M52 HydrophobicContact CB-CG 4.42Å; V48-M52 HydrophobicContact CG2-CE 4.32Å; T49-M52 WeakPolarHBondContact O-CB 3.32Å; T49-M52 VanDerWaalsContact O-CG 3.28Å; T49-M52 WeakPolarHBondContact O-CG 3.49Å; T49-M52 PolarHBondContact O-N 3.34Å; T49-M52 VanDerWaalsContact O-N 3.14Å; M52-F54 VanDerWaalsContact C-N 3.32Å; M52-F54 PolarHBondContact O-N 2.76Å; M52-Q55 PolarHBondContact O-N 2.97Å; M52-S56 WeakPolarHBondContact O-CB 3.42Å; M52-S56 PolarHBondContact O-N 2.8Å; M52-S56 PolarHBondContact O-OG 3.42Å; M52-Y258 HydrophobicContact CE-CD1 3.42Å; M52-Y258 VanDerWaalsContact CE-CD1 3.42Å; M52-Y258 HydrophobicContact CE-CD2 3.3Å; M52-Y258 HydrophobicContact CE-CE1 3.77Å; M52-Y258 HydrophobicContact CE-CE2 3.6Å; M52-Y258 HydrophobicContact CE-CG 3.19Å; M52-Y258 HydrophobicContact SD-CD2 3.75Å; M52-Y258 HydrophobicContact SD-CE2 4.18Å; M52-Y258 HydrophobicContact SD-CG 4.08Å
53P89.4Confident89.1Confident54 Ų5439.6 Ų39.635%0.35122%0.22SC..Hα-helixtrans-62.7-39176-23.836000112.4F10 T50 T51 S56 T57F10-P53 HydrophobicContact CD2-CG 4.42Å; F10-P53 HydrophobicContact CE2-CG 4.31Å; F10-P53 HydrophobicContact CZ-CG 4.37Å; T50-P53 WeakPolarHBondContact O-CD 3.35Å; T51-P53 VanDerWaalsContact C-CD 3.45Å; P53-S56 WeakPolarHBondContact O-CB 3.41Å; P53-S56 PolarHBondContact O-N 3.46Å; P53-T57 PolarHBondContact O-N 3.22Å; P53-T57 PolarHBondContact O-OG1 2.84Å
54F89.8Confident89Confident82 Ų8238.1 Ų38.136%0.3621%0.21SC..Hα-helixtrans-64.5-44.2178-59.6-92.4000111T51 M52 S56 T57 D58 W64 F66T51-F54 WeakPolarHBondContact O-CB 3.2Å; T51-F54 PolarHBondContact O-N 3.11Å; T51-F54 VanDerWaalsContact O-N 3.08Å; M52-F54 VanDerWaalsContact C-N 3.32Å; M52-F54 PolarHBondContact O-N 2.76Å; F54-S56 VanDerWaalsContact C-N 3.31Å; F54-S56 PolarHBondContact O-N 3.22Å; F54-T57 PolarHBondContact O-N 2.76Å; F54-D58 PolarHBondContact O-N 3.2Å; F54-W64 HydrophobicContact CB-CH2 3.89Å; F54-W64 HydrophobicContact CB-CZ3 4.13Å; F54-F66 HydrophobicContact CB-CD2 4.38Å; F54-F66 HydrophobicContact CB-CE2 4.01Å; F54-F66 HydrophobicContact CB-CZ 4.46Å; F54-F66 AromaticContact CD1-CD1 3.82Å; F54-F66 HydrophobicContact CD1-CD1 3.82Å; F54-F66 AromaticContact CD1-CD2 3.8Å; F54-F66 HydrophobicContact CD1-CD2 3.8Å; F54-F66 AromaticContact CD1-CE1 3.84Å; F54-F66 HydrophobicContact CD1-CE1 3.84Å; F54-F66 AromaticContact CD1-CE2 3.81Å; F54-F66 HydrophobicContact CD1-CE2 3.81Å; F54-F66 AromaticContact CD1-CG 3.79Å; F54-F66 HydrophobicContact CD1-CG 3.79Å; F54-F66 AromaticContact CD1-CZ 3.82Å; F54-F66 HydrophobicContact CD1-CZ 3.82Å; F54-F66 HydrophobicContact CE1-CD1 4.03Å; F54-F66 HydrophobicContact CE1-CE1 4.17Å; F54-F66 HydrophobicContact CE1-CG 4.31Å; F54-F66 HydrophobicContact CG-CE2 4.37Å; F54-F66 HydrophobicContact CG-CZ 4.49Å
55Q86.4Confident89Confident12 Ų1241.6 Ų41.66%0.05623%0.232CC..Hα-helixtrans-63.3-36.7174.2-66.3-168.456.300112.8Y6 T51 M52 T57 D58 Y59 F74 Y258Y6-Q55 HydrophobicContact CD2-CB 4.31Å; Y6-Q55 HydrophobicContact CE2-CB 3.98Å; T51-Q55 PolarHBondContact O-N 3Å; M52-Q55 PolarHBondContact O-N 2.97Å; Q55-T57 VanDerWaalsContact C-N 3.34Å; Q55-D58 PolarHBondContact O-N 3.11Å; Q55-Y59 WeakPolarHBondContact O-CB 3.32Å; Q55-Y59 PolarHBondContact O-N 3.3Å; Q55-F74 HydrophobicContact CG-CD2 4.42Å; Q55-F74 HydrophobicContact CG-CE2 3.39Å; Q55-F74 HydrophobicContact CG-CZ 3.5Å; Q55-Y258 VanDerWaalsContact NE2-CZ 3.29Å; Q55-Y258 PolarHBondContact NE2-OH 2.86Å
56S87.8Confident89Confident11 Ų1145.1 Ų45.18%0.07725%0.248CC..Hα-helixtrans-64.3-41.4177.1-59.20000111.2Y6 M52 P53 F54 L60Y6-S56 WeakPolarHBondContact CB-OG 3.29Å; Y6-S56 WeakPolarHBondContact CD2-OG 3.36Å; M52-S56 WeakPolarHBondContact O-CB 3.42Å; M52-S56 PolarHBondContact O-N 2.8Å; M52-S56 PolarHBondContact O-OG 3.42Å; P53-S56 WeakPolarHBondContact O-CB 3.41Å; P53-S56 PolarHBondContact O-N 3.46Å; F54-S56 VanDerWaalsContact C-N 3.31Å; F54-S56 PolarHBondContact O-N 3.22Å; S56-L60 WeakPolarHBondContact O-CB 3.29Å; S56-L60 VanDerWaalsContact O-CG 3.27Å; S56-L60 WeakPolarHBondContact O-CG 3.44Å; S56-L60 PolarHBondContact O-N 3.32Å
57T88.8Confident89.1Confident46 Ų4646.2 Ų46.228%0.28226%0.26SS..Hα-helixtrans-67.3-43.7175.8-60.70000111.8P53 F54 Q55 Y59 L60 L61 P65 F66P53-T57 PolarHBondContact O-N 3.22Å; P53-T57 PolarHBondContact O-OG1 2.84Å; F54-T57 PolarHBondContact O-N 2.76Å; Q55-T57 VanDerWaalsContact C-N 3.34Å; T57-Y59 VanDerWaalsContact C-N 3.33Å; T57-Y59 PolarHBondContact O-N 2.94Å; T57-L60 PolarHBondContact O-N 2.64Å; T57-L61 HydrophobicContact CG2-CD1 3.55Å; T57-L61 HydrophobicContact CG2-CG 4.13Å; T57-L61 WeakPolarHBondContact O-CB 3.34Å; T57-L61 WeakPolarHBondContact O-CG 3.18Å; T57-L61 PolarHBondContact O-N 3.45Å; T57-P65 HydrophobicContact CG2-CG 3.87Å; T57-F66 HydrophobicContact CG2-CE2 3.89Å; T57-F66 HydrophobicContact CG2-CZ 3.6Å
58D86.4Confident89.1Confident38 Ų3846.6 Ų46.620%0.20326%0.26CS..Hα-helixtrans-57-46.5175.5-175.669.2000111.6F54 Q55 L60 S62 S63 W64F54-D58 PolarHBondContact O-N 3.2Å; Q55-D58 PolarHBondContact O-N 3.11Å; D58-L60 PolarHBondContact O-N 3.21Å; D58-S62 VanDerWaalsContact O-CA 3.31Å; D58-S62 WeakPolarHBondContact O-CA 3.31Å; D58-S62 PolarHBondContact O-N 3.45Å; D58-S63 PolarHBondContact O-N 2.93Å; D58-W64 HydrophobicContact CB-CE3 4.03Å; D58-W64 HydrophobicContact CB-CZ3 4.42Å; D58-W64 PolarHBondContact OD1-N 3.46Å
59Y84.6Confident89.3Confident75 Ų7552 Ų5229%0.29429%0.293SS..Hα-helixtrans-63.1-38.3175.6177.5-97.7000113.5I2 V3 Q55 T57 F251I2-Y59 HydrophobicContact CB-CE1 4.16Å; I2-Y59 HydrophobicContact CD1-CE1 4.34Å; I2-Y59 HydrophobicContact CD1-CE2 3.71Å; I2-Y59 HydrophobicContact CG2-CD1 4.43Å; I2-Y59 HydrophobicContact CG2-CG 4.5Å; V3-Y59 HydrophobicContact CG2-CD1 3.98Å; V3-Y59 HydrophobicContact CG2-CE1 4.5Å; Q55-Y59 WeakPolarHBondContact O-CB 3.32Å; Q55-Y59 PolarHBondContact O-N 3.3Å; T57-Y59 VanDerWaalsContact C-N 3.33Å; T57-Y59 PolarHBondContact O-N 2.94Å; Y59-F251 HydrophobicContact CD2-CD1 4.3Å; Y59-F251 AromaticContact CD2-CD2 3.68Å; Y59-F251 HydrophobicContact CD2-CD2 3.68Å; Y59-F251 HydrophobicContact CD2-CE1 4.46Å; Y59-F251 AromaticContact CD2-CE2 3.9Å; Y59-F251 HydrophobicContact CD2-CE2 3.9Å; Y59-F251 AromaticContact CD2-CG 3.92Å; Y59-F251 HydrophobicContact CD2-CG 3.92Å; Y59-F251 HydrophobicContact CD2-CZ 4.27Å; Y59-F251 AromaticContact CE2-CD2 3.96Å; Y59-F251 HydrophobicContact CE2-CD2 3.96Å; Y59-F251 HydrophobicContact CE2-CE2 4.45Å; Y59-F251 HydrophobicContact CE2-CG 4.34Å
60L87.3Confident89.4Confident116 Ų11653.2 Ų53.261%0.60730%0.303SS*.Hα-helixtrans-75.4-36.4-178.5-77.3174.2000113.2V3 S56 T57 D58V3-L60 HydrophobicContact CG1-CD1 4.44Å; V3-L60 HydrophobicContact CG2-CD1 4Å; V3-L60 HydrophobicContact CG2-CD2 3.84Å; V3-L60 HydrophobicContact CG2-CG 3.73Å; S56-L60 WeakPolarHBondContact O-CB 3.29Å; S56-L60 VanDerWaalsContact O-CG 3.27Å; S56-L60 WeakPolarHBondContact O-CG 3.44Å; S56-L60 PolarHBondContact O-N 3.32Å; T57-L60 PolarHBondContact O-N 2.64Å; D58-L60 PolarHBondContact O-N 3.21Å
61L86.6Confident89.6Confident103 Ų10350.5 Ų50.554%0.53929%0.286SS..Hα-helixtrans-91.1-12-178.2-63.4-179.7000112.7T57 S63 P65T57-L61 HydrophobicContact CG2-CD1 3.55Å; T57-L61 HydrophobicContact CG2-CG 4.13Å; T57-L61 WeakPolarHBondContact O-CB 3.34Å; T57-L61 WeakPolarHBondContact O-CG 3.18Å; T57-L61 PolarHBondContact O-N 3.45Å; L61-S63 PolarHBondContact O-N 3.44Å; L61-S63 VanDerWaalsContact O-N 3.15Å; L61-P65 HydrophobicContact CD1-CB 4.35Å; L61-P65 HydrophobicContact CD1-CG 3.92Å
62S84.5Confident89.8Confident76 Ų7653.2 Ų53.253%0.53130%0.298SS..THydrogen-bonded Turntrans50.132.6-168.7-57.50000112D58D58-S62 VanDerWaalsContact O-CA 3.31Å; D58-S62 WeakPolarHBondContact O-CA 3.31Å; D58-S62 PolarHBondContact O-N 3.45Å
63S88.3Confident90Very high26 Ų2656.8 Ų56.818%0.18232%0.32CS..SBendtrans-166.4145.4-173.9-173.60000109.2D58 L61 P65 T146D58-S63 PolarHBondContact O-N 2.93Å; L61-S63 PolarHBondContact O-N 3.44Å; L61-S63 VanDerWaalsContact O-N 3.15Å; S63-P65 WeakPolarHBondContact O-CD 3.28Å; S63-T146 CarbonylContact C-O 3.53Å; S63-T146 WeakPolarHBondContact CA-O 3.35Å; S63-T146 PolarHBondContact OG-N 2.94Å; S63-T146 VanDerWaalsContact OG-N 3.07Å
64W91.3Very high90.2Very high7 Ų755.8 Ų55.83%0.02731%0.31CS..  trans-92.4105.1-179.3-178.7-95.7000111.5F54 D58 F66 G67 A70 C71 F74 T139 T146 C148F54-W64 HydrophobicContact CB-CH2 3.89Å; F54-W64 HydrophobicContact CB-CZ3 4.13Å; D58-W64 HydrophobicContact CB-CE3 4.03Å; D58-W64 HydrophobicContact CB-CZ3 4.42Å; D58-W64 PolarHBondContact OD1-N 3.46Å; W64-F66 AromaticContact CD2-CD2 3.97Å; W64-F66 HydrophobicContact CD2-CD2 3.97Å; W64-F66 AromaticContact CE2-CD2 3.84Å; W64-F66 HydrophobicContact CE3-CD2 4.02Å; W64-F66 AromaticContact CH2-CD2 3.85Å; W64-F66 HydrophobicContact CH2-CD2 3.85Å; W64-F66 HydrophobicContact CZ2-CB 3.79Å; W64-F66 AromaticContact CZ2-CD2 3.78Å; W64-F66 HydrophobicContact CZ2-CD2 3.78Å; W64-F66 HydrophobicContact CZ2-CG 4.22Å; W64-F66 AromaticContact CZ3-CD2 3.96Å; W64-F66 HydrophobicContact CZ3-CD2 3.96Å; W64-F66 HydrophobicContact CZ3-CE2 4.4Å; W64-G67 PolarHBondContact NE1-O 3.39Å; W64-A70 HydrophobicContact CZ2-CB 3.82Å; W64-C71 HydrophobicContact CZ2-CB 4.27Å; W64-F74 HydrophobicContact CH2-CB 3.98Å; W64-F74 HydrophobicContact CH2-CD1 4.26Å; W64-F74 HydrophobicContact CH2-CG 4.06Å; W64-F74 HydrophobicContact CZ2-CB 4.45Å; W64-F74 HydrophobicContact CZ3-CD1 4.37Å; W64-F74 HydrophobicContact CZ3-CG 4.49Å; W64-T139 HydrophobicContact CG-CG2 4.49Å; W64-T146 HydrophobicContact CB-CG2 4.5Å; W64-T146 PolarHBondContact N-O 3.39Å; W64-C148 HydrophobicContact CB-CB 4.14Å; W64-C148 HydrophobicContact CD2-CB 3.77Å; W64-C148 HydrophobicContact CE3-CB 4.07Å; W64-C148 HydrophobicContact CG-CB 3.8Å
65P92.4Very high90.3Very high74 Ų7452.5 Ų52.548%0.48130%0.296SS..  trans-89.9-7.8-175.237.3-39.1000114.1T57 L61 S63 G67T57-P65 HydrophobicContact CG2-CG 3.87Å; L61-P65 HydrophobicContact CD1-CB 4.35Å; L61-P65 HydrophobicContact CD1-CG 3.92Å; S63-P65 WeakPolarHBondContact O-CD 3.28Å; P65-G67 VanDerWaalsContact C-N 3.33Å; P65-G67 PolarHBondContact O-N 2.81Å
66F92.1Very high90.6Very high75 Ų7552.5 Ų52.533%0.32930%0.297SS..SBendtrans-87.5-0.2-166.7-53-75.9000114.4F54 T57 W64 A70F54-F66 HydrophobicContact CB-CD2 4.38Å; F54-F66 HydrophobicContact CB-CE2 4.01Å; F54-F66 HydrophobicContact CB-CZ 4.46Å; F54-F66 AromaticContact CD1-CD1 3.82Å; F54-F66 HydrophobicContact CD1-CD1 3.82Å; F54-F66 AromaticContact CD1-CD2 3.8Å; F54-F66 HydrophobicContact CD1-CD2 3.8Å; F54-F66 AromaticContact CD1-CE1 3.84Å; F54-F66 HydrophobicContact CD1-CE1 3.84Å; F54-F66 AromaticContact CD1-CE2 3.81Å; F54-F66 HydrophobicContact CD1-CE2 3.81Å; F54-F66 AromaticContact CD1-CG 3.79Å; F54-F66 HydrophobicContact CD1-CG 3.79Å; F54-F66 AromaticContact CD1-CZ 3.82Å; F54-F66 HydrophobicContact CD1-CZ 3.82Å; F54-F66 HydrophobicContact CE1-CD1 4.03Å; F54-F66 HydrophobicContact CE1-CE1 4.17Å; F54-F66 HydrophobicContact CE1-CG 4.31Å; F54-F66 HydrophobicContact CG-CE2 4.37Å; F54-F66 HydrophobicContact CG-CZ 4.49Å; T57-F66 HydrophobicContact CG2-CE2 3.89Å; T57-F66 HydrophobicContact CG2-CZ 3.6Å; W64-F66 AromaticContact CD2-CD2 3.97Å; W64-F66 HydrophobicContact CD2-CD2 3.97Å; W64-F66 AromaticContact CE2-CD2 3.84Å; W64-F66 HydrophobicContact CE3-CD2 4.02Å; W64-F66 AromaticContact CH2-CD2 3.85Å; W64-F66 HydrophobicContact CH2-CD2 3.85Å; W64-F66 HydrophobicContact CZ2-CB 3.79Å; W64-F66 AromaticContact CZ2-CD2 3.78Å; W64-F66 HydrophobicContact CZ2-CD2 3.78Å; W64-F66 HydrophobicContact CZ2-CG 4.22Å; W64-F66 AromaticContact CZ3-CD2 3.96Å; W64-F66 HydrophobicContact CZ3-CD2 3.96Å; W64-F66 HydrophobicContact CZ3-CE2 4.4Å; F66-A70 HydrophobicContact CB-CB 3.58Å; F66-A70 WeakPolarHBondContact O-CB 3.27Å
67G92.4Very high90.9Very high34 Ų3453.6 Ų53.635%0.35130%0.302SS..Hα-helixtrans76.8176.1-179.600000114.5W64 P65 C71W64-G67 PolarHBondContact NE1-O 3.39Å; P65-G67 VanDerWaalsContact C-N 3.33Å; P65-G67 PolarHBondContact O-N 2.81Å; G67-C71 PolarHBondContact O-N 3.31Å
68E93.2Very high91Very high84 Ų8453.6 Ų53.639%0.39330%0.3SS..Hα-helixtrans-63.9-43.8-171-174-173.7145.200113.6A70 C71 K72 N138E68-A70 VanDerWaalsContact C-N 3.33Å; E68-A70 PolarHBondContact O-N 2.88Å; E68-C71 WeakPolarHBondContact O-CB 3.35Å; E68-C71 PolarHBondContact O-N 3.41Å; E68-C71 VanDerWaalsContact O-N 3.09Å; E68-K72 HydrophobicContact CG-CD 4.35Å; E68-K72 PolarHBondContact O-N 3.21Å; E68-K72 VanDerWaalsContact OE1-CE 3.3Å; E68-K72 WeakPolarHBondContact OE1-CE 3.17Å; E68-K72 IonicContact OE1-NZ 3.47Å; E68-K72 PolarHBondContact OE1-NZ 2.94Å; E68-N138 VanDerWaalsContact CG-OD1 3.28Å; E68-N138 WeakPolarHBondContact CG-OD1 3.45Å
69V93.8Very high91.2Very high115 Ų11553.8 Ų53.870%0.69730%0.298SS*.Hα-helixtrans-61.2-44.5-177.1177.50000110.8C71 K72 V73V69-C71 VanDerWaalsContact C-N 3.3Å; V69-C71 PolarHBondContact O-N 2.98Å; V69-K72 PolarHBondContact O-N 3.1Å; V69-V73 WeakPolarHBondContact O-CG2 3.41Å; V69-V73 PolarHBondContact O-N 3.41Å
70A93.4Very high91.6Very high26 Ų2652.2 Ų52.222%0.21529%0.292CS..Hα-helixtrans-64.3-37.6176.800000111.4W64 F66 E68 V73 F74W64-A70 HydrophobicContact CZ2-CB 3.82Å; F66-A70 HydrophobicContact CB-CB 3.58Å; F66-A70 WeakPolarHBondContact O-CB 3.27Å; E68-A70 VanDerWaalsContact C-N 3.33Å; E68-A70 PolarHBondContact O-N 2.88Å; A70-V73 PolarHBondContact O-N 2.98Å; A70-F74 WeakPolarHBondContact O-CB 3.3Å; A70-F74 PolarHBondContact O-N 3.08Å
71C94.3Very high91.8Very high0 Ų046.8 Ų46.80%026%0.264CS..Hα-helixtrans-61.6-46.8175.8174.70000111.8W64 G67 E68 V69 V73 F74 I75 T139 C148W64-C71 HydrophobicContact CZ2-CB 4.27Å; G67-C71 PolarHBondContact O-N 3.31Å; E68-C71 WeakPolarHBondContact O-CB 3.35Å; E68-C71 PolarHBondContact O-N 3.41Å; E68-C71 VanDerWaalsContact O-N 3.09Å; V69-C71 VanDerWaalsContact C-N 3.3Å; V69-C71 PolarHBondContact O-N 2.98Å; C71-V73 PolarHBondContact O-N 2.91Å; C71-F74 WeakPolarHBondContact O-CB 3.47Å; C71-F74 PolarHBondContact O-N 3.43Å; C71-I75 WeakPolarHBondContact O-CB 3.36Å; C71-I75 WeakPolarHBondContact O-CG1 3.26Å; C71-I75 PolarHBondContact O-N 2.98Å; C71-T139 HydrophobicContact CB-CG2 3.74Å; C71-C148 WeakPolarHBondContact CA-SG 3.2Å; C71-C148 HydrophobicContact CB-CB 3.82Å; C71-C148 WeakPolarHBondContact CB-SG 3.33Å; C71-C148 WeakPolarHBondContact SG-CA 3.39Å; C71-C148 WeakPolarHBondContact SG-CB 3.34Å; C71-C148 CovalentContact SG-SG 2.02Å; C71-C148 PolarHBondContact SG-SG 3.5Å
72K94.5Very high92Very high62 Ų6242.9 Ų42.927%0.2724%0.243SC..Hα-helixtrans-59.4-46.3176.6-76.2178167.4170.60112.4E68 V69 S76 M134 G137E68-K72 HydrophobicContact CG-CD 4.35Å; E68-K72 PolarHBondContact O-N 3.21Å; E68-K72 VanDerWaalsContact OE1-CE 3.3Å; E68-K72 WeakPolarHBondContact OE1-CE 3.17Å; E68-K72 IonicContact OE1-NZ 3.47Å; E68-K72 PolarHBondContact OE1-NZ 2.94Å; V69-K72 PolarHBondContact O-N 3.1Å; K72-S76 VanDerWaalsContact O-CB 3.28Å; K72-S76 WeakPolarHBondContact O-CB 3.33Å; K72-S76 PolarHBondContact O-N 3.13Å; K72-M134 HydrophobicContact CB-CG 4.44Å; K72-M134 WeakPolarHBondContact CG-O 3.49Å; K72-G137 WeakPolarHBondContact CE-O 3.36Å; K72-G137 WeakPolarHBondContact CG-O 3.29Å
73V92.8Very high92.3Very high77 Ų7739.9 Ų39.947%0.46722%0.22SC..Hα-helixtrans-64.6-44.2177.8172.20000110.8V69 A70 C71 S76 I77V69-V73 WeakPolarHBondContact O-CG2 3.41Å; V69-V73 PolarHBondContact O-N 3.41Å; A70-V73 PolarHBondContact O-N 2.98Å; C71-V73 PolarHBondContact O-N 2.91Å; V73-S76 PolarHBondContact O-N 3.27Å; V73-I77 HydrophobicContact CG1-CD1 3.67Å; V73-I77 HydrophobicContact CG1-CG1 4.35Å; V73-I77 VanDerWaalsContact O-CG1 3.3Å; V73-I77 WeakPolarHBondContact O-CG1 3.42Å; V73-I77 PolarHBondContact O-N 3.27Å
74F92.9Very high92.5Very high33 Ų3338.7 Ų38.715%0.14521%0.212CC..Hα-helixtrans-57.2-56.3177.5167-112.1000111.9T51 Q55 W64 A70 C71 S76 I77 D78T51-F74 HydrophobicContact CG2-CD2 4.18Å; Q55-F74 HydrophobicContact CG-CD2 4.42Å; Q55-F74 HydrophobicContact CG-CE2 3.39Å; Q55-F74 HydrophobicContact CG-CZ 3.5Å; W64-F74 HydrophobicContact CH2-CB 3.98Å; W64-F74 HydrophobicContact CH2-CD1 4.26Å; W64-F74 HydrophobicContact CH2-CG 4.06Å; W64-F74 HydrophobicContact CZ2-CB 4.45Å; W64-F74 HydrophobicContact CZ3-CD1 4.37Å; W64-F74 HydrophobicContact CZ3-CG 4.49Å; A70-F74 WeakPolarHBondContact O-CB 3.3Å; A70-F74 PolarHBondContact O-N 3.08Å; C71-F74 WeakPolarHBondContact O-CB 3.47Å; C71-F74 PolarHBondContact O-N 3.43Å; F74-S76 VanDerWaalsContact C-N 3.28Å; F74-S76 PolarHBondContact O-N 3.42Å; F74-I77 PolarHBondContact O-N 2.95Å; F74-D78 PolarHBondContact O-N 3.25Å
75I92.3Very high92.4Very high12 Ų1238.4 Ų38.46%0.06221%0.211CC..Hα-helixtrans-57.9-43.8179.1-72.3174.5000110.3C71 D78 Y79 A133 L150C71-I75 WeakPolarHBondContact O-CB 3.36Å; C71-I75 WeakPolarHBondContact O-CG1 3.26Å; C71-I75 PolarHBondContact O-N 2.98Å; I75-D78 PolarHBondContact O-N 3.43Å; I75-Y79 HydrophobicContact CG2-CD2 4.12Å; I75-Y79 HydrophobicContact CG2-CE2 4.27Å; I75-Y79 WeakPolarHBondContact O-CD2 3.23Å; I75-Y79 PolarHBondContact O-N 2.71Å; I75-Y79 VanDerWaalsContact O-N 3.12Å; I75-A133 HydrophobicContact CG2-CB 3.94Å; I75-A133 WeakPolarHBondContact CG2-O 3.44Å; I75-L150 HydrophobicContact CG2-CD2 3.66Å; I75-L150 HydrophobicContact CG2-CG 4.27Å
76S93.5Very high92.2Very high12 Ų1235.1 Ų35.18%0.08419%0.189CC..Hα-helixtrans-62-48.9179.4-166.60000112K72 V73 F74 D78 Y79 Y80 G130K72-S76 VanDerWaalsContact O-CB 3.28Å; K72-S76 WeakPolarHBondContact O-CB 3.33Å; K72-S76 PolarHBondContact O-N 3.13Å; V73-S76 PolarHBondContact O-N 3.27Å; F74-S76 VanDerWaalsContact C-N 3.28Å; F74-S76 PolarHBondContact O-N 3.42Å; S76-D78 VanDerWaalsContact C-N 3.27Å; S76-D78 PolarHBondContact O-N 3.46Å; S76-Y79 PolarHBondContact O-N 3.4Å; S76-Y80 WeakPolarHBondContact O-CB 3.32Å; S76-Y80 VanDerWaalsContact O-CD2 3.24Å; S76-Y80 WeakPolarHBondContact O-CD2 3.3Å; S76-Y80 PolarHBondContact O-N 3.45Å; S76-Y80 WeakPolarHBondContact OG-CD2 3.29Å; S76-Y80 WeakPolarHBondContact OG-CE2 3.47Å; S76-G130 PolarHBondContact OG-O 2.89Å
77I93.3Very high92.3Very high35 Ų3533.6 Ų33.618%0.17918%0.182CC..Hα-helixtrans-58.8-41.1179-70.9169.5000111L47 V48 T51 V73 F74 Y80 N81L47-I77 HydrophobicContact CB-CG2 4.16Å; V48-I77 HydrophobicContact CB-CG2 4.42Å; T51-I77 HydrophobicContact CG2-CB 4.07Å; T51-I77 HydrophobicContact CG2-CD1 3.99Å; T51-I77 HydrophobicContact CG2-CG2 3.65Å; V73-I77 HydrophobicContact CG1-CD1 3.67Å; V73-I77 HydrophobicContact CG1-CG1 4.35Å; V73-I77 VanDerWaalsContact O-CG1 3.3Å; V73-I77 WeakPolarHBondContact O-CG1 3.42Å; V73-I77 PolarHBondContact O-N 3.27Å; F74-I77 PolarHBondContact O-N 2.95Å; I77-Y80 PolarHBondContact O-N 3.32Å; I77-N81 WeakPolarHBondContact O-CB 3.46Å; I77-N81 PolarHBondContact O-N 2.92Å
78D90.7Very high92.2Very high46 Ų4632 Ų3225%0.24617%0.166CC..Hα-helixtrans-62.2-48.3179.9-165.150.5000111.8F74 I75 S76 N81 M82 Y258F74-D78 PolarHBondContact O-N 3.25Å; I75-D78 PolarHBondContact O-N 3.43Å; S76-D78 VanDerWaalsContact C-N 3.27Å; S76-D78 PolarHBondContact O-N 3.46Å; D78-N81 PolarHBondContact O-N 3.27Å; D78-M82 WeakPolarHBondContact O-CB 3.48Å; D78-M82 PolarHBondContact O-N 3.4Å; D78-Y258 VanDerWaalsContact CG-OH 3.31Å; D78-Y258 VanDerWaalsContact OD1-CE1 3.25Å; D78-Y258 WeakPolarHBondContact OD1-CE1 3.35Å; D78-Y258 VanDerWaalsContact OD1-CZ 3.31Å; D78-Y258 PolarHBondContact OD1-OH 3.35Å
