A0A087XE98_POEFO Loading...

Solute carrier family 5 member 8

AlphaFold DB , UniProt , Accession A0A087XE98, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 605 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
1M39.9Very low51.9Low235 Ų23594.9 Ų94.9100%1.15863%0.627SS**  0123.60-84.8159.5131.300107.8
2S28Very low54.9Low122 Ų12296.8 Ų96.885%0.85363%0.634SS**  trans-78135.2178.849.50000110.8
3G38.2Very low57.6Low77 Ų7792.3 Ų92.379%0.79461%0.61SS**  trans-24123.5-178.400000119.1
4S32.5Very low59.9Low113 Ų11385.9 Ų85.979%0.7957%0.568SS**  trans-143.388.8140.356.10000108.1V6S4-V6 VanDerWaalsContact C-N 3.25Å; S4-V6 PolarHBondContact O-N 3.36Å
5S40Very low61.7Low116 Ų11686.4 Ų86.481%0.81155%0.554SS**  trans-73.278.9168.253.50000109.6
6V42.6Very low63.6Low121 Ų12185.9 Ų85.973%0.73355%0.549SS*.  trans-144.799.2155.7-174.70000105.3S4 S8S4-V6 VanDerWaalsContact C-N 3.25Å; S4-V6 PolarHBondContact O-N 3.36Å; V6-S8 PolarHBondContact O-N 2.64Å
7T52Low65.2Low79 Ų7983.6 Ų83.649%0.48553%0.534SS..  trans-55.1106.3160.615.70000106S9 Y326T7-S9 PolarHBondContact O-N 2.82Å; T7-S9 VanDerWaalsContact O-N 3.16Å; T7-Y326 HydrophobicContact CG2-CE2 4.06Å
8S59.3Low66.5Low44 Ų4479.8 Ų79.831%0.30851%0.508SS..  trans-60.9123.4-179.368.60000107.4V6 M329V6-S8 PolarHBondContact O-N 2.64Å; S8-M329 WeakPolarHBondContact O-CE 3.45Å
9S71.4Confident67.7Low89 Ų8977.8 Ų77.862%0.62250%0.499SS*.  trans-60.4156.9166.856.50000109.6T7 A11T7-S9 PolarHBondContact O-N 2.82Å; T7-S9 VanDerWaalsContact O-N 3.16Å; S9-A11 PolarHBondContact O-N 3.47Å
10F81.4Confident68.9Low13 Ų1377.9 Ų77.96%0.05750%0.498CS..  trans-45.7133.5173.2-89.215000113.2D14 Y15 T159 L161 M329 P339 V343F10-D14 HydrophobicContact CB-CB 4.16Å; F10-D14 HydrophobicContact CD1-CB 4.29Å; F10-D14 HydrophobicContact CD2-CB 3.8Å; F10-D14 HydrophobicContact CE2-CB 4.09Å; F10-D14 HydrophobicContact CG-CB 3.87Å; F10-D14 HydrophobicContact CZ-CB 4.4Å; F10-Y15 HydrophobicContact CB-CD2 3.89Å; F10-Y15 HydrophobicContact CB-CE2 3.25Å; F10-Y15 HydrophobicContact CD2-CD1 4.29Å; F10-Y15 HydrophobicContact CD2-CD2 4.36Å; F10-Y15 HydrophobicContact CD2-CE1 4.06Å; F10-Y15 HydrophobicContact CD2-CE2 4.13Å; F10-Y15 HydrophobicContact CD2-CG 4.43Å; F10-Y15 AromaticContact CD2-CZ 3.96Å; F10-Y15 HydrophobicContact CG-CE2 4.22Å; F10-T159 HydrophobicContact CD1-CG2 4.47Å; F10-T159 VanDerWaalsContact CD1-O 3.24Å; F10-T159 WeakPolarHBondContact CD1-O 3.14Å; F10-T159 VanDerWaalsContact CE1-CB 3.42Å; F10-T159 HydrophobicContact CE1-CG2 3.71Å; F10-T159 WeakPolarHBondContact CG-O 3.4Å; F10-T159 HydrophobicContact CZ-CG2 3.93Å; F10-T159 PolarHBondContact N-O 3Å; F10-L161 HydrophobicContact CD2-CD1 4.36Å; F10-L161 HydrophobicContact CD2-CG 4.2Å; F10-L161 HydrophobicContact CE2-CD1 3.72Å; F10-L161 HydrophobicContact CE2-CG 4.06Å; F10-L161 HydrophobicContact CZ-CD1 4.31Å; F10-M329 HydrophobicContact CD1-CE 3.75Å; F10-M329 HydrophobicContact CD1-SD 3.91Å; F10-M329 HydrophobicContact CE1-CE 4.06Å; F10-M329 HydrophobicContact CE1-SD 3.56Å; F10-M329 VanDerWaalsContact CE1-SD 3.56Å; F10-P339 HydrophobicContact CE1-CB 4.06Å; F10-V343 HydrophobicContact CE1-CG2 4.47Å; F10-V343 HydrophobicContact CE2-CG2 4.23Å; F10-V343 HydrophobicContact CZ-CB 4.16Å; F10-V343 HydrophobicContact CZ-CG2 3.51Å
11A85.4Confident70Confident35 Ų3575 Ų7529%0.28948%0.478SS..  trans-75.6158.8166.500000109.4S9 A13 D14 Y15 P336S9-A11 PolarHBondContact O-N 3.47Å; A11-A13 PolarHBondContact O-N 3.43Å; A11-A13 VanDerWaalsContact O-N 3.13Å; A11-D14 WeakPolarHBondContact CB-OD2 3.37Å; A11-D14 PolarHBondContact N-OD2 3.28Å; A11-D14 WeakPolarHBondContact O-CB 3.36Å; A11-D14 PolarHBondContact O-N 2.99Å; A11-Y15 WeakPolarHBondContact O-CD2 3.29Å; A11-Y15 PolarHBondContact O-N 3.33Å; A11-P336 HydrophobicContact CB-CB 4.1Å
12V87.6Confident72.3Confident117 Ų11764.7 Ų64.771%0.70943%0.428SS*.Hα-helixtrans-54.1-36.8175.9178.80000111.4D14 Y15 V16V12-D14 VanDerWaalsContact C-N 3.27Å; V12-D14 PolarHBondContact O-N 2.92Å; V12-Y15 PolarHBondContact O-N 3.34Å; V12-V16 HydrophobicContact CG1-CG2 4.32Å; V12-V16 WeakPolarHBondContact O-CG2 3.29Å; V12-V16 PolarHBondContact O-N 2.79Å
13A90.4Very high75.3Confident39 Ų3964.6 Ų64.632%0.32242%0.417SS..Hα-helixtrans-59.2-35.3176.300000113A11 V16 V17 P336A11-A13 PolarHBondContact O-N 3.43Å; A11-A13 VanDerWaalsContact O-N 3.13Å; A13-V16 PolarHBondContact O-N 3.14Å; A13-V17 WeakPolarHBondContact O-CG2 3.1Å; A13-V17 PolarHBondContact O-N 3.3Å; A13-P336 HydrophobicContact CB-CB 3.81Å
14D89.6Confident77.8Confident3 Ų363.7 Ų63.72%0.01640%0.396CS..Hα-helixtrans-67.1-44.4179.5-60.7-51.5000111.3F10 A11 V12 V16 V17 F18 G337 P339 G340F10-D14 HydrophobicContact CB-CB 4.16Å; F10-D14 HydrophobicContact CD1-CB 4.29Å; F10-D14 HydrophobicContact CD2-CB 3.8Å; F10-D14 HydrophobicContact CE2-CB 4.09Å; F10-D14 HydrophobicContact CG-CB 3.87Å; F10-D14 HydrophobicContact CZ-CB 4.4Å; A11-D14 WeakPolarHBondContact CB-OD2 3.37Å; A11-D14 PolarHBondContact N-OD2 3.28Å; A11-D14 WeakPolarHBondContact O-CB 3.36Å; A11-D14 PolarHBondContact O-N 2.99Å; V12-D14 VanDerWaalsContact C-N 3.27Å; V12-D14 PolarHBondContact O-N 2.92Å; D14-V16 VanDerWaalsContact C-N 3.32Å; D14-V16 PolarHBondContact O-N 3.13Å; D14-V17 PolarHBondContact O-N 2.72Å; D14-F18 PolarHBondContact O-N 3.35Å; D14-F18 VanDerWaalsContact O-N 3.09Å; D14-G337 WeakPolarHBondContact OD1-CA 3.48Å; D14-G337 PolarHBondContact OD1-N 3.31Å; D14-P339 VanDerWaalsContact OD1-CD 3.31Å; D14-P339 WeakPolarHBondContact OD1-CD 3.45Å; D14-G340 PolarHBondContact OD1-N 3.19Å
15Y87.2Confident80.4Confident93 Ų9358.4 Ų58.437%0.36536%0.359SS..Hα-helixtrans-62-39.4173.4-67.9-80000112F10 A11 V12 F18 A19 L161F10-Y15 HydrophobicContact CB-CD2 3.89Å; F10-Y15 HydrophobicContact CB-CE2 3.25Å; F10-Y15 HydrophobicContact CD2-CD1 4.29Å; F10-Y15 HydrophobicContact CD2-CD2 4.36Å; F10-Y15 HydrophobicContact CD2-CE1 4.06Å; F10-Y15 HydrophobicContact CD2-CE2 4.13Å; F10-Y15 HydrophobicContact CD2-CG 4.43Å; F10-Y15 AromaticContact CD2-CZ 3.96Å; F10-Y15 HydrophobicContact CG-CE2 4.22Å; A11-Y15 WeakPolarHBondContact O-CD2 3.29Å; A11-Y15 PolarHBondContact O-N 3.33Å; V12-Y15 PolarHBondContact O-N 3.34Å; Y15-F18 PolarHBondContact O-N 3.47Å; Y15-A19 VanDerWaalsContact O-CB 3.28Å; Y15-A19 WeakPolarHBondContact O-CB 3.37Å; Y15-A19 PolarHBondContact O-N 3.01Å; Y15-L161 HydrophobicContact CD1-CD2 4.03Å; Y15-L161 HydrophobicContact CE1-CD2 3.5Å; Y15-L161 VanDerWaalsContact CE1-CD2 3.5Å; Y15-L161 HydrophobicContact CE1-CG 4.34Å
16V91.6Very high82.6Confident79 Ų7953.8 Ų53.848%0.47933%0.328SS..Hα-helixtrans-65-47.3178.2171.20000111.2V12 A13 D14 F18 A19 V20V12-V16 HydrophobicContact CG1-CG2 4.32Å; V12-V16 WeakPolarHBondContact O-CG2 3.29Å; V12-V16 PolarHBondContact O-N 2.79Å; A13-V16 PolarHBondContact O-N 3.14Å; D14-V16 VanDerWaalsContact C-N 3.32Å; D14-V16 PolarHBondContact O-N 3.13Å; V16-F18 VanDerWaalsContact C-N 3.3Å; V16-F18 PolarHBondContact O-N 3.32Å; V16-A19 PolarHBondContact O-N 3.16Å; V16-V20 HydrophobicContact CG1-CG2 4.23Å; V16-V20 WeakPolarHBondContact O-CB 3.39Å; V16-V20 VanDerWaalsContact O-CG2 3.25Å; V16-V20 WeakPolarHBondContact O-CG2 3.34Å; V16-V20 PolarHBondContact O-N 3.28Å
17V91.9Very high84.8Confident47 Ų4750.8 Ų50.829%0.28532%0.316SS..Hα-helixtrans-59.4-44.4178170.90000110.7A13 D14 V20 M21 L341A13-V17 WeakPolarHBondContact O-CG2 3.1Å; A13-V17 PolarHBondContact O-N 3.3Å; D14-V17 PolarHBondContact O-N 2.72Å; V17-V20 PolarHBondContact O-N 3.11Å; V17-M21 PolarHBondContact O-N 2.97Å; V17-M21 VanDerWaalsContact O-N 3.15Å; V17-L341 HydrophobicContact CG1-CB 4.21Å
18F87.9Confident86.5Confident15 Ų1548.1 Ų48.17%0.06630%0.3CS..Hα-helixtrans-62.2-46.8176.4179.2-125.7000112.3D14 Y15 V16 V20 M21 L22 V343 A344 Y347D14-F18 PolarHBondContact O-N 3.35Å; D14-F18 VanDerWaalsContact O-N 3.09Å; Y15-F18 PolarHBondContact O-N 3.47Å; V16-F18 VanDerWaalsContact C-N 3.3Å; V16-F18 PolarHBondContact O-N 3.32Å; F18-V20 PolarHBondContact O-N 2.74Å; F18-M21 HydrophobicContact CD2-CE 3.83Å; F18-M21 HydrophobicContact CE2-CE 3.67Å; F18-M21 PolarHBondContact O-N 3.27Å; F18-L22 HydrophobicContact CE1-CD1 3.98Å; F18-L22 HydrophobicContact CE2-CD1 4.33Å; F18-L22 HydrophobicContact CE2-CD2 4.42Å; F18-L22 HydrophobicContact CE2-CG 4.31Å; F18-L22 HydrophobicContact CZ-CD1 3.89Å; F18-L22 HydrophobicContact CZ-CG 4.36Å; F18-L22 PolarHBondContact O-N 3.25Å; F18-V343 HydrophobicContact CD2-CG1 3.87Å; F18-V343 HydrophobicContact CE2-CG1 4.16Å; F18-V343 HydrophobicContact CG-CG1 4.14Å; F18-A344 HydrophobicContact CD2-CB 4.47Å; F18-Y347 HydrophobicContact CD2-CD2 4.39Å; F18-Y347 HydrophobicContact CE2-CD1 4.37Å; F18-Y347 AromaticContact CE2-CD2 3.47Å; F18-Y347 HydrophobicContact CE2-CD2 3.47Å; F18-Y347 VanDerWaalsContact CE2-CD2 3.47Å; F18-Y347 HydrophobicContact CE2-CE2 4.2Å; F18-Y347 AromaticContact CE2-CG 3.57Å; F18-Y347 HydrophobicContact CE2-CG 3.57Å; F18-Y347 HydrophobicContact CZ-CD1 4.27Å; F18-Y347 AromaticContact CZ-CD2 3.72Å; F18-Y347 HydrophobicContact CZ-CD2 3.72Å; F18-Y347 HydrophobicContact CZ-CE2 4.02Å; F18-Y347 AromaticContact CZ-CG 3.86Å; F18-Y347 HydrophobicContact CZ-CG 3.86Å
19A89.3Confident87.7Confident42 Ų4246 Ų4635%0.34729%0.285SS..Hα-helixtrans-62.5-40177.800000112.4Y15 V16 M21 L22 L23Y15-A19 VanDerWaalsContact O-CB 3.28Å; Y15-A19 WeakPolarHBondContact O-CB 3.37Å; Y15-A19 PolarHBondContact O-N 3.01Å; V16-A19 PolarHBondContact O-N 3.16Å; A19-M21 VanDerWaalsContact C-N 3.33Å; A19-M21 PolarHBondContact O-N 3.3Å; A19-L22 PolarHBondContact O-N 2.88Å; A19-L23 WeakPolarHBondContact O-CB 3.35Å; A19-L23 VanDerWaalsContact O-CG 3.3Å; A19-L23 WeakPolarHBondContact O-CG 3.18Å; A19-L23 PolarHBondContact O-N 3.04Å
20V92.6Very high88.4Confident78 Ų7844.7 Ų44.747%0.47327%0.273SS..Hα-helixtrans-60.6-42.8176.41680000110.9V16 V17 F18 L22 L23 V24V16-V20 HydrophobicContact CG1-CG2 4.23Å; V16-V20 WeakPolarHBondContact O-CB 3.39Å; V16-V20 VanDerWaalsContact O-CG2 3.25Å; V16-V20 WeakPolarHBondContact O-CG2 3.34Å; V16-V20 PolarHBondContact O-N 3.28Å; V17-V20 PolarHBondContact O-N 3.11Å; F18-V20 PolarHBondContact O-N 2.74Å; V20-L22 VanDerWaalsContact C-N 3.35Å; V20-L22 PolarHBondContact O-N 3.31Å; V20-L23 PolarHBondContact O-N 2.92Å; V20-V24 HydrophobicContact CG1-CG2 4.24Å; V20-V24 WeakPolarHBondContact O-CB 3.4Å; V20-V24 VanDerWaalsContact O-CG2 3.28Å; V20-V24 WeakPolarHBondContact O-CG2 3.37Å; V20-V24 PolarHBondContact O-N 3.01Å