79Y91.8Very high91.8Very high41 Ų4128.7 Ų28.716%0.16115%0.151CC..Hα-helixtrans-64.1-43.4175.8-87.1-100.4000112.3I75 S76 N81 M82 F83 A133 L150 M163 V167I75-Y79 HydrophobicContact CG2-CD2 4.12Å; I75-Y79 HydrophobicContact CG2-CE2 4.27Å; I75-Y79 WeakPolarHBondContact O-CD2 3.23Å; I75-Y79 PolarHBondContact O-N 2.71Å; I75-Y79 VanDerWaalsContact O-N 3.12Å; S76-Y79 PolarHBondContact O-N 3.4Å; Y79-N81 PolarHBondContact O-N 2.91Å; Y79-M82 HydrophobicContact CD1-CE 4.37Å; Y79-M82 HydrophobicContact CE1-CE 4.49Å; Y79-M82 PolarHBondContact O-N 2.94Å; Y79-F83 HydrophobicContact CD1-CE2 4.07Å; Y79-F83 WeakPolarHBondContact O-CD2 3.4Å; Y79-F83 PolarHBondContact O-N 3.42Å; Y79-F83 VanDerWaalsContact O-N 3.1Å; Y79-A133 HydrophobicContact CD1-CB 4.03Å; Y79-A133 HydrophobicContact CD2-CB 3.78Å; Y79-A133 HydrophobicContact CE1-CB 4.48Å; Y79-A133 HydrophobicContact CE2-CB 4.22Å; Y79-A133 HydrophobicContact CG-CB 3.67Å; Y79-L150 HydrophobicContact CE2-CD1 3.91Å; Y79-L150 WeakPolarHBondContact OH-CD1 3.49Å; Y79-M163 HydrophobicContact CD1-CE 3.95Å; Y79-M163 HydrophobicContact CE1-CE 3.45Å; Y79-M163 VanDerWaalsContact CE1-CE 3.45Å; Y79-V167 HydrophobicContact CE1-CG2 3.96Å
80Y93Very high91.6Very high42 Ų4223.8 Ų23.817%0.16512%0.121CC..Hα-helixtrans-61.2-44.2176.7-92.1-72.2000112S76 I77 T84 W123 S127S76-Y80 WeakPolarHBondContact O-CB 3.32Å; S76-Y80 VanDerWaalsContact O-CD2 3.24Å; S76-Y80 WeakPolarHBondContact O-CD2 3.3Å; S76-Y80 PolarHBondContact O-N 3.45Å; S76-Y80 WeakPolarHBondContact OG-CD2 3.29Å; S76-Y80 WeakPolarHBondContact OG-CE2 3.47Å; I77-Y80 PolarHBondContact O-N 3.32Å; Y80-T84 WeakPolarHBondContact O-CB 3.4Å; Y80-T84 PolarHBondContact O-N 3.47Å; Y80-T84 PolarHBondContact O-OG1 3.46Å; Y80-W123 AromaticContact CD1-CE3 3.84Å; Y80-W123 HydrophobicContact CD1-CE3 3.84Å; Y80-W123 AromaticContact CD1-CZ3 3.76Å; Y80-W123 HydrophobicContact CD1-CZ3 3.76Å; Y80-W123 HydrophobicContact CE1-CE3 4.04Å; Y80-W123 HydrophobicContact CE1-CZ3 4.3Å; Y80-W123 HydrophobicContact CG-CZ3 4.32Å; Y80-S127 VanDerWaalsContact CE1-OG 3.29Å; Y80-S127 WeakPolarHBondContact CE1-OG 3.36Å; Y80-S127 WeakPolarHBondContact OH-CA 3.37Å; Y80-S127 WeakPolarHBondContact OH-CB 3.36Å; Y80-S127 PolarHBondContact OH-OG 3.39Å
81N91.6Very high91.4Very high3 Ų324.4 Ų24.42%0.01612%0.12CC..Hα-helixtrans-61.6-50.2176.4178.8-85.2000110.6A44 D45 V48 I77 D78 Y79 F83 T84 S85A44-N81 PolarHBondContact O-ND2 3Å; D45-N81 PolarHBondContact N-ND2 3.15Å; D45-N81 PolarHBondContact OD1-ND2 3.2Å; D45-N81 VanDerWaalsContact OD1-ND2 3.15Å; V48-N81 HydrophobicContact CB-CB 3.71Å; V48-N81 HydrophobicContact CG1-CB 4.31Å; V48-N81 VanDerWaalsContact CG1-ND2 3.32Å; V48-N81 WeakPolarHBondContact CG1-ND2 3.17Å; V48-N81 HydrophobicContact CG2-CB 3.93Å; I77-N81 WeakPolarHBondContact O-CB 3.46Å; I77-N81 PolarHBondContact O-N 2.92Å; D78-N81 PolarHBondContact O-N 3.27Å; Y79-N81 PolarHBondContact O-N 2.91Å; N81-F83 PolarHBondContact O-N 3.3Å; N81-T84 PolarHBondContact O-N 3.12Å; N81-S85 PolarHBondContact ND2-OG 3.31Å; N81-S85 WeakPolarHBondContact O-CB 3.33Å; N81-S85 PolarHBondContact O-N 3.31Å; N81-S85 PolarHBondContact O-OG 2.99Å
82M89.6Confident91Very high21 Ų2125.6 Ų25.610%0.10313%0.126CC..Hα-helixtrans-52.9-54.1-179.1-179.2177.574.900111.7D78 Y79 I86 V167 A171 W224D78-M82 WeakPolarHBondContact O-CB 3.48Å; D78-M82 PolarHBondContact O-N 3.4Å; Y79-M82 HydrophobicContact CD1-CE 4.37Å; Y79-M82 HydrophobicContact CE1-CE 4.49Å; Y79-M82 PolarHBondContact O-N 2.94Å; M82-I86 VanDerWaalsContact O-CG2 3.22Å; M82-I86 WeakPolarHBondContact O-CG2 2.91Å; M82-I86 PolarHBondContact O-N 2.9Å; M82-V167 HydrophobicContact CE-CB 4.19Å; M82-V167 HydrophobicContact CE-CG1 3.4Å; M82-V167 VanDerWaalsContact CE-CG1 3.4Å; M82-V167 HydrophobicContact CE-CG2 3.83Å; M82-V167 HydrophobicContact SD-CG1 3.83Å; M82-A171 HydrophobicContact CE-CB 3.82Å; M82-A171 HydrophobicContact CG-CB 3.96Å; M82-A171 HydrophobicContact SD-CB 3.94Å; M82-W224 HydrophobicContact CB-CH2 4.1Å; M82-W224 HydrophobicContact CB-CZ3 4.31Å; M82-W224 HydrophobicContact CG-CH2 3.89Å; M82-W224 HydrophobicContact CG-CZ3 3.67Å; M82-W224 HydrophobicContact SD-CZ3 4.14Å
83F92Very high90.5Very high13 Ų1322.8 Ų22.86%0.05711%0.114CC..Hα-helixtrans-72-43.4-177.8-77.7-74.7000113.2Y79 N81 S85 I86 F87 S126 A129 V167 F170 A171Y79-F83 HydrophobicContact CD1-CE2 4.07Å; Y79-F83 WeakPolarHBondContact O-CD2 3.4Å; Y79-F83 PolarHBondContact O-N 3.42Å; Y79-F83 VanDerWaalsContact O-N 3.1Å; N81-F83 PolarHBondContact O-N 3.3Å; F83-S85 VanDerWaalsContact C-N 3.34Å; F83-S85 PolarHBondContact O-N 2.9Å; F83-I86 WeakPolarHBondContact O-CG2 3.4Å; F83-I86 PolarHBondContact O-N 3.26Å; F83-F87 HydrophobicContact CB-CD2 4.42Å; F83-F87 HydrophobicContact CB-CE2 4.13Å; F83-F87 HydrophobicContact CD1-CE1 4.36Å; F83-F87 AromaticContact CD1-CE2 3.91Å; F83-F87 HydrophobicContact CD1-CE2 3.91Å; F83-F87 AromaticContact CD1-CZ 3.66Å; F83-F87 HydrophobicContact CD1-CZ 3.66Å; F83-F87 HydrophobicContact CE1-CZ 4.35Å; F83-F87 HydrophobicContact CG-CE2 4.47Å; F83-F87 WeakPolarHBondContact O-CB 3.42Å; F83-F87 VanDerWaalsContact O-CD2 3.3Å; F83-F87 WeakPolarHBondContact O-CD2 3.3Å; F83-F87 WeakPolarHBondContact O-CG 3.28Å; F83-F87 PolarHBondContact O-N 3.15Å; F83-S126 WeakPolarHBondContact CB-OG 3.23Å; F83-A129 HydrophobicContact CD2-CB 3.63Å; F83-A129 HydrophobicContact CE2-CB 3.27Å; F83-A129 HydrophobicContact CG-CB 4.48Å; F83-A129 HydrophobicContact CZ-CB 3.85Å; F83-V167 HydrophobicContact CE2-CG2 4.33Å; F83-V167 HydrophobicContact CZ-CG2 4.1Å; F83-F170 HydrophobicContact CE1-CB 3.98Å; F83-A171 HydrophobicContact CD1-CB 4.34Å; F83-A171 HydrophobicContact CE1-CB 4Å; F83-A171 HydrophobicContact CZ-CB 4.34Å
84T92.1Very high90.4Very high0 Ų020.5 Ų20.50%010%0.101CC..Hα-helixtrans-64.8-42.8-178.7-60.20000110.6N40 A44 Y80 N81 T88 I122 W123 S126N40-T84 VanDerWaalsContact ND2-CG2 3.34Å; N40-T84 WeakPolarHBondContact ND2-CG2 3.41Å; A44-T84 HydrophobicContact CB-CG2 3.95Å; Y80-T84 WeakPolarHBondContact O-CB 3.4Å; Y80-T84 PolarHBondContact O-N 3.47Å; Y80-T84 PolarHBondContact O-OG1 3.46Å; N81-T84 PolarHBondContact O-N 3.12Å; T84-T88 WeakPolarHBondContact O-CB 3.34Å; T84-T88 PolarHBondContact O-N 2.94Å; T84-T88 PolarHBondContact O-OG1 2.99Å; T84-I122 HydrophobicContact CG2-CG2 3.95Å; T84-W123 HydrophobicContact CG2-CZ2 4.2Å; T84-S126 PolarHBondContact N-OG 2.8Å; T84-S126 PolarHBondContact OG1-OG 2.8Å
85S89.5Confident90Very high2 Ų219 Ų191%0.0149%0.094CC..Hα-helixtrans-63.3-48.5-179.6-67.30000111.6L41 D45 N81 F83 T88 L89L41-S85 VanDerWaalsContact CD1-CA 3.47Å; D45-S85 PolarHBondContact OD1-OG 3.17Å; N81-S85 PolarHBondContact ND2-OG 3.31Å; N81-S85 WeakPolarHBondContact O-CB 3.33Å; N81-S85 PolarHBondContact O-N 3.31Å; N81-S85 PolarHBondContact O-OG 2.99Å; F83-S85 VanDerWaalsContact C-N 3.34Å; F83-S85 PolarHBondContact O-N 2.9Å; S85-T88 PolarHBondContact O-N 3.47Å; S85-L89 WeakPolarHBondContact O-CB 3.36Å; S85-L89 WeakPolarHBondContact O-CG 3.46Å; S85-L89 PolarHBondContact O-N 3.01Å
86I88.4Confident89.5Confident4 Ų423 Ų232%0.02111%0.108CC..Hα-helixtrans-70.9-39.7-178.4-170.747.2000113.1M82 F83 T88 L89 T90 P175 I179 F220M82-I86 VanDerWaalsContact O-CG2 3.22Å; M82-I86 WeakPolarHBondContact O-CG2 2.91Å; M82-I86 PolarHBondContact O-N 2.9Å; F83-I86 WeakPolarHBondContact O-CG2 3.4Å; F83-I86 PolarHBondContact O-N 3.26Å; I86-T88 VanDerWaalsContact C-N 3.3Å; I86-T88 PolarHBondContact O-N 3.49Å; I86-L89 HydrophobicContact CD1-CB 4.48Å; I86-L89 PolarHBondContact O-N 3.29Å; I86-T90 WeakPolarHBondContact O-CB 3.3Å; I86-T90 PolarHBondContact O-N 3.29Å; I86-T90 PolarHBondContact O-OG1 3.37Å; I86-P175 HydrophobicContact CD1-CB 3.51Å; I86-P175 HydrophobicContact CD1-CG 4.27Å; I86-P175 HydrophobicContact CG1-CB 3.28Å; I86-P175 HydrophobicContact CG1-CG 3.47Å; I86-P175 VanDerWaalsContact CG1-CG 3.47Å; I86-P175 HydrophobicContact CG2-CG 4.42Å; I86-I179 HydrophobicContact CD1-CD1 3.95Å; I86-F220 HydrophobicContact CB-CE2 4.49Å; I86-F220 HydrophobicContact CD1-CD2 4.12Å; I86-F220 HydrophobicContact CD1-CE1 3.87Å; I86-F220 HydrophobicContact CD1-CE2 3.33Å; I86-F220 HydrophobicContact CD1-CZ 3.18Å; I86-F220 HydrophobicContact CG1-CE2 4.13Å; I86-F220 HydrophobicContact CG1-CZ 3.84Å
87F92.4Very high89.1Confident43 Ų4324.9 Ų24.919%0.18911%0.114CC..Hα-helixtrans-65.6-36.8175.2-65.7-21000111.5F83 T90 M91 I122 L125F83-F87 HydrophobicContact CB-CD2 4.42Å; F83-F87 HydrophobicContact CB-CE2 4.13Å; F83-F87 HydrophobicContact CD1-CE1 4.36Å; F83-F87 AromaticContact CD1-CE2 3.91Å; F83-F87 HydrophobicContact CD1-CE2 3.91Å; F83-F87 AromaticContact CD1-CZ 3.66Å; F83-F87 HydrophobicContact CD1-CZ 3.66Å; F83-F87 HydrophobicContact CE1-CZ 4.35Å; F83-F87 HydrophobicContact CG-CE2 4.47Å; F83-F87 WeakPolarHBondContact O-CB 3.42Å; F83-F87 VanDerWaalsContact O-CD2 3.3Å; F83-F87 WeakPolarHBondContact O-CD2 3.3Å; F83-F87 WeakPolarHBondContact O-CG 3.28Å; F83-F87 PolarHBondContact O-N 3.15Å; F87-T90 PolarHBondContact O-N 3.42Å; F87-M91 PolarHBondContact O-N 2.82Å; F87-I122 HydrophobicContact CB-CD1 4.48Å; F87-I122 HydrophobicContact CB-CG1 4.07Å; F87-I122 HydrophobicContact CB-CG2 3.86Å; F87-I122 HydrophobicContact CD2-CG2 4.42Å; F87-L125 HydrophobicContact CD2-CB 4.3Å; F87-L125 HydrophobicContact CE2-CB 3.96Å
88T90.4Very high88.7Confident0 Ų024.4 Ų24.40%011%0.112CC..Hα-helixtrans-65.2-46.6174.1-57.40000111.3Y37 N40 L41 T84 S85 I86 T90 M91 M92Y37-T88 WeakPolarHBondContact O-CG2 3.48Å; N40-T88 HydrophobicContact CB-CG2 4.44Å; N40-T88 PolarHBondContact ND2-OG1 3.25Å; L41-T88 HydrophobicContact CB-CG2 4.15Å; T84-T88 WeakPolarHBondContact O-CB 3.34Å; T84-T88 PolarHBondContact O-N 2.94Å; T84-T88 PolarHBondContact O-OG1 2.99Å; S85-T88 PolarHBondContact O-N 3.47Å; I86-T88 VanDerWaalsContact C-N 3.3Å; I86-T88 PolarHBondContact O-N 3.49Å; T88-T90 VanDerWaalsContact C-N 3.31Å; T88-T90 PolarHBondContact O-N 3Å; T88-M91 PolarHBondContact O-N 3.38Å; T88-M92 HydrophobicContact CG2-CG 4.46Å; T88-M92 HydrophobicContact CG2-SD 4.32Å; T88-M92 VanDerWaalsContact O-CG 3.31Å; T88-M92 WeakPolarHBondContact O-CG 3.41Å; T88-M92 PolarHBondContact O-N 3.33Å
89L84.9Confident88.3Confident15 Ų1523.4 Ų23.48%0.07911%0.11CC..Hα-helixtrans-61.4-39.2176.3-74.5172.7000112.5L41 S85 I86 M92 S93 F220L41-L89 HydrophobicContact CD2-CD2 4.19Å; S85-L89 WeakPolarHBondContact O-CB 3.36Å; S85-L89 WeakPolarHBondContact O-CG 3.46Å; S85-L89 PolarHBondContact O-N 3.01Å; I86-L89 HydrophobicContact CD1-CB 4.48Å; I86-L89 PolarHBondContact O-N 3.29Å; L89-M92 PolarHBondContact O-N 2.9Å; L89-S93 PolarHBondContact O-N 2.95Å; L89-S93 PolarHBondContact O-OG 3.28Å; L89-F220 HydrophobicContact CD1-CD2 4.04Å
90T89.8Confident87.6Confident12 Ų1223.6 Ų23.67%0.07412%0.115CC..Hα-helixtrans-61.6-48.7174.5-56.60000110.4I86 F87 T88 M92 S93 V94 I178 I179I86-T90 WeakPolarHBondContact O-CB 3.3Å; I86-T90 PolarHBondContact O-N 3.29Å; I86-T90 PolarHBondContact O-OG1 3.37Å; F87-T90 PolarHBondContact O-N 3.42Å; T88-T90 VanDerWaalsContact C-N 3.31Å; T88-T90 PolarHBondContact O-N 3Å; T90-M92 PolarHBondContact O-N 2.96Å; T90-S93 WeakPolarHBondContact O-CB 3.15Å; T90-S93 PolarHBondContact O-N 3.42Å; T90-S93 VanDerWaalsContact O-N 3.1Å; T90-V94 WeakPolarHBondContact O-CG2 3.4Å; T90-V94 PolarHBondContact O-N 3.03Å; T90-I178 HydrophobicContact CG2-CB 3.91Å; T90-I178 HydrophobicContact CG2-CD1 4.18Å; T90-I178 HydrophobicContact CG2-CG2 3.52Å; T90-I179 HydrophobicContact CG2-CG1 4.46Å
91M90.1Very high87Confident40 Ų4022.2 Ų22.220%0.19711%0.111CC..Hα-helixtrans-67.1-34.1177.1-83.9-45.3-45.500113.8Y37 F87 T88 S93 V94 D95 F109 I118 I122Y37-M91 HydrophobicContact CE1-CB 4.31Å; F87-M91 PolarHBondContact O-N 2.82Å; T88-M91 PolarHBondContact O-N 3.38Å; M91-S93 VanDerWaalsContact C-N 3.26Å; M91-S93 PolarHBondContact O-N 3.43Å; M91-V94 HydrophobicContact CE-CB 3.69Å; M91-V94 HydrophobicContact CE-CG1 3.69Å; M91-V94 HydrophobicContact CE-CG2 4.46Å; M91-V94 PolarHBondContact O-N 3.38Å; M91-V94 HydrophobicContact SD-CB 4.22Å; M91-V94 HydrophobicContact SD-CG1 4.46Å; M91-V94 HydrophobicContact SD-CG2 4.37Å; M91-D95 WeakPolarHBondContact O-CB 3.24Å; M91-D95 PolarHBondContact O-N 3.27Å; M91-F109 HydrophobicContact CE-CE1 4.41Å; M91-F109 HydrophobicContact CE-CZ 4.05Å; M91-I118 HydrophobicContact CB-CG2 4.45Å; M91-I118 HydrophobicContact CG-CG2 3.81Å; M91-I122 HydrophobicContact CG-CD1 4.4Å
92M86Confident86.6Confident24 Ų2425.2 Ų25.212%0.11813%0.125CC..Hα-helixtrans-61.4-37.8171-72.9179.872.400111.3T34 Y37 I38 T88 L89 T90 D95 R96 Y268T34-M92 HydrophobicContact CG2-CE 4.35Å; Y37-M92 HydrophobicContact CD2-CG 4.35Å; Y37-M92 HydrophobicContact CG-CG 4.17Å; I38-M92 HydrophobicContact CD1-CE 4.29Å; I38-M92 HydrophobicContact CG1-CE 3.66Å; I38-M92 HydrophobicContact CG1-SD 4.43Å; T88-M92 HydrophobicContact CG2-CG 4.46Å; T88-M92 HydrophobicContact CG2-SD 4.32Å; T88-M92 VanDerWaalsContact O-CG 3.31Å; T88-M92 WeakPolarHBondContact O-CG 3.41Å; T88-M92 PolarHBondContact O-N 3.33Å; L89-M92 PolarHBondContact O-N 2.9Å; T90-M92 PolarHBondContact O-N 2.96Å; M92-D95 PolarHBondContact O-N 2.93Å; M92-R96 VanDerWaalsContact O-CG 3.26Å; M92-R96 WeakPolarHBondContact O-CG 3.06Å; M92-R96 PolarHBondContact O-N 2.97Å; M92-R96 VanDerWaalsContact O-N 3.08Å; M92-Y268 HydrophobicContact CE-CE1 4.3Å
93S84.3Confident86.1Confident3 Ų328 Ų282%0.02115%0.145CC..Hα-helixtrans-67.5-41.5176.7-54.50000111.6L89 T90 M91 R96 Y97 Y183L89-S93 PolarHBondContact O-N 2.95Å; L89-S93 PolarHBondContact O-OG 3.28Å; T90-S93 WeakPolarHBondContact O-CB 3.15Å; T90-S93 PolarHBondContact O-N 3.42Å; T90-S93 VanDerWaalsContact O-N 3.1Å; M91-S93 VanDerWaalsContact C-N 3.26Å; M91-S93 PolarHBondContact O-N 3.43Å; S93-R96 PolarHBondContact O-N 3.27Å; S93-Y97 WeakPolarHBondContact O-CB 3.07Å; S93-Y97 PolarHBondContact O-N 3.14Å; S93-Y183 WeakPolarHBondContact OG-CE2 3.48Å; S93-Y183 PolarHBondContact OG-OH 2.96Å
94V89.1Confident85.8Confident30 Ų3032.8 Ų32.818%0.18218%0.175CC..Hα-helixtrans-65.2-44.2173.7174.20000111.7T90 M91 R96 Y97 I98 I178T90-V94 WeakPolarHBondContact O-CG2 3.4Å; T90-V94 PolarHBondContact O-N 3.03Å; M91-V94 HydrophobicContact CE-CB 3.69Å; M91-V94 HydrophobicContact CE-CG1 3.69Å; M91-V94 HydrophobicContact CE-CG2 4.46Å; M91-V94 PolarHBondContact O-N 3.38Å; M91-V94 HydrophobicContact SD-CB 4.22Å; M91-V94 HydrophobicContact SD-CG1 4.46Å; M91-V94 HydrophobicContact SD-CG2 4.37Å; V94-R96 VanDerWaalsContact C-N 3.27Å; V94-R96 PolarHBondContact O-N 3.31Å; V94-Y97 WeakPolarHBondContact O-CB 3.36Å; V94-Y97 PolarHBondContact O-N 2.81Å; V94-I98 HydrophobicContact CG1-CD1 3.78Å; V94-I98 HydrophobicContact CG1-CG1 4.34Å; V94-I98 WeakPolarHBondContact O-CG1 3.43Å; V94-I98 PolarHBondContact O-N 2.66Å; V94-I178 HydrophobicContact CG2-CG2 4.2Å
95D86.1Confident85.5Confident1 Ų139.5 Ų39.51%0.00520%0.204CC..Hα-helixtrans-54.5-45.1175.6175.569.7000111.1T34 Y37 M91 M92 I98 A99 R110T34-D95 PolarHBondContact OG1-OD2 3.46Å; Y37-D95 HydrophobicContact CE2-CB 4.26Å; M91-D95 WeakPolarHBondContact O-CB 3.24Å; M91-D95 PolarHBondContact O-N 3.27Å; M92-D95 PolarHBondContact O-N 2.93Å; D95-I98 PolarHBondContact O-N 3.31Å; D95-A99 WeakPolarHBondContact O-CB 3.44Å; D95-A99 PolarHBondContact O-N 3.21Å; D95-R110 WeakPolarHBondContact OD1-CD 3.33Å; D95-R110 WeakPolarHBondContact OD1-CG 3.22Å; D95-R110 IonicContact OD1-CZ 2.8Å; D95-R110 IonicContact OD1-NE 2.8Å; D95-R110 PolarHBondContact OD1-NE 2.84Å; D95-R110 IonicContact OD1-NH2 3.42Å; D95-R110 IonicContact OD2-CZ 2.79Å; D95-R110 IonicContact OD2-NE 3.08Å; D95-R110 PolarHBondContact OD2-NE 2.91Å; D95-R110 IonicContact OD2-NH2 2.66Å; D95-R110 PolarHBondContact OD2-NH2 3.35Å
96R80.8Confident85.2Confident95 Ų9539.9 Ų39.936%0.35821%0.207SC..Hα-helixtrans-69.1-41.7177.7-67.6-65.3174.2178.51.6112.6M92 S93 V94 I98 A99 V100 M186M92-R96 VanDerWaalsContact O-CG 3.26Å; M92-R96 WeakPolarHBondContact O-CG 3.06Å; M92-R96 PolarHBondContact O-N 2.97Å; M92-R96 VanDerWaalsContact O-N 3.08Å; S93-R96 PolarHBondContact O-N 3.27Å; V94-R96 VanDerWaalsContact C-N 3.27Å; V94-R96 PolarHBondContact O-N 3.31Å; R96-I98 PolarHBondContact O-N 2.89Å; R96-A99 PolarHBondContact O-N 3.38Å; R96-V100 WeakPolarHBondContact O-CG2 3.04Å; R96-V100 PolarHBondContact O-N 2.87Å; R96-V100 VanDerWaalsContact O-N 3.11Å; R96-M186 HydrophobicContact CB-SD 4.43Å
97Y84.8Confident84.9Confident52 Ų5246.2 Ų46.220%0.20424%0.241CC..Hα-helixtrans-57.2-48.9173.3166.3-100.9000111.5S93 V94 A99 V100 C101 H102 L185 M186S93-Y97 WeakPolarHBondContact O-CB 3.07Å; S93-Y97 PolarHBondContact O-N 3.14Å; V94-Y97 WeakPolarHBondContact O-CB 3.36Å; V94-Y97 PolarHBondContact O-N 2.81Å; Y97-A99 PolarHBondContact O-N 2.99Å; Y97-V100 PolarHBondContact O-N 3.49Å; Y97-C101 HydrophobicContact CD2-CB 4.06Å; Y97-C101 VanDerWaalsContact CD2-SG 3.53Å; Y97-C101 HydrophobicContact CE2-CB 3.69Å; Y97-C101 WeakPolarHBondContact CE2-SG 3.36Å; Y97-C101 VanDerWaalsContact O-CB 3.26Å; Y97-C101 WeakPolarHBondContact O-CB 3.49Å; Y97-C101 PolarHBondContact O-N 2.85Å; Y97-H102 AromaticContact CE1-CD2 3.82Å; Y97-H102 AromaticContact CE1-NE2 3.89Å; Y97-H102 AromaticContact CZ-CD2 3.92Å; Y97-H102 AromaticContact CZ-NE2 3.63Å; Y97-H102 PolarHBondContact OH-NE2 2.87Å; Y97-L185 HydrophobicContact CD2-CB 4.09Å; Y97-L185 HydrophobicContact CE2-CB 3.61Å; Y97-L185 HydrophobicContact CE2-CD1 4.03Å; Y97-M186 HydrophobicContact CD2-CB 4.49Å
98I86.2Confident84.7Confident26 Ų2649.4 Ų49.413%0.13326%0.26CS..Hα-helixtrans-63.1-45179.3-66.6169.3000110.6V94 D95 R96 V100 H102 A106 F109V94-I98 HydrophobicContact CG1-CD1 3.78Å; V94-I98 HydrophobicContact CG1-CG1 4.34Å; V94-I98 WeakPolarHBondContact O-CG1 3.43Å; V94-I98 PolarHBondContact O-N 2.66Å; D95-I98 PolarHBondContact O-N 3.31Å; R96-I98 PolarHBondContact O-N 2.89Å; I98-V100 PolarHBondContact O-N 3.37Å; I98-H102 CarbonylContact O-C 3.19Å; I98-H102 WeakPolarHBondContact O-CA 3.33Å; I98-H102 PolarHBondContact O-N 3.2Å; I98-A106 HydrophobicContact CG2-CB 4.06Å; I98-F109 HydrophobicContact CD1-CD1 3.64Å; I98-F109 HydrophobicContact CD1-CD2 4.28Å; I98-F109 HydrophobicContact CD1-CE1 3.58Å; I98-F109 HydrophobicContact CD1-CE2 4.23Å; I98-F109 HydrophobicContact CD1-CG 4Å; I98-F109 HydrophobicContact CD1-CZ 3.89Å; I98-F109 HydrophobicContact CG2-CB 4.35Å; I98-F109 HydrophobicContact CG2-CD1 4.37Å
99A81.4Confident84.6Confident25 Ų2552.2 Ų52.221%0.20727%0.272CS..Hα-helixtrans-57.5-36.3179.300000113.4D95 R96 Y97D95-A99 WeakPolarHBondContact O-CB 3.44Å; D95-A99 PolarHBondContact O-N 3.21Å; R96-A99 PolarHBondContact O-N 3.38Å; Y97-A99 PolarHBondContact O-N 2.99Å
100V77.1Confident84.7Confident44 Ų4455.2 Ų55.227%0.26728%0.282SS..Hα-helixtrans-92.1-45.5-175172.40000112.1R96 Y97 I98 M186 L190R96-V100 WeakPolarHBondContact O-CG2 3.04Å; R96-V100 PolarHBondContact O-N 2.87Å; R96-V100 VanDerWaalsContact O-N 3.11Å; Y97-V100 PolarHBondContact O-N 3.49Å; I98-V100 PolarHBondContact O-N 3.37Å; V100-M186 HydrophobicContact CB-CG 3.97Å; V100-M186 HydrophobicContact CB-SD 4.44Å; V100-M186 HydrophobicContact CG1-CG 3.82Å; V100-M186 HydrophobicContact CG2-CG 4.23Å; V100-M186 HydrophobicContact CG2-SD 4.12Å; V100-L190 HydrophobicContact CG1-CD1 4.13Å; V100-L190 HydrophobicContact CG1-CD2 3.28Å; V100-L190 HydrophobicContact CG1-CG 3.65Å
101C80.9Confident84.7Confident14 Ų1456.7 Ų56.710%0.09529%0.291CS..Hα-helixtrans-85.3-28.4-173.4-63.70000113.1Y97 R189Y97-C101 HydrophobicContact CD2-CB 4.06Å; Y97-C101 VanDerWaalsContact CD2-SG 3.53Å; Y97-C101 HydrophobicContact CE2-CB 3.69Å; Y97-C101 WeakPolarHBondContact CE2-SG 3.36Å; Y97-C101 VanDerWaalsContact O-CB 3.26Å; Y97-C101 WeakPolarHBondContact O-CB 3.49Å; Y97-C101 PolarHBondContact O-N 2.85Å; C101-R189 HydrophobicContact CB-CG 4.35Å
102H83.6Confident84.6Confident65 Ų6557.4 Ų57.430%0.30130%0.299SS..  trans-134.264.1-173.1-59.1-77.1000111.4Y97 I98 V104 K105 A106Y97-H102 AromaticContact CE1-CD2 3.82Å; Y97-H102 AromaticContact CE1-NE2 3.89Å; Y97-H102 AromaticContact CZ-CD2 3.92Å; Y97-H102 AromaticContact CZ-NE2 3.63Å; Y97-H102 PolarHBondContact OH-NE2 2.87Å; I98-H102 CarbonylContact O-C 3.19Å; I98-H102 WeakPolarHBondContact O-CA 3.33Å; I98-H102 PolarHBondContact O-N 3.2Å; H102-V104 VanDerWaalsContact C-N 3.27Å; H102-V104 PolarHBondContact O-N 3.4Å; H102-K105 HydrophobicContact CB-CB 4.1Å; H102-K105 HydrophobicContact CB-CD 4.27Å; H102-K105 HydrophobicContact CB-CG 4.41Å; H102-K105 PolarHBondContact O-N 3.3Å; H102-K105 VanDerWaalsContact O-N 3.14Å; H102-A106 PolarHBondContact O-N 2.85Å
103P78.8Confident84.9Confident80 Ų8061 Ų6152%0.51932%0.322SS..Hα-helixtrans-60.7-31.7-170.124-34.8000114A106P103-A106 WeakPolarHBondContact O-CB 3.22Å; P103-A106 PolarHBondContact O-N 3.45Å
104V84.1Confident85.3Confident114 Ų11465.1 Ų65.169%0.69134%0.34SS*.Hα-helixtrans-68.8-49.5176.3-1780000110.7H102 A106 L107H102-V104 VanDerWaalsContact C-N 3.27Å; H102-V104 PolarHBondContact O-N 3.4Å; V104-A106 PolarHBondContact O-N 3.37Å; V104-L107 WeakPolarHBondContact O-CB 3.33Å; V104-L107 PolarHBondContact O-N 3.1Å
105K86.4Confident85.4Confident140 Ų14063.8 Ų63.861%0.60933%0.331SS*.Hα-helixtrans-63.6-27.6176.3-63-176.2178.7178.40112.3H102 L107 D108 F109H102-K105 HydrophobicContact CB-CB 4.1Å; H102-K105 HydrophobicContact CB-CD 4.27Å; H102-K105 HydrophobicContact CB-CG 4.41Å; H102-K105 PolarHBondContact O-N 3.3Å; H102-K105 VanDerWaalsContact O-N 3.14Å; K105-L107 PolarHBondContact O-N 3.34Å; K105-D108 PolarHBondContact O-N 3.42Å; K105-F109 WeakPolarHBondContact O-CB 3.29Å; K105-F109 PolarHBondContact O-N 2.91Å
106A83.6Confident85.7Confident10 Ų1070 Ų708%0.08336%0.358CS..Hα-helixtrans-62.9-29.417800000112.9I98 H102 P103 V104 D108 R110I98-A106 HydrophobicContact CG2-CB 4.06Å; H102-A106 PolarHBondContact O-N 2.85Å; P103-A106 WeakPolarHBondContact O-CB 3.22Å; P103-A106 PolarHBondContact O-N 3.45Å; V104-A106 PolarHBondContact O-N 3.37Å; A106-D108 VanDerWaalsContact C-N 3.32Å; A106-D108 PolarHBondContact O-N 2.87Å; A106-R110 HydrophobicContact CB-CG 4.31Å; A106-R110 VanDerWaalsContact O-CB 3.25Å; A106-R110 WeakPolarHBondContact O-CB 3.28Å; A106-R110 VanDerWaalsContact O-CG 3.3Å; A106-R110 WeakPolarHBondContact O-CG 3.37Å; A106-R110 PolarHBondContact O-N 3.38Å
107L82.9Confident86.4Confident138 Ų13869.9 Ų69.972%0.72336%0.364SS*.Hα-helixtrans-62.7-40.7176.6-64.5173000111.5V104 K105V104-L107 WeakPolarHBondContact O-CB 3.33Å; V104-L107 PolarHBondContact O-N 3.1Å; K105-L107 PolarHBondContact O-N 3.34Å
108D87.4Confident86.9Confident110 Ų11068.9 Ų68.959%0.58836%0.362SS*.Hα-helixtrans-82.3-34.9179.7-60.9-33.7000112.4K105 A106 K114K105-D108 PolarHBondContact O-N 3.42Å; A106-D108 VanDerWaalsContact C-N 3.32Å; A106-D108 PolarHBondContact O-N 2.87Å; D108-K114 WeakPolarHBondContact O-CD 3.37Å; D108-K114 WeakPolarHBondContact O-CE 3.48Å; D108-K114 PolarHBondContact O-NZ 3.36Å
109F87.4Confident87.2Confident59 Ų5968.4 Ų68.426%0.25936%0.359SS..Hα-helixtrans-77.7-43.6-175.4-173-97.8000112.6M91 I98 K105 T111 I118M91-F109 HydrophobicContact CE-CE1 4.41Å; M91-F109 HydrophobicContact CE-CZ 4.05Å; I98-F109 HydrophobicContact CD1-CD1 3.64Å; I98-F109 HydrophobicContact CD1-CD2 4.28Å; I98-F109 HydrophobicContact CD1-CE1 3.58Å; I98-F109 HydrophobicContact CD1-CE2 4.23Å; I98-F109 HydrophobicContact CD1-CG 4Å; I98-F109 HydrophobicContact CD1-CZ 3.89Å; I98-F109 HydrophobicContact CG2-CB 4.35Å; I98-F109 HydrophobicContact CG2-CD1 4.37Å; K105-F109 WeakPolarHBondContact O-CB 3.29Å; K105-F109 PolarHBondContact O-N 2.91Å; F109-T111 PolarHBondContact O-N 2.93Å; F109-I118 HydrophobicContact CZ-CD1 4.03Å
110R87.7Confident87.9Confident77 Ų7771.6 Ų71.629%0.29138%0.376SS..SBendtrans-85.948.1-169.3-56-17675.5-1515.7112.8A33 T34 D95 A106A33-R110 HydrophobicContact CB-CB 4.23Å; A33-R110 WeakPolarHBondContact CB-O 3.4Å; T34-R110 PolarHBondContact OG1-NH2 2.9Å; D95-R110 WeakPolarHBondContact OD1-CD 3.33Å; D95-R110 WeakPolarHBondContact OD1-CG 3.22Å; D95-R110 IonicContact OD1-CZ 2.8Å; D95-R110 IonicContact OD1-NE 2.8Å; D95-R110 PolarHBondContact OD1-NE 2.84Å; D95-R110 IonicContact OD1-NH2 3.42Å; D95-R110 IonicContact OD2-CZ 2.79Å; D95-R110 IonicContact OD2-NE 3.08Å; D95-R110 PolarHBondContact OD2-NE 2.91Å; D95-R110 IonicContact OD2-NH2 2.66Å; D95-R110 PolarHBondContact OD2-NH2 3.35Å; A106-R110 HydrophobicContact CB-CG 4.31Å; A106-R110 VanDerWaalsContact O-CB 3.25Å; A106-R110 WeakPolarHBondContact O-CB 3.28Å; A106-R110 VanDerWaalsContact O-CG 3.3Å; A106-R110 WeakPolarHBondContact O-CG 3.37Å; A106-R110 PolarHBondContact O-N 3.38Å
111T90.1Very high88.8Confident43 Ų4373.6 Ų73.626%0.26439%0.385SS..  trans-93.8144.2176.961.80000110.8F109 V113 K114 A115F109-T111 PolarHBondContact O-N 2.93Å; T111-V113 PolarHBondContact O-N 3.03Å; T111-K114 PolarHBondContact O-N 3.46Å; T111-K114 WeakPolarHBondContact OG1-CB 3.21Å; T111-K114 VanDerWaalsContact OG1-CG 3.26Å; T111-K114 WeakPolarHBondContact OG1-CG 3.4Å; T111-K114 PolarHBondContact OG1-N 3.29Å; T111-A115 PolarHBondContact O-N 3.24Å
112P88.1Confident89.5Confident55 Ų5573.2 Ų73.236%0.35738%0.382SS..Hα-helixtrans-55.9-33.8176.9-29.837.3000114I36 K116I36-P112 HydrophobicContact CD1-CB 3.59Å; P112-K116 WeakPolarHBondContact O-CG 3.33Å; P112-K116 PolarHBondContact O-N 3.49Å
113V91.5Very high90Very high100 Ų10073.7 Ų73.761%0.60638%0.381SS*.Hα-helixtrans-67-48.9179-179.70000110.7T111 A115 K116 I117T111-V113 PolarHBondContact O-N 3.03Å; V113-A115 VanDerWaalsContact C-N 3.33Å; V113-A115 PolarHBondContact O-N 2.99Å; V113-K116 PolarHBondContact O-N 3.27Å; V113-I117 HydrophobicContact CG1-CD1 4.14Å; V113-I117 WeakPolarHBondContact O-CG1 3.17Å; V113-I117 PolarHBondContact O-N 3.14Å
114K93.2Very high90.8Very high90 Ų9074.4 Ų74.439%0.39138%0.383SS..Hα-helixtrans-62.7-40.4177.3-71.3180-178.2177.20111.9D108 T111 K116 I117 I118D108-K114 WeakPolarHBondContact O-CD 3.37Å; D108-K114 WeakPolarHBondContact O-CE 3.48Å; D108-K114 PolarHBondContact O-NZ 3.36Å; T111-K114 PolarHBondContact O-N 3.46Å; T111-K114 WeakPolarHBondContact OG1-CB 3.21Å; T111-K114 VanDerWaalsContact OG1-CG 3.26Å; T111-K114 WeakPolarHBondContact OG1-CG 3.4Å; T111-K114 PolarHBondContact OG1-N 3.29Å; K114-K116 VanDerWaalsContact C-N 3.34Å; K114-K116 PolarHBondContact O-N 2.76Å; K114-I117 PolarHBondContact O-N 3Å; K114-I118 VanDerWaalsContact O-CG1 3.31Å; K114-I118 WeakPolarHBondContact O-CG1 3.37Å; K114-I118 PolarHBondContact O-N 2.99Å
115A91.4Very high91.3Very high1 Ų173.6 Ų73.61%0.00838%0.375CS..Hα-helixtrans-60.7-41.1175.800000112.4A33 I36 Y37 T111 V113 I118 N119A33-A115 HydrophobicContact CB-CB 3.95Å; I36-A115 HydrophobicContact CB-CB 4.04Å; I36-A115 HydrophobicContact CD1-CB 4.32Å; I36-A115 HydrophobicContact CG2-CB 3.81Å; Y37-A115 HydrophobicContact CE1-CB 4.4Å; Y37-A115 HydrophobicContact CE2-CB 4.29Å; T111-A115 PolarHBondContact O-N 3.24Å; V113-A115 VanDerWaalsContact C-N 3.33Å; V113-A115 PolarHBondContact O-N 2.99Å; A115-I118 PolarHBondContact O-N 3.38Å; A115-N119 PolarHBondContact O-N 3.19Å
116K92.2Very high91.7Very high131 Ų13166.9 Ų66.957%0.5735%0.346SS*.Hα-helixtrans-62.9-43.7174-73.7176.7-177.9-175.10112.2I36 P112 V113 K114 I118 N119 V120I36-K116 HydrophobicContact CD1-CG 4.32Å; I36-K116 HydrophobicContact CG2-CG 4.11Å; P112-K116 WeakPolarHBondContact O-CG 3.33Å; P112-K116 PolarHBondContact O-N 3.49Å; V113-K116 PolarHBondContact O-N 3.27Å; K114-K116 VanDerWaalsContact C-N 3.34Å; K114-K116 PolarHBondContact O-N 2.76Å; K116-I118 VanDerWaalsContact C-N 3.34Å; K116-N119 WeakPolarHBondContact O-CB 3.24Å; K116-N119 PolarHBondContact O-N 3.35Å; K116-V120 WeakPolarHBondContact O-CG2 3.42Å; K116-V120 PolarHBondContact O-N 2.83Å
117I95.2Very high92.2Very high93 Ų9367.7 Ų67.748%0.47735%0.351SS..Hα-helixtrans-61-45.7177-66167000110.2V113 K114 N119 V120 I121V113-I117 HydrophobicContact CG1-CD1 4.14Å; V113-I117 WeakPolarHBondContact O-CG1 3.17Å; V113-I117 PolarHBondContact O-N 3.14Å; K114-I117 PolarHBondContact O-N 3Å; I117-N119 VanDerWaalsContact C-N 3.32Å; I117-N119 PolarHBondContact O-N 3.37Å; I117-V120 PolarHBondContact O-N 2.85Å; I117-V120 VanDerWaalsContact O-N 3.16Å; I117-I121 HydrophobicContact CG2-CD1 4.03Å; I117-I121 WeakPolarHBondContact O-CG1 3.34Å; I117-I121 PolarHBondContact O-N 3.15Å
118I94.7Very high92.6Very high32 Ų3264.8 Ų64.816%0.16435%0.346CS..Hα-helixtrans-61.1-41.5177.5-68.7165.1000110.9Y37 M91 F109 K114 A115 K116 V120 I121 I122Y37-I118 HydrophobicContact CE1-CB 4.1Å; Y37-I118 HydrophobicContact CE1-CG2 3.72Å; Y37-I118 WeakPolarHBondContact OH-CD1 3.38Å; M91-I118 HydrophobicContact CB-CG2 4.45Å; M91-I118 HydrophobicContact CG-CG2 3.81Å; F109-I118 HydrophobicContact CZ-CD1 4.03Å; K114-I118 VanDerWaalsContact O-CG1 3.31Å; K114-I118 WeakPolarHBondContact O-CG1 3.37Å; K114-I118 PolarHBondContact O-N 2.99Å; A115-I118 PolarHBondContact O-N 3.38Å; K116-I118 VanDerWaalsContact C-N 3.34Å; I118-V120 PolarHBondContact O-N 3.04Å; I118-I121 WeakPolarHBondContact O-CB 3.13Å; I118-I121 PolarHBondContact O-N 3.07Å; I118-I122 HydrophobicContact CG2-CD1 4.07Å; I118-I122 HydrophobicContact CG2-CG1 4.48Å; I118-I122 WeakPolarHBondContact O-CG1 3.13Å; I118-I122 PolarHBondContact O-N 3.47Å
119N93.9Very high92.7Very high15 Ų1560 Ų608%0.0832%0.323CS..Hα-helixtrans-59.8-44.9174-76-9000112.1I36 Y37 A115 K116 I117 I121 I122 W123I36-N119 WeakPolarHBondContact CG2-ND2 3.23Å; I36-N119 PolarHBondContact O-ND2 3.43Å; Y37-N119 WeakPolarHBondContact CD1-OD1 3.08Å; A115-N119 PolarHBondContact O-N 3.19Å; K116-N119 WeakPolarHBondContact O-CB 3.24Å; K116-N119 PolarHBondContact O-N 3.35Å; I117-N119 VanDerWaalsContact C-N 3.32Å; I117-N119 PolarHBondContact O-N 3.37Å; N119-I121 VanDerWaalsContact C-N 3.28Å; N119-I121 PolarHBondContact O-N 3.46Å; N119-I122 WeakPolarHBondContact O-CB 3.48Å; N119-I122 PolarHBondContact O-N 3.37Å; N119-I122 VanDerWaalsContact O-N 3.11Å; N119-W123 PolarHBondContact O-N 2.86Å
120V95.3Very high92.9Very high92 Ų9257.2 Ų57.256%0.55831%0.31SS*.Hα-helixtrans-58.9-43176.1173.30000110.6K116 I117 I118 I122 W123 V124K116-V120 WeakPolarHBondContact O-CG2 3.42Å; K116-V120 PolarHBondContact O-N 2.83Å; I117-V120 PolarHBondContact O-N 2.85Å; I117-V120 VanDerWaalsContact O-N 3.16Å; I118-V120 PolarHBondContact O-N 3.04Å; V120-I122 VanDerWaalsContact C-N 3.33Å; V120-I122 PolarHBondContact O-N 3.46Å; V120-W123 PolarHBondContact O-N 2.81Å; V120-V124 HydrophobicContact CG1-CG2 4.47Å; V120-V124 WeakPolarHBondContact O-CG2 3.28Å; V120-V124 PolarHBondContact O-N 3.22Å
121I96.1Very high93.1Very high87 Ų8757.5 Ų57.545%0.44632%0.317SS..Hα-helixtrans-60.4-43.3175.2-66.4166.8000111I117 I118 N119 W123 V124 L125I117-I121 HydrophobicContact CG2-CD1 4.03Å; I117-I121 WeakPolarHBondContact O-CG1 3.34Å; I117-I121 PolarHBondContact O-N 3.15Å; I118-I121 WeakPolarHBondContact O-CB 3.13Å; I118-I121 PolarHBondContact O-N 3.07Å; N119-I121 VanDerWaalsContact C-N 3.28Å; N119-I121 PolarHBondContact O-N 3.46Å; I121-W123 VanDerWaalsContact C-N 3.32Å; I121-W123 PolarHBondContact O-N 2.94Å; I121-V124 PolarHBondContact O-N 3.39Å; I121-L125 HydrophobicContact CG2-CD1 3.86Å; I121-L125 HydrophobicContact CG2-CG 4.19Å; I121-L125 WeakPolarHBondContact O-CB 3.16Å; I121-L125 VanDerWaalsContact O-CG 3.31Å; I121-L125 WeakPolarHBondContact O-CG 3.41Å; I121-L125 PolarHBondContact O-N 3.46Å
122I95.6Very high93.2Very high6 Ų658 Ų583%0.03132%0.321CS..Hα-helixtrans-58.4-44.5177.3-71.4167.8000111.1T84 F87 M91 I118 N119 V120 L125 S126T84-I122 HydrophobicContact CG2-CG2 3.95Å; F87-I122 HydrophobicContact CB-CD1 4.48Å; F87-I122 HydrophobicContact CB-CG1 4.07Å; F87-I122 HydrophobicContact CB-CG2 3.86Å; F87-I122 HydrophobicContact CD2-CG2 4.42Å; M91-I122 HydrophobicContact CG-CD1 4.4Å; I118-I122 HydrophobicContact CG2-CD1 4.07Å; I118-I122 HydrophobicContact CG2-CG1 4.48Å; I118-I122 WeakPolarHBondContact O-CG1 3.13Å; I118-I122 PolarHBondContact O-N 3.47Å; N119-I122 WeakPolarHBondContact O-CB 3.48Å; N119-I122 PolarHBondContact O-N 3.37Å; N119-I122 VanDerWaalsContact O-N 3.11Å; V120-I122 VanDerWaalsContact C-N 3.33Å; V120-I122 PolarHBondContact O-N 3.46Å; I122-L125 PolarHBondContact O-N 3.49Å; I122-S126 VanDerWaalsContact O-CB 3.29Å; I122-S126 WeakPolarHBondContact O-CB 3.33Å; I122-S126 PolarHBondContact O-N 3.45Å; I122-S126 PolarHBondContact O-OG 3.31Å
123W95.2Very high93.4Very high74 Ų7455.5 Ų55.528%0.2831%0.305SS..Hα-helixtrans-65.3-40.7177-80.699.6000112.4N40 V43 L47 Y80 T84 N119 V120 I121 S126 S127N40-W123 PolarHBondContact OD1-NE1 3.45Å; V43-W123 HydrophobicContact CG1-CZ2 4.21Å; L47-W123 HydrophobicContact CD1-CH2 4.19Å; Y80-W123 AromaticContact CD1-CE3 3.84Å; Y80-W123 HydrophobicContact CD1-CE3 3.84Å; Y80-W123 AromaticContact CD1-CZ3 3.76Å; Y80-W123 HydrophobicContact CD1-CZ3 3.76Å; Y80-W123 HydrophobicContact CE1-CE3 4.04Å; Y80-W123 HydrophobicContact CE1-CZ3 4.3Å; Y80-W123 HydrophobicContact CG-CZ3 4.32Å; T84-W123 HydrophobicContact CG2-CZ2 4.2Å; N119-W123 PolarHBondContact O-N 2.86Å; V120-W123 PolarHBondContact O-N 2.81Å; I121-W123 VanDerWaalsContact C-N 3.32Å; I121-W123 PolarHBondContact O-N 2.94Å; W123-S126 PolarHBondContact O-N 3.44Å; W123-S127 WeakPolarHBondContact O-CB 3.17Å; W123-S127 PolarHBondContact O-N 3.27Å; W123-S127 PolarHBondContact O-OG 2.83Å
124V95.6Very high93.5Very high95 Ų9554.6 Ų54.658%0.57629%0.294SS*.Hα-helixtrans-63-45.8175.5171.30000110.7V120 I121 S126 S127 A128V120-V124 HydrophobicContact CG1-CG2 4.47Å; V120-V124 WeakPolarHBondContact O-CG2 3.28Å; V120-V124 PolarHBondContact O-N 3.22Å; I121-V124 PolarHBondContact O-N 3.39Å; V124-S126 VanDerWaalsContact C-N 3.34Å; V124-S126 PolarHBondContact O-N 2.99Å; V124-S127 WeakPolarHBondContact O-CB 3.44Å; V124-S127 PolarHBondContact O-N 3.27Å; V124-A128 PolarHBondContact O-N 3.31Å
125L94.1Very high93.5Very high97 Ų9755.1 Ų55.151%0.50831%0.305SS..Hα-helixtrans-63.7-40.1176.7-69.9174.8000112F87 I121 I122 S127 A128F87-L125 HydrophobicContact CD2-CB 4.3Å; F87-L125 HydrophobicContact CE2-CB 3.96Å; I121-L125 HydrophobicContact CG2-CD1 3.86Å; I121-L125 HydrophobicContact CG2-CG 4.19Å; I121-L125 WeakPolarHBondContact O-CB 3.16Å; I121-L125 VanDerWaalsContact O-CG 3.31Å; I121-L125 WeakPolarHBondContact O-CG 3.41Å; I121-L125 PolarHBondContact O-N 3.46Å; I122-L125 PolarHBondContact O-N 3.49Å; L125-S127 VanDerWaalsContact C-N 3.29Å; L125-S127 PolarHBondContact O-N 2.86Å; L125-A128 VanDerWaalsContact O-CB 3.27Å; L125-A128 WeakPolarHBondContact O-CB 3.38Å; L125-A128 PolarHBondContact O-N 2.87Å
126S94.5Very high93.5Very high0 Ų057.2 Ų57.20%032%0.316CS..Hα-helixtrans-68.1-32.1177.2-590000111.5F83 T84 I122 W123 V124 A128 A129 G130F83-S126 WeakPolarHBondContact CB-OG 3.23Å; T84-S126 PolarHBondContact N-OG 2.8Å; T84-S126 PolarHBondContact OG1-OG 2.8Å; I122-S126 VanDerWaalsContact O-CB 3.29Å; I122-S126 WeakPolarHBondContact O-CB 3.33Å; I122-S126 PolarHBondContact O-N 3.45Å; I122-S126 PolarHBondContact O-OG 3.31Å; W123-S126 PolarHBondContact O-N 3.44Å; V124-S126 VanDerWaalsContact C-N 3.34Å; V124-S126 PolarHBondContact O-N 2.99Å; S126-A128 PolarHBondContact O-N 3.32Å; S126-A129 PolarHBondContact O-N 3.2Å; S126-A129 VanDerWaalsContact O-N 3.11Å; S126-G130 PolarHBondContact O-N 3.33Å
127S94Very high93.5Very high27 Ų2751 Ų5119%0.18929%0.289CS..Hα-helixtrans-64.2-26.9174.4-58.10000112.9Y80 W123 V124 L125 A129 G130 I131Y80-S127 VanDerWaalsContact CE1-OG 3.29Å; Y80-S127 WeakPolarHBondContact CE1-OG 3.36Å; Y80-S127 WeakPolarHBondContact OH-CA 3.37Å; Y80-S127 WeakPolarHBondContact OH-CB 3.36Å; Y80-S127 PolarHBondContact OH-OG 3.39Å; W123-S127 WeakPolarHBondContact O-CB 3.17Å; W123-S127 PolarHBondContact O-N 3.27Å; W123-S127 PolarHBondContact O-OG 2.83Å; V124-S127 WeakPolarHBondContact O-CB 3.44Å; V124-S127 PolarHBondContact O-N 3.27Å; L125-S127 VanDerWaalsContact C-N 3.29Å; L125-S127 PolarHBondContact O-N 2.86Å; S127-A129 PolarHBondContact O-N 2.91Å; S127-G130 PolarHBondContact O-N 2.84Å; S127-I131 WeakPolarHBondContact O-CB 3.32Å; S127-I131 WeakPolarHBondContact O-CG1 3.2Å; S127-I131 PolarHBondContact O-N 3.08Å
128A91.9Very high93.5Very high76 Ų7649.2 Ų49.263%0.62828%0.28SS*.Hα-helixtrans-62.1-22.8174.700000112.9V124 L125 S126 P132V124-A128 PolarHBondContact O-N 3.31Å; L125-A128 VanDerWaalsContact O-CB 3.27Å; L125-A128 WeakPolarHBondContact O-CB 3.38Å; L125-A128 PolarHBondContact O-N 2.87Å; S126-A128 PolarHBondContact O-N 3.32Å; A128-P132 WeakPolarHBondContact O-CD 3.31Å; A128-P132 VanDerWaalsContact O-CG 3.28Å; A128-P132 WeakPolarHBondContact O-CG 3.26Å
129A89.4Confident93.3Very high11 Ų1149.1 Ų49.19%0.09128%0.281CS..Hα-helixtrans-105.6-37.4171.900000112.7F83 S126 S127 P132 A133 M163F83-A129 HydrophobicContact CD2-CB 3.63Å; F83-A129 HydrophobicContact CE2-CB 3.27Å; F83-A129 HydrophobicContact CG-CB 4.48Å; F83-A129 HydrophobicContact CZ-CB 3.85Å; S126-A129 PolarHBondContact O-N 3.2Å; S126-A129 VanDerWaalsContact O-N 3.11Å; S127-A129 PolarHBondContact O-N 2.91Å; A129-P132 WeakPolarHBondContact O-CD 3.4Å; A129-A133 VanDerWaalsContact O-CB 3.28Å; A129-A133 WeakPolarHBondContact O-CB 3.45Å; A129-A133 PolarHBondContact O-N 3.28Å; A129-M163 HydrophobicContact CB-CE 4.22Å
130G91.2Very high93.1Very high0 Ų052.4 Ų52.40%030%0.299CS..Hα-helixtrans-67.7-35.2-177.800000114.3S76 S126 S127 M134S76-G130 PolarHBondContact OG-O 2.89Å; S126-G130 PolarHBondContact O-N 3.33Å; S127-G130 PolarHBondContact O-N 2.84Å; G130-M134 WeakPolarHBondContact O-CB 3.31Å; G130-M134 PolarHBondContact O-N 2.88Å
131I92.7Very high92.8Very high83 Ų8352.2 Ų52.243%0.42630%0.298SS..Hα-helixtrans-70.8-50.9176.6-64.6171.8000110.8S127 A133 M134 V135S127-I131 WeakPolarHBondContact O-CB 3.32Å; S127-I131 WeakPolarHBondContact O-CG1 3.2Å; S127-I131 PolarHBondContact O-N 3.08Å; I131-A133 VanDerWaalsContact C-N 3.28Å; I131-A133 PolarHBondContact O-N 3.35Å; I131-M134 WeakPolarHBondContact O-CB 3.31Å; I131-M134 PolarHBondContact O-N 2.99Å; I131-M134 VanDerWaalsContact O-N 3.11Å; I131-V135 HydrophobicContact CG2-CG2 4.48Å; I131-V135 WeakPolarHBondContact O-CG2 3.42Å; I131-V135 PolarHBondContact O-N 2.71Å