21M91.4Very high88.7Confident17 Ų1750.4 Ų50.48%0.08430%0.295CS..Hα-helixtrans-60.2-43.4176.4178.2-78.2-67.400112V17 F18 A19 V24 S25 A344 L351V17-M21 PolarHBondContact O-N 2.97Å; V17-M21 VanDerWaalsContact O-N 3.15Å; F18-M21 HydrophobicContact CD2-CE 3.83Å; F18-M21 HydrophobicContact CE2-CE 3.67Å; F18-M21 PolarHBondContact O-N 3.27Å; A19-M21 VanDerWaalsContact C-N 3.33Å; A19-M21 PolarHBondContact O-N 3.3Å; M21-V24 PolarHBondContact O-N 3.36Å; M21-S25 PolarHBondContact O-N 2.82Å; M21-S25 PolarHBondContact O-OG 2.9Å; M21-A344 HydrophobicContact CB-CB 3.96Å; M21-A344 HydrophobicContact CE-CB 4.23Å; M21-A344 HydrophobicContact CG-CB 4.1Å; M21-L351 HydrophobicContact CE-CD1 3.98Å; M21-L351 HydrophobicContact SD-CD1 3.75Å
22L88.3Confident88.5Confident19 Ų1950.2 Ų50.210%0.09929%0.288CS..Hα-helixtrans-63.8-44.3176.4-65.5178.9000111.8F18 A19 V20 S25 A26 V173 L351F18-L22 HydrophobicContact CE1-CD1 3.98Å; F18-L22 HydrophobicContact CE2-CD1 4.33Å; F18-L22 HydrophobicContact CE2-CD2 4.42Å; F18-L22 HydrophobicContact CE2-CG 4.31Å; F18-L22 HydrophobicContact CZ-CD1 3.89Å; F18-L22 HydrophobicContact CZ-CG 4.36Å; F18-L22 PolarHBondContact O-N 3.25Å; A19-L22 PolarHBondContact O-N 2.88Å; V20-L22 VanDerWaalsContact C-N 3.35Å; V20-L22 PolarHBondContact O-N 3.31Å; L22-S25 PolarHBondContact O-N 3.44Å; L22-A26 PolarHBondContact O-N 3.02Å; L22-V173 HydrophobicContact CB-CG1 4.42Å; L22-V173 HydrophobicContact CD2-CG1 4.35Å; L22-L351 HydrophobicContact CD2-CD1 3.67Å
23L90.9Very high88.1Confident120 Ų12045.8 Ų45.863%0.62826%0.263SS*.Hα-helixtrans-64.9-41.3178.8-71.9173.2000112.1A19 V20 S25 A26 A27A19-L23 WeakPolarHBondContact O-CB 3.35Å; A19-L23 VanDerWaalsContact O-CG 3.3Å; A19-L23 WeakPolarHBondContact O-CG 3.18Å; A19-L23 PolarHBondContact O-N 3.04Å; V20-L23 PolarHBondContact O-N 2.92Å; L23-S25 VanDerWaalsContact C-N 3.35Å; L23-A26 PolarHBondContact O-N 3.44Å; L23-A27 VanDerWaalsContact O-CB 3.24Å; L23-A27 WeakPolarHBondContact O-CB 3.44Å; L23-A27 PolarHBondContact O-N 3.48Å
24V90.3Very high87.8Confident58 Ų5851.4 Ų51.435%0.35228%0.277SS..Hα-helixtrans-62-44.5175.2169.10000110.4V20 M21 A26 A27 V28 I192V20-V24 HydrophobicContact CG1-CG2 4.24Å; V20-V24 WeakPolarHBondContact O-CB 3.4Å; V20-V24 VanDerWaalsContact O-CG2 3.28Å; V20-V24 WeakPolarHBondContact O-CG2 3.37Å; V20-V24 PolarHBondContact O-N 3.01Å; M21-V24 PolarHBondContact O-N 3.36Å; V24-A26 VanDerWaalsContact C-N 3.35Å; V24-A26 PolarHBondContact O-N 3.34Å; V24-A27 PolarHBondContact O-N 3.41Å; V24-V28 WeakPolarHBondContact O-CG2 3.45Å; V24-V28 PolarHBondContact O-N 2.65Å; V24-I192 HydrophobicContact CG1-CD1 4.18Å; V24-I192 HydrophobicContact CG1-CG2 4.28Å
25S86.8Confident87.2Confident2 Ų254.3 Ų54.31%0.01430%0.295CS..Hα-helixtrans-60.2-45176.8-59.90000111.6M21 L22 L23 G29 Q193M21-S25 PolarHBondContact O-N 2.82Å; M21-S25 PolarHBondContact O-OG 2.9Å; L22-S25 PolarHBondContact O-N 3.44Å; L23-S25 VanDerWaalsContact C-N 3.35Å; S25-G29 PolarHBondContact O-N 2.96Å; S25-Q193 PolarHBondContact OG-NE2 3.28Å
26A87.4Confident86.5Confident19 Ų1952.1 Ų52.116%0.15729%0.289CS..Hα-helixtrans-64.3-42.6175.800000112.5L22 L23 V24 V28 G29 V30 V173L22-A26 PolarHBondContact O-N 3.02Å; L23-A26 PolarHBondContact O-N 3.44Å; V24-A26 VanDerWaalsContact C-N 3.35Å; V24-A26 PolarHBondContact O-N 3.34Å; A26-V28 PolarHBondContact O-N 3.23Å; A26-G29 PolarHBondContact O-N 3.19Å; A26-G29 VanDerWaalsContact O-N 3.15Å; A26-V30 WeakPolarHBondContact O-CG2 3.16Å; A26-V30 PolarHBondContact O-N 3.5Å; A26-V173 HydrophobicContact CB-CG1 4.48Å
27A89.3Confident85.4Confident58 Ų5854.5 Ų54.548%0.47929%0.289SS..Hα-helixtrans-62.5-40.2-179.300000112.2L23 V24 G29 V30 Y31L23-A27 VanDerWaalsContact O-CB 3.24Å; L23-A27 WeakPolarHBondContact O-CB 3.44Å; L23-A27 PolarHBondContact O-N 3.48Å; V24-A27 PolarHBondContact O-N 3.41Å; A27-G29 VanDerWaalsContact C-N 3.33Å; A27-G29 PolarHBondContact O-N 3.47Å; A27-V30 PolarHBondContact O-N 3.2Å; A27-Y31 WeakPolarHBondContact O-CB 3.41Å; A27-Y31 PolarHBondContact O-N 2.9Å
28V86.8Confident83.8Confident23 Ų2360.9 Ų60.914%0.13931%0.313CS..Hα-helixtrans-61.6-42.5174.2173.30000110.9V24 A26 V30 Y31 F32 W188 T189 I192V24-V28 WeakPolarHBondContact O-CG2 3.45Å; V24-V28 PolarHBondContact O-N 2.65Å; A26-V28 PolarHBondContact O-N 3.23Å; V28-V30 PolarHBondContact O-N 2.98Å; V28-Y31 PolarHBondContact O-N 3.33Å; V28-F32 HydrophobicContact CG1-CD2 3.86Å; V28-F32 HydrophobicContact CG1-CE2 3.94Å; V28-F32 WeakPolarHBondContact O-CD2 3.37Å; V28-F32 PolarHBondContact O-N 3.11Å; V28-F32 VanDerWaalsContact O-N 3.08Å; V28-W188 HydrophobicContact CG1-CB 4.14Å; V28-T189 HydrophobicContact CB-CG2 3.77Å; V28-T189 HydrophobicContact CG1-CG2 3.66Å; V28-I192 HydrophobicContact CG2-CD1 3.8Å
29G83.6Confident82.3Confident0 Ų065.1 Ų65.10%033%0.333CS..Hα-helixtrans-58.5-46.2174.100000113.2S25 A26 A27 A33S25-G29 PolarHBondContact O-N 2.96Å; A26-G29 PolarHBondContact O-N 3.19Å; A26-G29 VanDerWaalsContact O-N 3.15Å; A27-G29 VanDerWaalsContact C-N 3.33Å; A27-G29 PolarHBondContact O-N 3.47Å; G29-A33 WeakPolarHBondContact O-CB 3.35Å; G29-A33 PolarHBondContact O-N 2.7Å
30V86.8Confident80.9Confident62 Ų6270.3 Ų70.338%0.37634%0.344SS..Hα-helixtrans-65.4-41.8177.3176.10000111.4A26 A27 V28 F32 A33 W34 F176 M180A26-V30 WeakPolarHBondContact O-CG2 3.16Å; A26-V30 PolarHBondContact O-N 3.5Å; A27-V30 PolarHBondContact O-N 3.2Å; V28-V30 PolarHBondContact O-N 2.98Å; V30-F32 PolarHBondContact O-N 3.4Å; V30-A33 PolarHBondContact O-N 3.26Å; V30-W34 WeakPolarHBondContact O-CB 3.21Å; V30-W34 PolarHBondContact O-N 3.18Å; V30-F176 HydrophobicContact CG2-CE1 3.89Å; V30-F176 HydrophobicContact CG2-CZ 4.26Å; V30-M180 HydrophobicContact CB-CE 4.49Å; V30-M180 HydrophobicContact CG1-CE 4.49Å; V30-M180 HydrophobicContact CG2-CE 4Å; V30-M180 HydrophobicContact CG2-SD 4.15Å
31Y87.1Confident79.6Confident133 Ų13368.4 Ų68.452%0.52233%0.334SS..Hα-helixtrans-58.6-48.7178.9171.8-97.4000112A27 V28 W34 T35A27-Y31 WeakPolarHBondContact O-CB 3.41Å; A27-Y31 PolarHBondContact O-N 2.9Å; V28-Y31 PolarHBondContact O-N 3.33Å; Y31-W34 PolarHBondContact O-N 3.3Å; Y31-T35 WeakPolarHBondContact O-CB 3.34Å; Y31-T35 PolarHBondContact O-N 3.45Å; Y31-T35 PolarHBondContact O-OG1 2.92Å
32F82.3Confident78.1Confident30 Ų3067.7 Ų67.713%0.13233%0.33CS..Hα-helixtrans-68.9-37.3177.6-83.5-72.7000112V28 V30 W34 T35 D36 K184 A185 W188V28-F32 HydrophobicContact CG1-CD2 3.86Å; V28-F32 HydrophobicContact CG1-CE2 3.94Å; V28-F32 WeakPolarHBondContact O-CD2 3.37Å; V28-F32 PolarHBondContact O-N 3.11Å; V28-F32 VanDerWaalsContact O-N 3.08Å; V30-F32 PolarHBondContact O-N 3.4Å; F32-W34 VanDerWaalsContact C-N 3.26Å; F32-W34 PolarHBondContact O-N 3.27Å; F32-T35 PolarHBondContact O-N 3.33Å; F32-D36 WeakPolarHBondContact O-CB 3.41Å; F32-D36 PolarHBondContact O-N 2.92Å; F32-K184 HydrophobicContact CD1-CB 4.32Å; F32-K184 HydrophobicContact CE1-CB 4.48Å; F32-A185 HydrophobicContact CB-CB 3.87Å; F32-A185 HydrophobicContact CD2-CB 4.07Å; F32-A185 HydrophobicContact CG-CB 4.2Å; F32-W188 HydrophobicContact CE2-CB 3.74Å; F32-W188 AromaticContact CE2-CD1 3.59Å; F32-W188 AromaticContact CE2-CG 3.77Å; F32-W188 HydrophobicContact CE2-CG 3.77Å; F32-W188 HydrophobicContact CZ-CB 4.26Å; F32-W188 AromaticContact CZ-CD1 3.21Å; F32-W188 AromaticContact CZ-CG 3.77Å; F32-W188 HydrophobicContact CZ-CG 3.77Å; F32-W188 AromaticContact CZ-NE1 3.69Å
33A79.7Confident76.8Confident24 Ų2468 Ų6820%0.19834%0.339CS..Hα-helixtrans-60.9-35.9174.200000112.6G29 V30 R37 M180G29-A33 WeakPolarHBondContact O-CB 3.35Å; G29-A33 PolarHBondContact O-N 2.7Å; V30-A33 PolarHBondContact O-N 3.26Å; A33-R37 PolarHBondContact O-N 3.47Å; A33-M180 HydrophobicContact CB-CB 3.93Å; A33-M180 HydrophobicContact CB-CE 3.99Å; A33-M180 WeakPolarHBondContact CB-O 3.44Å
34W82.6Confident75.7Confident158 Ų15864.3 Ų64.360%0.59832%0.32SS*.Hα-helixtrans-77.6-42177.3-175.165.9000112.7V30 Y31 F32 R37V30-W34 WeakPolarHBondContact O-CB 3.21Å; V30-W34 PolarHBondContact O-N 3.18Å; Y31-W34 PolarHBondContact O-N 3.3Å; F32-W34 VanDerWaalsContact C-N 3.26Å; F32-W34 PolarHBondContact O-N 3.27Å; W34-R37 WeakPolarHBondContact O-CB 3.34Å; W34-R37 WeakPolarHBondContact O-CD 3.29Å; W34-R37 WeakPolarHBondContact O-CG 3.49Å; W34-R37 PolarHBondContact O-N 3.48Å
35T78.6Confident74.6Confident64 Ų6462.7 Ų62.739%0.39331%0.308SS..Hα-helixtrans-67.7-44.8-179-55.80000111.2Y31 F32 R37Y31-T35 WeakPolarHBondContact O-CB 3.34Å; Y31-T35 PolarHBondContact O-N 3.45Å; Y31-T35 PolarHBondContact O-OG1 2.92Å; F32-T35 PolarHBondContact O-N 3.33Å; T35-R37 VanDerWaalsContact C-N 3.26Å; T35-R37 PolarHBondContact O-N 3.45Å
36D71.5Confident73.5Confident46 Ų4662.6 Ų62.625%0.24631%0.307CS..G310 helixtrans-85.36.1-177.4-72.8-3000112.8F32 K38 Q39 K184F32-D36 WeakPolarHBondContact O-CB 3.41Å; F32-D36 PolarHBondContact O-N 2.92Å; D36-K38 PolarHBondContact O-N 3.04Å; D36-Q39 PolarHBondContact O-N 3.48Å; D36-K184 IonicContact OD1-NZ 2.69Å; D36-K184 WeakPolarHBondContact OD2-CD 3.39Å; D36-K184 IonicContact OD2-NZ 2.8Å; D36-K184 PolarHBondContact OD2-NZ 2.97Å
37R68.5Low72.6Confident130 Ų13062.3 Ų62.349%0.49130%0.303SS..G310 helixtrans-56.9-22.8-17875.9-174.2168.3157.3-2.5114.7A33 W34 T35 R40A33-R37 PolarHBondContact O-N 3.47Å; W34-R37 WeakPolarHBondContact O-CB 3.34Å; W34-R37 WeakPolarHBondContact O-CD 3.29Å; W34-R37 WeakPolarHBondContact O-CG 3.49Å; W34-R37 PolarHBondContact O-N 3.48Å; T35-R37 VanDerWaalsContact C-N 3.26Å; T35-R37 PolarHBondContact O-N 3.45Å; R37-R40 PolarHBondContact O-NE 2.84Å; R37-R40 VanDerWaalsContact O-NE 3.12Å
38K58.8Low71.3Confident181 Ų18159.5 Ų59.579%0.78728%0.281SS*.G310 helixtrans-91.5-19.7-178.3-64.1-173.5179.6-177.40113.4D36D36-K38 PolarHBondContact O-N 3.04Å
39Q55.7Low70.4Confident103 Ų10359.1 Ų59.148%0.48128%0.281SS..  trans-106.285.8178.8-71-176.4-11.700109.5D36D36-Q39 PolarHBondContact O-N 3.48Å
40R59.3Low70Confident152 Ų15260.3 Ų60.357%0.57429%0.285SS*.  trans-102.962.5-171.5-62.6-173.3-178.3-173.9-1.5113R37R37-R40 PolarHBondContact O-NE 2.84Å; R37-R40 VanDerWaalsContact O-NE 3.12Å
41S67Low69.5Low38 Ų3866 Ų6627%0.26630%0.3SS..  trans-103.2141.8162.681.60000110G43 D44 F45S41-G43 PolarHBondContact O-N 2.91Å; S41-D44 PolarHBondContact O-N 3.34Å; S41-D44 VanDerWaalsContact OG-CB 3.31Å; S41-D44 WeakPolarHBondContact OG-CB 3.3Å; S41-D44 PolarHBondContact OG-N 3.43Å; S41-D44 PolarHBondContact OG-OD2 3.5Å; S41-F45 PolarHBondContact O-N 2.88Å
42A59.8Low69.3Low1 Ų160.6 Ų60.61%0.00828%0.28CS..Hα-helixtrans-66.2-32.6176.100000110.3D44 F45 L46 E378 L381 T382A42-D44 VanDerWaalsContact C-N 3.34Å; A42-D44 PolarHBondContact O-N 2.96Å; A42-F45 PolarHBondContact O-N 3.42Å; A42-L46 WeakPolarHBondContact O-CB 3.44Å; A42-L46 WeakPolarHBondContact O-CG 3.46Å; A42-L46 PolarHBondContact O-N 3.26Å; A42-E378 VanDerWaalsContact CB-OE2 3.24Å; A42-E378 WeakPolarHBondContact CB-OE2 3.42Å; A42-E378 PolarHBondContact N-OE2 3.28Å; A42-L381 HydrophobicContact CB-CB 3.98Å; A42-L381 HydrophobicContact CB-CD2 3.87Å; A42-L381 HydrophobicContact CB-CG 4.06Å; A42-T382 WeakPolarHBondContact CA-OG1 3.4Å; A42-T382 PolarHBondContact N-OG1 3.35Å
43G60Low69.6Low27 Ų2762 Ų6228%0.27829%0.291SS..Hα-helixtrans-55.3-43.6169.900000113S41 L46 T47S41-G43 PolarHBondContact O-N 2.91Å; G43-L46 PolarHBondContact O-N 2.98Å; G43-T47 WeakPolarHBondContact O-CA 3.49Å; G43-T47 WeakPolarHBondContact O-CB 3.27Å; G43-T47 PolarHBondContact O-N 3.41Å; G43-T47 PolarHBondContact O-OG1 3.4Å
44D68.9Low70.1Confident42 Ų4261 Ų6123%0.22528%0.283CS..Hα-helixtrans-67.8-38.7177.2-72.8-40.9000112.5S41 A42 G48 G49S41-D44 PolarHBondContact O-N 3.34Å; S41-D44 VanDerWaalsContact OG-CB 3.31Å; S41-D44 WeakPolarHBondContact OG-CB 3.3Å; S41-D44 PolarHBondContact OG-N 3.43Å; S41-D44 PolarHBondContact OG-OD2 3.5Å; A42-D44 VanDerWaalsContact C-N 3.34Å; A42-D44 PolarHBondContact O-N 2.96Å; D44-G48 WeakPolarHBondContact O-CA 3.46Å; D44-G48 PolarHBondContact O-N 3.34Å; D44-G49 WeakPolarHBondContact OD1-CA 3.23Å
45F66.3Low70.5Confident24 Ų2457.7 Ų57.711%0.10528%0.277CS..Hα-helixtrans-64.8-42.6177.5-174.8-98.3000111.7S41 A42 G182 L183 K386S41-F45 PolarHBondContact O-N 2.88Å; A42-F45 PolarHBondContact O-N 3.42Å; F45-G182 VanDerWaalsContact CE2-N 3.31Å; F45-L183 PolarHBondContact O-N 3.37Å; F45-K386 HydrophobicContact CE1-CG 4.44Å; F45-K386 HydrophobicContact CE2-CG 4.29Å; F45-K386 HydrophobicContact CZ-CG 3.93Å
46L63Low71Confident0 Ų055.5 Ų55.50%026%0.263CS..Hα-helixtrans-82.4-38.7-177.4-65.1179.8000112.9A42 G43 T113 L183 Q266 A363 E367A42-L46 WeakPolarHBondContact O-CB 3.44Å; A42-L46 WeakPolarHBondContact O-CG 3.46Å; A42-L46 PolarHBondContact O-N 3.26Å; G43-L46 PolarHBondContact O-N 2.98Å; L46-T113 HydrophobicContact CB-CG2 4.32Å; L46-T113 HydrophobicContact CD1-CG2 4.25Å; L46-L183 WeakPolarHBondContact O-CD2 3.28Å; L46-Q266 PolarHBondContact O-NE2 3.5Å; L46-A363 HydrophobicContact CD2-CB 3.77Å; L46-E367 HydrophobicContact CD1-CG 4.4Å
47T68.1Low71.9Confident12 Ų1253.3 Ų53.37%0.07425%0.251CS..Hα-helixtrans-110.52.7-172.170.90000113.7G43 G49 R50 T113 A270G43-T47 WeakPolarHBondContact O-CA 3.49Å; G43-T47 WeakPolarHBondContact O-CB 3.27Å; G43-T47 PolarHBondContact O-N 3.41Å; G43-T47 PolarHBondContact O-OG1 3.4Å; T47-G49 PolarHBondContact O-N 3.38Å; T47-G49 VanDerWaalsContact O-N 3.15Å; T47-R50 PolarHBondContact O-N 3.07Å; T47-R50 VanDerWaalsContact O-N 3.15Å; T47-T113 HydrophobicContact CG2-CG2 4.06Å; T47-A270 WeakPolarHBondContact O-CB 3.32Å
48G63.4Low73Confident0 Ų047.2 Ų47.20%023%0.229CC..G310 helixtrans61.620-174.200000113.5D44 R50 K184D44-G48 WeakPolarHBondContact O-CA 3.46Å; D44-G48 PolarHBondContact O-N 3.34Å; G48-R50 PolarHBondContact O-N 2.89Å; G48-K184 WeakPolarHBondContact O-CE 3.26Å
49G67.6Low74.6Confident14 Ų1441.4 Ų41.414%0.14421%0.205CC..G310 helixtrans69.112.1-176.300000114.4D44 T47 R51D44-G49 WeakPolarHBondContact OD1-CA 3.23Å; T47-G49 PolarHBondContact O-N 3.38Å; T47-G49 VanDerWaalsContact O-N 3.15Å; G49-R51 WeakPolarHBondContact O-CG 3.43Å; G49-R51 PolarHBondContact O-N 2.84Å
50R73.9Confident76.3Confident26 Ų2636.5 Ų36.510%0.09818%0.182CC..G310 helixtrans53.634.2-176.3-59.7-177.2176.61747.2114.7T47 G48 S111 A270 K272 N596T47-R50 PolarHBondContact O-N 3.07Å; T47-R50 VanDerWaalsContact O-N 3.15Å; G48-R50 PolarHBondContact O-N 2.89Å; R50-S111 PolarHBondContact NH1-OG 3.33Å; R50-S111 PolarHBondContact NH2-O 2.87Å; R50-A270 CarbonylContact C-O 3.6Å; R50-A270 WeakPolarHBondContact CA-O 3.36Å; R50-K272 VanDerWaalsContact O-CA 3.27Å; R50-K272 WeakPolarHBondContact O-CA 3.34Å; R50-N596 WeakPolarHBondContact CD-ND2 3.42Å; R50-N596 PolarHBondContact NH1-ND2 3.36Å; R50-N596 PolarHBondContact NH1-OD1 2.88Å
51R78.3Confident77.8Confident182 Ų18229.2 Ų29.269%0.68716%0.155SC*.  trans-107.43.2-178.2-71.1169-168.7-158.90.8113.2G49 A270G49-R51 WeakPolarHBondContact O-CG 3.43Å; G49-R51 PolarHBondContact O-N 2.84Å; R51-A270 PolarHBondContact N-O 3.36Å
52L81.8Confident79Confident18 Ų1827.5 Ų27.59%0.09414%0.143CC..BIsolated β-bridgetrans-72.5150.8-173.7-59.3178.4000111.5V57 V187 A270 C271 K272L52-V57 HydrophobicContact CB-CG2 3.48Å; L52-V57 VanDerWaalsContact CB-CG2 3.48Å; L52-V57 HydrophobicContact CD1-CG2 3.82Å; L52-V57 HydrophobicContact CG-CG2 4.29Å; L52-V187 HydrophobicContact CD1-CG2 4.22Å; L52-A270 WeakPolarHBondContact CB-O 3.21Å; L52-A270 HydrophobicContact CD1-CB 3.96Å; L52-A270 PolarHBondContact N-O 3.39Å; L52-A270 VanDerWaalsContact N-O 3.15Å; L52-C271 WeakPolarHBondContact O-CA 3.31Å; L52-K272 PolarHBondContact O-N 3.36Å; L52-K272 VanDerWaalsContact O-N 3.07Å
53T88.1Confident80.3Confident59 Ų5927.5 Ų27.536%0.36214%0.142SC..  trans-98.5162.7175.955.10000110.6L55 P56 V57T53-L55 VanDerWaalsContact C-N 3.29Å; T53-L55 PolarHBondContact O-N 3.33Å; T53-P56 WeakPolarHBondContact O-CD 3.45Å; T53-P56 VanDerWaalsContact OG1-CD 3.24Å; T53-P56 WeakPolarHBondContact OG1-CD 3.49Å; T53-V57 VanDerWaalsContact O-CG2 3.31Å; T53-V57 WeakPolarHBondContact O-CG2 3.29Å
54A90.8Very high81.4Confident3 Ų326.2 Ų26.23%0.02513%0.129CC..Hα-helixtrans-59.6-35.5-172.700000114.1S58 Q276 L279 S280 I283A54-S58 WeakPolarHBondContact O-CB 3.45Å; A54-S58 PolarHBondContact O-N 3.34Å; A54-Q276 HydrophobicContact CB-CB 4.46Å; A54-Q276 WeakPolarHBondContact CB-O 3.39Å; A54-L279 HydrophobicContact CB-CB 3.92Å; A54-L279 HydrophobicContact CB-CD2 3.79Å; A54-L279 HydrophobicContact CB-CG 3.82Å; A54-S280 WeakPolarHBondContact O-CB 3.22Å; A54-I283 HydrophobicContact CB-CD1 4.37Å
55L90.9Very high81.6Confident90 Ų9024.6 Ų24.647%0.47112%0.12SC..Hα-helixtrans-72.1-53.7-171.1-176.270000113.4T53 V57 S58 M59 I283T53-L55 VanDerWaalsContact C-N 3.29Å; T53-L55 PolarHBondContact O-N 3.33Å; L55-V57 VanDerWaalsContact C-N 3.29Å; L55-V57 PolarHBondContact O-N 2.94Å; L55-S58 WeakPolarHBondContact O-CB 3.27Å; L55-S58 PolarHBondContact O-N 3.49Å; L55-M59 HydrophobicContact CD1-CE 3.67Å; L55-M59 HydrophobicContact CD2-CE 4.06Å; L55-M59 HydrophobicContact CG-CE 3.7Å; L55-M59 HydrophobicContact CG-SD 4.45Å; L55-M59 WeakPolarHBondContact O-CG 3.36Å; L55-M59 PolarHBondContact O-N 2.87Å; L55-I283 HydrophobicContact CD1-CG2 4.15Å
56P88.7Confident82Confident17 Ų1723.5 Ų23.511%0.1112%0.115CC..Hα-helixtrans-61.6-39176.1-2233.8000112.2T53 M59 S60 V187 W188T53-P56 WeakPolarHBondContact O-CD 3.45Å; T53-P56 VanDerWaalsContact OG1-CD 3.24Å; T53-P56 WeakPolarHBondContact OG1-CD 3.49Å; P56-M59 PolarHBondContact O-N 3.3Å; P56-S60 WeakPolarHBondContact O-CB 3.41Å; P56-S60 PolarHBondContact O-N 2.76Å; P56-V187 HydrophobicContact CB-CG1 3.97Å; P56-W188 HydrophobicContact CG-CZ2 4.41Å
57V90.7Very high82.9Confident0 Ų023.5 Ų23.50%012%0.116CC..Hα-helixtrans-62.3-45.1176.4173.70000110.5L52 T53 L55 S60 L61 R267L52-V57 HydrophobicContact CB-CG2 3.48Å; L52-V57 VanDerWaalsContact CB-CG2 3.48Å; L52-V57 HydrophobicContact CD1-CG2 3.82Å; L52-V57 HydrophobicContact CG-CG2 4.29Å; T53-V57 VanDerWaalsContact O-CG2 3.31Å; T53-V57 WeakPolarHBondContact O-CG2 3.29Å; L55-V57 VanDerWaalsContact C-N 3.29Å; L55-V57 PolarHBondContact O-N 2.94Å; V57-S60 PolarHBondContact O-N 2.97Å; V57-L61 HydrophobicContact CG1-CD1 3.94Å; V57-L61 HydrophobicContact CG1-CG 4.21Å; V57-L61 WeakPolarHBondContact O-CB 3.35Å; V57-L61 WeakPolarHBondContact O-CG 3.32Å; V57-L61 PolarHBondContact O-N 2.74Å; V57-R267 HydrophobicContact CG1-CB 4.19Å; V57-R267 WeakPolarHBondContact CG1-O 3.18Å
58S92.6Very high83.6Confident2 Ų223 Ų231%0.01411%0.112CC..Hα-helixtrans-60.4-48.2177.4171.80000113.1A54 L55 S60 L61 S62 S280 I283 N284A54-S58 WeakPolarHBondContact O-CB 3.45Å; A54-S58 PolarHBondContact O-N 3.34Å; L55-S58 WeakPolarHBondContact O-CB 3.27Å; L55-S58 PolarHBondContact O-N 3.49Å; S58-S60 VanDerWaalsContact C-N 3.28Å; S58-S60 PolarHBondContact O-N 3.44Å; S58-L61 WeakPolarHBondContact O-CB 3.24Å; S58-L61 PolarHBondContact O-N 3.45Å; S58-S62 PolarHBondContact O-N 2.9Å; S58-S62 PolarHBondContact O-OG 3.4Å; S58-S280 VanDerWaalsContact CB-O 3.26Å; S58-S280 WeakPolarHBondContact CB-O 3.26Å; S58-S280 PolarHBondContact OG-O 3.28Å; S58-I283 VanDerWaalsContact OG-CB 3.22Å; S58-I283 WeakPolarHBondContact OG-CB 3.4Å; S58-I283 WeakPolarHBondContact OG-CG2 3.38Å; S58-N284 VanDerWaalsContact OG-CA 3.25Å; S58-N284 WeakPolarHBondContact OG-CA 3.48Å; S58-N284 PolarHBondContact OG-N 3.36Å
59M91.4Very high84.5Confident59 Ų5923.7 Ų23.729%0.29112%0.116SC..Hα-helixtrans-61-41.2177.5-70.4173.9-179.400111.2L55 P56 S62 A63 V191 L194L55-M59 HydrophobicContact CD1-CE 3.67Å; L55-M59 HydrophobicContact CD2-CE 4.06Å; L55-M59 HydrophobicContact CG-CE 3.7Å; L55-M59 HydrophobicContact CG-SD 4.45Å; L55-M59 WeakPolarHBondContact O-CG 3.36Å; L55-M59 PolarHBondContact O-N 2.87Å; P56-M59 PolarHBondContact O-N 3.3Å; M59-S62 PolarHBondContact O-N 2.97Å; M59-A63 PolarHBondContact O-N 3.09Å; M59-V191 HydrophobicContact CB-CG2 3.77Å; M59-V191 HydrophobicContact CG-CG2 4.5Å; M59-V191 HydrophobicContact SD-CB 4.35Å; M59-V191 HydrophobicContact SD-CG1 3.69Å; M59-V191 HydrophobicContact SD-CG2 3.92Å; M59-L194 HydrophobicContact CB-CD2 3.87Å; M59-L194 HydrophobicContact CG-CD2 4.09Å
60S91.6Very high85.4Confident0 Ų023.4 Ų23.40%011%0.112CC..Hα-helixtrans-64.1-47.5175177.10000111.8P56 V57 S58 S62 A63 S64 D190 R267P56-S60 WeakPolarHBondContact O-CB 3.41Å; P56-S60 PolarHBondContact O-N 2.76Å; V57-S60 PolarHBondContact O-N 2.97Å; S58-S60 VanDerWaalsContact C-N 3.28Å; S58-S60 PolarHBondContact O-N 3.44Å; S60-S62 PolarHBondContact O-N 2.94Å; S60-A63 PolarHBondContact O-N 2.75Å; S60-S64 WeakPolarHBondContact O-CB 3.27Å; S60-S64 PolarHBondContact O-N 3.46Å; S60-S64 PolarHBondContact O-OG 3.47Å; S60-D190 PolarHBondContact OG-OD2 2.97Å; S60-R267 PolarHBondContact OG-NE 2.77Å; S60-R267 PolarHBondContact OG-NH2 3.46Å