132P91.5Very high92.2Very high54 Ų5452.7 Ų52.735%0.35130%0.301SS..Hα-helixtrans-55.3-42.8172.8-28.836.6000112.9A128 A129 M134 V135 L136A128-P132 WeakPolarHBondContact O-CD 3.31Å; A128-P132 VanDerWaalsContact O-CG 3.28Å; A128-P132 WeakPolarHBondContact O-CG 3.26Å; A129-P132 WeakPolarHBondContact O-CD 3.4Å; P132-M134 VanDerWaalsContact C-N 3.3Å; P132-M134 PolarHBondContact O-N 2.71Å; P132-V135 PolarHBondContact O-N 2.87Å; P132-L136 WeakPolarHBondContact O-CB 3.42Å; P132-L136 WeakPolarHBondContact O-CG 3.44Å; P132-L136 PolarHBondContact O-N 3.2Å
133A91.7Very high91.5Very high2 Ų260 Ų602%0.01734%0.34CS..Hα-helixtrans-61.2-38.117700000112.5I75 Y79 A129 I131 G137 L150I75-A133 HydrophobicContact CG2-CB 3.94Å; I75-A133 WeakPolarHBondContact CG2-O 3.44Å; Y79-A133 HydrophobicContact CD1-CB 4.03Å; Y79-A133 HydrophobicContact CD2-CB 3.78Å; Y79-A133 HydrophobicContact CE1-CB 4.48Å; Y79-A133 HydrophobicContact CE2-CB 4.22Å; Y79-A133 HydrophobicContact CG-CB 3.67Å; A129-A133 VanDerWaalsContact O-CB 3.28Å; A129-A133 WeakPolarHBondContact O-CB 3.45Å; A129-A133 PolarHBondContact O-N 3.28Å; I131-A133 VanDerWaalsContact C-N 3.28Å; I131-A133 PolarHBondContact O-N 3.35Å; A133-G137 WeakPolarHBondContact O-CA 3.16Å; A133-G137 PolarHBondContact O-N 2.9Å; A133-L150 HydrophobicContact CB-CD2 4.17Å; A133-L150 WeakPolarHBondContact O-CD2 3.3Å
134M93.3Very high90.9Very high80 Ų8059.7 Ų59.739%0.39436%0.36SS..Hα-helixtrans-67-39.1175.1-173.6-179.765.100112.8K72 G130 I131 P132K72-M134 HydrophobicContact CB-CG 4.44Å; K72-M134 WeakPolarHBondContact CG-O 3.49Å; G130-M134 WeakPolarHBondContact O-CB 3.31Å; G130-M134 PolarHBondContact O-N 2.88Å; I131-M134 WeakPolarHBondContact O-CB 3.31Å; I131-M134 PolarHBondContact O-N 2.99Å; I131-M134 VanDerWaalsContact O-N 3.11Å; P132-M134 VanDerWaalsContact C-N 3.3Å; P132-M134 PolarHBondContact O-N 2.71Å
135V93.9Very high90.4Very high101 Ų10158 Ų5861%0.61235%0.351SS*.Hα-helixtrans-71.8-41179.9173.20000111.1I131 P132I131-V135 HydrophobicContact CG2-CG2 4.48Å; I131-V135 WeakPolarHBondContact O-CG2 3.42Å; I131-V135 PolarHBondContact O-N 2.71Å; P132-V135 PolarHBondContact O-N 2.87Å
136L92.2Very high90.2Very high46 Ų4654.8 Ų54.824%0.24134%0.335CS..Hα-helixtrans-80.7-22.5-179-63.6169.4000112.7P132 N138 L150 Q151 F152P132-L136 WeakPolarHBondContact O-CB 3.42Å; P132-L136 WeakPolarHBondContact O-CG 3.44Å; P132-L136 PolarHBondContact O-N 3.2Å; L136-N138 PolarHBondContact O-N 2.88Å; L136-L150 HydrophobicContact CB-CD2 3.91Å; L136-Q151 VanDerWaalsContact CD2-O 3.29Å; L136-Q151 WeakPolarHBondContact CD2-O 3.2Å; L136-Q151 PolarHBondContact O-N 3.03Å; L136-F152 HydrophobicContact CD1-CD1 3.93Å; L136-F152 HydrophobicContact CD1-CE1 3.79Å
137G92.4Very high90Very high0 Ų060.6 Ų60.60%036%0.362CS..EExtended strand (participates in β ladder)trans-61.5124.517700000111K72 A133K72-G137 WeakPolarHBondContact CE-O 3.36Å; K72-G137 WeakPolarHBondContact CG-O 3.29Å; A133-G137 WeakPolarHBondContact O-CA 3.16Å; A133-G137 PolarHBondContact O-N 2.9Å
138N93.8Very high89.8Confident55 Ų5560.7 Ų60.729%0.29436%0.362SS..EExtended strand (participates in β ladder)trans-152161.5178.7-160.99.2000111E68 L136 A149 Q151E68-N138 VanDerWaalsContact CG-OD1 3.28Å; E68-N138 WeakPolarHBondContact CG-OD1 3.45Å; L136-N138 PolarHBondContact O-N 2.88Å; N138-A149 PolarHBondContact N-O 2.94Å; N138-A149 PolarHBondContact O-N 2.82Å; N138-A149 VanDerWaalsContact O-N 3.08Å; N138-Q151 HydrophobicContact CB-CB 4.38Å; N138-Q151 HydrophobicContact CB-CG 3.7Å
139T91.9Very high89.7Confident31 Ų3158.6 Ų58.619%0.1935%0.345CS..EExtended strand (participates in β ladder)trans-93.9130.3171.948.10000110.4W64 C71 T146 E147W64-T139 HydrophobicContact CG-CG2 4.49Å; C71-T139 HydrophobicContact CB-CG2 3.74Å; T139-T146 HydrophobicContact CG2-CG2 4.13Å; T139-E147 CarbonylContact C-O 3.55Å; T139-E147 VanDerWaalsContact CA-O 3.26Å; T139-E147 WeakPolarHBondContact CA-O 2.87Å
140N89.3Confident89.8Confident84 Ų8459.2 Ų59.245%0.44935%0.347SS..EExtended strand (participates in β ladder)trans-116.6126.8172.2-169.7-7.2000109.4T146 E147N140-T146 WeakPolarHBondContact O-CA 3.42Å; N140-E147 PolarHBondContact N-O 2.98Å; N140-E147 PolarHBondContact O-N 3.18Å
141T88.9Confident89.8Confident88 Ų8862.2 Ų62.254%0.5436%0.361SS..EExtended strand (participates in β ladder)trans-103.4114.3179.3-55.10000109.4T145 T146T141-T145 CarbonylContact C-O 3.58Å; T141-T145 WeakPolarHBondContact CA-O 3.4Å; T141-T146 PolarHBondContact OG1-OG1 3.44Å
142N83.8Confident89.6Confident96 Ų9659.3 Ų59.351%0.51335%0.345SS..EExtended strand (participates in β ladder)trans-121.5129.2175.4-169.10.1000109.3G144 T145N142-G144 PolarHBondContact O-N 3.29Å; N142-T145 PolarHBondContact N-O 2.91Å; N142-T145 PolarHBondContact O-N 3.06Å; N142-T145 VanDerWaalsContact O-O 3.05Å; N142-T145 PolarHBondContact O-OG1 3.4Å
143N80.8Confident89.6Confident159 Ų15960 Ų6085%0.8535%0.349SS*.THydrogen-bonded Turntrans49.633.7177.4-63.3-26.8000115.7T145N143-T145 VanDerWaalsContact C-N 3.3Å; N143-T145 PolarHBondContact O-N 3.4Å
144G81.6Confident89.4Confident68 Ų6867.1 Ų67.170%0.70139%0.387SS*.THydrogen-bonded Turntrans84.4-5.6-179.700000115.2N142N142-G144 PolarHBondContact O-N 3.29Å
145T85.4Confident89.3Confident61 Ų6167.3 Ų67.337%0.37439%0.394SS..EExtended strand (participates in β ladder)trans-96.8130.9169.947.10000110.1T141 N142 N143T141-T145 CarbonylContact C-O 3.58Å; T141-T145 WeakPolarHBondContact CA-O 3.4Å; N142-T145 PolarHBondContact N-O 2.91Å; N142-T145 PolarHBondContact O-N 3.06Å; N142-T145 VanDerWaalsContact O-O 3.05Å; N142-T145 PolarHBondContact O-OG1 3.4Å; N143-T145 VanDerWaalsContact C-N 3.3Å; N143-T145 PolarHBondContact O-N 3.4Å
146T90.4Very high89Confident28 Ų2867 Ų6717%0.17238%0.383CS..EExtended strand (participates in β ladder)trans-105.1125.6178.6-600000109S63 W64 T139 N140 T141S63-T146 CarbonylContact C-O 3.53Å; S63-T146 WeakPolarHBondContact CA-O 3.35Å; S63-T146 PolarHBondContact OG-N 2.94Å; S63-T146 VanDerWaalsContact OG-N 3.07Å; W64-T146 HydrophobicContact CB-CG2 4.5Å; W64-T146 PolarHBondContact N-O 3.39Å; T139-T146 HydrophobicContact CG2-CG2 4.13Å; N140-T146 WeakPolarHBondContact O-CA 3.42Å; T141-T146 PolarHBondContact OG1-OG1 3.44Å
147E88.9Confident88.7Confident123 Ų12369.5 Ų69.558%0.57540%0.401SS*.EExtended strand (participates in β ladder)trans-110.7138.3178.9-65.1-177.4174.400110.2T139 N140T139-E147 CarbonylContact C-O 3.55Å; T139-E147 VanDerWaalsContact CA-O 3.26Å; T139-E147 WeakPolarHBondContact CA-O 2.87Å; N140-E147 PolarHBondContact N-O 2.98Å; N140-E147 PolarHBondContact O-N 3.18Å
148C91.3Very high88.5Confident28 Ų2876.2 Ų76.219%0.18943%0.427CS..EExtended strand (participates in β ladder)trans-96.5112171.5173.30000109.5W64 C71W64-C148 HydrophobicContact CB-CB 4.14Å; W64-C148 HydrophobicContact CD2-CB 3.77Å; W64-C148 HydrophobicContact CE3-CB 4.07Å; W64-C148 HydrophobicContact CG-CB 3.8Å; C71-C148 WeakPolarHBondContact CA-SG 3.2Å; C71-C148 HydrophobicContact CB-CB 3.82Å; C71-C148 WeakPolarHBondContact CB-SG 3.33Å; C71-C148 WeakPolarHBondContact SG-CA 3.39Å; C71-C148 WeakPolarHBondContact SG-CB 3.34Å; C71-C148 CovalentContact SG-SG 2.02Å; C71-C148 PolarHBondContact SG-SG 3.5Å
149A89.7Confident88.3Confident33 Ų3378.9 Ų78.927%0.27343%0.433SS..EExtended strand (participates in β ladder)trans-147.5164.6-176.400000112.3N138 Q151N138-A149 PolarHBondContact N-O 2.94Å; N138-A149 PolarHBondContact O-N 2.82Å; N138-A149 VanDerWaalsContact O-N 3.08Å; A149-Q151 PolarHBondContact O-N 3.49Å
150L90.8Very high88.1Confident23 Ų2378.6 Ų78.612%0.1243%0.43CS..EExtended strand (participates in β ladder)trans-72.9122.3168-70.2170.9000109.3I75 Y79 A133 L136 F152I75-L150 HydrophobicContact CG2-CD2 3.66Å; I75-L150 HydrophobicContact CG2-CG 4.27Å; Y79-L150 HydrophobicContact CE2-CD1 3.91Å; Y79-L150 WeakPolarHBondContact OH-CD1 3.49Å; A133-L150 HydrophobicContact CB-CD2 4.17Å; A133-L150 WeakPolarHBondContact O-CD2 3.3Å; L136-L150 HydrophobicContact CB-CD2 3.91Å; L150-F152 HydrophobicContact CB-CD2 4.35Å; L150-F152 HydrophobicContact CB-CE2 3.7Å; L150-F152 HydrophobicContact CB-CZ 3.94Å; L150-F152 HydrophobicContact CD1-CE2 4.33Å; L150-F152 HydrophobicContact CD1-CZ 3.93Å
151Q91Very high88Confident63 Ų6376.2 Ų76.229%0.29442%0.419SS..  trans-99.1109.4174.4-61.4-59.3-20.400109.2L136 N138 A149L136-Q151 VanDerWaalsContact CD2-O 3.29Å; L136-Q151 WeakPolarHBondContact CD2-O 3.2Å; L136-Q151 PolarHBondContact O-N 3.03Å; N138-Q151 HydrophobicContact CB-CB 4.38Å; N138-Q151 HydrophobicContact CB-CG 3.7Å; A149-Q151 PolarHBondContact O-N 3.49Å
152F90Very high88Confident23 Ų2375 Ų7510%0.10141%0.409CS..PPolyproline II helixtrans-91.5148.4179.5-66.8-77.8000111.8L136 L150 Y156 W159 D160 M163L136-F152 HydrophobicContact CD1-CD1 3.93Å; L136-F152 HydrophobicContact CD1-CE1 3.79Å; L150-F152 HydrophobicContact CB-CD2 4.35Å; L150-F152 HydrophobicContact CB-CE2 3.7Å; L150-F152 HydrophobicContact CB-CZ 3.94Å; L150-F152 HydrophobicContact CD1-CE2 4.33Å; L150-F152 HydrophobicContact CD1-CZ 3.93Å; F152-Y156 HydrophobicContact CB-CD2 3.79Å; F152-Y156 HydrophobicContact CB-CE2 4.08Å; F152-Y156 HydrophobicContact CB-CG 4.42Å; F152-Y156 HydrophobicContact CD2-CD2 4.41Å; F152-Y156 AromaticContact CD2-CE2 3.91Å; F152-Y156 HydrophobicContact CD2-CE2 3.91Å; F152-W159 HydrophobicContact CB-CB 3.86Å; F152-W159 HydrophobicContact CD1-CB 3.72Å; F152-W159 HydrophobicContact CG-CB 4Å; F152-D160 HydrophobicContact CD2-CB 3.66Å; F152-D160 HydrophobicContact CE2-CB 3.79Å; F152-D160 HydrophobicContact CG-CB 4.35Å; F152-M163 HydrophobicContact CE1-CB 3.99Å; F152-M163 HydrophobicContact CE1-CG 4.33Å; F152-M163 HydrophobicContact CZ-CB 3.87Å; F152-M163 HydrophobicContact CZ-CG 4.14Å
153P90.3Very high88.2Confident67 Ų6772.2 Ų72.244%0.43539%0.393SS..PPolyproline II helixtrans-68.9159.8174.829.6-33.9000111.5P155 Y156 W159P153-P155 CarbonylContact O-C 3.23Å; P153-P155 VanDerWaalsContact O-C 3.23Å; P153-Y156 PolarHBondContact O-N 3.35Å; P153-W159 HydrophobicContact CG-CD2 4.42Å; P153-W159 HydrophobicContact CG-CG 4.15Å; P153-W159 VanDerWaalsContact O-CD1 3.25Å
154D88.4Confident88.5Confident152 Ų15267.2 Ų67.281%0.81336%0.364SS*.SBendtrans-65.3134.9173.6-75.4-50.7000111.6
155P90.6Very high88.8Confident84 Ų8467.4 Ų67.455%0.54535%0.348SS..SBendcis-80.3119.3-1.928.7-30.1000113P153 T157 Y158P153-P155 CarbonylContact O-C 3.23Å; P153-P155 VanDerWaalsContact O-C 3.23Å; P155-T157 PolarHBondContact O-N 3.39Å; P155-Y158 PolarHBondContact O-N 3.36Å; P155-Y158 VanDerWaalsContact O-N 3.15Å
156Y86.9Confident89Confident94 Ų9466.5 Ų66.537%0.36934%0.343SS..Hα-helixtrans-51.6-49.6-173.9-179.8-86.1000113.4F152 P153 Y158 W159 D160F152-Y156 HydrophobicContact CB-CD2 3.79Å; F152-Y156 HydrophobicContact CB-CE2 4.08Å; F152-Y156 HydrophobicContact CB-CG 4.42Å; F152-Y156 HydrophobicContact CD2-CD2 4.41Å; F152-Y156 AromaticContact CD2-CE2 3.91Å; F152-Y156 HydrophobicContact CD2-CE2 3.91Å; P153-Y156 PolarHBondContact O-N 3.35Å; Y156-Y158 VanDerWaalsContact C-N 3.25Å; Y156-Y158 PolarHBondContact O-N 3.46Å; Y156-W159 PolarHBondContact O-N 3.43Å; Y156-D160 HydrophobicContact CD1-CB 4.22Å; Y156-D160 HydrophobicContact CE1-CB 3.92Å; Y156-D160 VanDerWaalsContact O-CB 3.29Å; Y156-D160 WeakPolarHBondContact O-CB 2.89Å; Y156-D160 PolarHBondContact O-N 2.94Å
157T86.9Confident88.9Confident100 Ų10065.5 Ų65.561%0.61334%0.337SS*.Hα-helixtrans-59.1-35.3-175.8-48.90000112.7P155 T161P155-T157 PolarHBondContact O-N 3.39Å; T157-T161 WeakPolarHBondContact O-CB 3.28Å; T157-T161 PolarHBondContact O-N 3.42Å; T157-T161 PolarHBondContact O-OG1 3.06Å
158Y88.5Confident88.9Confident140 Ų14062.2 Ų62.255%0.54932%0.321SS..Hα-helixtrans-67-51.5-179.9175.3-97.3000111.1P155 Y156 T161 L162P155-Y158 PolarHBondContact O-N 3.36Å; P155-Y158 VanDerWaalsContact O-N 3.15Å; Y156-Y158 VanDerWaalsContact C-N 3.25Å; Y156-Y158 PolarHBondContact O-N 3.46Å; Y158-T161 PolarHBondContact O-N 2.9Å; Y158-L162 HydrophobicContact CE1-CD2 4.22Å; Y158-L162 VanDerWaalsContact O-CB 3.23Å; Y158-L162 WeakPolarHBondContact O-CB 3.47Å; Y158-L162 PolarHBondContact O-N 2.83Å
159W89.9Confident88.8Confident111 Ų11164.4 Ų64.442%0.4233%0.33SS..Hα-helixtrans-69.5-40.6-177.2-70.2106.5000112.6F152 P153 Y156 L162 M163F152-W159 HydrophobicContact CB-CB 3.86Å; F152-W159 HydrophobicContact CD1-CB 3.72Å; F152-W159 HydrophobicContact CG-CB 4Å; P153-W159 HydrophobicContact CG-CD2 4.42Å; P153-W159 HydrophobicContact CG-CG 4.15Å; P153-W159 VanDerWaalsContact O-CD1 3.25Å; Y156-W159 PolarHBondContact O-N 3.43Å; W159-L162 HydrophobicContact CE3-CD2 4.13Å; W159-L162 HydrophobicContact CZ3-CD2 4.17Å; W159-L162 PolarHBondContact O-N 3.37Å; W159-M163 WeakPolarHBondContact O-CB 3.08Å; W159-M163 PolarHBondContact O-N 2.66Å
160D86.6Confident88.9Confident25 Ų2568.1 Ų68.113%0.13434%0.341CS..Hα-helixtrans-61.1-47.3174.1172.767.2000111.4F152 Y156 M163 K164F152-D160 HydrophobicContact CD2-CB 3.66Å; F152-D160 HydrophobicContact CE2-CB 3.79Å; F152-D160 HydrophobicContact CG-CB 4.35Å; Y156-D160 HydrophobicContact CD1-CB 4.22Å; Y156-D160 HydrophobicContact CE1-CB 3.92Å; Y156-D160 VanDerWaalsContact O-CB 3.29Å; Y156-D160 WeakPolarHBondContact O-CB 2.89Å; Y156-D160 PolarHBondContact O-N 2.94Å; D160-M163 PolarHBondContact O-N 2.83Å; D160-K164 WeakPolarHBondContact O-CB 3.48Å; D160-K164 VanDerWaalsContact O-CG 3.27Å; D160-K164 WeakPolarHBondContact O-CG 3.17Å; D160-K164 PolarHBondContact O-N 2.9Å; D160-K164 WeakPolarHBondContact OD1-CE 3.2Å; D160-K164 IonicContact OD1-NZ 2.63Å; D160-K164 PolarHBondContact OD1-NZ 3.27Å; D160-K164 WeakPolarHBondContact OD2-CE 3.32Å; D160-K164 IonicContact OD2-NZ 3.73Å; D160-K164 PolarHBondContact OD2-NZ 3.09Å
161T86.7Confident88.7Confident34 Ų3467.1 Ų67.121%0.20934%0.335CS..Hα-helixtrans-65.1-43.6177.5-58.60000111.5T157 Y158 M163 K164 I165T157-T161 WeakPolarHBondContact O-CB 3.28Å; T157-T161 PolarHBondContact O-N 3.42Å; T157-T161 PolarHBondContact O-OG1 3.06Å; Y158-T161 PolarHBondContact O-N 2.9Å; T161-M163 PolarHBondContact O-N 3.14Å; T161-K164 PolarHBondContact O-N 3.32Å; T161-I165 HydrophobicContact CG2-CD1 3.77Å; T161-I165 HydrophobicContact CG2-CG1 4.35Å; T161-I165 VanDerWaalsContact O-CG1 3.29Å; T161-I165 WeakPolarHBondContact O-CG1 3.32Å; T161-I165 PolarHBondContact O-N 3.47Å
162L89Confident88.5Confident63 Ų6365 Ų6533%0.3333%0.325SS..Hα-helixtrans-58.8-48.3177.2176.861.7000111Y158 W159 K164 I165 C166Y158-L162 HydrophobicContact CE1-CD2 4.22Å; Y158-L162 VanDerWaalsContact O-CB 3.23Å; Y158-L162 WeakPolarHBondContact O-CB 3.47Å; Y158-L162 PolarHBondContact O-N 2.83Å; W159-L162 HydrophobicContact CE3-CD2 4.13Å; W159-L162 HydrophobicContact CZ3-CD2 4.17Å; W159-L162 PolarHBondContact O-N 3.37Å; L162-K164 PolarHBondContact O-N 2.94Å; L162-I165 PolarHBondContact O-N 3.21Å; L162-C166 WeakPolarHBondContact O-CB 3.47Å; L162-C166 PolarHBondContact O-N 3.42Å; L162-C166 PolarHBondContact O-SG 2.85Å
163M88.1Confident88.4Confident37 Ų3766.2 Ų66.218%0.18233%0.334CS..Hα-helixtrans-61.4-44.6179.1-169.164.6-177.300111.2Y79 A129 F152 W159 D160 T161 I165 C166 V167Y79-M163 HydrophobicContact CD1-CE 3.95Å; Y79-M163 HydrophobicContact CE1-CE 3.45Å; Y79-M163 VanDerWaalsContact CE1-CE 3.45Å; A129-M163 HydrophobicContact CB-CE 4.22Å; F152-M163 HydrophobicContact CE1-CB 3.99Å; F152-M163 HydrophobicContact CE1-CG 4.33Å; F152-M163 HydrophobicContact CZ-CB 3.87Å; F152-M163 HydrophobicContact CZ-CG 4.14Å; W159-M163 WeakPolarHBondContact O-CB 3.08Å; W159-M163 PolarHBondContact O-N 2.66Å; D160-M163 PolarHBondContact O-N 2.83Å; T161-M163 PolarHBondContact O-N 3.14Å; M163-I165 PolarHBondContact O-N 2.94Å; M163-C166 PolarHBondContact O-N 2.9Å; M163-V167 HydrophobicContact CE-CG2 4.29Å; M163-V167 WeakPolarHBondContact O-CB 3.48Å; M163-V167 VanDerWaalsContact O-CG2 3.3Å; M163-V167 WeakPolarHBondContact O-CG2 3.41Å; M163-V167 PolarHBondContact O-N 3.35Å
164K86.6Confident88.5Confident54 Ų5464.5 Ų64.524%0.23533%0.326CS..Hα-helixtrans-60.2-43176.2-72.7170.9-179.2163.90112.3D160 T161 L162 V167 F168 I231 A235D160-K164 WeakPolarHBondContact O-CB 3.48Å; D160-K164 VanDerWaalsContact O-CG 3.27Å; D160-K164 WeakPolarHBondContact O-CG 3.17Å; D160-K164 PolarHBondContact O-N 2.9Å; D160-K164 WeakPolarHBondContact OD1-CE 3.2Å; D160-K164 IonicContact OD1-NZ 2.63Å; D160-K164 PolarHBondContact OD1-NZ 3.27Å; D160-K164 WeakPolarHBondContact OD2-CE 3.32Å; D160-K164 IonicContact OD2-NZ 3.73Å; D160-K164 PolarHBondContact OD2-NZ 3.09Å; T161-K164 PolarHBondContact O-N 3.32Å; L162-K164 PolarHBondContact O-N 2.94Å; K164-V167 PolarHBondContact O-N 3.05Å; K164-F168 WeakPolarHBondContact O-CB 3.15Å; K164-F168 PolarHBondContact O-N 3.46Å; K164-I231 HydrophobicContact CB-CG2 3.87Å; K164-I231 HydrophobicContact CD-CG2 4.06Å; K164-I231 HydrophobicContact CG-CG2 3.72Å; K164-A235 HydrophobicContact CB-CB 4.5Å; K164-A235 HydrophobicContact CD-CB 4.04Å
165I87.8Confident88.5Confident72 Ų7257.5 Ų57.537%0.36929%0.289SS..Hα-helixtrans-65.5-46.3176.6-69.6170.8000110.7T161 L162 M163 V167 F168 I169T161-I165 HydrophobicContact CG2-CD1 3.77Å; T161-I165 HydrophobicContact CG2-CG1 4.35Å; T161-I165 VanDerWaalsContact O-CG1 3.29Å; T161-I165 WeakPolarHBondContact O-CG1 3.32Å; T161-I165 PolarHBondContact O-N 3.47Å; L162-I165 PolarHBondContact O-N 3.21Å; M163-I165 PolarHBondContact O-N 2.94Å; I165-V167 VanDerWaalsContact C-N 3.34Å; I165-V167 PolarHBondContact O-N 3.36Å; I165-F168 PolarHBondContact O-N 3.45Å; I165-I169 HydrophobicContact CG2-CD1 3.75Å; I165-I169 HydrophobicContact CG2-CG1 4.41Å; I165-I169 WeakPolarHBondContact O-CG1 3.12Å; I165-I169 PolarHBondContact O-N 2.99Å
166C90.1Very high88.3Confident42 Ų4255.4 Ų55.428%0.28427%0.273SS..Hα-helixtrans-59.2-45.6176.9-72.50000111.3L162 M163 I169 F170L162-C166 WeakPolarHBondContact O-CB 3.47Å; L162-C166 PolarHBondContact O-N 3.42Å; L162-C166 PolarHBondContact O-SG 2.85Å; M163-C166 PolarHBondContact O-N 2.9Å; C166-I169 PolarHBondContact O-N 2.92Å; C166-F170 HydrophobicContact CB-CD2 4.33Å; C166-F170 WeakPolarHBondContact O-CB 3.38Å; C166-F170 VanDerWaalsContact O-CD2 3.23Å; C166-F170 WeakPolarHBondContact O-CD2 3.15Å; C166-F170 PolarHBondContact O-N 3.3Å
167V89.6Confident88.5Confident7 Ų755.7 Ų55.74%0.04228%0.28CS..Hα-helixtrans-58.8-48174.1164.50000110.9Y79 M82 F83 M163 K164 I165 I169 A171Y79-V167 HydrophobicContact CE1-CG2 3.96Å; M82-V167 HydrophobicContact CE-CB 4.19Å; M82-V167 HydrophobicContact CE-CG1 3.4Å; M82-V167 VanDerWaalsContact CE-CG1 3.4Å; M82-V167 HydrophobicContact CE-CG2 3.83Å; M82-V167 HydrophobicContact SD-CG1 3.83Å; F83-V167 HydrophobicContact CE2-CG2 4.33Å; F83-V167 HydrophobicContact CZ-CG2 4.1Å; M163-V167 HydrophobicContact CE-CG2 4.29Å; M163-V167 WeakPolarHBondContact O-CB 3.48Å; M163-V167 VanDerWaalsContact O-CG2 3.3Å; M163-V167 WeakPolarHBondContact O-CG2 3.41Å; M163-V167 PolarHBondContact O-N 3.35Å; K164-V167 PolarHBondContact O-N 3.05Å; I165-V167 VanDerWaalsContact C-N 3.34Å; I165-V167 PolarHBondContact O-N 3.36Å; V167-I169 VanDerWaalsContact C-N 3.32Å; V167-I169 PolarHBondContact O-N 2.84Å; V167-A171 HydrophobicContact CG1-CB 4.28Å; V167-A171 WeakPolarHBondContact O-CA 2.97Å; V167-A171 WeakPolarHBondContact O-CB 3.33Å; V167-A171 PolarHBondContact O-N 3.07Å