61L91.9Very high86.2Confident0 Ų022.2 Ų22.20%011%0.107CC..Hα-helixtrans-53.9-38.2172.7-72.1170.1000112.1V57 S58 Y258 Q264 R267 Y268 L281 N284V57-L61 HydrophobicContact CG1-CD1 3.94Å; V57-L61 HydrophobicContact CG1-CG 4.21Å; V57-L61 WeakPolarHBondContact O-CB 3.35Å; V57-L61 WeakPolarHBondContact O-CG 3.32Å; V57-L61 PolarHBondContact O-N 2.74Å; S58-L61 WeakPolarHBondContact O-CB 3.24Å; S58-L61 PolarHBondContact O-N 3.45Å; L61-Y258 HydrophobicContact CB-CE1 4.3Å; L61-Y258 HydrophobicContact CD2-CE1 4.39Å; L61-Y258 PolarHBondContact O-OH 2.86Å; L61-Q264 HydrophobicContact CD2-CB 4.28Å; L61-R267 HydrophobicContact CD2-CB 3.75Å; L61-R267 HydrophobicContact CD2-CG 4.45Å; L61-R267 HydrophobicContact CG-CB 4.29Å; L61-Y268 HydrophobicContact CD2-CD1 4.35Å; L61-L281 HydrophobicContact CD1-CD2 4.21Å; L61-N284 HydrophobicContact CB-CB 4.13Å; L61-N284 HydrophobicContact CD1-CB 4.4Å
62S90.9Very high86.7Confident2 Ų213.8 Ų13.81%0.0148%0.076CC..Hα-helixtrans-71.4-42.7178.6-63.70000112.2S58 M59 S60 M66 N284S58-S62 PolarHBondContact O-N 2.9Å; S58-S62 PolarHBondContact O-OG 3.4Å; M59-S62 PolarHBondContact O-N 2.97Å; S60-S62 PolarHBondContact O-N 2.94Å; S62-M66 VanDerWaalsContact O-CB 3.3Å; S62-M66 WeakPolarHBondContact O-CB 3.47Å; S62-M66 WeakPolarHBondContact O-CG 3.22Å; S62-N284 WeakPolarHBondContact CA-OD1 3.47Å; S62-N284 WeakPolarHBondContact CB-OD1 3.37Å; S62-N284 PolarHBondContact N-OD1 3.35Å; S62-N284 PolarHBondContact OG-O 2.98Å; S62-N284 PolarHBondContact OG-OD1 2.93Å
63A87.8Confident87Confident0 Ų013 Ų130%07%0.072CC..Hα-helixtrans-70.5-31.3-178.900000113.1M59 S60 F65 M66 D190 L194 S352M59-A63 PolarHBondContact O-N 3.09Å; S60-A63 PolarHBondContact O-N 2.75Å; A63-F65 PolarHBondContact O-N 3.45Å; A63-M66 PolarHBondContact O-N 2.98Å; A63-D190 HydrophobicContact CB-CB 3.9Å; A63-L194 HydrophobicContact CB-CB 4.23Å; A63-S352 PolarHBondContact O-OG 2.86Å
64S82.3Confident87.2Confident0 Ų011 Ų110%06%0.059CC..SBendtrans-71.5-21.7-161.9-66.60000117.3S60 D190 Q264 R267 T353 S356S60-S64 WeakPolarHBondContact O-CB 3.27Å; S60-S64 PolarHBondContact O-N 3.46Å; S60-S64 PolarHBondContact O-OG 3.47Å; S64-D190 PolarHBondContact OG-OD2 2.88Å; S64-Q264 VanDerWaalsContact CB-NE2 3.32Å; S64-R267 VanDerWaalsContact CB-NH1 3.3Å; S64-R267 PolarHBondContact OG-NH1 3.38Å; S64-R267 PolarHBondContact OG-NH2 2.86Å; S64-T353 VanDerWaalsContact O-CA 3.24Å; S64-T353 WeakPolarHBondContact O-CA 3.24Å; S64-T353 WeakPolarHBondContact O-CB 3.46Å; S64-T353 PolarHBondContact O-OG1 3.47Å; S64-T353 VanDerWaalsContact O-OG1 3.08Å; S64-S356 WeakPolarHBondContact CB-OG 3.36Å; S64-S356 PolarHBondContact OG-OG 3.4Å
65F73.5Confident87.3Confident8 Ų810.9 Ų10.94%0.0356%0.058CC..SBendtrans-125.96.1173.5-82.7-73.8000112A63 S67 Y142 W254 I257 A263 Q264 T353 F417A63-F65 PolarHBondContact O-N 3.45Å; F65-S67 VanDerWaalsContact C-N 3.29Å; F65-S67 PolarHBondContact O-N 3.34Å; F65-Y142 AromaticContact CD1-CE1 3.74Å; F65-Y142 HydrophobicContact CD1-CE1 3.74Å; F65-Y142 HydrophobicContact CE1-CD1 4.1Å; F65-Y142 AromaticContact CE1-CE1 3.48Å; F65-Y142 HydrophobicContact CE1-CE1 3.48Å; F65-Y142 VanDerWaalsContact CE1-CE1 3.48Å; F65-W254 HydrophobicContact CB-CZ3 4.23Å; F65-I257 HydrophobicContact CB-CG2 4.33Å; F65-I257 HydrophobicContact CD1-CG2 4.36Å; F65-I257 HydrophobicContact CD2-CG2 3.43Å; F65-I257 VanDerWaalsContact CD2-CG2 3.43Å; F65-I257 HydrophobicContact CE2-CG2 3.75Å; F65-I257 HydrophobicContact CG-CG2 3.78Å; F65-I257 HydrophobicContact CZ-CG2 4.35Å; F65-A263 HydrophobicContact CE2-CB 4.14Å; F65-A263 HydrophobicContact CZ-CB 4.39Å; F65-Q264 HydrophobicContact CD2-CG 3.84Å; F65-Q264 HydrophobicContact CE2-CG 3.74Å; F65-Q264 VanDerWaalsContact CE2-NE2 3.27Å; F65-T353 HydrophobicContact CD1-CG2 4.48Å; F65-F417 HydrophobicContact CD1-CE2 4.5Å; F65-F417 HydrophobicContact CD1-CZ 4.19Å; F65-F417 HydrophobicContact CE1-CE1 4.28Å; F65-F417 HydrophobicContact CE1-CE2 4.13Å; F65-F417 AromaticContact CE1-CZ 3.48Å; F65-F417 HydrophobicContact CE1-CZ 3.48Å; F65-F417 VanDerWaalsContact CE1-CZ 3.48Å; F65-F417 HydrophobicContact CZ-CZ 4.14Å
66M75.7Confident87.3Confident1 Ų16.7 Ų6.71%0.0054%0.037CC..  trans-90.172.3167.8-68.2-66.1153.300108.3S62 A63 T70 Y92 M197 W254 L288 I291 G349S62-M66 VanDerWaalsContact O-CB 3.3Å; S62-M66 WeakPolarHBondContact O-CB 3.47Å; S62-M66 WeakPolarHBondContact O-CG 3.22Å; A63-M66 PolarHBondContact O-N 2.98Å; M66-T70 HydrophobicContact SD-CG2 3.6Å; M66-T70 VanDerWaalsContact SD-CG2 3.6Å; M66-Y92 HydrophobicContact CE-CE1 4.38Å; M66-Y92 WeakPolarHBondContact CE-OH 3.44Å; M66-M197 HydrophobicContact CB-CE 3.99Å; M66-M197 WeakPolarHBondContact O-CE 3.33Å; M66-W254 HydrophobicContact CE-CH2 3.54Å; M66-W254 HydrophobicContact CE-CZ2 4.07Å; M66-W254 HydrophobicContact CE-CZ3 4.21Å; M66-L288 HydrophobicContact CE-CD2 3.26Å; M66-L288 HydrophobicContact CG-CD2 4.03Å; M66-L288 HydrophobicContact SD-CD2 4.39Å; M66-I291 HydrophobicContact CB-CD1 3.92Å; M66-I291 HydrophobicContact CG-CD1 3.7Å; M66-I291 HydrophobicContact CG-CG2 4.34Å; M66-I291 HydrophobicContact SD-CG2 4Å; M66-G349 WeakPolarHBondContact O-CA 3.4Å
67S81.1Confident87.4Confident1 Ų16.9 Ų6.91%0.0074%0.036CC..  trans-76.3177.4-17747.60000112.9F65 I69 T70 V71 Y142 G349 T353F65-S67 VanDerWaalsContact C-N 3.29Å; F65-S67 PolarHBondContact O-N 3.34Å; S67-I69 PolarHBondContact O-N 3.24Å; S67-I69 VanDerWaalsContact O-N 3.07Å; S67-I69 WeakPolarHBondContact OG-CB 3.45Å; S67-T70 WeakPolarHBondContact O-CB 3.32Å; S67-T70 PolarHBondContact O-N 3.28Å; S67-V71 PolarHBondContact O-N 2.77Å; S67-Y142 PolarHBondContact OG-OH 2.85Å; S67-G349 WeakPolarHBondContact CA-O 3.25Å; S67-T353 WeakPolarHBondContact CB-OG1 3.14Å
68A82.5Confident87.5Confident0 Ų06.9 Ų6.90%04%0.036CC..Hα-helixtrans-50.2-30.6169.100000113T70 V71 L72 P150 T346 S350A68-T70 VanDerWaalsContact C-N 3.27Å; A68-T70 PolarHBondContact O-N 3.22Å; A68-V71 PolarHBondContact O-N 3.18Å; A68-V71 VanDerWaalsContact O-N 3.09Å; A68-L72 HydrophobicContact CB-CD1 4.41Å; A68-L72 WeakPolarHBondContact O-CB 3.27Å; A68-L72 WeakPolarHBondContact O-CG 3.45Å; A68-L72 PolarHBondContact O-N 3.05Å; A68-P150 HydrophobicContact CB-CB 3.68Å; A68-P150 HydrophobicContact CB-CG 4Å; A68-T346 HydrophobicContact CB-CG2 3.57Å; A68-T346 WeakPolarHBondContact CB-O 3.45Å; A68-S350 WeakPolarHBondContact CB-OG 3.41Å
69I81.8Confident87.6Confident15 Ų156.9 Ų6.98%0.0774%0.036CC..Hα-helixtrans-52.2-43.4171.3-77.6163.8000111.5S67 G73 Y142 I145 V146 A149 L410 A413S67-I69 PolarHBondContact O-N 3.24Å; S67-I69 VanDerWaalsContact O-N 3.07Å; S67-I69 WeakPolarHBondContact OG-CB 3.45Å; I69-G73 WeakPolarHBondContact O-CA 3.24Å; I69-G73 PolarHBondContact O-N 3.29Å; I69-Y142 HydrophobicContact CD1-CE2 4.38Å; I69-I145 HydrophobicContact CD1-CG2 4.4Å; I69-V146 HydrophobicContact CD1-CG2 4.03Å; I69-A149 HydrophobicContact CG1-CB 4.16Å; I69-L410 HydrophobicContact CB-CD1 4.06Å; I69-L410 HydrophobicContact CG1-CD1 4.38Å; I69-L410 HydrophobicContact CG2-CD1 3.14Å; I69-A413 HydrophobicContact CD1-CB 3.65Å
70T87.6Confident87.5Confident9 Ų96.8 Ų6.86%0.0553%0.032CC..Hα-helixtrans-69.7-40.9176.2-54.70000111.1M66 S67 A68 N74 I291M66-T70 HydrophobicContact SD-CG2 3.6Å; M66-T70 VanDerWaalsContact SD-CG2 3.6Å; S67-T70 WeakPolarHBondContact O-CB 3.32Å; S67-T70 PolarHBondContact O-N 3.28Å; A68-T70 VanDerWaalsContact C-N 3.27Å; A68-T70 PolarHBondContact O-N 3.22Å; T70-N74 WeakPolarHBondContact CG2-ND2 3.48Å; T70-N74 WeakPolarHBondContact O-CB 3.46Å; T70-N74 PolarHBondContact O-N 3.06Å; T70-I291 HydrophobicContact CG2-CG2 3.91Å
71V89.7Confident87.4Confident1 Ų18.5 Ų8.51%0.0064%0.039CC..Hα-helixtrans-67.9-37.6-176.1-179.60000112.2S67 A68 P75 M197 F201 F342S67-V71 PolarHBondContact O-N 2.77Å; A68-V71 PolarHBondContact O-N 3.18Å; A68-V71 VanDerWaalsContact O-N 3.09Å; V71-P75 WeakPolarHBondContact O-CD 3.41Å; V71-P75 WeakPolarHBondContact O-CG 3.3Å; V71-M197 HydrophobicContact CG2-CE 3.85Å; V71-F201 HydrophobicContact CB-CZ 4.22Å; V71-F201 HydrophobicContact CG1-CE1 4.35Å; V71-F201 HydrophobicContact CG1-CZ 4.14Å; V71-F201 HydrophobicContact CG2-CE2 4.1Å; V71-F201 HydrophobicContact CG2-CZ 4.13Å; V71-F342 HydrophobicContact CG1-CE2 4.11Å; V71-F342 HydrophobicContact CG1-CZ 4.02Å
72L89.9Confident87.5Confident5 Ų58.6 Ų8.63%0.0264%0.04CC..Hα-helixtrans-99.5-45.4-176.2-59.3170.5000112.1A68 A76 A153 M324 P325 F342 T346A68-L72 HydrophobicContact CB-CD1 4.41Å; A68-L72 WeakPolarHBondContact O-CB 3.27Å; A68-L72 WeakPolarHBondContact O-CG 3.45Å; A68-L72 PolarHBondContact O-N 3.05Å; L72-A76 PolarHBondContact O-N 3.09Å; L72-A153 HydrophobicContact CD1-CB 3.48Å; L72-A153 VanDerWaalsContact CD1-CB 3.48Å; L72-M324 HydrophobicContact CD2-CB 4.28Å; L72-P325 HydrophobicContact CD2-CG 3.63Å; L72-F342 HydrophobicContact CD2-CE1 3.99Å; L72-F342 HydrophobicContact CD2-CZ 4.15Å; L72-T346 HydrophobicContact CD1-CG2 3.56Å; L72-T346 HydrophobicContact CD2-CG2 4.1Å; L72-T346 HydrophobicContact CG-CG2 3.79Å
73G88.4Confident87.6Confident2 Ų28.7 Ų8.72%0.0214%0.041CC..Hα-helixtrans-74.6-44.1-172.900000113.5I69 A76 E77I69-G73 WeakPolarHBondContact O-CA 3.24Å; I69-G73 PolarHBondContact O-N 3.29Å; G73-A76 PolarHBondContact O-N 3.44Å; G73-E77 WeakPolarHBondContact O-CG 3.32Å; G73-E77 PolarHBondContact O-N 3.39Å
74N91.2Very high87.7Confident16 Ų169.4 Ų9.49%0.0865%0.046CC..Hα-helixtrans-62.4-45.7-178.7-71.96.8000112.9T70 A76 E77 V78 I85 S295T70-N74 WeakPolarHBondContact CG2-ND2 3.48Å; T70-N74 WeakPolarHBondContact O-CB 3.46Å; T70-N74 PolarHBondContact O-N 3.06Å; N74-A76 VanDerWaalsContact C-N 3.3Å; N74-A76 PolarHBondContact O-N 2.94Å; N74-E77 PolarHBondContact O-N 2.97Å; N74-V78 WeakPolarHBondContact O-CG2 3.44Å; N74-V78 PolarHBondContact O-N 3.27Å; N74-I85 HydrophobicContact CB-CD1 4.24Å; N74-S295 PolarHBondContact ND2-OG 3.44Å
75P93.6Very high88.1Confident0 Ų09.6 Ų9.60%05%0.047CC..Hα-helixtrans-61-38.3174.9-25.736.2000113.1V71 V78 Y79 F201 A298 M324V71-P75 WeakPolarHBondContact O-CD 3.41Å; V71-P75 WeakPolarHBondContact O-CG 3.3Å; P75-V78 PolarHBondContact O-N 3.01Å; P75-Y79 PolarHBondContact O-N 3.4Å; P75-F201 HydrophobicContact CG-CE1 4.41Å; P75-A298 HydrophobicContact CG-CB 4.29Å; P75-M324 HydrophobicContact CB-CG 3.45Å; P75-M324 VanDerWaalsContact CB-CG 3.45Å; P75-M324 HydrophobicContact CB-SD 3.57Å; P75-M324 VanDerWaalsContact CB-SD 3.57Å; P75-M324 HydrophobicContact CG-CE 4.48Å; P75-M324 HydrophobicContact CG-CG 3.85Å; P75-M324 HydrophobicContact CG-SD 4.07Å
76A90.9Very high89.1Confident3 Ų310.5 Ų10.53%0.0256%0.056CC..Hα-helixtrans-65.8-37.9175.800000112.2L72 G73 N74 Y79 R80 L323L72-A76 PolarHBondContact O-N 3.09Å; G73-A76 PolarHBondContact O-N 3.44Å; N74-A76 VanDerWaalsContact C-N 3.3Å; N74-A76 PolarHBondContact O-N 2.94Å; A76-Y79 WeakPolarHBondContact O-CB 3.29Å; A76-Y79 PolarHBondContact O-N 2.99Å; A76-R80 WeakPolarHBondContact O-CG 3.37Å; A76-R80 PolarHBondContact O-N 2.77Å; A76-R80 VanDerWaalsContact O-N 3.11Å; A76-L323 HydrophobicContact CB-CD1 4.37Å
77E90Very high89.9Confident21 Ų2112.1 Ų12.110%0.0986%0.063CC..Hα-helixtrans-63.5-42172.2-71.7-76.3168.100110.8G73 N74 Y79 R80 Y81 I85 R240 H241 L410G73-E77 WeakPolarHBondContact O-CG 3.32Å; G73-E77 PolarHBondContact O-N 3.39Å; N74-E77 PolarHBondContact O-N 2.97Å; E77-Y79 VanDerWaalsContact C-N 3.34Å; E77-Y79 PolarHBondContact O-N 2.85Å; E77-R80 PolarHBondContact O-N 2.68Å; E77-Y81 WeakPolarHBondContact O-CA 2.98Å; E77-Y81 WeakPolarHBondContact O-CB 3.37Å; E77-Y81 PolarHBondContact O-N 3.07Å; E77-Y81 WeakPolarHBondContact OE2-CD2 3.49Å; E77-Y81 WeakPolarHBondContact OE2-CE2 3.46Å; E77-I85 HydrophobicContact CB-CD1 4.08Å; E77-R240 IonicContact OE1-CZ 2.69Å; E77-R240 IonicContact OE1-NH2 3.75Å; E77-R240 PolarHBondContact OE1-NH2 3.48Å; E77-R240 IonicContact OE2-NE 2.54Å; E77-R240 IonicContact OE2-NH2 3.16Å; E77-H241 IonicContact OE2-CE1 2.83Å; E77-H241 PolarHBondContact OE2-CE1 3.41Å; E77-H241 VanDerWaalsContact OE2-CE1 3.26Å; E77-L410 HydrophobicContact CG-CD2 3.97Å
78V94.1Very high90.5Very high0 Ų012.6 Ų12.60%07%0.065CC..Hα-helixtrans-64.2-39.2175172.60000112.3N74 P75 R80 G82 I85 V296 M300N74-V78 WeakPolarHBondContact O-CG2 3.44Å; N74-V78 PolarHBondContact O-N 3.27Å; P75-V78 PolarHBondContact O-N 3.01Å; V78-R80 VanDerWaalsContact C-N 3.3Å; V78-R80 PolarHBondContact O-N 3.13Å; V78-G82 WeakPolarHBondContact CA-O 3.31Å; V78-G82 WeakPolarHBondContact O-CA 3.26Å; V78-G82 PolarHBondContact O-N 2.85Å; V78-I85 HydrophobicContact CG2-CG2 3.51Å; V78-V296 HydrophobicContact CG2-CB 4.39Å; V78-V296 HydrophobicContact CG2-CG1 4.29Å; V78-V296 HydrophobicContact CG2-CG2 4.18Å; V78-M300 HydrophobicContact CG1-CG 4.1Å
79Y93.1Very high91.1Very high1 Ų113.8 Ų13.80%0.0047%0.074CC..Hα-helixtrans-59.8-41.6176.8-174.7-94.8000112.2P75 A76 E77 R227 L302 F303 D310 L323 L475P75-Y79 PolarHBondContact O-N 3.4Å; A76-Y79 WeakPolarHBondContact O-CB 3.29Å; A76-Y79 PolarHBondContact O-N 2.99Å; E77-Y79 VanDerWaalsContact C-N 3.34Å; E77-Y79 PolarHBondContact O-N 2.85Å; Y79-R227 PolarHBondContact O-NE 3.27Å; Y79-R227 PolarHBondContact O-NH2 3.44Å; Y79-L302 HydrophobicContact CD2-CB 4.43Å; Y79-L302 HydrophobicContact CD2-CD2 3.98Å; Y79-L302 HydrophobicContact CD2-CG 3.73Å; Y79-L302 HydrophobicContact CE2-CG 4.29Å; Y79-L302 HydrophobicContact CG-CD2 4.12Å; Y79-L302 HydrophobicContact CG-CG 4.37Å; Y79-F303 HydrophobicContact CD2-CB 3.85Å; Y79-F303 HydrophobicContact CD2-CD2 4.13Å; Y79-F303 HydrophobicContact CE2-CB 4.23Å; Y79-F303 AromaticContact CE2-CD2 3.99Å; Y79-F303 HydrophobicContact CE2-CD2 3.99Å; Y79-D310 WeakPolarHBondContact OH-CB 3.14Å; Y79-D310 PolarHBondContact OH-OD1 2.7Å; Y79-D310 VanDerWaalsContact OH-OD1 3.06Å; Y79-L323 HydrophobicContact CD1-CD1 3.64Å; Y79-L323 HydrophobicContact CE1-CD1 4.1Å; Y79-L323 HydrophobicContact CE1-CD2 4.38Å; Y79-L323 HydrophobicContact CG-CD1 4.09Å; Y79-L475 HydrophobicContact CD1-CD2 3.98Å; Y79-L475 HydrophobicContact CE1-CD1 4.08Å; Y79-L475 HydrophobicContact CE1-CD2 3.31Å; Y79-L475 HydrophobicContact CE1-CG 4.34Å
80R90.8Very high91.7Very high57 Ų5715.3 Ų15.322%0.2158%0.084CC..Hα-helixtrans-91.6-35.1-174.1-67.6-17367.5-172.41.6115.1A76 E77 V78 W312 P320 L473A76-R80 WeakPolarHBondContact O-CG 3.37Å; A76-R80 PolarHBondContact O-N 2.77Å; A76-R80 VanDerWaalsContact O-N 3.11Å; E77-R80 PolarHBondContact O-N 2.68Å; V78-R80 VanDerWaalsContact C-N 3.3Å; V78-R80 PolarHBondContact O-N 3.13Å; R80-W312 VanDerWaalsContact NH2-CH2 3.26Å; R80-P320 VanDerWaalsContact NH1-CG 3.26Å; R80-L473 WeakPolarHBondContact O-CB 3.24Å; R80-L473 PolarHBondContact O-N 3.1Å
81Y89.7Confident92.1Very high36 Ų3614.9 Ų14.914%0.1418%0.081CC..Hα-helixtrans-125-5.1-171.1-57.9-76.5000113.3E77 S470 P472E77-Y81 WeakPolarHBondContact O-CA 2.98Å; E77-Y81 WeakPolarHBondContact O-CB 3.37Å; E77-Y81 PolarHBondContact O-N 3.07Å; E77-Y81 WeakPolarHBondContact OE2-CD2 3.49Å; E77-Y81 WeakPolarHBondContact OE2-CE2 3.46Å; Y81-S470 WeakPolarHBondContact CD1-O 3.36Å; Y81-S470 VanDerWaalsContact CE1-O 3.32Å; Y81-S470 WeakPolarHBondContact CE1-O 3.35Å; Y81-P472 HydrophobicContact CE1-CB 4.04Å
82G91.9Very high92.4Very high3 Ų315 Ų153%0.0318%0.082CC..  trans91.5178.517600000114.3V78 S84 R227V78-G82 WeakPolarHBondContact CA-O 3.31Å; V78-G82 WeakPolarHBondContact O-CA 3.26Å; V78-G82 PolarHBondContact O-N 2.85Å; G82-S84 PolarHBondContact O-N 3.34Å; G82-S84 VanDerWaalsContact O-N 3.09Å; G82-R227 WeakPolarHBondContact CA-O 3.24Å
83A93.4Very high92.7Very high4 Ų416.8 Ų16.83%0.0339%0.093CC..G310 helixtrans-75.16.6-173.900000114I85 A86 R227 L228 L230 V296A83-I85 PolarHBondContact O-N 3.17Å; A83-I85 VanDerWaalsContact O-N 3.14Å; A83-A86 WeakPolarHBondContact O-CB 3.36Å; A83-A86 PolarHBondContact O-N 3.49Å; A83-R227 WeakPolarHBondContact CB-O 3.31Å; A83-R227 PolarHBondContact N-O 2.89Å; A83-L228 HydrophobicContact CB-CD2 4.18Å; A83-L230 VanDerWaalsContact C-CD2 3.42Å; A83-L230 HydrophobicContact CB-CD2 3.88Å; A83-L230 VanDerWaalsContact O-CD2 3.28Å; A83-L230 WeakPolarHBondContact O-CD2 3.33Å; A83-V296 HydrophobicContact CB-CG1 3.88Å
84S91.3Very high93.1Very high15 Ų1521.7 Ų21.711%0.10511%0.114CC..G310 helixtrans-55.2-32.1179.259.70000112.2G82 A86 F87 L246G82-S84 PolarHBondContact O-N 3.34Å; G82-S84 VanDerWaalsContact O-N 3.09Å; S84-A86 PolarHBondContact O-N 2.87Å; S84-F87 WeakPolarHBondContact O-CB 3.41Å; S84-F87 WeakPolarHBondContact O-CD2 3.12Å; S84-F87 PolarHBondContact O-N 3.44Å; S84-L246 VanDerWaalsContact C-CD1 3.48Å; S84-L246 WeakPolarHBondContact O-CD1 3.36Å
85I90.5Very high93.3Very high4 Ų421 Ų212%0.02111%0.11CC..G310 helixtrans-52.4-22.1174.2-161167.7000113.8N74 E77 V78 A83 F87 Y88 V296N74-I85 HydrophobicContact CB-CD1 4.24Å; E77-I85 HydrophobicContact CB-CD1 4.08Å; V78-I85 HydrophobicContact CG2-CG2 3.51Å; A83-I85 PolarHBondContact O-N 3.17Å; A83-I85 VanDerWaalsContact O-N 3.14Å; I85-F87 PolarHBondContact O-N 3.1Å; I85-F87 VanDerWaalsContact O-N 3.1Å; I85-Y88 HydrophobicContact CD1-CD2 4.41Å; I85-Y88 HydrophobicContact CD1-CE2 4.16Å; I85-Y88 HydrophobicContact CG1-CD2 3.54Å; I85-Y88 HydrophobicContact CG1-CE2 3.63Å; I85-Y88 WeakPolarHBondContact O-CD2 3.38Å; I85-Y88 PolarHBondContact O-N 3.02Å; I85-V296 HydrophobicContact CG2-CG2 3.66Å
86A93.6Very high93.4Very high26 Ų2621 Ų2122%0.21511%0.11CC..G310 helixtrans-56.4-23.3172.500000113.1A83 S84 Y88 A89 V296A83-A86 WeakPolarHBondContact O-CB 3.36Å; A83-A86 PolarHBondContact O-N 3.49Å; S84-A86 PolarHBondContact O-N 2.87Å; A86-Y88 PolarHBondContact O-N 3.1Å; A86-Y88 VanDerWaalsContact O-N 3.17Å; A86-A89 WeakPolarHBondContact O-CB 3.21Å; A86-A89 PolarHBondContact O-N 3.25Å; A86-V296 HydrophobicContact CB-CG2 4.3Å
87F93.4Very high93.6Very high35 Ų3524.5 Ų24.515%0.15413%0.128CC..G310 helixtrans-65.2-12.5175-70.5-55.2000114.5S84 I85 A89 V90 S91 L230 F243 L246S84-F87 WeakPolarHBondContact O-CB 3.41Å; S84-F87 WeakPolarHBondContact O-CD2 3.12Å; S84-F87 PolarHBondContact O-N 3.44Å; I85-F87 PolarHBondContact O-N 3.1Å; I85-F87 VanDerWaalsContact O-N 3.1Å; F87-A89 PolarHBondContact O-N 2.94Å; F87-A89 VanDerWaalsContact O-N 3.11Å; F87-V90 WeakPolarHBondContact O-CB 3.43Å; F87-V90 PolarHBondContact O-N 3.31Å; F87-S91 PolarHBondContact O-N 2.96Å; F87-L230 HydrophobicContact CE2-CB 4.42Å; F87-L230 WeakPolarHBondContact CE2-O 3.32Å; F87-L230 HydrophobicContact CZ-CB 4.21Å; F87-L230 WeakPolarHBondContact CZ-O 3.03Å; F87-F243 AromaticContact CD1-CD2 3.63Å; F87-F243 HydrophobicContact CD1-CD2 3.63Å; F87-F243 AromaticContact CD1-CE2 3.97Å; F87-F243 HydrophobicContact CD1-CE2 3.97Å; F87-F243 HydrophobicContact CD2-CD2 4.27Å; F87-F243 AromaticContact CE1-CD2 3.6Å; F87-F243 HydrophobicContact CE1-CD2 3.6Å; F87-F243 HydrophobicContact CE1-CE2 4.03Å; F87-F243 HydrophobicContact CE2-CB 4.39Å; F87-F243 HydrophobicContact CE2-CD2 4.23Å; F87-F243 AromaticContact CG-CD2 3.99Å; F87-F243 HydrophobicContact CG-CD2 3.99Å; F87-F243 AromaticContact CZ-CD2 3.91Å; F87-F243 HydrophobicContact CZ-CD2 3.91Å; F87-L246 HydrophobicContact CB-CB 3.93Å; F87-L246 HydrophobicContact CB-CD1 4.27Å; F87-L246 HydrophobicContact CD2-CD1 4.46Å
88Y92.6Very high93.8Very high12 Ų1226.6 Ų26.65%0.04714%0.139CC..Hα-helixtrans-56.3-24.1164.3-82.3-57.5000112.9I85 A86 V90 S91 Y92 L246 W254 L523I85-Y88 HydrophobicContact CD1-CD2 4.41Å; I85-Y88 HydrophobicContact CD1-CE2 4.16Å; I85-Y88 HydrophobicContact CG1-CD2 3.54Å; I85-Y88 HydrophobicContact CG1-CE2 3.63Å; I85-Y88 WeakPolarHBondContact O-CD2 3.38Å; I85-Y88 PolarHBondContact O-N 3.02Å; A86-Y88 PolarHBondContact O-N 3.1Å; A86-Y88 VanDerWaalsContact O-N 3.17Å; Y88-V90 PolarHBondContact O-N 2.82Å; Y88-S91 WeakPolarHBondContact O-CB 3.3Å; Y88-S91 PolarHBondContact O-N 3.36Å; Y88-S91 VanDerWaalsContact O-N 3.1Å; Y88-Y92 VanDerWaalsContact O-CD2 3.31Å; Y88-Y92 WeakPolarHBondContact O-CD2 3.32Å; Y88-Y92 VanDerWaalsContact O-CG 3.25Å; Y88-Y92 PolarHBondContact O-N 3.41Å; Y88-L246 HydrophobicContact CD2-CD2 4.1Å; Y88-L246 HydrophobicContact CE1-CD2 4.27Å; Y88-L246 HydrophobicContact CE2-CD2 3.7Å; Y88-W254 AromaticContact CD1-CD1 3.91Å; Y88-W254 AromaticContact CD1-NE1 3.51Å; Y88-W254 AromaticContact CE1-NE1 3.59Å; Y88-L523 HydrophobicContact CE1-CD2 4.47Å; Y88-L523 WeakPolarHBondContact OH-CD2 3.42Å
89A94.8Very high93.9Very high24 Ų2426.6 Ų26.620%0.19814%0.139CC..Hα-helixtrans-54.4-39.4172.400000111.9A86 F87 V93 W289 L292A86-A89 WeakPolarHBondContact O-CB 3.21Å; A86-A89 PolarHBondContact O-N 3.25Å; F87-A89 PolarHBondContact O-N 2.94Å; F87-A89 VanDerWaalsContact O-N 3.11Å; A89-V93 WeakPolarHBondContact O-CG2 3.36Å; A89-V93 PolarHBondContact O-N 3.47Å; A89-W289 PolarHBondContact O-NE1 2.73Å; A89-L292 HydrophobicContact CB-CD2 4.03Å
90V95.4Very high94Very high47 Ų4726.6 Ų26.629%0.28514%0.139SC..Hα-helixtrans-70.1-43.8176.6179.30000110.5F87 Y88 Y92 V93 F94F87-V90 WeakPolarHBondContact O-CB 3.43Å; F87-V90 PolarHBondContact O-N 3.31Å; Y88-V90 PolarHBondContact O-N 2.82Å; V90-Y92 VanDerWaalsContact C-N 3.3Å; V90-Y92 PolarHBondContact O-N 2.85Å; V90-V93 WeakPolarHBondContact O-CB 3.46Å; V90-V93 PolarHBondContact O-N 2.93Å; V90-V93 VanDerWaalsContact O-N 3.12Å; V90-F94 HydrophobicContact CG1-CD2 3.88Å; V90-F94 HydrophobicContact CG1-CE2 3.49Å; V90-F94 VanDerWaalsContact CG1-CE2 3.49Å; V90-F94 WeakPolarHBondContact O-CD2 3.28Å; V90-F94 PolarHBondContact O-N 3.26Å