168F87.7Confident88.7Confident54 Ų5454.6 Ų54.624%0.23727%0.269CS..Iπ-helixtrans-59.2-42.1178.3-178.8-105.5000112.6K164 I165 F172 V173 H228 L232K164-F168 WeakPolarHBondContact O-CB 3.15Å; K164-F168 PolarHBondContact O-N 3.46Å; I165-F168 PolarHBondContact O-N 3.45Å; F168-F172 HydrophobicContact CD2-CD1 4.26Å; F168-F172 AromaticContact CE2-CD1 3.78Å; F168-F172 HydrophobicContact CE2-CD1 3.78Å; F168-F172 HydrophobicContact CE2-CE1 4.27Å; F168-F172 HydrophobicContact CZ-CD1 4.31Å; F168-F172 VanDerWaalsContact O-CB 3.32Å; F168-F172 WeakPolarHBondContact O-CB 3.25Å; F168-F172 PolarHBondContact O-N 2.75Å; F168-V173 HydrophobicContact CD1-CG2 3.86Å; F168-V173 HydrophobicContact CE1-CG2 3.41Å; F168-V173 VanDerWaalsContact CE1-CG2 3.41Å; F168-V173 HydrophobicContact CE2-CG2 4.35Å; F168-V173 HydrophobicContact CZ-CG2 3.69Å; F168-V173 PolarHBondContact O-N 2.64Å; F168-H228 HydrophobicContact CD2-CB 3.99Å; F168-H228 HydrophobicContact CE2-CB 4.2Å; F168-L232 HydrophobicContact CE2-CD2 4.49Å; F168-L232 HydrophobicContact CZ-CD2 4.31Å
169I90Very high88.6Confident74 Ų7448.3 Ų48.338%0.37925%0.245SC..Iπ-helixtrans-70.8-53.5179.9-66.5170.4000110.8I165 C166 V167 V173 A174I165-I169 HydrophobicContact CG2-CD1 3.75Å; I165-I169 HydrophobicContact CG2-CG1 4.41Å; I165-I169 WeakPolarHBondContact O-CG1 3.12Å; I165-I169 PolarHBondContact O-N 2.99Å; C166-I169 PolarHBondContact O-N 2.92Å; V167-I169 VanDerWaalsContact C-N 3.32Å; V167-I169 PolarHBondContact O-N 2.84Å; I169-V173 PolarHBondContact O-N 3.15Å; I169-A174 WeakPolarHBondContact O-CB 3.44Å; I169-A174 PolarHBondContact O-N 2.99Å
170F90.6Very high88.4Confident112 Ų11246.1 Ų46.149%0.49124%0.244SC..Iπ-helixtrans-85.6-29.3-168.9-68.3-66000114.1F83 C166 P175F83-F170 HydrophobicContact CE1-CB 3.98Å; C166-F170 HydrophobicContact CB-CD2 4.33Å; C166-F170 WeakPolarHBondContact O-CB 3.38Å; C166-F170 VanDerWaalsContact O-CD2 3.23Å; C166-F170 WeakPolarHBondContact O-CD2 3.15Å; C166-F170 PolarHBondContact O-N 3.3Å; F170-P175 VanDerWaalsContact O-CD 3.23Å; F170-P175 WeakPolarHBondContact O-CD 3.13Å; F170-P175 WeakPolarHBondContact O-CG 3.44Å
171A87.8Confident88.5Confident1 Ų148.4 Ų48.41%0.00826%0.259CS..Iπ-helixtrans-93.7-12.3178.400000113.3M82 F83 V167M82-A171 HydrophobicContact CE-CB 3.82Å; M82-A171 HydrophobicContact CG-CB 3.96Å; M82-A171 HydrophobicContact SD-CB 3.94Å; F83-A171 HydrophobicContact CD1-CB 4.34Å; F83-A171 HydrophobicContact CE1-CB 4Å; F83-A171 HydrophobicContact CZ-CB 4.34Å; V167-A171 HydrophobicContact CG1-CB 4.28Å; V167-A171 WeakPolarHBondContact O-CA 2.97Å; V167-A171 WeakPolarHBondContact O-CB 3.33Å; V167-A171 PolarHBondContact O-N 3.07Å
172F86.3Confident88.5Confident20 Ų2047.5 Ų47.59%0.08825%0.253CS..Iπ-helixtrans-130.9-68.6-178.6-173.5-110.9000113.6F168 P175 L176 F220 W224 T225 H228F168-F172 HydrophobicContact CD2-CD1 4.26Å; F168-F172 AromaticContact CE2-CD1 3.78Å; F168-F172 HydrophobicContact CE2-CD1 3.78Å; F168-F172 HydrophobicContact CE2-CE1 4.27Å; F168-F172 HydrophobicContact CZ-CD1 4.31Å; F168-F172 VanDerWaalsContact O-CB 3.32Å; F168-F172 WeakPolarHBondContact O-CB 3.25Å; F168-F172 PolarHBondContact O-N 2.75Å; F172-P175 WeakPolarHBondContact O-CD 3.2Å; F172-L176 HydrophobicContact CE1-CD2 4.43Å; F172-L176 HydrophobicContact CZ-CD2 4.19Å; F172-L176 WeakPolarHBondContact O-CB 3.49Å; F172-L176 PolarHBondContact O-N 3.44Å; F172-F220 HydrophobicContact CD2-CE1 4.13Å; F172-F220 HydrophobicContact CD2-CZ 4.43Å; F172-F220 HydrophobicContact CE2-CE1 4.34Å; F172-W224 HydrophobicContact CD2-CB 4.34Å; F172-W224 HydrophobicContact CE2-CB 4.4Å; F172-T225 HydrophobicContact CZ-CG2 4.28Å; F172-T225 VanDerWaalsContact CZ-OG1 3.32Å; F172-T225 WeakPolarHBondContact CZ-OG1 3.33Å; F172-H228 HydrophobicContact CD1-CB 4.47Å; F172-H228 AromaticContact CD2-CD2 3.52Å; F172-H228 HydrophobicContact CG-CB 4.42Å; F172-H228 AromaticContact CG-CD2 3.62Å
173V88.8Confident88.1Confident47 Ų4745.5 Ų45.529%0.28524%0.242SC..Iπ-helixtrans-63.5-54.7-169.1176.30000112.8F168 I169 L176 I177F168-V173 HydrophobicContact CD1-CG2 3.86Å; F168-V173 HydrophobicContact CE1-CG2 3.41Å; F168-V173 VanDerWaalsContact CE1-CG2 3.41Å; F168-V173 HydrophobicContact CE2-CG2 4.35Å; F168-V173 HydrophobicContact CZ-CG2 3.69Å; F168-V173 PolarHBondContact O-N 2.64Å; I169-V173 PolarHBondContact O-N 3.15Å; V173-L176 PolarHBondContact O-N 3.26Å; V173-I177 HydrophobicContact CG1-CD1 3.79Å; V173-I177 VanDerWaalsContact O-CG1 3.32Å; V173-I177 WeakPolarHBondContact O-CG1 3.37Å; V173-I177 PolarHBondContact O-N 3.48Å
174A91.4Very high87.8Confident32 Ų3247.2 Ų47.226%0.26425%0.254SS..Hα-helixtrans-62.8-47.4-17700000112.2I169 L176 I177 I178I169-A174 WeakPolarHBondContact O-CB 3.44Å; I169-A174 PolarHBondContact O-N 2.99Å; A174-L176 PolarHBondContact O-N 2.87Å; A174-I177 PolarHBondContact O-N 3.37Å; A174-I178 WeakPolarHBondContact O-CG1 3.33Å; A174-I178 PolarHBondContact O-N 3.27Å; A174-I178 VanDerWaalsContact O-N 3.08Å
175P89.3Confident87.8Confident5 Ų548.2 Ų48.23%0.03226%0.262CS..Hα-helixtrans-57-44.7171.5-28.736.6000114I86 F170 F172 I177 I178 I179I86-P175 HydrophobicContact CD1-CB 3.51Å; I86-P175 HydrophobicContact CD1-CG 4.27Å; I86-P175 HydrophobicContact CG1-CB 3.28Å; I86-P175 HydrophobicContact CG1-CG 3.47Å; I86-P175 VanDerWaalsContact CG1-CG 3.47Å; I86-P175 HydrophobicContact CG2-CG 4.42Å; F170-P175 VanDerWaalsContact O-CD 3.23Å; F170-P175 WeakPolarHBondContact O-CD 3.13Å; F170-P175 WeakPolarHBondContact O-CG 3.44Å; F172-P175 WeakPolarHBondContact O-CD 3.2Å; P175-I177 VanDerWaalsContact C-N 3.31Å; P175-I177 PolarHBondContact O-N 3.34Å; P175-I178 PolarHBondContact O-N 2.99Å; P175-I179 VanDerWaalsContact O-CB 3.28Å; P175-I179 WeakPolarHBondContact O-CB 3.15Å; P175-I179 WeakPolarHBondContact O-CG1 3.27Å; P175-I179 PolarHBondContact O-N 3.43Å
176L86.9Confident87.4Confident40 Ų4044.9 Ų44.921%0.20925%0.245CC..Hα-helixtrans-61.4-41.2-179.2-175.867.4000111.6F172 V173 A174 T180 F220 V221F172-L176 HydrophobicContact CE1-CD2 4.43Å; F172-L176 HydrophobicContact CZ-CD2 4.19Å; F172-L176 WeakPolarHBondContact O-CB 3.49Å; F172-L176 PolarHBondContact O-N 3.44Å; V173-L176 PolarHBondContact O-N 3.26Å; A174-L176 PolarHBondContact O-N 2.87Å; L176-T180 WeakPolarHBondContact O-CB 3.44Å; L176-T180 PolarHBondContact O-N 3.46Å; L176-T180 PolarHBondContact O-OG1 2.97Å; L176-F220 HydrophobicContact CD1-CD1 4.45Å; L176-V221 HydrophobicContact CD1-CG2 3.67Å
177I90.3Very high86.7Confident100 Ų10044.5 Ų44.551%0.51324%0.241SC..Hα-helixtrans-62.1-50.6175.1-68.3167.1000110.2V173 A174 P175 I179 T180 V181V173-I177 HydrophobicContact CG1-CD1 3.79Å; V173-I177 VanDerWaalsContact O-CG1 3.32Å; V173-I177 WeakPolarHBondContact O-CG1 3.37Å; V173-I177 PolarHBondContact O-N 3.48Å; A174-I177 PolarHBondContact O-N 3.37Å; P175-I177 VanDerWaalsContact C-N 3.31Å; P175-I177 PolarHBondContact O-N 3.34Å; I177-I179 PolarHBondContact O-N 3.2Å; I177-T180 PolarHBondContact O-N 3.05Å; I177-V181 HydrophobicContact CG2-CG2 4.33Å; I177-V181 WeakPolarHBondContact O-CB 3.29Å; I177-V181 VanDerWaalsContact O-CG2 3.31Å; I177-V181 WeakPolarHBondContact O-CG2 3.37Å; I177-V181 PolarHBondContact O-N 3.36Å
178I90.9Very high86.3Confident76 Ų7648.9 Ų48.939%0.3926%0.264SS..Hα-helixtrans-60.1-48.5-179-64.5165.3000110.5T90 V94 A174 P175 T180 V181 C182T90-I178 HydrophobicContact CG2-CB 3.91Å; T90-I178 HydrophobicContact CG2-CD1 4.18Å; T90-I178 HydrophobicContact CG2-CG2 3.52Å; V94-I178 HydrophobicContact CG2-CG2 4.2Å; A174-I178 WeakPolarHBondContact O-CG1 3.33Å; A174-I178 PolarHBondContact O-N 3.27Å; A174-I178 VanDerWaalsContact O-N 3.08Å; P175-I178 PolarHBondContact O-N 2.99Å; I178-T180 VanDerWaalsContact C-N 3.35Å; I178-T180 PolarHBondContact O-N 3.15Å; I178-V181 PolarHBondContact O-N 3.29Å; I178-C182 WeakPolarHBondContact O-CB 3.41Å; I178-C182 PolarHBondContact O-N 2.98Å; I178-C182 PolarHBondContact O-SG 3.12Å
179I86.7Confident85.9Confident9 Ų952 Ų525%0.04627%0.274CS..Hα-helixtrans-57.7-48.6178.1-71.9171.4000110.2I86 T90 P175 I177 C182 Y183 V217I86-I179 HydrophobicContact CD1-CD1 3.95Å; T90-I179 HydrophobicContact CG2-CG1 4.46Å; P175-I179 VanDerWaalsContact O-CB 3.28Å; P175-I179 WeakPolarHBondContact O-CB 3.15Å; P175-I179 WeakPolarHBondContact O-CG1 3.27Å; P175-I179 PolarHBondContact O-N 3.43Å; I177-I179 PolarHBondContact O-N 3.2Å; I179-C182 PolarHBondContact O-N 2.96Å; I179-Y183 HydrophobicContact CG2-CD2 3.54Å; I179-Y183 HydrophobicContact CG2-CE2 3.58Å; I179-Y183 WeakPolarHBondContact O-CB 3.32Å; I179-Y183 WeakPolarHBondContact O-CD2 3.34Å; I179-Y183 PolarHBondContact O-N 3.37Å; I179-V217 HydrophobicContact CG2-CG2 3.75Å
180T85.1Confident85.1Confident64 Ų6449.4 Ų49.439%0.39326%0.261SS..Hα-helixtrans-63.2-45.5-179.2-60.70000111.9L176 I177 I178 T184L176-T180 WeakPolarHBondContact O-CB 3.44Å; L176-T180 PolarHBondContact O-N 3.46Å; L176-T180 PolarHBondContact O-OG1 2.97Å; I177-T180 PolarHBondContact O-N 3.05Å; I178-T180 VanDerWaalsContact C-N 3.35Å; I178-T180 PolarHBondContact O-N 3.15Å; T180-T184 VanDerWaalsContact O-CB 3.26Å; T180-T184 WeakPolarHBondContact O-CB 3.19Å; T180-T184 PolarHBondContact O-N 2.79Å; T180-T184 PolarHBondContact O-OG1 3.22Å
181V89.4Confident84.2Confident74 Ų7450.2 Ų50.245%0.44826%0.264SS..Hα-helixtrans-63.4-50.4177.3171.60000110.8I177 I178 Y183 T184 L185I177-V181 HydrophobicContact CG2-CG2 4.33Å; I177-V181 WeakPolarHBondContact O-CB 3.29Å; I177-V181 VanDerWaalsContact O-CG2 3.31Å; I177-V181 WeakPolarHBondContact O-CG2 3.37Å; I177-V181 PolarHBondContact O-N 3.36Å; I178-V181 PolarHBondContact O-N 3.29Å; V181-Y183 VanDerWaalsContact C-N 3.28Å; V181-Y183 PolarHBondContact O-N 2.56Å; V181-T184 PolarHBondContact O-N 3.33Å; V181-L185 HydrophobicContact CG1-CD1 3.85Å; V181-L185 HydrophobicContact CG1-CG 4.3Å; V181-L185 WeakPolarHBondContact O-CB 3.3Å; V181-L185 VanDerWaalsContact O-CG 3.29Å; V181-L185 WeakPolarHBondContact O-CG 3.41Å; V181-L185 PolarHBondContact O-N 3.31Å
182C86.3Confident83.5Confident14 Ų1452.6 Ų52.610%0.09528%0.28CS..Hα-helixtrans-55.1-46.1179.1-70.40000111.5I178 I179 M186I178-C182 WeakPolarHBondContact O-CB 3.41Å; I178-C182 PolarHBondContact O-N 2.98Å; I178-C182 PolarHBondContact O-SG 3.12Å; I179-C182 PolarHBondContact O-N 2.96Å; C182-M186 VanDerWaalsContact O-CB 3.29Å; C182-M186 WeakPolarHBondContact O-CB 3.49Å; C182-M186 PolarHBondContact O-N 2.95Å
183Y80.5Confident82.6Confident22 Ų2254 Ų549%0.08629%0.291CS..Hα-helixtrans-74.1-36.5-178.7-74.9-49.3000113.5S93 I179 V181 M186 V187 V213 V217S93-Y183 WeakPolarHBondContact OG-CE2 3.48Å; S93-Y183 PolarHBondContact OG-OH 2.96Å; I179-Y183 HydrophobicContact CG2-CD2 3.54Å; I179-Y183 HydrophobicContact CG2-CE2 3.58Å; I179-Y183 WeakPolarHBondContact O-CB 3.32Å; I179-Y183 WeakPolarHBondContact O-CD2 3.34Å; I179-Y183 PolarHBondContact O-N 3.37Å; V181-Y183 VanDerWaalsContact C-N 3.28Å; V181-Y183 PolarHBondContact O-N 2.56Å; Y183-M186 HydrophobicContact CD1-CE 3.57Å; Y183-M186 HydrophobicContact CD1-SD 4.28Å; Y183-M186 HydrophobicContact CE1-CE 4.04Å; Y183-M186 PolarHBondContact O-N 2.82Å; Y183-V187 WeakPolarHBondContact O-CG2 3.39Å; Y183-V187 PolarHBondContact O-N 3.25Å; Y183-V213 HydrophobicContact CD1-CB 4.08Å; Y183-V213 HydrophobicContact CD1-CG1 3.12Å; Y183-V213 HydrophobicContact CD1-CG2 3.86Å; Y183-V213 HydrophobicContact CD2-CG1 3.65Å; Y183-V213 HydrophobicContact CE1-CB 3.91Å; Y183-V213 HydrophobicContact CE1-CG1 3.36Å; Y183-V213 HydrophobicContact CE1-CG2 3.3Å; Y183-V213 HydrophobicContact CE2-CG1 3.85Å; Y183-V213 HydrophobicContact CG-CG1 3.27Å; Y183-V217 HydrophobicContact CD2-CG2 3.64Å; Y183-V217 HydrophobicContact CE2-CG2 3.75Å
184T82.3Confident81.3Confident72 Ų7259.1 Ų59.144%0.44231%0.305SS..Hα-helixtrans-61.5-49.6174.7-59.70000110.3T180 V181 M186 V187 L188T180-T184 VanDerWaalsContact O-CB 3.26Å; T180-T184 WeakPolarHBondContact O-CB 3.19Å; T180-T184 PolarHBondContact O-N 2.79Å; T180-T184 PolarHBondContact O-OG1 3.22Å; V181-T184 PolarHBondContact O-N 3.33Å; T184-M186 VanDerWaalsContact C-N 3.32Å; T184-M186 PolarHBondContact O-N 2.95Å; T184-V187 PolarHBondContact O-N 2.92Å; T184-L188 HydrophobicContact CG2-CD1 4.13Å; T184-L188 HydrophobicContact CG2-CG 4.48Å; T184-L188 VanDerWaalsContact O-CG 3.31Å; T184-L188 WeakPolarHBondContact O-CG 3.41Å; T184-L188 PolarHBondContact O-N 3.39Å
185L85.5Confident79.6Confident76 Ų7665.2 Ų65.240%0.39833%0.332SS..Hα-helixtrans-61.7-40.4177.5-66.5176.6000112.1Y97 V181 L188 R189Y97-L185 HydrophobicContact CD2-CB 4.09Å; Y97-L185 HydrophobicContact CE2-CB 3.61Å; Y97-L185 HydrophobicContact CE2-CD1 4.03Å; V181-L185 HydrophobicContact CG1-CD1 3.85Å; V181-L185 HydrophobicContact CG1-CG 4.3Å; V181-L185 WeakPolarHBondContact O-CB 3.3Å; V181-L185 VanDerWaalsContact O-CG 3.29Å; V181-L185 WeakPolarHBondContact O-CG 3.41Å; V181-L185 PolarHBondContact O-N 3.31Å; L185-L188 PolarHBondContact O-N 3.49Å; L185-R189 WeakPolarHBondContact O-CB 3.13Å; L185-R189 PolarHBondContact O-N 3.25Å
186M79.9Confident78Confident1 Ų172.2 Ų72.21%0.00537%0.368CS..Hα-helixtrans-59.6-49.7173.9-175.2-174.374.900111.2R96 Y97 V100 C182 Y183 T184 L188 R189 L190 I209 V213R96-M186 HydrophobicContact CB-SD 4.43Å; Y97-M186 HydrophobicContact CD2-CB 4.49Å; V100-M186 HydrophobicContact CB-CG 3.97Å; V100-M186 HydrophobicContact CB-SD 4.44Å; V100-M186 HydrophobicContact CG1-CG 3.82Å; V100-M186 HydrophobicContact CG2-CG 4.23Å; V100-M186 HydrophobicContact CG2-SD 4.12Å; C182-M186 VanDerWaalsContact O-CB 3.29Å; C182-M186 WeakPolarHBondContact O-CB 3.49Å; C182-M186 PolarHBondContact O-N 2.95Å; Y183-M186 HydrophobicContact CD1-CE 3.57Å; Y183-M186 HydrophobicContact CD1-SD 4.28Å; Y183-M186 HydrophobicContact CE1-CE 4.04Å; Y183-M186 PolarHBondContact O-N 2.82Å; T184-M186 VanDerWaalsContact C-N 3.32Å; T184-M186 PolarHBondContact O-N 2.95Å; M186-L188 VanDerWaalsContact C-N 3.34Å; M186-L188 PolarHBondContact O-N 3.48Å; M186-R189 PolarHBondContact O-N 2.95Å; M186-L190 HydrophobicContact CG-CD1 3.96Å; M186-L190 HydrophobicContact CG-CG 4.42Å; M186-L190 WeakPolarHBondContact O-CB 3.18Å; M186-L190 WeakPolarHBondContact O-CG 3.39Å; M186-L190 PolarHBondContact O-N 3.47Å; M186-I209 HydrophobicContact CE-CG2 4.45Å; M186-V213 HydrophobicContact CE-CG1 4.37Å; M186-V213 HydrophobicContact CE-CG2 3.95Å
187V75.6Confident76.5Confident35 Ų3573.6 Ų73.621%0.21238%0.382CS..Hα-helixtrans-61.9-41.3178.8170.50000111.7Y183 T184 L190 K191 T210Y183-V187 WeakPolarHBondContact O-CG2 3.39Å; Y183-V187 PolarHBondContact O-N 3.25Å; T184-V187 PolarHBondContact O-N 2.92Å; V187-L190 PolarHBondContact O-N 3.34Å; V187-K191 HydrophobicContact CG1-CD 4.29Å; V187-K191 WeakPolarHBondContact O-CG 3.29Å; V187-K191 PolarHBondContact O-N 2.88Å; V187-T210 HydrophobicContact CG2-CG2 3.89Å
188L81.5Confident75Confident98 Ų9872.6 Ų72.651%0.51340%0.396SS..Hα-helixtrans-62.1-45.1176.4-70.5174.2000111.6T184 L185 M186 L190 K191 S192T184-L188 HydrophobicContact CG2-CD1 4.13Å; T184-L188 HydrophobicContact CG2-CG 4.48Å; T184-L188 VanDerWaalsContact O-CG 3.31Å; T184-L188 WeakPolarHBondContact O-CG 3.41Å; T184-L188 PolarHBondContact O-N 3.39Å; L185-L188 PolarHBondContact O-N 3.49Å; M186-L188 VanDerWaalsContact C-N 3.34Å; M186-L188 PolarHBondContact O-N 3.48Å; L188-L190 VanDerWaalsContact C-N 3.31Å; L188-L190 PolarHBondContact O-N 2.91Å; L188-K191 PolarHBondContact O-N 3.27Å; L188-S192 PolarHBondContact O-N 2.97Å; L188-S192 PolarHBondContact O-OG 3.4Å
189R79.8Confident73.5Confident119 Ų11972.1 Ų72.145%0.44940%0.399SS..Hα-helixtrans-62.7-40.3176-178.158.2172.8178.70.3112C101 L185 M186 K191 S192 V193C101-R189 HydrophobicContact CB-CG 4.35Å; L185-R189 WeakPolarHBondContact O-CB 3.13Å; L185-R189 PolarHBondContact O-N 3.25Å; M186-R189 PolarHBondContact O-N 2.95Å; R189-K191 VanDerWaalsContact C-N 3.35Å; R189-S192 WeakPolarHBondContact CA-OG 3.24Å; R189-S192 PolarHBondContact O-N 3.07Å; R189-S192 PolarHBondContact O-OG 3.29Å; R189-V193 HydrophobicContact CG-CG2 4.42Å; R189-V193 VanDerWaalsContact O-CG2 3.29Å; R189-V193 WeakPolarHBondContact O-CG2 3.36Å; R189-V193 PolarHBondContact O-N 3.33Å
190L71.9Confident72.1Confident21 Ų2182.4 Ų82.411%0.1144%0.438CS..Hα-helixtrans-65.5-38.3177.3-73.7179.4000112.2V100 M186 V187 L188 R194 L206V100-L190 HydrophobicContact CG1-CD1 4.13Å; V100-L190 HydrophobicContact CG1-CD2 3.28Å; V100-L190 HydrophobicContact CG1-CG 3.65Å; M186-L190 HydrophobicContact CG-CD1 3.96Å; M186-L190 HydrophobicContact CG-CG 4.42Å; M186-L190 WeakPolarHBondContact O-CB 3.18Å; M186-L190 WeakPolarHBondContact O-CG 3.39Å; M186-L190 PolarHBondContact O-N 3.47Å; V187-L190 PolarHBondContact O-N 3.34Å; L188-L190 VanDerWaalsContact C-N 3.31Å; L188-L190 PolarHBondContact O-N 2.91Å; L190-R194 WeakPolarHBondContact O-CB 3.3Å; L190-R194 PolarHBondContact O-N 3.36Å; L190-L206 HydrophobicContact CB-CD1 4.47Å; L190-L206 HydrophobicContact CB-CD2 3.74Å; L190-L206 HydrophobicContact CB-CG 4.18Å; L190-L206 HydrophobicContact CD1-CD1 3.79Å; L190-L206 HydrophobicContact CD1-CD2 4.37Å; L190-L206 HydrophobicContact CD1-CG 3.86Å; L190-L206 HydrophobicContact CD2-CD1 3.23Å; L190-L206 HydrophobicContact CD2-CD2 3.94Å; L190-L206 HydrophobicContact CD2-CG 3.89Å; L190-L206 HydrophobicContact CG-CD1 3.96Å; L190-L206 HydrophobicContact CG-CD2 4.19Å; L190-L206 HydrophobicContact CG-CG 4.15Å
191K71.4Confident70.8Confident129 Ų12986.8 Ų86.856%0.56145%0.453SS*.Hα-helixtrans-69.4-34.9172.6-74.3-179.6179.8-178.60112.9V187 L188 R189 R194V187-K191 HydrophobicContact CG1-CD 4.29Å; V187-K191 WeakPolarHBondContact O-CG 3.29Å; V187-K191 PolarHBondContact O-N 2.88Å; L188-K191 PolarHBondContact O-N 3.27Å; R189-K191 VanDerWaalsContact C-N 3.35Å; K191-R194 WeakPolarHBondContact O-CB 3.42Å
192S73.3Confident69.2Low50 Ų5089.6 Ų89.635%0.3546%0.46SS..Hα-helixtrans-75.3-41179.5640000112.7L188 R189 R194 L195L188-S192 PolarHBondContact O-N 2.97Å; L188-S192 PolarHBondContact O-OG 3.4Å; R189-S192 WeakPolarHBondContact CA-OG 3.24Å; R189-S192 PolarHBondContact O-N 3.07Å; R189-S192 PolarHBondContact O-OG 3.29Å; S192-R194 PolarHBondContact O-N 3.03Å; S192-L195 PolarHBondContact O-N 2.62Å
193V66.9Low67.7Low50 Ų5090.5 Ų90.530%0.30346%0.463SS..Hα-helixtrans-65-27.2174177.60000111.6R189 L195 L196 S197R189-V193 HydrophobicContact CG-CG2 4.42Å; R189-V193 VanDerWaalsContact O-CG2 3.29Å; R189-V193 WeakPolarHBondContact O-CG2 3.36Å; R189-V193 PolarHBondContact O-N 3.33Å; V193-L195 VanDerWaalsContact C-N 3.34Å; V193-L195 PolarHBondContact O-N 3.46Å; V193-L196 PolarHBondContact O-N 3.46Å; V193-L196 VanDerWaalsContact O-N 3.15Å; V193-S197 PolarHBondContact O-N 3.36Å
194R61.6Low66.7Low154 Ų15498.3 Ų98.358%0.58149%0.493SS*.Hα-helixtrans-61.6-36.5173.9176.9-174178.6-169.5-0.8113L190 K191 S192 L196L190-R194 WeakPolarHBondContact O-CB 3.3Å; L190-R194 PolarHBondContact O-N 3.36Å; K191-R194 WeakPolarHBondContact O-CB 3.42Å; S192-R194 PolarHBondContact O-N 3.03Å; R194-L196 PolarHBondContact O-N 3.32Å