91S95.4Very high94Very high0 Ų024.9 Ų24.90%013%0.134CC..Hα-helixtrans-56.8-41.3174.3-70.20000113.3F87 Y88 V93 F94 T95 L246 S247 A251F87-S91 PolarHBondContact O-N 2.96Å; Y88-S91 WeakPolarHBondContact O-CB 3.3Å; Y88-S91 PolarHBondContact O-N 3.36Å; Y88-S91 VanDerWaalsContact O-N 3.1Å; S91-V93 VanDerWaalsContact C-N 3.32Å; S91-V93 PolarHBondContact O-N 2.87Å; S91-F94 PolarHBondContact O-N 3.36Å; S91-T95 VanDerWaalsContact O-CB 3.29Å; S91-T95 WeakPolarHBondContact O-CB 3.24Å; S91-T95 PolarHBondContact O-N 3.01Å; S91-T95 PolarHBondContact O-OG1 3.45Å; S91-L246 PolarHBondContact OG-O 3.17Å; S91-S247 VanDerWaalsContact OG-C 3.3Å; S91-S247 WeakPolarHBondContact OG-CA 3.07Å; S91-S247 PolarHBondContact OG-O 3.31Å; S91-A251 PolarHBondContact OG-N 2.87Å
92Y95.7Very high94.2Very high3 Ų324.2 Ų24.21%0.01213%0.134CC..Hα-helixtrans-62.8-39177-62.6-35.9000111.9M66 Y88 V90 T95 M96 W254 L285 L288 W289 L292M66-Y92 HydrophobicContact CE-CE1 4.38Å; M66-Y92 WeakPolarHBondContact CE-OH 3.44Å; Y88-Y92 VanDerWaalsContact O-CD2 3.31Å; Y88-Y92 WeakPolarHBondContact O-CD2 3.32Å; Y88-Y92 VanDerWaalsContact O-CG 3.25Å; Y88-Y92 PolarHBondContact O-N 3.41Å; V90-Y92 VanDerWaalsContact C-N 3.3Å; V90-Y92 PolarHBondContact O-N 2.85Å; Y92-T95 PolarHBondContact O-N 2.97Å; Y92-M96 VanDerWaalsContact O-CG 3.31Å; Y92-M96 WeakPolarHBondContact O-CG 3.37Å; Y92-M96 PolarHBondContact O-N 3.46Å; Y92-W254 HydrophobicContact CD1-CD2 4.18Å; Y92-W254 HydrophobicContact CD1-CG 4.08Å; Y92-W254 AromaticContact CE1-CD1 3.77Å; Y92-W254 AromaticContact CE1-CD2 3.56Å; Y92-W254 HydrophobicContact CE1-CD2 3.56Å; Y92-W254 AromaticContact CE1-CE2 3.37Å; Y92-W254 HydrophobicContact CE1-CE3 4.1Å; Y92-W254 AromaticContact CE1-CG 3.84Å; Y92-W254 HydrophobicContact CE1-CG 3.84Å; Y92-W254 HydrophobicContact CE1-CH2 4.27Å; Y92-W254 AromaticContact CE1-CZ2 3.76Å; Y92-W254 HydrophobicContact CE1-CZ2 3.76Å; Y92-W254 HydrophobicContact CE1-CZ3 4.42Å; Y92-W254 AromaticContact CE1-NE1 3.5Å; Y92-W254 WeakPolarHBondContact OH-CZ2 3.44Å; Y92-L285 VanDerWaalsContact CB-CD1 3.48Å; Y92-L288 HydrophobicContact CD1-CD1 3.98Å; Y92-L288 HydrophobicContact CD2-CB 3.77Å; Y92-L288 HydrophobicContact CD2-CD1 4.42Å; Y92-L288 HydrophobicContact CE1-CD1 4.33Å; Y92-L288 HydrophobicContact CE2-CB 3.88Å; Y92-L288 HydrophobicContact CG-CB 4.23Å; Y92-L288 HydrophobicContact CG-CD1 4.04Å; Y92-W289 AromaticContact CD2-CD1 3.99Å; Y92-L292 HydrophobicContact CD2-CD2 4.44Å; Y92-L292 HydrophobicContact CE2-CB 4.28Å; Y92-L292 HydrophobicContact CE2-CD2 3.88Å
93V96.8Very high94.3Very high43 Ų4324.2 Ų24.226%0.26113%0.132SC..Hα-helixtrans-60.2-53.9176.1175.60000110.6A89 V90 S91 T95 M96 L97 L285 W289A89-V93 WeakPolarHBondContact O-CG2 3.36Å; A89-V93 PolarHBondContact O-N 3.47Å; V90-V93 WeakPolarHBondContact O-CB 3.46Å; V90-V93 PolarHBondContact O-N 2.93Å; V90-V93 VanDerWaalsContact O-N 3.12Å; S91-V93 VanDerWaalsContact C-N 3.32Å; S91-V93 PolarHBondContact O-N 2.87Å; V93-T95 VanDerWaalsContact C-N 3.28Å; V93-T95 PolarHBondContact O-N 3.26Å; V93-M96 PolarHBondContact O-N 3.45Å; V93-L97 HydrophobicContact CG1-CD1 3.75Å; V93-L97 HydrophobicContact CG1-CG 4.37Å; V93-L97 WeakPolarHBondContact O-CB 3.26Å; V93-L97 VanDerWaalsContact O-CG 3.28Å; V93-L97 WeakPolarHBondContact O-CG 3.12Å; V93-L97 PolarHBondContact O-N 3.1Å; V93-L285 HydrophobicContact CG2-CD1 4.32Å; V93-L285 HydrophobicContact CG2-CD2 4.21Å; V93-W289 HydrophobicContact CG2-CH2 4.19Å; V93-W289 HydrophobicContact CG2-CZ2 3.35Å
94F96.1Very high94.3Very high106 Ų10624 Ų2447%0.46513%0.131SC..Hα-helixtrans-59.3-42.7179.4-73-61.8000111.6V90 S91 L97 I98 A251V90-F94 HydrophobicContact CG1-CD2 3.88Å; V90-F94 HydrophobicContact CG1-CE2 3.49Å; V90-F94 VanDerWaalsContact CG1-CE2 3.49Å; V90-F94 WeakPolarHBondContact O-CD2 3.28Å; V90-F94 PolarHBondContact O-N 3.26Å; S91-F94 PolarHBondContact O-N 3.36Å; F94-L97 PolarHBondContact O-N 3.36Å; F94-I98 WeakPolarHBondContact O-CB 3.33Å; F94-I98 WeakPolarHBondContact O-CG1 3.24Å; F94-I98 PolarHBondContact O-N 3.41Å; F94-A251 HydrophobicContact CB-CB 4.2Å
95T95.7Very high94.3Very high0 Ų023.3 Ų23.30%013%0.126CC..Hα-helixtrans-59.8-50.5178.4-62.40000112.2S91 Y92 V93 I98 T99 A251 W254 L255 Y258S91-T95 VanDerWaalsContact O-CB 3.29Å; S91-T95 WeakPolarHBondContact O-CB 3.24Å; S91-T95 PolarHBondContact O-N 3.01Å; S91-T95 PolarHBondContact O-OG1 3.45Å; Y92-T95 PolarHBondContact O-N 2.97Å; V93-T95 VanDerWaalsContact C-N 3.28Å; V93-T95 PolarHBondContact O-N 3.26Å; T95-I98 PolarHBondContact O-N 2.85Å; T95-T99 VanDerWaalsContact O-CB 3.22Å; T95-T99 WeakPolarHBondContact O-CB 3.34Å; T95-T99 PolarHBondContact O-N 3.36Å; T95-T99 PolarHBondContact O-OG1 2.69Å; T95-A251 PolarHBondContact OG1-O 3.32Å; T95-W254 VanDerWaalsContact CG2-C 3.41Å; T95-W254 HydrophobicContact CG2-CB 3.93Å; T95-W254 WeakPolarHBondContact CG2-O 3.06Å; T95-W254 WeakPolarHBondContact OG1-CB 3.32Å; T95-L255 HydrophobicContact CG2-CB 4.48Å; T95-Y258 HydrophobicContact CG2-CD2 4.09Å; T95-Y258 HydrophobicContact CG2-CG 4.3Å
96M95.4Very high94.3Very high0 Ų023.2 Ų23.20%013%0.126CC..Hα-helixtrans-67.1-38.9-178-65.4-51.9133.100111.7Y92 V93 S100 Y258 L281 N284 L285 L288Y92-M96 VanDerWaalsContact O-CG 3.31Å; Y92-M96 WeakPolarHBondContact O-CG 3.37Å; Y92-M96 PolarHBondContact O-N 3.46Å; V93-M96 PolarHBondContact O-N 3.45Å; M96-S100 WeakPolarHBondContact O-CB 3.33Å; M96-S100 PolarHBondContact O-N 3.09Å; M96-Y258 HydrophobicContact CE-CD1 3.73Å; M96-Y258 HydrophobicContact CE-CD2 3.52Å; M96-Y258 HydrophobicContact CE-CE1 3.88Å; M96-Y258 HydrophobicContact CE-CE2 3.64Å; M96-Y258 HydrophobicContact CE-CG 3.55Å; M96-Y258 HydrophobicContact SD-CD1 4.22Å; M96-Y258 HydrophobicContact SD-CG 4.4Å; M96-L281 HydrophobicContact SD-CB 4.23Å; M96-L281 HydrophobicContact SD-CD2 4.17Å; M96-N284 WeakPolarHBondContact CE-ND2 3.43Å; M96-L285 HydrophobicContact CG-CB 4.13Å; M96-L285 HydrophobicContact CG-CD1 4.26Å; M96-L288 HydrophobicContact CE-CD1 3.73Å
97L95.3Very high94.2Very high77 Ų7722 Ų2240%0.40312%0.115SC..Hα-helixtrans-61.6-52.6175.6-72173.7000111.2V93 F94 T99 S100 E101 F282V93-L97 HydrophobicContact CG1-CD1 3.75Å; V93-L97 HydrophobicContact CG1-CG 4.37Å; V93-L97 WeakPolarHBondContact O-CB 3.26Å; V93-L97 VanDerWaalsContact O-CG 3.28Å; V93-L97 WeakPolarHBondContact O-CG 3.12Å; V93-L97 PolarHBondContact O-N 3.1Å; F94-L97 PolarHBondContact O-N 3.36Å; L97-T99 PolarHBondContact O-N 3.17Å; L97-S100 PolarHBondContact O-N 3.23Å; L97-E101 WeakPolarHBondContact O-CB 3.21Å; L97-E101 WeakPolarHBondContact O-CG 3.23Å; L97-E101 PolarHBondContact O-N 3.4Å; L97-F282 HydrophobicContact CD2-CE1 3.9Å; L97-F282 HydrophobicContact CD2-CZ 4.07Å
98I95.6Very high94Very high66 Ų6621 Ų2134%0.33811%0.111SC..Hα-helixtrans-65.2-41.2-179-62.1166.5000110.3F94 T95 S100 E101 V102 F103 L255F94-I98 WeakPolarHBondContact O-CB 3.33Å; F94-I98 WeakPolarHBondContact O-CG1 3.24Å; F94-I98 PolarHBondContact O-N 3.41Å; T95-I98 PolarHBondContact O-N 2.85Å; I98-S100 PolarHBondContact O-N 3.34Å; I98-E101 PolarHBondContact O-N 3.27Å; I98-V102 HydrophobicContact CG2-CB 4.21Å; I98-V102 HydrophobicContact CG2-CG2 3.98Å; I98-V102 WeakPolarHBondContact O-CA 3.32Å; I98-V102 VanDerWaalsContact O-CB 3.25Å; I98-V102 WeakPolarHBondContact O-CB 3.26Å; I98-V102 PolarHBondContact O-N 3.1Å; I98-F103 HydrophobicContact CG2-CD2 4.32Å; I98-F103 HydrophobicContact CG2-CE2 3.96Å; I98-L255 HydrophobicContact CB-CD1 3.9Å; I98-L255 HydrophobicContact CB-CD2 4.38Å; I98-L255 HydrophobicContact CD1-CD2 4.25Å; I98-L255 HydrophobicContact CG2-CD1 3.72Å; I98-L255 HydrophobicContact CG2-CD2 3.78Å; I98-L255 HydrophobicContact CG2-CG 4.42Å
99T96Very high93.7Very high0 Ų025 Ų250%013%0.129CC..Iπ-helixtrans-61.1-47.1177.1-58.30000111.5T95 L97 E101 F103 L104 Y258 Y268 L281T95-T99 VanDerWaalsContact O-CB 3.22Å; T95-T99 WeakPolarHBondContact O-CB 3.34Å; T95-T99 PolarHBondContact O-N 3.36Å; T95-T99 PolarHBondContact O-OG1 2.69Å; L97-T99 PolarHBondContact O-N 3.17Å; T99-E101 VanDerWaalsContact C-N 3.34Å; T99-E101 PolarHBondContact O-N 3.46Å; T99-F103 PolarHBondContact O-N 3.38Å; T99-L104 VanDerWaalsContact O-CB 3.23Å; T99-L104 WeakPolarHBondContact O-CB 3.36Å; T99-L104 PolarHBondContact O-N 3.05Å; T99-Y258 WeakPolarHBondContact CG2-O 3.23Å; T99-Y268 HydrophobicContact CG2-CE1 4.23Å; T99-L281 HydrophobicContact CG2-CD1 3.86Å; T99-L281 HydrophobicContact CG2-CD2 4.25Å
100S94.6Very high93.3Very high0 Ų025.9 Ų25.90%013%0.13CC..Iπ-helixtrans-63.7-36.3179.9172.40000113.4M96 L97 I98 P105M96-S100 WeakPolarHBondContact O-CB 3.33Å; M96-S100 PolarHBondContact O-N 3.09Å; L97-S100 PolarHBondContact O-N 3.23Å; I98-S100 PolarHBondContact O-N 3.34Å; S100-P105 WeakPolarHBondContact O-CD 3.49Å
101E91.4Very high92.7Very high21 Ų2125.2 Ų25.210%0.09813%0.127CC..Iπ-helixtrans-96-30.7-172.4-64.8-54128.900114.1L97 I98 T99 L557 T562 T563L97-E101 WeakPolarHBondContact O-CB 3.21Å; L97-E101 WeakPolarHBondContact O-CG 3.23Å; L97-E101 PolarHBondContact O-N 3.4Å; I98-E101 PolarHBondContact O-N 3.27Å; T99-E101 VanDerWaalsContact C-N 3.34Å; T99-E101 PolarHBondContact O-N 3.46Å; E101-L557 WeakPolarHBondContact O-CD1 3.3Å; E101-T562 VanDerWaalsContact OE2-CA 3.26Å; E101-T562 WeakPolarHBondContact OE2-CA 3.41Å; E101-T562 WeakPolarHBondContact OE2-CB 3.45Å; E101-T563 WeakPolarHBondContact OE1-CB 3.32Å; E101-T563 WeakPolarHBondContact OE1-CG2 3.32Å; E101-T563 PolarHBondContact OE1-OG1 2.86Å; E101-T563 PolarHBondContact OE2-N 3.44Å; E101-T563 PolarHBondContact OE2-OG1 3.36Å; E101-T563 VanDerWaalsContact OE2-OG1 3.13Å
102V92.7Very high92.1Very high23 Ų2325.3 Ų25.314%0.13913%0.127CC..Iπ-helixtrans-104.9-54.3-173.3178.70000111.9I98 I432 L433 L557I98-V102 HydrophobicContact CG2-CB 4.21Å; I98-V102 HydrophobicContact CG2-CG2 3.98Å; I98-V102 WeakPolarHBondContact O-CA 3.32Å; I98-V102 VanDerWaalsContact O-CB 3.25Å; I98-V102 WeakPolarHBondContact O-CB 3.26Å; I98-V102 PolarHBondContact O-N 3.1Å; V102-I432 HydrophobicContact CG1-CG2 3.97Å; V102-L433 HydrophobicContact CG1-CD2 3.92Å; V102-L433 HydrophobicContact CG1-CG 4.41Å; V102-L557 HydrophobicContact CB-CD2 4.36Å; V102-L557 HydrophobicContact CG1-CD2 4.27Å; V102-L557 HydrophobicContact CG2-CD2 4.11Å