195L55.6Low65.6Low160 Ų16099 Ų9984%0.83849%0.494SS*.Hα-helixtrans-66.9-18.3177-68.8170.5000112.5S192 V193S192-L195 PolarHBondContact O-N 2.62Å; V193-L195 VanDerWaalsContact C-N 3.34Å; V193-L195 PolarHBondContact O-N 3.46Å
196L56.5Low64.3Low152 Ų15297.4 Ų97.480%0.79649%0.485SS*.Hα-helixtrans-103-14.9-172.3-68.3164.4000114.7V193 R194V193-L196 PolarHBondContact O-N 3.46Å; V193-L196 VanDerWaalsContact O-N 3.15Å; R194-L196 PolarHBondContact O-N 3.32Å
197S56.4Low63.3Low70 Ų70103.8 Ų103.849%0.4951%0.51SS..Hα-helixtrans-138.62.5-163-152.70000118.2V193 S199V193-S197 PolarHBondContact O-N 3.36Å; S197-S199 PolarHBondContact O-N 3.37Å
198G57.6Low62.8Low78 Ų78106.5 Ų106.580%0.80452%0.516SS*.  trans55.4-3.4158.400000121.7
199S60.6Low62Low67 Ų67105 Ų10547%0.46951%0.508SS..  trans-87.3122-171.4177.70000113.9S197 E201 D203S197-S199 PolarHBondContact O-N 3.37Å; S199-E201 PolarHBondContact O-N 2.94Å; S199-D203 PolarHBondContact O-N 3.15Å
200R57.3Low61Low225 Ų225101 Ų10185%0.84950%0.496SS*.Hα-helixtrans-67-26.2-179.8-78.8166.785.9174.34.3114.7D203 R204R200-D203 WeakPolarHBondContact O-CB 3.15Å; R200-R204 PolarHBondContact O-N 3.28Å
201E56.5Low60.6Low155 Ų155109.1 Ų109.172%0.72453%0.526SS*.Hα-helixtrans-78.8-40.1-179.8-169176.8-178.700111.6S199 D203 R204 N205S199-E201 PolarHBondContact O-N 2.94Å; E201-D203 PolarHBondContact O-N 2.99Å; E201-R204 PolarHBondContact O-N 3.21Å; E201-N205 PolarHBondContact O-N 3.43Å
202K56.6Low60.3Low133 Ų133105.1 Ų105.158%0.57851%0.51SS*.Hα-helixtrans-59.2-35.4172.1-146.6171.3-174.7174.70110.6L206K202-L206 WeakPolarHBondContact O-CB 3.39Å; K202-L206 PolarHBondContact O-N 3.46Å; K202-L206 VanDerWaalsContact O-N 3.07Å
203D53.8Low59.6Low33 Ų33103 Ų10318%0.17650%0.495CS..Hα-helixtrans-64.7-36.7178.8-161.226.3000113.9S199 R200 E201 R207S199-D203 PolarHBondContact O-N 3.15Å; R200-D203 WeakPolarHBondContact O-CB 3.15Å; E201-D203 PolarHBondContact O-N 2.99Å; D203-R207 PolarHBondContact O-N 2.91Å; D203-R207 IonicContact OD1-CZ 2.79Å; D203-R207 IonicContact OD1-NH1 2.97Å; D203-R207 PolarHBondContact OD1-NH1 3.26Å; D203-R207 IonicContact OD1-NH2 3.7Å; D203-R207 IonicContact OD2-CZ 3.46Å; D203-R207 IonicContact OD2-NH1 3.37Å; D203-R207 PolarHBondContact OD2-NH1 2.96Å; D203-R207 IonicContact OD2-NH2 3.32Å; D203-R207 PolarHBondContact OD2-NH2 3.48Å
204R60.6Low59.4Low186 Ų186106.2 Ų106.270%0.70251%0.51SS*.Hα-helixtrans-71.9-45.1178.5-165176.886-1774.7112R200 E201 L206 R208R200-R204 PolarHBondContact O-N 3.28Å; E201-R204 PolarHBondContact O-N 3.21Å; R204-L206 VanDerWaalsContact C-N 3.28Å; R204-L206 PolarHBondContact O-N 3.03Å; R204-R208 WeakPolarHBondContact O-CB 3.28Å; R204-R208 PolarHBondContact O-N 3.43Å
205N58.5Low59.8Low88 Ų88101.8 Ų101.847%0.47150%0.5SS..Hα-helixtrans-65.1-35.5176.5-80.6-2.3000111.3E201 R208 I209E201-N205 PolarHBondContact O-N 3.43Å; N205-R208 PolarHBondContact O-N 2.86Å; N205-I209 WeakPolarHBondContact O-CD1 3.3Å; N205-I209 VanDerWaalsContact O-CG1 3.24Å; N205-I209 WeakPolarHBondContact O-CG1 3.31Å; N205-I209 PolarHBondContact O-N 2.9Å
206L57.9Low60.4Low41 Ų4195.6 Ų95.622%0.21547%0.469CS..Hα-helixtrans-66.7-48.3176.7-142.570000113.4L190 K202 R204 R208 I209 T210L190-L206 HydrophobicContact CB-CD1 4.47Å; L190-L206 HydrophobicContact CB-CD2 3.74Å; L190-L206 HydrophobicContact CB-CG 4.18Å; L190-L206 HydrophobicContact CD1-CD1 3.79Å; L190-L206 HydrophobicContact CD1-CD2 4.37Å; L190-L206 HydrophobicContact CD1-CG 3.86Å; L190-L206 HydrophobicContact CD2-CD1 3.23Å; L190-L206 HydrophobicContact CD2-CD2 3.94Å; L190-L206 HydrophobicContact CD2-CG 3.89Å; L190-L206 HydrophobicContact CG-CD1 3.96Å; L190-L206 HydrophobicContact CG-CD2 4.19Å; L190-L206 HydrophobicContact CG-CG 4.15Å; K202-L206 WeakPolarHBondContact O-CB 3.39Å; K202-L206 PolarHBondContact O-N 3.46Å; K202-L206 VanDerWaalsContact O-N 3.07Å; R204-L206 VanDerWaalsContact C-N 3.28Å; R204-L206 PolarHBondContact O-N 3.03Å; L206-R208 VanDerWaalsContact C-N 3.25Å; L206-R208 PolarHBondContact O-N 2.92Å; L206-I209 PolarHBondContact O-N 3Å; L206-I209 VanDerWaalsContact O-N 3.15Å; L206-T210 PolarHBondContact O-N 3.22Å; L206-T210 PolarHBondContact O-OG1 2.67Å
207R58.6Low60.9Low136 Ų13689.9 Ų89.951%0.51344%0.44SS..Hα-helixtrans-61.4-36.1175.2-81.7-168-79.1-89.62.2111.9D203 R211D203-R207 PolarHBondContact O-N 2.91Å; D203-R207 IonicContact OD1-CZ 2.79Å; D203-R207 IonicContact OD1-NH1 2.97Å; D203-R207 PolarHBondContact OD1-NH1 3.26Å; D203-R207 IonicContact OD1-NH2 3.7Å; D203-R207 IonicContact OD2-CZ 3.46Å; D203-R207 IonicContact OD2-NH1 3.37Å; D203-R207 PolarHBondContact OD2-NH1 2.96Å; D203-R207 IonicContact OD2-NH2 3.32Å; D203-R207 PolarHBondContact OD2-NH2 3.48Å; R207-R211 WeakPolarHBondContact O-CB 3.03Å; R207-R211 PolarHBondContact O-N 3.43Å
208R66.5Low61.7Low92 Ų9289 Ų8935%0.34744%0.437SS..Hα-helixtrans-62-45.8173.2-173.1175.2176.8167.3-2.7111R204 N205 L206 L212 F270 L271 E273R204-R208 WeakPolarHBondContact O-CB 3.28Å; R204-R208 PolarHBondContact O-N 3.43Å; N205-R208 PolarHBondContact O-N 2.86Å; L206-R208 VanDerWaalsContact C-N 3.25Å; L206-R208 PolarHBondContact O-N 2.92Å; R208-L212 WeakPolarHBondContact O-CB 2.99Å; R208-L212 PolarHBondContact O-N 3.08Å; R208-F270 PolarHBondContact NH2-O 3.18Å; R208-L271 PolarHBondContact NH2-O 3.04Å; R208-E273 IonicContact CZ-OE1 2.62Å; R208-E273 IonicContact NH1-OE1 3.03Å; R208-E273 PolarHBondContact NH1-OE1 3.38Å; R208-E273 IonicContact NH2-OE1 3.69Å; R208-E273 PolarHBondContact NH2-OE1 3.46Å
209I63.5Low62.6Low66 Ų6686.7 Ų86.734%0.33841%0.407SS..Hα-helixtrans-65.4-45.4177.4-67.1163.8000111.4M186 N205 L206 L212 V213M186-I209 HydrophobicContact CE-CG2 4.45Å; N205-I209 WeakPolarHBondContact O-CD1 3.3Å; N205-I209 VanDerWaalsContact O-CG1 3.24Å; N205-I209 WeakPolarHBondContact O-CG1 3.31Å; N205-I209 PolarHBondContact O-N 2.9Å; L206-I209 PolarHBondContact O-N 3Å; L206-I209 VanDerWaalsContact O-N 3.15Å; I209-L212 WeakPolarHBondContact O-CB 3.38Å; I209-L212 PolarHBondContact O-N 3.07Å; I209-V213 WeakPolarHBondContact O-CB 3.38Å; I209-V213 WeakPolarHBondContact O-CG2 3.2Å; I209-V213 PolarHBondContact O-N 2.85Å
210T58.8Low63.2Low34 Ų3483.8 Ų83.821%0.20939%0.386CS..Hα-helixtrans-64.7-41.6177.6-57.30000112.1V187 L206 V213 L214V187-T210 HydrophobicContact CG2-CG2 3.89Å; L206-T210 PolarHBondContact O-N 3.22Å; L206-T210 PolarHBondContact O-OG1 2.67Å; T210-V213 PolarHBondContact O-N 3.21Å; T210-L214 HydrophobicContact CG2-CD1 4.34Å; T210-L214 WeakPolarHBondContact O-CG 3.43Å; T210-L214 PolarHBondContact O-N 3.32Å
211R64.1Low64.1Low193 Ų19375.5 Ų75.573%0.72836%0.36SS*.Hα-helixtrans-64-43.7176-176.5178.8177.7-174.7-0.2111.3R207 V213 L214 V215R207-R211 WeakPolarHBondContact O-CB 3.03Å; R207-R211 PolarHBondContact O-N 3.43Å; R211-V213 VanDerWaalsContact C-N 3.27Å; R211-V213 PolarHBondContact O-N 3Å; R211-L214 PolarHBondContact O-N 3.14Å; R211-V215 VanDerWaalsContact O-CG2 3.27Å; R211-V215 WeakPolarHBondContact O-CG2 3.43Å; R211-V215 PolarHBondContact O-N 2.84Å
212L64.5Low65.3Low45 Ų4572.4 Ų72.424%0.23635%0.352CS..Hα-helixtrans-54.4-47.4174.9178.5164.2000111.1R208 I209 V215 V216 L271R208-L212 WeakPolarHBondContact O-CB 2.99Å; R208-L212 PolarHBondContact O-N 3.08Å; I209-L212 WeakPolarHBondContact O-CB 3.38Å; I209-L212 PolarHBondContact O-N 3.07Å; L212-V215 PolarHBondContact O-N 3.47Å; L212-V216 HydrophobicContact CD2-CG2 4.13Å; L212-V216 WeakPolarHBondContact O-CG2 3.34Å; L212-V216 PolarHBondContact O-N 2.83Å; L212-L271 HydrophobicContact CB-CD1 4.48Å; L212-L271 HydrophobicContact CB-CD2 3.91Å; L212-L271 HydrophobicContact CD1-CB 3.54Å; L212-L271 HydrophobicContact CD1-CD1 3.58Å; L212-L271 HydrophobicContact CD1-CD2 3.59Å; L212-L271 HydrophobicContact CD1-CG 3.69Å; L212-L271 HydrophobicContact CD2-CD1 4.13Å; L212-L271 HydrophobicContact CG-CB 4.3Å; L212-L271 HydrophobicContact CG-CD1 3.38Å; L212-L271 HydrophobicContact CG-CD2 3.62Å; L212-L271 HydrophobicContact CG-CG 3.89Å
213V59.1Low66.5Low6 Ų666.3 Ų66.34%0.03633%0.326CS..Hα-helixtrans-65.1-45.7-178.8159.80000112Y183 M186 I209 T210 R211 V215 V216 V217Y183-V213 HydrophobicContact CD1-CB 4.08Å; Y183-V213 HydrophobicContact CD1-CG1 3.12Å; Y183-V213 HydrophobicContact CD1-CG2 3.86Å; Y183-V213 HydrophobicContact CD2-CG1 3.65Å; Y183-V213 HydrophobicContact CE1-CB 3.91Å; Y183-V213 HydrophobicContact CE1-CG1 3.36Å; Y183-V213 HydrophobicContact CE1-CG2 3.3Å; Y183-V213 HydrophobicContact CE2-CG1 3.85Å; Y183-V213 HydrophobicContact CG-CG1 3.27Å; M186-V213 HydrophobicContact CE-CG1 4.37Å; M186-V213 HydrophobicContact CE-CG2 3.95Å; I209-V213 WeakPolarHBondContact O-CB 3.38Å; I209-V213 WeakPolarHBondContact O-CG2 3.2Å; I209-V213 PolarHBondContact O-N 2.85Å; T210-V213 PolarHBondContact O-N 3.21Å; R211-V213 VanDerWaalsContact C-N 3.27Å; R211-V213 PolarHBondContact O-N 3Å; V213-V215 VanDerWaalsContact C-N 3.26Å; V213-V215 PolarHBondContact O-N 3.12Å; V213-V216 PolarHBondContact O-N 2.02Å; V213-V217 WeakPolarHBondContact O-CG2 3.29Å; V213-V217 PolarHBondContact O-N 3.47Å
214L63.3Low67.7Low117 Ų11765.7 Ų65.761%0.61332%0.321SS*.Hα-helixtrans-60.5-38.9175-73.2171000111.7T210 R211 A218T210-L214 HydrophobicContact CG2-CD1 4.34Å; T210-L214 WeakPolarHBondContact O-CG 3.43Å; T210-L214 PolarHBondContact O-N 3.32Å; R211-L214 PolarHBondContact O-N 3.14Å; L214-A218 WeakPolarHBondContact O-CB 3.23Å; L214-A218 PolarHBondContact O-N 3.04Å
215V69.4Low68.8Low60 Ų6058.4 Ų58.436%0.36430%0.297SS..Hα-helixtrans-65.1-47175.7170.70000110.9R211 L212 V213 V217 A218 V219 L267R211-V215 VanDerWaalsContact O-CG2 3.27Å; R211-V215 WeakPolarHBondContact O-CG2 3.43Å; R211-V215 PolarHBondContact O-N 2.84Å; L212-V215 PolarHBondContact O-N 3.47Å; V213-V215 VanDerWaalsContact C-N 3.26Å; V213-V215 PolarHBondContact O-N 3.12Å; V215-V217 PolarHBondContact O-N 3.14Å; V215-A218 PolarHBondContact O-N 2.81Å; V215-V219 HydrophobicContact CG1-CG2 4.18Å; V215-V219 WeakPolarHBondContact O-CB 3.47Å; V215-V219 WeakPolarHBondContact O-CG2 3.13Å; V215-V219 PolarHBondContact O-N 3.22Å; V215-L267 HydrophobicContact CG1-CD2 4Å
216V68Low70.1Confident31 Ų3156.2 Ų56.219%0.18829%0.288CS..Hα-helixtrans-62.2-44.5179.5171.90000111.5L212 V213 V219 F220 L267L212-V216 HydrophobicContact CD2-CG2 4.13Å; L212-V216 WeakPolarHBondContact O-CG2 3.34Å; L212-V216 PolarHBondContact O-N 2.83Å; V213-V216 PolarHBondContact O-N 2.02Å; V216-V219 PolarHBondContact O-N 2.98Å; V216-F220 WeakPolarHBondContact O-CB 3.37Å; V216-F220 PolarHBondContact O-N 2.82Å; V216-L267 HydrophobicContact CG2-CD1 4.4Å
217V66.8Low71.3Confident31 Ų3155 Ų5519%0.18828%0.281CS..Hα-helixtrans-64.9-44.1176.8175.50000111.1I179 Y183 V213 V215 F220 V221I179-V217 HydrophobicContact CG2-CG2 3.75Å; Y183-V217 HydrophobicContact CD2-CG2 3.64Å; Y183-V217 HydrophobicContact CE2-CG2 3.75Å; V213-V217 WeakPolarHBondContact O-CG2 3.29Å; V213-V217 PolarHBondContact O-N 3.47Å; V215-V217 PolarHBondContact O-N 3.14Å; V217-F220 PolarHBondContact O-N 2.9Å; V217-V221 HydrophobicContact CG1-CG2 4.43Å; V217-V221 WeakPolarHBondContact O-CG2 3.26Å; V217-V221 PolarHBondContact O-N 3.43Å
218A72.7Confident72.5Confident51 Ų5148.6 Ų48.642%0.42126%0.257SS..Hα-helixtrans-63.5-43.4178.200000111.7L214 V215 V221 V222L214-A218 WeakPolarHBondContact O-CB 3.23Å; L214-A218 PolarHBondContact O-N 3.04Å; V215-A218 PolarHBondContact O-N 2.81Å; A218-V221 PolarHBondContact O-N 3.08Å; A218-V222 VanDerWaalsContact O-CB 3.29Å; A218-V222 WeakPolarHBondContact O-CB 3.08Å; A218-V222 WeakPolarHBondContact O-CG2 3.23Å; A218-V222 PolarHBondContact O-N 3.45Å
219V76.6Confident73.3Confident30 Ų3048.7 Ų48.718%0.18226%0.264CS..Hα-helixtrans-61.5-46.4175.7170.40000110.1V215 V216 V221 V222 C223 L263V215-V219 HydrophobicContact CG1-CG2 4.18Å; V215-V219 WeakPolarHBondContact O-CB 3.47Å; V215-V219 WeakPolarHBondContact O-CG2 3.13Å; V215-V219 PolarHBondContact O-N 3.22Å; V216-V219 PolarHBondContact O-N 2.98Å; V219-V221 PolarHBondContact O-N 3.33Å; V219-V222 PolarHBondContact O-N 2.92Å; V219-C223 WeakPolarHBondContact O-CB 3.2Å; V219-C223 PolarHBondContact O-N 3.04Å; V219-C223 PolarHBondContact O-SG 3.31Å; V219-C223 VanDerWaalsContact O-SG 3.32Å; V219-L263 HydrophobicContact CG1-CD1 3.86Å
220F73.7Confident74.2Confident7 Ų747.2 Ų47.23%0.03126%0.255CS..Hα-helixtrans-58.6-49.7177.4-178.5-98.6000112.1I86 L89 F172 L176 V216 V217 C223 W224I86-F220 HydrophobicContact CB-CE2 4.49Å; I86-F220 HydrophobicContact CD1-CD2 4.12Å; I86-F220 HydrophobicContact CD1-CE1 3.87Å; I86-F220 HydrophobicContact CD1-CE2 3.33Å; I86-F220 HydrophobicContact CD1-CZ 3.18Å; I86-F220 HydrophobicContact CG1-CE2 4.13Å; I86-F220 HydrophobicContact CG1-CZ 3.84Å; L89-F220 HydrophobicContact CD1-CD2 4.04Å; F172-F220 HydrophobicContact CD2-CE1 4.13Å; F172-F220 HydrophobicContact CD2-CZ 4.43Å; F172-F220 HydrophobicContact CE2-CE1 4.34Å; L176-F220 HydrophobicContact CD1-CD1 4.45Å; V216-F220 WeakPolarHBondContact O-CB 3.37Å; V216-F220 PolarHBondContact O-N 2.82Å; V217-F220 PolarHBondContact O-N 2.9Å; F220-C223 PolarHBondContact O-N 3.38Å; F220-W224 AromaticContact CD2-CD1 3.36Å; F220-W224 HydrophobicContact CD2-CG 4.17Å; F220-W224 AromaticContact CD2-NE1 3.78Å; F220-W224 HydrophobicContact CE2-CB 4.34Å; F220-W224 AromaticContact CE2-CD1 3.31Å; F220-W224 HydrophobicContact CE2-CD2 4.3Å; F220-W224 AromaticContact CE2-CG 3.74Å; F220-W224 HydrophobicContact CE2-CG 3.74Å; F220-W224 AromaticContact CE2-NE1 3.64Å; F220-W224 HydrophobicContact CZ-CB 4.27Å; F220-W224 HydrophobicContact CZ-CG 4.12Å; F220-W224 WeakPolarHBondContact O-CB 3.07Å; F220-W224 PolarHBondContact O-N 3.35Å
221V77.1Confident75.2Confident50 Ų5047.6 Ų47.630%0.30326%0.255SS..Hα-helixtrans-61.8-49178.4171.60000110.7L176 V217 A218 V219 C223 T225L176-V221 HydrophobicContact CD1-CG2 3.67Å; V217-V221 HydrophobicContact CG1-CG2 4.43Å; V217-V221 WeakPolarHBondContact O-CG2 3.26Å; V217-V221 PolarHBondContact O-N 3.43Å; A218-V221 PolarHBondContact O-N 3.08Å; V219-V221 PolarHBondContact O-N 3.33Å; V221-C223 VanDerWaalsContact C-N 3.33Å; V221-C223 PolarHBondContact O-N 3.34Å; V221-T225 WeakPolarHBondContact CG1-OG1 3.48Å; V221-T225 WeakPolarHBondContact O-CB 3.39Å; V221-T225 PolarHBondContact O-N 2.95Å; V221-T225 PolarHBondContact O-OG1 3.41Å
222V81.4Confident76Confident90 Ų9041.1 Ų41.155%0.54524%0.235SC..Hα-helixtrans-63.8-39.5-178.6170.70000111.4A218 V219 P226 L256A218-V222 VanDerWaalsContact O-CB 3.29Å; A218-V222 WeakPolarHBondContact O-CB 3.08Å; A218-V222 WeakPolarHBondContact O-CG2 3.23Å; A218-V222 PolarHBondContact O-N 3.45Å; V219-V222 PolarHBondContact O-N 2.92Å; V222-P226 WeakPolarHBondContact O-CD 3.38Å; V222-P226 WeakPolarHBondContact O-CG 3.18Å; V222-L256 WeakPolarHBondContact O-CD2 3.37Å
223C81Confident76.8Confident5 Ų542.4 Ų42.43%0.03424%0.244CC..Hα-helixtrans-74.3-41.6-178.2-73.70000113.7V219 F220 V221 L256 G257 N260V219-C223 WeakPolarHBondContact O-CB 3.2Å; V219-C223 PolarHBondContact O-N 3.04Å; V219-C223 PolarHBondContact O-SG 3.31Å; V219-C223 VanDerWaalsContact O-SG 3.32Å; F220-C223 PolarHBondContact O-N 3.38Å; V221-C223 VanDerWaalsContact C-N 3.33Å; V221-C223 PolarHBondContact O-N 3.34Å; C223-L256 WeakPolarHBondContact CB-O 3.43Å; C223-L256 PolarHBondContact SG-O 2.75Å; C223-G257 PolarHBondContact O-N 3.07Å; C223-N260 HydrophobicContact CB-CB 3.95Å
224W80.3Confident77.6Confident20 Ų2046.4 Ų46.48%0.07626%0.261CS..Hα-helixtrans-98.4-26.5-171-71.490.9000114.1M82 F172 F220 I227 H228 N260M82-W224 HydrophobicContact CB-CH2 4.1Å; M82-W224 HydrophobicContact CB-CZ3 4.31Å; M82-W224 HydrophobicContact CG-CH2 3.89Å; M82-W224 HydrophobicContact CG-CZ3 3.67Å; M82-W224 HydrophobicContact SD-CZ3 4.14Å; F172-W224 HydrophobicContact CD2-CB 4.34Å; F172-W224 HydrophobicContact CE2-CB 4.4Å; F220-W224 AromaticContact CD2-CD1 3.36Å; F220-W224 HydrophobicContact CD2-CG 4.17Å; F220-W224 AromaticContact CD2-NE1 3.78Å; F220-W224 HydrophobicContact CE2-CB 4.34Å; F220-W224 AromaticContact CE2-CD1 3.31Å; F220-W224 HydrophobicContact CE2-CD2 4.3Å; F220-W224 AromaticContact CE2-CG 3.74Å; F220-W224 HydrophobicContact CE2-CG 3.74Å; F220-W224 AromaticContact CE2-NE1 3.64Å; F220-W224 HydrophobicContact CZ-CB 4.27Å; F220-W224 HydrophobicContact CZ-CG 4.12Å; F220-W224 WeakPolarHBondContact O-CB 3.07Å; F220-W224 PolarHBondContact O-N 3.35Å; W224-I227 HydrophobicContact CE3-CG2 4.24Å; W224-I227 WeakPolarHBondContact O-CG2 3.32Å; W224-I227 PolarHBondContact O-N 2.95Å; W224-H228 AromaticContact CE3-NE2 3.74Å; W224-H228 PolarHBondContact O-CD2 2.82Å; W224-H228 PolarHBondContact O-N 3.37Å; W224-N260 PolarHBondContact NE1-ND2 3.3Å
225T83Confident78Confident33 Ų3341.9 Ų41.920%0.20224%0.241CC..Hα-helixtrans-60.1-44.4-178.1-570000112.9F172 V221 I227 H228 I229F172-T225 HydrophobicContact CZ-CG2 4.28Å; F172-T225 VanDerWaalsContact CZ-OG1 3.32Å; F172-T225 WeakPolarHBondContact CZ-OG1 3.33Å; V221-T225 WeakPolarHBondContact CG1-OG1 3.48Å; V221-T225 WeakPolarHBondContact O-CB 3.39Å; V221-T225 PolarHBondContact O-N 2.95Å; V221-T225 PolarHBondContact O-OG1 3.41Å; T225-I227 PolarHBondContact O-N 3.37Å; T225-H228 PolarHBondContact O-N 3.46Å; T225-I229 HydrophobicContact CG2-CD1 3.5Å; T225-I229 VanDerWaalsContact CG2-CD1 3.5Å; T225-I229 HydrophobicContact CG2-CG1 3.94Å; T225-I229 WeakPolarHBondContact O-CB 3.27Å; T225-I229 WeakPolarHBondContact O-CG1 3.27Å; T225-I229 PolarHBondContact O-N 3.43Å
226P85.4Confident78.3Confident42 Ų4245.4 Ų45.427%0.27326%0.257SS..Hα-helixtrans-60.3-42.9-177.2-27.438.8000112.9V222 F230 C253 L256V222-P226 WeakPolarHBondContact O-CD 3.38Å; V222-P226 WeakPolarHBondContact O-CG 3.18Å; P226-F230 WeakPolarHBondContact O-CB 3.43Å; P226-F230 PolarHBondContact O-N 2.83Å; P226-C253 HydrophobicContact CB-CB 4.16Å; P226-L256 HydrophobicContact CG-CD2 3.89Å
227I83.8Confident78.7Confident15 Ų1545.9 Ų45.98%0.07726%0.262CS..Hα-helixtrans-68.8-40.1179.5-171.958.2000111.8W224 T225 F230 I231 Y250 C253 V254W224-I227 HydrophobicContact CE3-CG2 4.24Å; W224-I227 WeakPolarHBondContact O-CG2 3.32Å; W224-I227 PolarHBondContact O-N 2.95Å; T225-I227 PolarHBondContact O-N 3.37Å; I227-F230 PolarHBondContact O-N 3.32Å; I227-I231 HydrophobicContact CD1-CD1 4.39Å; I227-I231 HydrophobicContact CD1-CG1 4.48Å; I227-I231 HydrophobicContact CG1-CD1 4.01Å; I227-I231 VanDerWaalsContact O-CG1 3.27Å; I227-I231 WeakPolarHBondContact O-CG1 3.03Å; I227-I231 PolarHBondContact O-N 3.34Å; I227-Y250 HydrophobicContact CD1-CD2 3.97Å; I227-Y250 HydrophobicContact CD1-CE2 3.71Å; I227-C253 HydrophobicContact CB-CB 4.09Å; I227-C253 HydrophobicContact CD1-CB 4.12Å; I227-V254 HydrophobicContact CD1-CG2 3.58Å; I227-V254 HydrophobicContact CG1-CG2 4.34Å
228H83.2Confident78.5Confident3 Ų350 Ų501%0.01430%0.299CS..Hα-helixtrans-68.9-37.6177.4-76.8-57.9000113.1F168 F172 W224 T225 F230 I231 L232F168-H228 HydrophobicContact CD2-CB 3.99Å; F168-H228 HydrophobicContact CE2-CB 4.2Å; F172-H228 HydrophobicContact CD1-CB 4.47Å; F172-H228 AromaticContact CD2-CD2 3.52Å; F172-H228 HydrophobicContact CG-CB 4.42Å; F172-H228 AromaticContact CG-CD2 3.62Å; W224-H228 AromaticContact CE3-NE2 3.74Å; W224-H228 PolarHBondContact O-CD2 2.82Å; W224-H228 PolarHBondContact O-N 3.37Å; T225-H228 PolarHBondContact O-N 3.46Å; H228-F230 VanDerWaalsContact C-N 3.33Å; H228-I231 PolarHBondContact O-N 3.32Å; H228-L232 WeakPolarHBondContact O-CB 3.2Å; H228-L232 PolarHBondContact O-N 2.93Å
229I84.1Confident78.2Confident94 Ų9452.4 Ų52.448%0.48231%0.313SS..Hα-helixtrans-61.5-45.7171.3-70.6177.1000109.7T225 I231 L232 V233T225-I229 HydrophobicContact CG2-CD1 3.5Å; T225-I229 VanDerWaalsContact CG2-CD1 3.5Å; T225-I229 HydrophobicContact CG2-CG1 3.94Å; T225-I229 WeakPolarHBondContact O-CB 3.27Å; T225-I229 WeakPolarHBondContact O-CG1 3.27Å; T225-I229 PolarHBondContact O-N 3.43Å; I229-I231 PolarHBondContact O-N 3.03Å; I229-L232 PolarHBondContact O-N 3.27Å; I229-V233 HydrophobicContact CG2-CG2 4.2Å; I229-V233 VanDerWaalsContact O-CG2 3.3Å; I229-V233 WeakPolarHBondContact O-CG2 3.36Å; I229-V233 PolarHBondContact O-N 3.29Å
230F82.8Confident77.8Confident35 Ų3553 Ų5315%0.15432%0.316CS..Hα-helixtrans-61.5-44.1-179.7-164.6-80.6000112.1P226 I227 H228 L232 V233 K234 V246 A249 Y250P226-F230 WeakPolarHBondContact O-CB 3.43Å; P226-F230 PolarHBondContact O-N 2.83Å; I227-F230 PolarHBondContact O-N 3.32Å; H228-F230 VanDerWaalsContact C-N 3.33Å; F230-L232 VanDerWaalsContact C-N 3.35Å; F230-V233 PolarHBondContact O-N 3.19Å; F230-K234 HydrophobicContact CD1-CD 4.42Å; F230-K234 HydrophobicContact CD1-CG 4.4Å; F230-K234 HydrophobicContact CE1-CD 3.87Å; F230-K234 HydrophobicContact CE1-CG 4.11Å; F230-K234 PolarHBondContact O-N 2.58Å; F230-V246 HydrophobicContact CE2-CG1 4.14Å; F230-V246 HydrophobicContact CZ-CG1 3.62Å; F230-A249 HydrophobicContact CE2-CB 4.4Å; F230-Y250 AromaticContact CD1-CD2 3.62Å; F230-Y250 HydrophobicContact CD1-CD2 3.62Å; F230-Y250 HydrophobicContact CD1-CE2 4.43Å; F230-Y250 HydrophobicContact CD1-CG 4.49Å; F230-Y250 AromaticContact CE1-CD2 3.54Å; F230-Y250 HydrophobicContact CE1-CD2 3.54Å; F230-Y250 HydrophobicContact CE1-CG 4.04Å; F230-Y250 HydrophobicContact CG-CD2 4.43Å; F230-Y250 HydrophobicContact CZ-CD2 4.32Å; F230-Y250 HydrophobicContact CZ-CG 4.44Å
231I79.8Confident77.8Confident41 Ų4156.6 Ų56.621%0.2134%0.34CS..Hα-helixtrans-61.6-43.5175.4-69.4165.8000110.8K164 I227 H228 I229 K234 A235K164-I231 HydrophobicContact CB-CG2 3.87Å; K164-I231 HydrophobicContact CD-CG2 4.06Å; K164-I231 HydrophobicContact CG-CG2 3.72Å; I227-I231 HydrophobicContact CD1-CD1 4.39Å; I227-I231 HydrophobicContact CD1-CG1 4.48Å; I227-I231 HydrophobicContact CG1-CD1 4.01Å; I227-I231 VanDerWaalsContact O-CG1 3.27Å; I227-I231 WeakPolarHBondContact O-CG1 3.03Å; I227-I231 PolarHBondContact O-N 3.34Å; H228-I231 PolarHBondContact O-N 3.32Å; I229-I231 PolarHBondContact O-N 3.03Å; I231-K234 PolarHBondContact O-N 2.63Å; I231-A235 WeakPolarHBondContact O-CB 3.46Å; I231-A235 PolarHBondContact O-N 2.95Å
232L79.6Confident77.5Confident58 Ų5862.8 Ų62.830%0.30437%0.366SS..Hα-helixtrans-65.7-42.5179.2-174.566.3000111.9F168 H228 I229 F230 A235 L236F168-L232 HydrophobicContact CE2-CD2 4.49Å; F168-L232 HydrophobicContact CZ-CD2 4.31Å; H228-L232 WeakPolarHBondContact O-CB 3.2Å; H228-L232 PolarHBondContact O-N 2.93Å; I229-L232 PolarHBondContact O-N 3.27Å; F230-L232 VanDerWaalsContact C-N 3.35Å; L232-A235 PolarHBondContact O-N 2.83Å; L232-L236 HydrophobicContact CD1-CD1 3.78Å; L232-L236 HydrophobicContact CD1-CG 4.1Å; L232-L236 HydrophobicContact CD2-CD1 4.44Å; L232-L236 HydrophobicContact CG-CD1 3.8Å; L232-L236 HydrophobicContact CG-CG 4.38Å; L232-L236 WeakPolarHBondContact O-CB 3.29Å; L232-L236 WeakPolarHBondContact O-CG 3.12Å; L232-L236 PolarHBondContact O-N 3.15Å
233V82.8Confident77.4Confident72 Ų7261.8 Ų61.844%0.43636%0.36SS..Hα-helixtrans-61.4-47.2175.8170.20000110.2I229 F230 A235 L236 S237 V240I229-V233 HydrophobicContact CG2-CG2 4.2Å; I229-V233 VanDerWaalsContact O-CG2 3.3Å; I229-V233 WeakPolarHBondContact O-CG2 3.36Å; I229-V233 PolarHBondContact O-N 3.29Å; F230-V233 PolarHBondContact O-N 3.19Å; V233-A235 VanDerWaalsContact C-N 3.26Å; V233-A235 PolarHBondContact O-N 3.42Å; V233-L236 PolarHBondContact O-N 3.36Å; V233-S237 WeakPolarHBondContact O-CB 3.38Å; V233-S237 PolarHBondContact O-N 2.88Å; V233-S237 PolarHBondContact O-OG 3.45Å; V233-V240 HydrophobicContact CG1-CG2 4.21Å
234K74.4Confident77.1Confident89 Ų8967.6 Ų67.639%0.38740%0.395SS..Hα-helixtrans-63.2-29.2174.9-86.1-159.8172-169.20113.5F230 I231 V240F230-K234 HydrophobicContact CD1-CD 4.42Å; F230-K234 HydrophobicContact CD1-CG 4.4Å; F230-K234 HydrophobicContact CE1-CD 3.87Å; F230-K234 HydrophobicContact CE1-CG 4.11Å; F230-K234 PolarHBondContact O-N 2.58Å; I231-K234 PolarHBondContact O-N 2.63Å; K234-V240 HydrophobicContact CG-CG2 4.31Å
235A72.3Confident77.1Confident22 Ų2270 Ų7018%0.18242%0.42CS..Hα-helixtrans-76.2-36.8177.300000112.6K164 I231 L232 V233K164-A235 HydrophobicContact CB-CB 4.5Å; K164-A235 HydrophobicContact CD-CB 4.04Å; I231-A235 WeakPolarHBondContact O-CB 3.46Å; I231-A235 PolarHBondContact O-N 2.95Å; L232-A235 PolarHBondContact O-N 2.83Å; V233-A235 VanDerWaalsContact C-N 3.26Å; V233-A235 PolarHBondContact O-N 3.42Å
236L76.4Confident77Confident134 Ų13470 Ų7070%0.70242%0.42SS*.Hα-helixtrans-93.7-20.5-174.2-64.4177.5000113.9L232 V233L232-L236 HydrophobicContact CD1-CD1 3.78Å; L232-L236 HydrophobicContact CD1-CG 4.1Å; L232-L236 HydrophobicContact CD2-CD1 4.44Å; L232-L236 HydrophobicContact CG-CD1 3.8Å; L232-L236 HydrophobicContact CG-CG 4.38Å; L232-L236 WeakPolarHBondContact O-CB 3.29Å; L232-L236 WeakPolarHBondContact O-CG 3.12Å; L232-L236 PolarHBondContact O-N 3.15Å; V233-L236 PolarHBondContact O-N 3.36Å
237S75.3Confident76.5Confident42 Ų4272.4 Ų72.429%0.29443%0.428SS..  trans-114.4119.7179.963.80000111.3V233 S239 V240V233-S237 WeakPolarHBondContact O-CB 3.38Å; V233-S237 PolarHBondContact O-N 2.88Å; V233-S237 PolarHBondContact O-OG 3.45Å; S237-S239 PolarHBondContact O-N 2.88Å; S237-V240 WeakPolarHBondContact OG-CG2 3.32Å
238A62.8Low76.2Confident117 Ų11773.4 Ų73.497%0.96744%0.439SS*.THydrogen-bonded Turntrans-75.5-6-179.300000113.7
239S66.1Low76.1Confident102 Ų10275.3 Ų75.371%0.71346%0.455SS*.THydrogen-bonded Turntrans-131.544.1-167.565.80000112.9S237 P241S237-S239 PolarHBondContact O-N 2.88Å; S239-P241 WeakPolarHBondContact O-CD 3.21Å
240V68.6Low76.1Confident41 Ų4175.1 Ų75.125%0.24845%0.449CS..  trans-78.6118.1170.6-175.30000108.6V233 K234 S237 E242 V246V233-V240 HydrophobicContact CG1-CG2 4.21Å; K234-V240 HydrophobicContact CG-CG2 4.31Å; S237-V240 WeakPolarHBondContact OG-CG2 3.32Å; V240-E242 PolarHBondContact O-N 3.34Å; V240-V246 HydrophobicContact CG1-CG1 3.95Å
241P73.8Confident75.9Confident84 Ų8474.3 Ų74.355%0.54545%0.446SS..  trans-63129.6179-21.433.5000111.5S239 T243 V246S239-P241 WeakPolarHBondContact O-CD 3.21Å; P241-T243 HydrophobicContact CB-CG2 3.9Å; P241-T243 PolarHBondContact O-N 3.17Å; P241-V246 WeakPolarHBondContact O-CB 3.44Å; P241-V246 WeakPolarHBondContact O-CG2 3.36Å
242E70.1Confident76Confident179 Ų17978.4 Ų78.484%0.83646%0.462SS*.  trans-7955174.1-61.7-166.8156.300111.6V240V240-E242 PolarHBondContact O-N 3.34Å
243T79.1Confident76.2Confident69 Ų6976.4 Ų76.442%0.42345%0.453SS..  trans-80.3155.517660.80000110.7P241 A245 V246 M247P241-T243 HydrophobicContact CB-CG2 3.9Å; P241-T243 PolarHBondContact O-N 3.17Å; T243-A245 PolarHBondContact O-N 3.22Å; T243-A245 VanDerWaalsContact O-N 3.12Å; T243-V246 PolarHBondContact O-N 2.92Å; T243-V246 WeakPolarHBondContact OG1-CG2 3.48Å; T243-V246 PolarHBondContact OG1-N 2.93Å; T243-M247 PolarHBondContact O-N 2.96Å
244T76Confident76.2Confident127 Ų12773.8 Ų73.878%0.77944%0.437SS*.Hα-helixtrans-53.8-33.4173.9-46.70000112.4A248T244-A248 VanDerWaalsContact O-CB 3.26Å; T244-A248 WeakPolarHBondContact O-CB 3.48Å; T244-A248 PolarHBondContact O-N 3.41Å
245A80.3Confident76.5Confident71 Ų7169.8 Ų69.859%0.58742%0.42SS*.Hα-helixtrans-65.7-41.1176.100000112.4T243 A249T243-A245 PolarHBondContact O-N 3.22Å; T243-A245 VanDerWaalsContact O-N 3.12Å; A245-A249 VanDerWaalsContact O-CB 3.32Å; A245-A249 WeakPolarHBondContact O-CB 3.45Å; A245-A249 PolarHBondContact O-N 2.82Å
246V80.1Confident77Confident33 Ų3370.9 Ų70.920%0.242%0.423CS..Hα-helixtrans-69.8-40.5178.2171.20000111F230 V240 P241 T243 A249 Y250F230-V246 HydrophobicContact CE2-CG1 4.14Å; F230-V246 HydrophobicContact CZ-CG1 3.62Å; V240-V246 HydrophobicContact CG1-CG1 3.95Å; P241-V246 WeakPolarHBondContact O-CB 3.44Å; P241-V246 WeakPolarHBondContact O-CG2 3.36Å; T243-V246 PolarHBondContact O-N 2.92Å; T243-V246 WeakPolarHBondContact OG1-CG2 3.48Å; T243-V246 PolarHBondContact OG1-N 2.93Å; V246-A249 PolarHBondContact O-N 3.47Å; V246-Y250 PolarHBondContact O-N 2.93Å
247M75.4Confident77.3Confident92 Ų9264.7 Ų64.745%0.45339%0.392SS..Hα-helixtrans-64-45.9174.1-169.6178.7-170.200111.3T243 A249 Y250 F251T243-M247 PolarHBondContact O-N 2.96Å; M247-A249 VanDerWaalsContact C-N 3.33Å; M247-A249 PolarHBondContact O-N 3.23Å; M247-Y250 WeakPolarHBondContact O-CB 3.3Å; M247-Y250 PolarHBondContact O-N 3.4Å; M247-F251 HydrophobicContact CE-CE2 3.63Å; M247-F251 HydrophobicContact CE-CZ 4.26Å; M247-F251 HydrophobicContact CG-CD2 3.87Å; M247-F251 HydrophobicContact CG-CE2 3.59Å; M247-F251 WeakPolarHBondContact O-CD2 3.38Å; M247-F251 PolarHBondContact O-N 2.8Å; M247-F251 HydrophobicContact SD-CE2 4.37Å
248A77.4Confident77.6Confident37 Ų3763.3 Ų63.331%0.30638%0.38SS..Hα-helixtrans-61.3-40.5175.600000112.4T244 F252T244-A248 VanDerWaalsContact O-CB 3.26Å; T244-A248 WeakPolarHBondContact O-CB 3.48Å; T244-A248 PolarHBondContact O-N 3.41Å; A248-F252 VanDerWaalsContact O-CB 3.27Å; A248-F252 WeakPolarHBondContact O-CB 3.21Å; A248-F252 PolarHBondContact O-N 3.24Å
249A82.1Confident78.4Confident42 Ų4259.5 Ų59.535%0.34735%0.345SS..Hα-helixtrans-63.9-40175.100000112.1F230 A245 V246 M247 F252 C253F230-A249 HydrophobicContact CE2-CB 4.4Å; A245-A249 VanDerWaalsContact O-CB 3.32Å; A245-A249 WeakPolarHBondContact O-CB 3.45Å; A245-A249 PolarHBondContact O-N 2.82Å; V246-A249 PolarHBondContact O-N 3.47Å; M247-A249 VanDerWaalsContact C-N 3.33Å; M247-A249 PolarHBondContact O-N 3.23Å; A249-F252 PolarHBondContact O-N 3.39Å; A249-C253 PolarHBondContact O-N 3.49Å; A249-C253 PolarHBondContact O-SG 3.02Å
250Y82.4Confident79.1Confident90 Ų9054.9 Ų54.935%0.35331%0.312SS..Hα-helixtrans-59.9-55.8174.7175.5-105.2000111.6I227 F230 V246 M247 F252 C253 V254I227-Y250 HydrophobicContact CD1-CD2 3.97Å; I227-Y250 HydrophobicContact CD1-CE2 3.71Å; F230-Y250 AromaticContact CD1-CD2 3.62Å; F230-Y250 HydrophobicContact CD1-CD2 3.62Å; F230-Y250 HydrophobicContact CD1-CE2 4.43Å; F230-Y250 HydrophobicContact CD1-CG 4.49Å; F230-Y250 AromaticContact CE1-CD2 3.54Å; F230-Y250 HydrophobicContact CE1-CD2 3.54Å; F230-Y250 HydrophobicContact CE1-CG 4.04Å; F230-Y250 HydrophobicContact CG-CD2 4.43Å; F230-Y250 HydrophobicContact CZ-CD2 4.32Å; F230-Y250 HydrophobicContact CZ-CG 4.44Å; V246-Y250 PolarHBondContact O-N 2.93Å; M247-Y250 WeakPolarHBondContact O-CB 3.3Å; M247-Y250 PolarHBondContact O-N 3.4Å; Y250-F252 PolarHBondContact O-N 2.9Å; Y250-C253 WeakPolarHBondContact O-CB 3.36Å; Y250-C253 PolarHBondContact O-N 3.49Å; Y250-V254 HydrophobicContact CD1-CG2 4.33Å; Y250-V254 HydrophobicContact CD2-CG2 4.37Å; Y250-V254 HydrophobicContact CE1-CG2 3.96Å; Y250-V254 HydrophobicContact CE2-CG2 4.02Å; Y250-V254 WeakPolarHBondContact O-CG2 3.46Å; Y250-V254 PolarHBondContact O-N 3.43Å
251F79.4Confident79.6Confident19 Ų1953 Ų538%0.08330%0.3CS..Hα-helixtrans-61.6-31.9179.4-77.1-71.6000112.7I2 Y6 Y59 M247 A255I2-F251 HydrophobicContact CD1-CB 3.9Å; I2-F251 HydrophobicContact CG2-CB 4.43Å; Y6-F251 PolarHBondContact OH-O 3.05Å; Y59-F251 HydrophobicContact CD2-CD1 4.3Å; Y59-F251 AromaticContact CD2-CD2 3.68Å; Y59-F251 HydrophobicContact CD2-CD2 3.68Å; Y59-F251 HydrophobicContact CD2-CE1 4.46Å; Y59-F251 AromaticContact CD2-CE2 3.9Å; Y59-F251 HydrophobicContact CD2-CE2 3.9Å; Y59-F251 AromaticContact CD2-CG 3.92Å; Y59-F251 HydrophobicContact CD2-CG 3.92Å; Y59-F251 HydrophobicContact CD2-CZ 4.27Å; Y59-F251 AromaticContact CE2-CD2 3.96Å; Y59-F251 HydrophobicContact CE2-CD2 3.96Å; Y59-F251 HydrophobicContact CE2-CE2 4.45Å; Y59-F251 HydrophobicContact CE2-CG 4.34Å; M247-F251 HydrophobicContact CE-CE2 3.63Å; M247-F251 HydrophobicContact CE-CZ 4.26Å; M247-F251 HydrophobicContact CG-CD2 3.87Å; M247-F251 HydrophobicContact CG-CE2 3.59Å; M247-F251 WeakPolarHBondContact O-CD2 3.38Å; M247-F251 PolarHBondContact O-N 2.8Å; M247-F251 HydrophobicContact SD-CE2 4.37Å; F251-A255 WeakPolarHBondContact O-CB 3.4Å; F251-A255 PolarHBondContact O-N 3.4Å
252F81.9Confident79.7Confident127 Ų12749.2 Ų49.256%0.55728%0.276SS*.Hα-helixtrans-67.1-43.9172.4-178.9-96.8000112.5A248 A249 Y250 V254 A255 L256A248-F252 VanDerWaalsContact O-CB 3.27Å; A248-F252 WeakPolarHBondContact O-CB 3.21Å; A248-F252 PolarHBondContact O-N 3.24Å; A249-F252 PolarHBondContact O-N 3.39Å; Y250-F252 PolarHBondContact O-N 2.9Å; F252-V254 VanDerWaalsContact C-N 3.32Å; F252-V254 PolarHBondContact O-N 3.34Å; F252-A255 WeakPolarHBondContact O-CB 3.26Å; F252-A255 PolarHBondContact O-N 2.88Å; F252-L256 PolarHBondContact O-N 3.08Å
253C84.4Confident80.1Confident16 Ų1643.2 Ų43.211%0.10825%0.25CC..Hα-helixtrans-63.1-40.9175.6-67.30000111.4P226 I227 A249 Y250 L256 G257P226-C253 HydrophobicContact CB-CB 4.16Å; I227-C253 HydrophobicContact CB-CB 4.09Å; I227-C253 HydrophobicContact CD1-CB 4.12Å; A249-C253 PolarHBondContact O-N 3.49Å; A249-C253 PolarHBondContact O-SG 3.02Å; Y250-C253 WeakPolarHBondContact O-CB 3.36Å; Y250-C253 PolarHBondContact O-N 3.49Å; C253-L256 PolarHBondContact O-N 3.23Å; C253-G257 PolarHBondContact O-N 2.94Å
254V81.4Confident80Confident17 Ų1740.2 Ų40.210%0.10323%0.231CC..Hα-helixtrans-60.4-46.1172.7170.40000110.7I227 Y250 F252 L256 G257 Y258I227-V254 HydrophobicContact CD1-CG2 3.58Å; I227-V254 HydrophobicContact CG1-CG2 4.34Å; Y250-V254 HydrophobicContact CD1-CG2 4.33Å; Y250-V254 HydrophobicContact CD2-CG2 4.37Å; Y250-V254 HydrophobicContact CE1-CG2 3.96Å; Y250-V254 HydrophobicContact CE2-CG2 4.02Å; Y250-V254 WeakPolarHBondContact O-CG2 3.46Å; Y250-V254 PolarHBondContact O-N 3.43Å; F252-V254 VanDerWaalsContact C-N 3.32Å; F252-V254 PolarHBondContact O-N 3.34Å; V254-L256 VanDerWaalsContact C-N 3.28Å; V254-L256 PolarHBondContact O-N 2.93Å; V254-G257 PolarHBondContact O-N 3.04Å; V254-G257 VanDerWaalsContact O-N 3.15Å; V254-Y258 HydrophobicContact CG1-CD2 3.71Å; V254-Y258 HydrophobicContact CG1-CE2 3.13Å; V254-Y258 VanDerWaalsContact O-CD2 3.23Å; V254-Y258 WeakPolarHBondContact O-CD2 3.34Å; V254-Y258 PolarHBondContact O-N 3.47Å
255A81.4Confident79.8Confident5 Ų534.7 Ų34.74%0.04120%0.197CC..Hα-helixtrans-57.5-40.8175.700000113V5 Y6 F251 F252 G257 Y258 T259V5-A255 HydrophobicContact CG1-CB 4.3Å; Y6-A255 HydrophobicContact CD1-CB 4.19Å; Y6-A255 HydrophobicContact CE1-CB 3.46Å; Y6-A255 VanDerWaalsContact CE1-CB 3.46Å; F251-A255 WeakPolarHBondContact O-CB 3.4Å; F251-A255 PolarHBondContact O-N 3.4Å; F252-A255 WeakPolarHBondContact O-CB 3.26Å; F252-A255 PolarHBondContact O-N 2.88Å; A255-G257 VanDerWaalsContact C-N 3.35Å; A255-Y258 PolarHBondContact O-N 3.43Å; A255-T259 PolarHBondContact O-N 3.44Å; A255-T259 PolarHBondContact O-OG1 3.19Å
256L83.3Confident79.3Confident45 Ų4534.6 Ų34.624%0.23619%0.186CC..Hα-helixtrans-67.7-38179.4-163.572.5000111.5V222 C223 P226 F252 C253 V254 T259V222-L256 WeakPolarHBondContact O-CD2 3.37Å; C223-L256 WeakPolarHBondContact CB-O 3.43Å; C223-L256 PolarHBondContact SG-O 2.75Å; P226-L256 HydrophobicContact CG-CD2 3.89Å; F252-L256 PolarHBondContact O-N 3.08Å; C253-L256 PolarHBondContact O-N 3.23Å; V254-L256 VanDerWaalsContact C-N 3.28Å; V254-L256 PolarHBondContact O-N 2.93Å; L256-T259 WeakPolarHBondContact O-CB 3.35Å; L256-T259 PolarHBondContact O-N 2.88Å
257G81.4Confident78.7Confident4 Ų434.3 Ų34.34%0.04118%0.183CC..Hα-helixtrans-58-50.8170.700000111.8C223 C253 V254 A255 T259 N260C223-G257 PolarHBondContact O-N 3.07Å; C253-G257 PolarHBondContact O-N 2.94Å; V254-G257 PolarHBondContact O-N 3.04Å; V254-G257 VanDerWaalsContact O-N 3.15Å; A255-G257 VanDerWaalsContact C-N 3.35Å; G257-T259 VanDerWaalsContact C-N 3.27Å; G257-T259 PolarHBondContact O-N 2.83Å; G257-N260 WeakPolarHBondContact O-CB 3.36Å; G257-N260 PolarHBondContact O-N 3.32Å
258Y81.3Confident78.4Confident13 Ų1331.1 Ų31.15%0.05117%0.166CC..Hα-helixtrans-67.5-25.2178.8-63.6-48.3000114.6V48 M52 Q55 D78 V254 A255 N260 S261 S262V48-Y258 HydrophobicContact CG2-CD1 3.94Å; V48-Y258 HydrophobicContact CG2-CE1 3.54Å; M52-Y258 HydrophobicContact CE-CD1 3.42Å; M52-Y258 VanDerWaalsContact CE-CD1 3.42Å; M52-Y258 HydrophobicContact CE-CD2 3.3Å; M52-Y258 HydrophobicContact CE-CE1 3.77Å; M52-Y258 HydrophobicContact CE-CE2 3.6Å; M52-Y258 HydrophobicContact CE-CG 3.19Å; M52-Y258 HydrophobicContact SD-CD2 3.75Å; M52-Y258 HydrophobicContact SD-CE2 4.18Å; M52-Y258 HydrophobicContact SD-CG 4.08Å; Q55-Y258 VanDerWaalsContact NE2-CZ 3.29Å; Q55-Y258 PolarHBondContact NE2-OH 2.86Å; D78-Y258 VanDerWaalsContact CG-OH 3.31Å; D78-Y258 VanDerWaalsContact OD1-CE1 3.25Å; D78-Y258 WeakPolarHBondContact OD1-CE1 3.35Å; D78-Y258 VanDerWaalsContact OD1-CZ 3.31Å; D78-Y258 PolarHBondContact OD1-OH 3.35Å; V254-Y258 HydrophobicContact CG1-CD2 3.71Å; V254-Y258 HydrophobicContact CG1-CE2 3.13Å; V254-Y258 VanDerWaalsContact O-CD2 3.23Å; V254-Y258 WeakPolarHBondContact O-CD2 3.34Å; V254-Y258 PolarHBondContact O-N 3.47Å; A255-Y258 PolarHBondContact O-N 3.43Å; Y258-N260 PolarHBondContact O-N 2.96Å; Y258-S261 WeakPolarHBondContact O-CB 3.14Å; Y258-S261 PolarHBondContact O-N 2.95Å; Y258-S262 PolarHBondContact O-N 2.86Å
259T79.6Confident77.8Confident37 Ų3730.7 Ų30.723%0.22716%0.163CC..Hα-helixtrans-59.2-30.7172.9-58.90000110.9A255 L256 G257 S261 S262 L263A255-T259 PolarHBondContact O-N 3.44Å; A255-T259 PolarHBondContact O-OG1 3.19Å; L256-T259 WeakPolarHBondContact O-CB 3.35Å; L256-T259 PolarHBondContact O-N 2.88Å; G257-T259 VanDerWaalsContact C-N 3.27Å; G257-T259 PolarHBondContact O-N 2.83Å; T259-S261 VanDerWaalsContact C-N 3.29Å; T259-S261 PolarHBondContact O-N 2.95Å; T259-S262 PolarHBondContact O-N 3.22Å; T259-S262 VanDerWaalsContact O-N 3.14Å; T259-L263 HydrophobicContact CG2-CD1 3.83Å; T259-L263 HydrophobicContact CG2-CG 3.94Å; T259-L263 WeakPolarHBondContact O-CB 3.4Å; T259-L263 VanDerWaalsContact O-CG 3.23Å; T259-L263 WeakPolarHBondContact O-CG 3.35Å; T259-L263 PolarHBondContact O-N 2.8Å
260N81.2Confident76.8Confident5 Ų535.4 Ų35.43%0.02718%0.176CC..Hα-helixtrans-56.1-42.6173.6-172.764.2000112.2C223 W224 G257 Y258 S262 L263 N264C223-N260 HydrophobicContact CB-CB 3.95Å; W224-N260 PolarHBondContact NE1-ND2 3.3Å; G257-N260 WeakPolarHBondContact O-CB 3.36Å; G257-N260 PolarHBondContact O-N 3.32Å; Y258-N260 PolarHBondContact O-N 2.96Å; N260-S262 VanDerWaalsContact C-N 3.32Å; N260-S262 PolarHBondContact O-N 3.15Å; N260-L263 PolarHBondContact O-N 3.29Å; N260-N264 VanDerWaalsContact O-CG 3.31Å; N260-N264 PolarHBondContact O-N 3.05Å; N260-N264 PolarHBondContact O-ND2 3.25Å; N260-N264 PolarHBondContact O-OD1 2.91Å