103F94.7Very high91.4Very high2 Ų226.1 Ų26.11%0.00913%0.133CC..Iπ-helixtrans-88.9-49.6-169.1-66.2-88.5000112.6I98 T99 P105 V106 F107 L255 G259 I260 L425 F428 I432I98-F103 HydrophobicContact CG2-CD2 4.32Å; I98-F103 HydrophobicContact CG2-CE2 3.96Å; T99-F103 PolarHBondContact O-N 3.38Å; F103-P105 VanDerWaalsContact C-CD 3.47Å; F103-V106 PolarHBondContact O-N 2.87Å; F103-F107 HydrophobicContact CB-CD2 4.36Å; F103-F107 HydrophobicContact CB-CE2 3.99Å; F103-F107 HydrophobicContact CD1-CE2 4.18Å; F103-F107 HydrophobicContact CD1-CZ 4.32Å; F103-F107 WeakPolarHBondContact O-CD2 3.19Å; F103-F107 PolarHBondContact O-N 2.95Å; F103-L255 HydrophobicContact CD2-CD1 4.15Å; F103-L255 HydrophobicContact CE2-CD1 3.81Å; F103-L255 HydrophobicContact CE2-CD2 4.19Å; F103-L255 HydrophobicContact CE2-CG 4.11Å; F103-G259 WeakPolarHBondContact CB-O 3.14Å; F103-I260 HydrophobicContact CD1-CG2 3.72Å; F103-I260 HydrophobicContact CE1-CG2 3.49Å; F103-I260 VanDerWaalsContact CE1-CG2 3.49Å; F103-I260 HydrophobicContact CZ-CG2 4.34Å; F103-L425 HydrophobicContact CE1-CD1 4.23Å; F103-L425 HydrophobicContact CE2-CD1 4.4Å; F103-L425 HydrophobicContact CZ-CD1 3.64Å; F103-F428 HydrophobicContact CE1-CB 4.13Å; F103-I432 HydrophobicContact CD1-CD1 3.55Å; F103-I432 HydrophobicContact CE1-CD1 3.87Å; F103-I432 HydrophobicContact CG-CD1 4.42Å
104L93.5Very high91.1Very high0 Ų024 Ų240%012%0.12CC..Hα-helixtrans-53.1-46.4-177.5170.668.2000113.3T99 V106 F107 Y108 Y268 M274 A277 R278 L281T99-L104 VanDerWaalsContact O-CB 3.23Å; T99-L104 WeakPolarHBondContact O-CB 3.36Å; T99-L104 PolarHBondContact O-N 3.05Å; L104-V106 VanDerWaalsContact C-N 3.3Å; L104-V106 PolarHBondContact O-N 3.17Å; L104-F107 PolarHBondContact O-N 3.49Å; L104-Y108 HydrophobicContact CD1-CD2 4.47Å; L104-Y108 VanDerWaalsContact O-CB 3.23Å; L104-Y108 WeakPolarHBondContact O-CB 3.21Å; L104-Y108 PolarHBondContact O-N 3.41Å; L104-Y268 HydrophobicContact CB-CE2 4.38Å; L104-Y268 HydrophobicContact CD1-CD2 3.25Å; L104-Y268 HydrophobicContact CD1-CE2 3.53Å; L104-Y268 HydrophobicContact CD1-CG 4.17Å; L104-M274 HydrophobicContact CD1-SD 4.4Å; L104-M274 HydrophobicContact CD2-SD 4.21Å; L104-M274 HydrophobicContact CG-SD 3.91Å; L104-A277 HydrophobicContact CD1-CB 3.77Å; L104-A277 HydrophobicContact CD2-CB 4.09Å; L104-R278 HydrophobicContact CD2-CB 4.31Å; L104-R278 HydrophobicContact CD2-CG 3.4Å; L104-R278 VanDerWaalsContact CD2-CG 3.4Å; L104-L281 HydrophobicContact CD2-CD1 3.95Å
105P90.4Very high90.9Very high1 Ų119 Ų191%0.00610%0.098CC..Hα-helixtrans-63.8-36.6-175.1-22.635.5000113S100 F103 K109 M274 D561S100-P105 WeakPolarHBondContact O-CD 3.49Å; F103-P105 VanDerWaalsContact C-CD 3.47Å; P105-K109 WeakPolarHBondContact O-CB 3.28Å; P105-K109 WeakPolarHBondContact O-CD 3.29Å; P105-K109 WeakPolarHBondContact O-CG 3.12Å; P105-K109 PolarHBondContact O-N 2.84Å; P105-M274 HydrophobicContact CB-CE 4.45Å; P105-D561 HydrophobicContact CB-CB 3.95Å
106V91.4Very high90.9Very high1 Ų119.1 Ų19.11%0.00610%0.099CC..Hα-helixtrans-69.3-52.6-179.4179.60000109.8F103 L104 Y108 K109 L110 Y118 I432F103-V106 PolarHBondContact O-N 2.87Å; L104-V106 VanDerWaalsContact C-N 3.3Å; L104-V106 PolarHBondContact O-N 3.17Å; V106-Y108 PolarHBondContact O-N 3.03Å; V106-K109 PolarHBondContact O-N 2.74Å; V106-L110 HydrophobicContact CG1-CD1 3.91Å; V106-L110 WeakPolarHBondContact O-CG 3.47Å; V106-L110 PolarHBondContact O-N 3.04Å; V106-Y118 HydrophobicContact CG1-CD2 4.06Å; V106-Y118 HydrophobicContact CG1-CE2 3.74Å; V106-I432 HydrophobicContact CG2-CG2 4.07Å
107F92.4Very high90.7Very high0 Ų021.8 Ų21.80%011%0.111CC..Hα-helixtrans-65.9-40.5-177.4-60.3-34.5000113.2F103 L104 K109 L110 S111 I112 T115 Y118 G259 V265 I269 F428 I432F103-F107 HydrophobicContact CB-CD2 4.36Å; F103-F107 HydrophobicContact CB-CE2 3.99Å; F103-F107 HydrophobicContact CD1-CE2 4.18Å; F103-F107 HydrophobicContact CD1-CZ 4.32Å; F103-F107 WeakPolarHBondContact O-CD2 3.19Å; F103-F107 PolarHBondContact O-N 2.95Å; L104-F107 PolarHBondContact O-N 3.49Å; F107-K109 PolarHBondContact O-N 3.31Å; F107-L110 PolarHBondContact O-N 3.09Å; F107-S111 PolarHBondContact O-N 2.92Å; F107-I112 HydrophobicContact CB-CD1 4.07Å; F107-I112 HydrophobicContact CB-CG1 4.41Å; F107-I112 HydrophobicContact CD1-CD1 3.47Å; F107-I112 VanDerWaalsContact CD1-CD1 3.47Å; F107-I112 HydrophobicContact CE1-CD1 4.19Å; F107-I112 HydrophobicContact CG-CD1 4.01Å; F107-T115 HydrophobicContact CD1-CG2 4.45Å; F107-T115 HydrophobicContact CD2-CG2 4.28Å; F107-T115 HydrophobicContact CE1-CG2 3.92Å; F107-T115 HydrophobicContact CE2-CG2 3.71Å; F107-T115 HydrophobicContact CZ-CG2 3.51Å; F107-Y118 HydrophobicContact CD1-CG 4.49Å; F107-Y118 HydrophobicContact CE1-CD1 4.14Å; F107-Y118 HydrophobicContact CE1-CD2 4.38Å; F107-Y118 AromaticContact CE1-CG 3.88Å; F107-Y118 HydrophobicContact CE1-CG 3.88Å; F107-G259 WeakPolarHBondContact CE2-O 3.3Å; F107-V265 HydrophobicContact CB-CG1 4.37Å; F107-V265 HydrophobicContact CD2-CG1 3.79Å; F107-V265 HydrophobicContact CD2-CG2 4.41Å; F107-V265 HydrophobicContact CE2-CG1 4.39Å; F107-V265 HydrophobicContact CE2-CG2 4.32Å; F107-V265 HydrophobicContact CG-CG1 4.28Å; F107-I269 HydrophobicContact CB-CG2 4.35Å; F107-F428 HydrophobicContact CE1-CD1 4.2Å; F107-F428 HydrophobicContact CE1-CE1 4.15Å; F107-F428 AromaticContact CZ-CD1 3.81Å; F107-F428 HydrophobicContact CZ-CD1 3.81Å; F107-F428 AromaticContact CZ-CE1 3.95Å; F107-F428 HydrophobicContact CZ-CE1 3.95Å; F107-I432 HydrophobicContact CE1-CD1 4.47Å; F107-I432 HydrophobicContact CZ-CD1 4.24Å
108Y88.3Confident90.7Very high15 Ų1518.1 Ų18.16%0.0599%0.092CC..Hα-helixtrans-66-38.2-179.2-168.8-74.9000111.7L104 V106 S111 C271 K272 S273 M274 A277L104-Y108 HydrophobicContact CD1-CD2 4.47Å; L104-Y108 VanDerWaalsContact O-CB 3.23Å; L104-Y108 WeakPolarHBondContact O-CB 3.21Å; L104-Y108 PolarHBondContact O-N 3.41Å; V106-Y108 PolarHBondContact O-N 3.03Å; Y108-S111 PolarHBondContact O-N 3.06Å; Y108-C271 PolarHBondContact OH-O 2.92Å; Y108-K272 PolarHBondContact OH-O 2.91Å; Y108-S273 VanDerWaalsContact OH-C 3.23Å; Y108-S273 WeakPolarHBondContact OH-CA 3.48Å; Y108-S273 PolarHBondContact OH-N 3.45Å; Y108-M274 HydrophobicContact CD1-CB 4.36Å; Y108-M274 HydrophobicContact CD1-CE 3.6Å; Y108-M274 HydrophobicContact CD1-SD 4.18Å; Y108-M274 HydrophobicContact CD2-SD 4.38Å; Y108-M274 HydrophobicContact CE1-CB 4.31Å; Y108-M274 HydrophobicContact CG-CE 3.72Å; Y108-M274 HydrophobicContact CG-SD 3.88Å; Y108-M274 PolarHBondContact OH-N 3.13Å; Y108-A277 HydrophobicContact CD2-CB 4.15Å; Y108-A277 HydrophobicContact CE2-CB 4.2Å
109K86.8Confident90.7Very high97 Ų9715 Ų1542%0.4228%0.076SC..Hα-helixtrans-68.2-42.1177.5-76.4175.8178.9-167.70113P105 V106 F107 S111 D561P105-K109 WeakPolarHBondContact O-CB 3.28Å; P105-K109 WeakPolarHBondContact O-CD 3.29Å; P105-K109 WeakPolarHBondContact O-CG 3.12Å; P105-K109 PolarHBondContact O-N 2.84Å; V106-K109 PolarHBondContact O-N 2.74Å; F107-K109 PolarHBondContact O-N 3.31Å; K109-S111 PolarHBondContact O-N 3.49Å; K109-D561 IonicContact NZ-OD1 3.75Å; K109-D561 PolarHBondContact NZ-OD1 2.93Å; K109-D561 IonicContact NZ-OD2 3.95Å; K109-D561 PolarHBondContact NZ-OD2 3.37Å
110L86Confident90.7Very high42 Ų4217.8 Ų17.822%0.229%0.089CC..Hα-helixtrans-70.3-12.5-179.5-66.1171.1000112.6V106 F107 I112 Y118 L121 L555V106-L110 HydrophobicContact CG1-CD1 3.91Å; V106-L110 WeakPolarHBondContact O-CG 3.47Å; V106-L110 PolarHBondContact O-N 3.04Å; F107-L110 PolarHBondContact O-N 3.09Å; L110-I112 HydrophobicContact CB-CG2 3.76Å; L110-I112 PolarHBondContact O-N 3.1Å; L110-I112 VanDerWaalsContact O-N 3.11Å; L110-Y118 HydrophobicContact CD1-CD2 3.63Å; L110-Y118 HydrophobicContact CD1-CE2 4.29Å; L110-L121 HydrophobicContact CD2-CD1 4.49Å; L110-L555 HydrophobicContact CD1-CD2 3.95Å; L110-L555 HydrophobicContact CD2-CD2 3.82Å
111S83Confident90.6Very high33 Ų3322.1 Ų22.123%0.23111%0.111CC..THydrogen-bonded Turntrans54.831.5179.1-74.70000113.1R50 F107 Y108 K109R50-S111 PolarHBondContact NH1-OG 3.33Å; R50-S111 PolarHBondContact NH2-O 2.87Å; F107-S111 PolarHBondContact O-N 2.92Å; Y108-S111 PolarHBondContact O-N 3.06Å; K109-S111 PolarHBondContact O-N 3.49Å
112I83Confident90.7Very high1 Ų121.7 Ų21.71%0.00511%0.109CC..  trans-68.3149.2179.760.5-176.2000111.1F107 L110 E117 I269F107-I112 HydrophobicContact CB-CD1 4.07Å; F107-I112 HydrophobicContact CB-CG1 4.41Å; F107-I112 HydrophobicContact CD1-CD1 3.47Å; F107-I112 VanDerWaalsContact CD1-CD1 3.47Å; F107-I112 HydrophobicContact CE1-CD1 4.19Å; F107-I112 HydrophobicContact CG-CD1 4.01Å; L110-I112 HydrophobicContact CB-CG2 3.76Å; L110-I112 PolarHBondContact O-N 3.1Å; L110-I112 VanDerWaalsContact O-N 3.11Å; I112-E117 WeakPolarHBondContact CA-OE2 3.42Å; I112-E117 HydrophobicContact CB-CB 4.23Å; I112-E117 WeakPolarHBondContact CB-OE2 3.17Å; I112-E117 HydrophobicContact CG2-CB 4.03Å; I112-E117 HydrophobicContact CG2-CG 4.05Å; I112-I269 VanDerWaalsContact O-CD1 3.32Å; I112-I269 WeakPolarHBondContact O-CD1 3.09Å
113T80.1Confident90.8Very high20 Ų2021.7 Ų21.712%0.12311%0.107CC..SBendtrans-97.3-38.8172.4-56.10000110.6L46 T47 E117 Q262 E367L46-T113 HydrophobicContact CB-CG2 4.32Å; L46-T113 HydrophobicContact CD1-CG2 4.25Å; T47-T113 HydrophobicContact CG2-CG2 4.06Å; T113-E117 PolarHBondContact N-OE2 3.09Å; T113-Q262 PolarHBondContact O-NE2 3.37Å; T113-E367 HydrophobicContact CG2-CG 3.73Å
114S90.9Very high90.8Very high0 Ų024.3 Ų24.30%012%0.121CC..SBendtrans-100.9133.4169.1175.70000110.1Y116 E117 D368S114-Y116 PolarHBondContact O-N 2.94Å; S114-Y116 PolarHBondContact OG-N 3.4Å; S114-E117 WeakPolarHBondContact O-CB 3.18Å; S114-E117 PolarHBondContact O-N 3.01Å; S114-E117 VanDerWaalsContact O-N 3.12Å; S114-D368 WeakPolarHBondContact CB-OD1 3.34Å; S114-D368 VanDerWaalsContact OG-CG 3.23Å; S114-D368 PolarHBondContact OG-OD1 3.28Å; S114-D368 PolarHBondContact OG-OD2 3Å
115T92.6Very high90.8Very high1 Ų128.5 Ų28.51%0.00614%0.137CC..THydrogen-bonded Turntrans-60.4-28.5174.4-41.50000111.1F107 E117 Y118 Q262 V265 F428F107-T115 HydrophobicContact CD1-CG2 4.45Å; F107-T115 HydrophobicContact CD2-CG2 4.28Å; F107-T115 HydrophobicContact CE1-CG2 3.92Å; F107-T115 HydrophobicContact CE2-CG2 3.71Å; F107-T115 HydrophobicContact CZ-CG2 3.51Å; T115-E117 VanDerWaalsContact C-N 3.32Å; T115-E117 PolarHBondContact O-N 3.42Å; T115-Y118 VanDerWaalsContact O-CB 3.31Å; T115-Y118 WeakPolarHBondContact O-CB 3.19Å; T115-Y118 PolarHBondContact O-N 2.95Å; T115-Q262 PolarHBondContact OG1-OE1 2.73Å; T115-V265 HydrophobicContact CG2-CB 4.42Å; T115-V265 HydrophobicContact CG2-CG1 4.1Å; T115-V265 HydrophobicContact CG2-CG2 4Å; T115-V265 WeakPolarHBondContact OG1-CB 3.45Å; T115-V265 WeakPolarHBondContact OG1-CG1 3.46Å; T115-F428 HydrophobicContact CG2-CE1 3.81Å; T115-F428 HydrophobicContact CG2-CZ 3.91Å; T115-F428 VanDerWaalsContact O-CE1 3.32Å; T115-F428 WeakPolarHBondContact O-CE1 3.41Å