261S79.5Confident75.6Confident0 Ų033.4 Ų33.40%017%0.171CC..Hα-helixtrans-65.7-31.7178.2-660000113.4N17 D45 Y258 T259N17-S261 PolarHBondContact ND2-O 3.08Å; N17-S261 VanDerWaalsContact ND2-O 3.14Å; D45-S261 WeakPolarHBondContact OD1-CB 3.49Å; D45-S261 PolarHBondContact OD1-OG 2.97Å; Y258-S261 WeakPolarHBondContact O-CB 3.14Å; Y258-S261 PolarHBondContact O-N 2.95Å; T259-S261 VanDerWaalsContact C-N 3.29Å; T259-S261 PolarHBondContact O-N 2.95Å
262S76.6Confident74.8Confident6 Ų634.5 Ų34.54%0.04218%0.177CC..Hα-helixtrans-87.4-19.8177.5-580000113.5V9 G13 Y258 T259 N260V9-S262 VanDerWaalsContact CG1-OG 3.29Å; V9-S262 WeakPolarHBondContact CG1-OG 3.13Å; V9-S262 PolarHBondContact O-OG 3.04Å; G13-S262 VanDerWaalsContact CA-OG 3.3Å; G13-S262 WeakPolarHBondContact CA-OG 3.3Å; Y258-S262 PolarHBondContact O-N 2.86Å; T259-S262 PolarHBondContact O-N 3.22Å; T259-S262 VanDerWaalsContact O-N 3.14Å; N260-S262 VanDerWaalsContact C-N 3.32Å; N260-S262 PolarHBondContact O-N 3.15Å
263L77.5Confident73.8Confident53 Ų5332.9 Ų32.928%0.27717%0.171SC..Hα-helixtrans-78.6-23.1175.6-72.6174.3000112.9V219 T259 N260 I266 L267V219-L263 HydrophobicContact CG1-CD1 3.86Å; T259-L263 HydrophobicContact CG2-CD1 3.83Å; T259-L263 HydrophobicContact CG2-CG 3.94Å; T259-L263 WeakPolarHBondContact O-CB 3.4Å; T259-L263 VanDerWaalsContact O-CG 3.23Å; T259-L263 WeakPolarHBondContact O-CG 3.35Å; T259-L263 PolarHBondContact O-N 2.8Å; N260-L263 PolarHBondContact O-N 3.29Å; L263-I266 HydrophobicContact CD2-CD1 4.35Å; L263-I266 WeakPolarHBondContact O-CB 3.44Å; L263-I266 PolarHBondContact O-N 3.45Å; L263-I266 VanDerWaalsContact O-N 3.15Å; L263-L267 WeakPolarHBondContact O-CG 3.43Å; L263-L267 PolarHBondContact O-N 2.98Å
264N77.3Confident72.8Confident5 Ų536.3 Ų36.33%0.02719%0.189CC..Hα-helixtrans-56.5-49.7-177.3-71.3-33000113.7L41 D45 N260 I266 L267 Y268L41-N264 HydrophobicContact CD2-CB 4.24Å; L41-N264 WeakPolarHBondContact CD2-ND2 3.23Å; D45-N264 PolarHBondContact OD2-ND2 3.27Å; N260-N264 VanDerWaalsContact O-CG 3.31Å; N260-N264 PolarHBondContact O-N 3.05Å; N260-N264 PolarHBondContact O-ND2 3.25Å; N260-N264 PolarHBondContact O-OD1 2.91Å; N264-I266 VanDerWaalsContact C-N 3.31Å; N264-I266 PolarHBondContact O-N 3.48Å; N264-L267 WeakPolarHBondContact O-CB 3.38Å; N264-L267 PolarHBondContact O-N 2.99Å; N264-Y268 HydrophobicContact CB-CE2 4.03Å; N264-Y268 WeakPolarHBondContact O-CD2 3.31Å; N264-Y268 WeakPolarHBondContact O-CE2 3.42Å; N264-Y268 VanDerWaalsContact O-CG 3.27Å; N264-Y268 PolarHBondContact O-N 2.63Å
265P71Confident71.9Confident11 Ų1135.7 Ų35.77%0.07119%0.185CC..Hα-helixtrans-60-38174.9-25.435.2000113.8N17 V20 Y268 A269N17-P265 WeakPolarHBondContact OD1-CG 3.3Å; V20-P265 HydrophobicContact CG2-CB 4.04Å; V20-P265 HydrophobicContact CG2-CG 4.36Å; P265-Y268 PolarHBondContact O-N 3.48Å; P265-A269 WeakPolarHBondContact O-CB 3.44Å; P265-A269 PolarHBondContact O-N 3.06Å
266I70.1Confident71.3Confident70 Ų7038.9 Ų38.936%0.35920%0.198SC..Hα-helixtrans-65.1-46.6178.6-63.5175.2000109.3V12 L263 N264 Y268 A269 F270V12-I266 HydrophobicContact CG1-CD1 4.21Å; L263-I266 HydrophobicContact CD2-CD1 4.35Å; L263-I266 WeakPolarHBondContact O-CB 3.44Å; L263-I266 PolarHBondContact O-N 3.45Å; L263-I266 VanDerWaalsContact O-N 3.15Å; N264-I266 VanDerWaalsContact C-N 3.31Å; N264-I266 PolarHBondContact O-N 3.48Å; I266-Y268 PolarHBondContact O-N 2.9Å; I266-A269 PolarHBondContact O-N 3.32Å; I266-F270 HydrophobicContact CG2-CD2 3.63Å; I266-F270 HydrophobicContact CG2-CE2 3.62Å; I266-F270 WeakPolarHBondContact O-CD2 3.42Å; I266-F270 PolarHBondContact O-N 2.85Å
267L68.3Low70.5Confident27 Ų2743 Ų4314%0.14121%0.21CC..Hα-helixtrans-54.8-51.9173.3-71.2169.6000110V215 V216 L263 N264 A269 F270 L271V215-L267 HydrophobicContact CG1-CD2 4Å; V216-L267 HydrophobicContact CG2-CD1 4.4Å; L263-L267 WeakPolarHBondContact O-CG 3.43Å; L263-L267 PolarHBondContact O-N 2.98Å; N264-L267 WeakPolarHBondContact O-CB 3.38Å; N264-L267 PolarHBondContact O-N 2.99Å; L267-A269 VanDerWaalsContact C-N 3.34Å; L267-A269 PolarHBondContact O-N 3.42Å; L267-F270 PolarHBondContact O-N 3.32Å; L267-L271 HydrophobicContact CB-CD1 3.92Å; L267-L271 HydrophobicContact CD2-CD1 4.15Å; L267-L271 WeakPolarHBondContact O-CB 3.08Å; L267-L271 WeakPolarHBondContact O-CD1 3.35Å; L267-L271 WeakPolarHBondContact O-CG 3.44Å; L267-L271 PolarHBondContact O-N 3.44Å
268Y67.8Low69.8Low25 Ų2543.1 Ų43.110%0.09821%0.21CC..Hα-helixtrans-60.5-41.9179.4-54.5-39.7000113.3V20 I38 L41 M92 N264 P265 I266 F270 L271 D272V20-Y268 HydrophobicContact CG2-CD2 4.36Å; I38-Y268 HydrophobicContact CB-CE2 4.41Å; I38-Y268 HydrophobicContact CD1-CD1 4.09Å; I38-Y268 HydrophobicContact CD1-CE1 3.98Å; I38-Y268 HydrophobicContact CG1-CE1 3.96Å; I38-Y268 HydrophobicContact CG1-CE2 4.33Å; I38-Y268 HydrophobicContact CG2-CD2 3.79Å; I38-Y268 HydrophobicContact CG2-CE2 3.47Å; I38-Y268 VanDerWaalsContact CG2-CE2 3.47Å; I38-Y268 HydrophobicContact CG2-CG 4.45Å; L41-Y268 WeakPolarHBondContact CD2-OH 3.49Å; M92-Y268 HydrophobicContact CE-CE1 4.3Å; N264-Y268 HydrophobicContact CB-CE2 4.03Å; N264-Y268 WeakPolarHBondContact O-CD2 3.31Å; N264-Y268 WeakPolarHBondContact O-CE2 3.42Å; N264-Y268 VanDerWaalsContact O-CG 3.27Å; N264-Y268 PolarHBondContact O-N 2.63Å; P265-Y268 PolarHBondContact O-N 3.48Å; I266-Y268 PolarHBondContact O-N 2.9Å; Y268-F270 VanDerWaalsContact C-N 3.34Å; Y268-F270 PolarHBondContact O-N 2.91Å; Y268-L271 PolarHBondContact O-N 3.28Å; Y268-D272 PolarHBondContact O-N 3.03Å
269A64.9Low69.2Low27 Ų2745.6 Ų45.622%0.22322%0.221CC..Hα-helixtrans-64.4-34.117800000112.8P265 I266 L267 K276P265-A269 WeakPolarHBondContact O-CB 3.44Å; P265-A269 PolarHBondContact O-N 3.06Å; I266-A269 PolarHBondContact O-N 3.32Å; L267-A269 VanDerWaalsContact C-N 3.34Å; L267-A269 PolarHBondContact O-N 3.42Å; A269-K276 WeakPolarHBondContact O-CD 3.42Å; A269-K276 WeakPolarHBondContact O-CE 3.27Å; A269-K276 WeakPolarHBondContact O-CG 3.21Å
270F62.2Low68.7Low142 Ų14250.7 Ų50.762%0.62324%0.236SC*.Hα-helixtrans-80.4-28.8175.9-80.7-72.4000113.2R208 I266 L267 Y268 K276R208-F270 PolarHBondContact NH2-O 3.18Å; I266-F270 HydrophobicContact CG2-CD2 3.63Å; I266-F270 HydrophobicContact CG2-CE2 3.62Å; I266-F270 WeakPolarHBondContact O-CD2 3.42Å; I266-F270 PolarHBondContact O-N 2.85Å; L267-F270 PolarHBondContact O-N 3.32Å; Y268-F270 VanDerWaalsContact C-N 3.34Å; Y268-F270 PolarHBondContact O-N 2.91Å; F270-K276 WeakPolarHBondContact O-CE 3.32Å; F270-K276 PolarHBondContact O-NZ 3.44Å
271L57.9Low68Low47 Ų4752.5 Ų52.525%0.24625%0.246CC..Hα-helixtrans-98.8-34.6-164.2-63168.7000113.8R208 L212 L267 Y268R208-L271 PolarHBondContact NH2-O 3.04Å; L212-L271 HydrophobicContact CB-CD1 4.48Å; L212-L271 HydrophobicContact CB-CD2 3.91Å; L212-L271 HydrophobicContact CD1-CB 3.54Å; L212-L271 HydrophobicContact CD1-CD1 3.58Å; L212-L271 HydrophobicContact CD1-CD2 3.59Å; L212-L271 HydrophobicContact CD1-CG 3.69Å; L212-L271 HydrophobicContact CD2-CD1 4.13Å; L212-L271 HydrophobicContact CG-CB 4.3Å; L212-L271 HydrophobicContact CG-CD1 3.38Å; L212-L271 HydrophobicContact CG-CD2 3.62Å; L212-L271 HydrophobicContact CG-CG 3.89Å; L267-L271 HydrophobicContact CB-CD1 3.92Å; L267-L271 HydrophobicContact CD2-CD1 4.15Å; L267-L271 WeakPolarHBondContact O-CB 3.08Å; L267-L271 WeakPolarHBondContact O-CD1 3.35Å; L267-L271 WeakPolarHBondContact O-CG 3.44Å; L267-L271 PolarHBondContact O-N 3.44Å; Y268-L271 PolarHBondContact O-N 3.28Å
272D62.4Low67.4Low42 Ų4257.4 Ų57.423%0.22527%0.268CS..  trans-107.9115.6-177.7-168.6-30.4000111.8Y268 N274 F275 K276Y268-D272 PolarHBondContact O-N 3.03Å; D272-N274 PolarHBondContact O-N 3.29Å; D272-N274 WeakPolarHBondContact OD1-CA 3.27Å; D272-N274 VanDerWaalsContact OD1-CB 3.24Å; D272-N274 WeakPolarHBondContact OD1-CB 3.44Å; D272-N274 PolarHBondContact OD1-N 2.94Å; D272-N274 PolarHBondContact OD1-ND2 3.07Å; D272-F275 HydrophobicContact CB-CB 4.09Å; D272-F275 HydrophobicContact CB-CD2 3.77Å; D272-F275 HydrophobicContact CB-CG 4.39Å; D272-F275 PolarHBondContact O-N 3.15Å; D272-F275 VanDerWaalsContact O-N 3.14Å; D272-K276 PolarHBondContact O-N 2.89Å
273E61Low66.9Low93 Ų9360.9 Ų60.944%0.43529%0.291SS..Hα-helixtrans-63-27.3178.9-64.8-63.3146.300112.7R208 K276 R277R208-E273 IonicContact CZ-OE1 2.62Å; R208-E273 IonicContact NH1-OE1 3.03Å; R208-E273 PolarHBondContact NH1-OE1 3.38Å; R208-E273 IonicContact NH2-OE1 3.69Å; R208-E273 PolarHBondContact NH2-OE1 3.46Å; E273-K276 IonicContact OE1-NZ 2.8Å; E273-K276 PolarHBondContact OE1-NZ 3.05Å; E273-R277 WeakPolarHBondContact O-CB 3.49Å; E273-R277 PolarHBondContact O-N 2.88Å
274N61.6Low66.3Low88 Ų8862 Ų6247%0.47130%0.303SS..Hα-helixtrans-72-39.6174.5-58.5-55.6000110.8M30 D272 R277 C278M30-N274 HydrophobicContact SD-CB 4.2Å; D272-N274 PolarHBondContact O-N 3.29Å; D272-N274 WeakPolarHBondContact OD1-CA 3.27Å; D272-N274 VanDerWaalsContact OD1-CB 3.24Å; D272-N274 WeakPolarHBondContact OD1-CB 3.44Å; D272-N274 PolarHBondContact OD1-N 2.94Å; D272-N274 PolarHBondContact OD1-ND2 3.07Å; N274-R277 PolarHBondContact O-N 3.06Å; N274-C278 PolarHBondContact O-N 3.35Å; N274-C278 PolarHBondContact O-SG 2.75Å
275F64.2Low65.2Low5 Ų567.7 Ų67.72%0.02234%0.34CS..Hα-helixtrans-63.6-47.2172-89-85.7000110.6V20 V23 I24 M30 I38 D272 R277 C278 F279V20-F275 HydrophobicContact CG1-CE1 4.27Å; V23-F275 HydrophobicContact CG1-CE1 4.42Å; I24-F275 HydrophobicContact CD1-CZ 4.15Å; I24-F275 HydrophobicContact CG1-CE1 4.45Å; I24-F275 HydrophobicContact CG1-CZ 4.12Å; M30-F275 HydrophobicContact CE-CD1 4.04Å; M30-F275 HydrophobicContact CE-CD2 3.53Å; M30-F275 HydrophobicContact CE-CE1 3.87Å; M30-F275 HydrophobicContact CE-CE2 3.35Å; M30-F275 HydrophobicContact CE-CG 3.89Å; M30-F275 HydrophobicContact CE-CZ 3.54Å; I38-F275 HydrophobicContact CD1-CE2 4.17Å; I38-F275 HydrophobicContact CD1-CZ 4.48Å; I38-F275 HydrophobicContact CG2-CZ 4.25Å; D272-F275 HydrophobicContact CB-CB 4.09Å; D272-F275 HydrophobicContact CB-CD2 3.77Å; D272-F275 HydrophobicContact CB-CG 4.39Å; D272-F275 PolarHBondContact O-N 3.15Å; D272-F275 VanDerWaalsContact O-N 3.14Å; F275-R277 VanDerWaalsContact C-N 3.28Å; F275-R277 PolarHBondContact O-N 3.45Å; F275-C278 PolarHBondContact O-N 3.05Å; F275-F279 VanDerWaalsContact O-CB 3.3Å; F275-F279 WeakPolarHBondContact O-CB 3.41Å; F275-F279 PolarHBondContact O-N 3.03Å
276K67.9Low64.4Low71 Ų7171 Ų7131%0.30938%0.375SS..Hα-helixtrans-53.3-45.4174.8-73.1-177-174.8171.70112.8A269 F270 D272 E273 F279 R280A269-K276 WeakPolarHBondContact O-CD 3.42Å; A269-K276 WeakPolarHBondContact O-CE 3.27Å; A269-K276 WeakPolarHBondContact O-CG 3.21Å; F270-K276 WeakPolarHBondContact O-CE 3.32Å; F270-K276 PolarHBondContact O-NZ 3.44Å; D272-K276 PolarHBondContact O-N 2.89Å; E273-K276 IonicContact OE1-NZ 2.8Å; E273-K276 PolarHBondContact OE1-NZ 3.05Å; K276-F279 PolarHBondContact O-N 3.2Å; K276-R280 VanDerWaalsContact O-CB 3.31Å; K276-R280 WeakPolarHBondContact O-CB 3.26Å; K276-R280 PolarHBondContact O-N 2.92Å
277R66.8Low63.2Low132 Ų13270.2 Ų70.250%0.49839%0.385SS..Hα-helixtrans-64.7-49.1-179.7-169.1177.7-62.8173.5-1.1111.1E273 N274 F275 F279 R280 D281E273-R277 WeakPolarHBondContact O-CB 3.49Å; E273-R277 PolarHBondContact O-N 2.88Å; N274-R277 PolarHBondContact O-N 3.06Å; F275-R277 VanDerWaalsContact C-N 3.28Å; F275-R277 PolarHBondContact O-N 3.45Å; R277-F279 VanDerWaalsContact C-N 3.33Å; R277-F279 PolarHBondContact O-N 2.95Å; R277-R280 PolarHBondContact O-N 3.03Å; R277-D281 PolarHBondContact O-N 3.4Å
278C66.3Low62.1Low7 Ų781.5 Ų81.55%0.04743%0.425CS..Hα-helixtrans-63.9-37.5177.8-62.10000112.5V23 Y27 N274 F275 D281 F282V23-C278 HydrophobicContact CG1-CB 3.73Å; Y27-C278 HydrophobicContact CD2-CB 4.38Å; Y27-C278 HydrophobicContact CE2-CB 4.13Å; N274-C278 PolarHBondContact O-N 3.35Å; N274-C278 PolarHBondContact O-SG 2.75Å; F275-C278 PolarHBondContact O-N 3.05Å; C278-D281 PolarHBondContact O-N 2.96Å; C278-F282 PolarHBondContact O-N 2.92Å
279F68.4Low61Low64 Ų6482.1 Ų82.128%0.28144%0.439SS..Hα-helixtrans-66.1-41.2176.8-138-88.8000111.4L19 F275 K276 R277 F282 C283L19-F279 HydrophobicContact CB-CE2 4.48Å; L19-F279 HydrophobicContact CD2-CD1 4.25Å; L19-F279 HydrophobicContact CD2-CD2 3.91Å; L19-F279 HydrophobicContact CD2-CE1 3.61Å; L19-F279 HydrophobicContact CD2-CE2 3.22Å; L19-F279 HydrophobicContact CD2-CG 4.4Å; L19-F279 HydrophobicContact CD2-CZ 3.07Å; L19-F279 HydrophobicContact CG-CD2 4.2Å; L19-F279 HydrophobicContact CG-CE2 3.65Å; L19-F279 HydrophobicContact CG-CZ 4.03Å; F275-F279 VanDerWaalsContact O-CB 3.3Å; F275-F279 WeakPolarHBondContact O-CB 3.41Å; F275-F279 PolarHBondContact O-N 3.03Å; K276-F279 PolarHBondContact O-N 3.2Å; R277-F279 VanDerWaalsContact C-N 3.33Å; R277-F279 PolarHBondContact O-N 2.95Å; F279-F282 PolarHBondContact O-N 3.41Å; F279-C283 PolarHBondContact O-N 3.04Å; F279-C283 PolarHBondContact O-SG 3.42Å; F279-C283 VanDerWaalsContact O-SG 3.39Å
280R69.1Low60Low144 Ų14489.4 Ų89.454%0.54347%0.469SS..Hα-helixtrans-65.9-40175.2-176.617762.3-150.11111.9K276 R277 F282 C283 C284K276-R280 VanDerWaalsContact O-CB 3.31Å; K276-R280 WeakPolarHBondContact O-CB 3.26Å; K276-R280 PolarHBondContact O-N 2.92Å; R277-R280 PolarHBondContact O-N 3.03Å; R280-F282 PolarHBondContact O-N 3.15Å; R280-C283 PolarHBondContact O-N 2.9Å; R280-C284 WeakPolarHBondContact O-CA 3.38Å; R280-C284 WeakPolarHBondContact O-CB 3.37Å; R280-C284 PolarHBondContact O-N 3.12Å
281D66.9Low59.1Low43 Ų4386.6 Ų86.623%0.2347%0.471CS..Hα-helixtrans-65.6-29.6176.7-64.7-11.4000111.5R277 C278R277-D281 PolarHBondContact O-N 3.4Å; C278-D281 PolarHBondContact O-N 2.96Å
282F66.4Low58.5Low103 Ų10390.2 Ų90.245%0.45249%0.491SS..Hα-helixtrans-75.5-48.2173.2-176.8-98.2000112.8L19 Y22 C278 F279 R280L19-F282 HydrophobicContact CD1-CD1 3.8Å; L19-F282 HydrophobicContact CD1-CD2 4.39Å; L19-F282 HydrophobicContact CD1-CE1 3.82Å; L19-F282 HydrophobicContact CD1-CE2 4.4Å; L19-F282 HydrophobicContact CD1-CG 4.09Å; L19-F282 HydrophobicContact CD1-CZ 4.13Å; L19-F282 HydrophobicContact CD2-CD1 4.31Å; L19-F282 HydrophobicContact CD2-CE1 4.4Å; Y22-F282 HydrophobicContact CD1-CD2 4.4Å; Y22-F282 HydrophobicContact CD1-CE2 4.24Å; Y22-F282 AromaticContact CE1-CD2 3.87Å; Y22-F282 HydrophobicContact CE1-CD2 3.87Å; Y22-F282 AromaticContact CE1-CE2 3.79Å; Y22-F282 HydrophobicContact CE1-CE2 3.79Å; C278-F282 PolarHBondContact O-N 2.92Å; F279-F282 PolarHBondContact O-N 3.41Å; R280-F282 PolarHBondContact O-N 3.15Å
283C67.6Low57.7Low80 Ų8089.9 Ų89.954%0.54149%0.491SS..Hα-helixtrans-74.6-27.7-178.3-64.90000113.4F279 R280F279-C283 PolarHBondContact O-N 3.04Å; F279-C283 PolarHBondContact O-SG 3.42Å; F279-C283 VanDerWaalsContact O-SG 3.39Å; R280-C283 PolarHBondContact O-N 2.9Å
284C63.8Low56.8Low77 Ų7791.3 Ų91.352%0.5250%0.498SS..  trans-132.384.3-178.5-63.20000110.4R280 G286R280-C284 WeakPolarHBondContact O-CA 3.38Å; R280-C284 WeakPolarHBondContact O-CB 3.37Å; R280-C284 PolarHBondContact O-N 3.12Å; C284-G286 PolarHBondContact O-N 3.37Å
285P55Low55.5Low124 Ų12489.5 Ų89.581%0.80550%0.5SS*.THydrogen-bonded Turntrans-62.3-7.9-178.1-22.532.7000115.6
286G54Low54.3Low79 Ų7994.5 Ų94.581%0.81453%0.531SS*.THydrogen-bonded Turntrans-104.62.7-167.700000117.9C284C284-G286 PolarHBondContact O-N 3.37Å
287G45Very low52.7Low54 Ų5496.5 Ų96.556%0.55755%0.554SS**SBendtrans-10786.2-173.300000114.6G289G287-G289 PolarHBondContact O-N 3.45Å; G287-G289 VanDerWaalsContact O-N 3.12Å
288R45.9Very low51.3Low264 Ų264100.7 Ų100.7100%0.99657%0.569SS**SBendtrans22.875.1161.8-71.8-178.8174.2-176-1.8116.1
289G44.8Very low49.9Very low38 Ų38104.8 Ų104.839%0.39259%0.594SS.*  trans-158.11.6174.500000116.2G287 A291G287-G289 PolarHBondContact O-N 3.45Å; G287-G289 VanDerWaalsContact O-N 3.12Å; G289-A291 PolarHBondContact O-N 2.96Å
290H43.8Very low48.2Very low181 Ų181113.4 Ų113.484%0.83863%0.625SS**THydrogen-bonded Turntrans-65.3-9.5-172.3-153.979.8000114.6
291A43.2Very low46.7Very low82 Ų82110.5 Ų110.568%0.67863%0.626SS**THydrogen-bonded Turntrans-87.1-25.3-172.100000115.1G289G289-A291 PolarHBondContact O-N 2.96Å
292D45.3Very low45.3Very low124 Ų124113 Ų11366%0.66364%0.643SS**SBendtrans-99.8-13-164.2-94.4-16.4000116K29K29-D292 PolarHBondContact NZ-O 2.88Å
293C44.6Very low43.8Very low34 Ų34114.7 Ų114.723%0.2366%0.656CS.*SBendtrans-84.7-21.4-179-140.60000113.3Y27 K29Y27-C293 HydrophobicContact CD1-CB 4.33Å; K29-C293 VanDerWaalsContact CE-O 3.25Å; K29-C293 WeakPolarHBondContact CE-O 3.33Å
294H42.1Very low42.2Very low124 Ų124121.4 Ų121.457%0.57467%0.671SS**SBendtrans-102.7-10-176.8-84.8-78000115.2
295G33.8Very low40.9Very low49 Ų49124.3 Ų124.351%0.50568%0.681SS.*  trans-111.660.4-165.500000117.3
296V39.2Very low39.9Very low111 Ų111126.8 Ų126.867%0.67368%0.681SS**  trans-13943.4161.6-162.10000111.1
297S35.7Very low39Very low113 Ų113129.2 Ų129.279%0.7968%0.68SS**SBendtrans-107.3-5.7167.1-178.80000112.6
298R36.6Very low38.5Very low219 Ų219132.8 Ų132.883%0.82670%0.696SS**SBendtrans-113.6-0.8-173-86.1-173.9175.5169-1.3116.3
299V37.3Very low38.2Very low94 Ų94124.4 Ų124.457%0.5768%0.682SS**THydrogen-bonded Turntrans-93.31.3-178.7-174.20000112.8
300R33Very low37.8Very low244 Ų244129.4 Ų129.492%0.92171%0.705SS**THydrogen-bonded Turntrans-91.40.1177.7-137.3175.8-174.7173.10.6114.5
301S36.8Very low37.2Very low83 Ų83130.6 Ų130.658%0.5871%0.711SS**SBendtrans-109.1-10.5178.7630000115.1
302T37.1Very low36.6Very low95 Ų95130.8 Ų130.858%0.58372%0.722SS**SBendtrans-100.32.1-179.530.60000114.8
303L34.9Very low36.2Very low139 Ų139137 Ų13773%0.72874%0.736SS**SBendtrans-105.68.1176.2-102138.7000113.7
304R34Very low35.6Very low222 Ų222139 Ų13984%0.83876%0.763SS**SBendtrans-103.9-10.4174.1-110.6179.8175.7-178.9-3.5114.9
305D36.1Very low35.2Very low138 Ų138141.5 Ų141.574%0.73878%0.78SS**SBendtrans-105.83.2-177.3-70.1-17.4000114.5
306H35.5Very low35.3Very low176 Ų176142.1 Ų142.182%0.81579%0.786SS**SBendtrans-112.919.3179.2-81.8-52000115.2
307T35.2Very low35.2Very low129 Ų129152.6 Ų152.679%0.79181%0.814SS**SBendtrans-115.317.7173.37.60000114.6
308C34.8Very low35.2Very low130 Ų130154.6 Ų154.688%0.87882%0.815SS**SBendtrans-133.148.7175.7-1430000113.4
309A39.3Very low35.1Very low87 Ų87151.2 Ų151.272%0.71981%0.814SS**SBendtrans-15471169.100000111.4
310T34.8Very low35Very low143 Ų143154.3 Ų154.388%0.87783%0.828SS**  trans-178.392.3148.3370000109.6
311E32.2Very low35.1Very low206 Ų206149.1 Ų149.196%0.96382%0.823SS**  trans-166123.3144.8-113.1173.6-172.900108.9
312G31.3Very low35Very low87 Ų87153.2 Ų153.290%0.89784%0.838SS**  trans137.665.8173.300000115
313R35.7Very low34.9Very low254 Ų254157.1 Ų157.196%0.95886%0.855SS**  trans-115.8112.6158.7-154.4-179.1-167.3-168.53.4108.4
314G32.6Very low34.9Very low77 Ų77158.4 Ų158.479%0.79486%0.864SS**  trans77.9121.6157.600000117
315D34Very low35Very low175 Ų175153.5 Ų153.594%0.93687%0.866SS**  176.2150.693.3-156.14.9000111.3
316G36Very low34.9Very low62 Ų62154.8 Ų154.864%0.63988%0.876SS**  trans100.297.4145.400000121.5
317R37Very low34.8Very low331 Ų331152.8 Ų152.8100%1.24988%0.882SS**  trans850151.7-66.7-175.1-174.5179.22.8119.9

Retrieved 317 of 317 residues in 89.3 ms (Link to these results)

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