116Y94.5Very high91Very high2 Ų230.6 Ų30.61%0.00815%0.154CC..THydrogen-bonded Turntrans-77.6-16-179.6-54.7-74.2000113.5S114 Y118 L119 E120 R128 G131 T132 F135 V364 F428S114-Y116 PolarHBondContact O-N 2.94Å; S114-Y116 PolarHBondContact OG-N 3.4Å; Y116-Y118 PolarHBondContact O-N 2.71Å; Y116-L119 HydrophobicContact CD1-CD1 3.85Å; Y116-L119 WeakPolarHBondContact O-CB 3.2Å; Y116-L119 PolarHBondContact O-N 2.75Å; Y116-E120 PolarHBondContact O-N 3.49Å; Y116-R128 WeakPolarHBondContact O-CG 3.27Å; Y116-G131 VanDerWaalsContact CD1-C 3.46Å; Y116-G131 WeakPolarHBondContact CE1-O 3.32Å; Y116-T132 WeakPolarHBondContact CB-OG1 3.43Å; Y116-F135 HydrophobicContact CE1-CB 4.25Å; Y116-F135 HydrophobicContact CE2-CB 3.72Å; Y116-F135 AromaticContact CE2-CD1 3.9Å; Y116-F135 HydrophobicContact CE2-CD1 3.9Å; Y116-F135 HydrophobicContact CE2-CD2 4.25Å; Y116-F135 AromaticContact CE2-CG 3.66Å; Y116-F135 HydrophobicContact CE2-CG 3.66Å; Y116-F135 VanDerWaalsContact CZ-CB 3.41Å; Y116-F135 AromaticContact CZ-CG 3.69Å; Y116-F135 WeakPolarHBondContact OH-CB 3.46Å; Y116-F135 WeakPolarHBondContact OH-CD2 3.42Å; Y116-F135 WeakPolarHBondContact OH-CG 3.32Å; Y116-V364 HydrophobicContact CD2-CG1 4.2Å; Y116-V364 HydrophobicContact CD2-CG2 4.09Å; Y116-V364 HydrophobicContact CE2-CG1 4.44Å; Y116-V364 HydrophobicContact CE2-CG2 4.1Å; Y116-F428 HydrophobicContact CD1-CE2 4.1Å; Y116-F428 AromaticContact CD1-CZ 3.87Å; Y116-F428 HydrophobicContact CD1-CZ 3.87Å; Y116-F428 AromaticContact CE1-CE2 3.85Å; Y116-F428 HydrophobicContact CE1-CE2 3.85Å; Y116-F428 AromaticContact CE1-CZ 4Å; Y116-F428 HydrophobicContact CE1-CZ 4Å
117E92.6Very high91.2Very high56 Ų5630.5 Ų30.526%0.26215%0.154SC..Hα-helixtrans-57-37.3170.7-172.1177.9-17900111.1I112 T113 S114 T115 L119 E120 L121I112-E117 WeakPolarHBondContact CA-OE2 3.42Å; I112-E117 HydrophobicContact CB-CB 4.23Å; I112-E117 WeakPolarHBondContact CB-OE2 3.17Å; I112-E117 HydrophobicContact CG2-CB 4.03Å; I112-E117 HydrophobicContact CG2-CG 4.05Å; T113-E117 PolarHBondContact N-OE2 3.09Å; S114-E117 WeakPolarHBondContact O-CB 3.18Å; S114-E117 PolarHBondContact O-N 3.01Å; S114-E117 VanDerWaalsContact O-N 3.12Å; T115-E117 VanDerWaalsContact C-N 3.32Å; T115-E117 PolarHBondContact O-N 3.42Å; E117-L119 PolarHBondContact O-N 3.49Å; E117-E120 PolarHBondContact O-N 2.89Å; E117-E120 VanDerWaalsContact O-N 3.1Å; E117-L121 WeakPolarHBondContact O-CG 3.11Å; E117-L121 PolarHBondContact O-N 3.41Å; E117-L121 VanDerWaalsContact O-N 3.1Å
118Y95.1Very high91.4Very high0 Ų031.4 Ų31.40%016%0.157CC..Hα-helixtrans-53.4-40.5171.9170.7-102.3000112.8V106 F107 L110 T115 Y116 E120 L121 R122 F428 G431 I432 L555V106-Y118 HydrophobicContact CG1-CD2 4.06Å; V106-Y118 HydrophobicContact CG1-CE2 3.74Å; F107-Y118 HydrophobicContact CD1-CG 4.49Å; F107-Y118 HydrophobicContact CE1-CD1 4.14Å; F107-Y118 HydrophobicContact CE1-CD2 4.38Å; F107-Y118 AromaticContact CE1-CG 3.88Å; F107-Y118 HydrophobicContact CE1-CG 3.88Å; L110-Y118 HydrophobicContact CD1-CD2 3.63Å; L110-Y118 HydrophobicContact CD1-CE2 4.29Å; T115-Y118 VanDerWaalsContact O-CB 3.31Å; T115-Y118 WeakPolarHBondContact O-CB 3.19Å; T115-Y118 PolarHBondContact O-N 2.95Å; Y116-Y118 PolarHBondContact O-N 2.71Å; Y118-E120 VanDerWaalsContact C-N 3.31Å; Y118-E120 PolarHBondContact O-N 3.45Å; Y118-L121 PolarHBondContact O-N 2.85Å; Y118-R122 HydrophobicContact CE1-CB 4.24Å; Y118-R122 HydrophobicContact CE1-CG 4.43Å; Y118-R122 HydrophobicContact CE2-CB 4.28Å; Y118-R122 WeakPolarHBondContact O-CB 3.46Å; Y118-R122 PolarHBondContact O-N 2.98Å; Y118-F428 AromaticContact CD1-CD1 3.61Å; Y118-F428 HydrophobicContact CD1-CD1 3.61Å; Y118-F428 AromaticContact CD1-CE1 3.69Å; Y118-F428 HydrophobicContact CD1-CE1 3.69Å; Y118-F428 HydrophobicContact CE1-CD1 4.06Å; Y118-F428 HydrophobicContact CG-CE1 4.45Å; Y118-G431 PolarHBondContact OH-O 3.41Å; Y118-G431 VanDerWaalsContact OH-O 3.13Å; Y118-I432 HydrophobicContact CE1-CD1 4.44Å; Y118-I432 HydrophobicContact CE1-CG1 3.8Å; Y118-I432 HydrophobicContact CE2-CG1 4.3Å; Y118-I432 VanDerWaalsContact OH-CA 3.28Å; Y118-I432 WeakPolarHBondContact OH-CA 3.48Å; Y118-I432 VanDerWaalsContact OH-CG1 3.24Å; Y118-I432 WeakPolarHBondContact OH-CG1 3.24Å; Y118-I432 PolarHBondContact OH-N 3.39Å; Y118-I432 VanDerWaalsContact OH-N 3.09Å; Y118-L555 HydrophobicContact CE2-CB 4.41Å; Y118-L555 HydrophobicContact CE2-CD2 4.5Å; Y118-L555 WeakPolarHBondContact CE2-O 3.24Å; Y118-L555 PolarHBondContact OH-O 3.36Å
119L95.6Very high91.7Very high0 Ų032.6 Ų32.60%017%0.165CC..Hα-helixtrans-68.9-30.5-178.5-61177.4000112.3Y116 E117 F123 N124 T127 L427 F428Y116-L119 HydrophobicContact CD1-CD1 3.85Å; Y116-L119 WeakPolarHBondContact O-CB 3.2Å; Y116-L119 PolarHBondContact O-N 2.75Å; E117-L119 PolarHBondContact O-N 3.49Å; L119-F123 HydrophobicContact CD2-CD2 4.41Å; L119-F123 HydrophobicContact CD2-CE2 4.48Å; L119-F123 WeakPolarHBondContact O-CA 3.42Å; L119-F123 WeakPolarHBondContact O-CB 3.17Å; L119-F123 PolarHBondContact O-N 2.97Å; L119-N124 PolarHBondContact O-N 3.41Å; L119-T127 HydrophobicContact CB-CG2 4.07Å; L119-T127 HydrophobicContact CD1-CG2 4.34Å; L119-T127 HydrophobicContact CD2-CG2 4.48Å; L119-L427 HydrophobicContact CD1-CD2 3.71Å; L119-L427 HydrophobicContact CD1-CG 4.47Å; L119-L427 HydrophobicContact CD2-CD2 4.09Å; L119-L427 HydrophobicContact CD2-CG 3.94Å; L119-F428 HydrophobicContact CD1-CE1 4.44Å; L119-F428 HydrophobicContact CD1-CE2 3.98Å; L119-F428 HydrophobicContact CD1-CZ 3.82Å; L119-F428 HydrophobicContact CD2-CD1 3.99Å; L119-F428 HydrophobicContact CD2-CD2 4.43Å; L119-F428 HydrophobicContact CD2-CE1 3.88Å; L119-F428 HydrophobicContact CD2-CE2 4.32Å; L119-F428 HydrophobicContact CD2-CG 4.28Å; L119-F428 HydrophobicContact CD2-CZ 4.05Å; L119-F428 HydrophobicContact CG-CE1 3.9Å; L119-F428 HydrophobicContact CG-CE2 4.3Å; L119-F428 HydrophobicContact CG-CZ 3.77Å
120E94.6Very high92.1Very high59 Ų5931.3 Ų31.328%0.27616%0.161SC..Hα-helixtrans-72.1-45.7173.5178.4163.2-155.800111.3Y116 E117 Y118 R122 R125 R128Y116-E120 PolarHBondContact O-N 3.49Å; E117-E120 PolarHBondContact O-N 2.89Å; E117-E120 VanDerWaalsContact O-N 3.1Å; Y118-E120 VanDerWaalsContact C-N 3.31Å; Y118-E120 PolarHBondContact O-N 3.45Å; E120-R122 VanDerWaalsContact C-N 3.27Å; E120-R122 PolarHBondContact O-N 3.04Å; E120-R125 HydrophobicContact CG-CB 4.5Å; E120-R125 WeakPolarHBondContact OE1-CB 3.41Å; E120-R128 HydrophobicContact CB-CB 3.8Å; E120-R128 HydrophobicContact CB-CG 4.36Å; E120-R128 WeakPolarHBondContact OE2-CD 3.09Å; E120-R128 IonicContact OE2-CZ 3.54Å; E120-R128 IonicContact OE2-NE 3.65Å; E120-R128 IonicContact OE2-NH1 2.68Å; E120-R128 PolarHBondContact OE2-NH1 2.94Å
121L92.5Very high92.6Very high90 Ų9029.3 Ų29.347%0.47115%0.151SC..Hα-helixtrans-59.9-39.4175.9-64.1174.2000111.5L110 E117 Y118 L555L110-L121 HydrophobicContact CD2-CD1 4.49Å; E117-L121 WeakPolarHBondContact O-CG 3.11Å; E117-L121 PolarHBondContact O-N 3.41Å; E117-L121 VanDerWaalsContact O-N 3.1Å; Y118-L121 PolarHBondContact O-N 2.85Å; L121-L555 HydrophobicContact CB-CD1 4.39Å; L121-L555 HydrophobicContact CB-CD2 3.71Å; L121-L555 HydrophobicContact CD1-CD2 4.3Å; L121-L555 WeakPolarHBondContact O-CD1 3.41Å
122R94.1Very high93.2Very high13 Ų1327.8 Ų27.85%0.04914%0.14CC..Hα-helixtrans-81.7-35.5-177.4-179.858.5-173.485.5-2.8113.9Y118 E120 G431 C434 P435 A437Y118-R122 HydrophobicContact CE1-CB 4.24Å; Y118-R122 HydrophobicContact CE1-CG 4.43Å; Y118-R122 HydrophobicContact CE2-CB 4.28Å; Y118-R122 WeakPolarHBondContact O-CB 3.46Å; Y118-R122 PolarHBondContact O-N 2.98Å; E120-R122 VanDerWaalsContact C-N 3.27Å; E120-R122 PolarHBondContact O-N 3.04Å; R122-G431 PolarHBondContact NE-O 3.34Å; R122-C434 PolarHBondContact NH2-O 3.45Å; R122-P435 PolarHBondContact NH2-O 3.4Å; R122-A437 VanDerWaalsContact CZ-O 3.28Å; R122-A437 PolarHBondContact NH1-O 3.13Å; R122-A437 PolarHBondContact NH2-O 3.19Å
123F94.6Very high93.8Very high22 Ų2232.2 Ų32.210%0.09616%0.162CC..THydrogen-bonded Turntrans-127.4-83.1-171.9-62-64.8000111.7L119 T127 L427 A437 S439 A442L119-F123 HydrophobicContact CD2-CD2 4.41Å; L119-F123 HydrophobicContact CD2-CE2 4.48Å; L119-F123 WeakPolarHBondContact O-CA 3.42Å; L119-F123 WeakPolarHBondContact O-CB 3.17Å; L119-F123 PolarHBondContact O-N 2.97Å; F123-T127 HydrophobicContact CB-CG2 4.28Å; F123-T127 HydrophobicContact CD2-CG2 3.97Å; F123-T127 HydrophobicContact CG-CG2 4.45Å; F123-L427 HydrophobicContact CE2-CD1 4.27Å; F123-A437 HydrophobicContact CE1-CB 3.98Å; F123-A437 HydrophobicContact CZ-CB 4.17Å; F123-S439 VanDerWaalsContact C-OG 3.24Å; F123-S439 WeakPolarHBondContact CA-OG 3.43Å; F123-S439 PolarHBondContact O-OG 3.34Å; F123-A442 HydrophobicContact CD1-CB 3.84Å; F123-A442 HydrophobicContact CD2-CB 3.98Å; F123-A442 HydrophobicContact CE1-CB 3.71Å; F123-A442 HydrophobicContact CE2-CB 3.84Å; F123-A442 HydrophobicContact CG-CB 3.96Å; F123-A442 HydrophobicContact CZ-CB 3.69Å
124N94.4Very high94.6Very high57 Ų5733 Ų3331%0.30517%0.165SC..  trans-170170.3178.261.814.1000110.9L119 A126 T127 R128 S439L119-N124 PolarHBondContact O-N 3.41Å; N124-A126 VanDerWaalsContact C-N 3.27Å; N124-A126 PolarHBondContact O-N 3.35Å; N124-A126 PolarHBondContact OD1-N 2.72Å; N124-T127 PolarHBondContact O-N 3.01Å; N124-T127 VanDerWaalsContact O-N 3.11Å; N124-T127 WeakPolarHBondContact OD1-CB 3.28Å; N124-T127 PolarHBondContact OD1-N 2.66Å; N124-T127 PolarHBondContact OD1-OG1 2.76Å; N124-R128 PolarHBondContact O-N 2.93Å; N124-S439 WeakPolarHBondContact ND2-CB 3.38Å
125R94.1Very high94.8Very high88 Ų8833.1 Ų33.133%0.33217%0.165SC..Hα-helixtrans-57-35.6177.5-166.5170.8-173.9154.85.6114.1E120 T127 R128 L129 P372 Y373E120-R125 HydrophobicContact CG-CB 4.5Å; E120-R125 WeakPolarHBondContact OE1-CB 3.41Å; R125-T127 VanDerWaalsContact C-N 3.32Å; R125-T127 PolarHBondContact O-N 2.85Å; R125-R128 PolarHBondContact O-N 2.88Å; R125-L129 HydrophobicContact CG-CD1 4.29Å; R125-L129 HydrophobicContact CG-CG 4.44Å; R125-L129 WeakPolarHBondContact O-CG 3.48Å; R125-L129 PolarHBondContact O-N 2.9Å; R125-P372 VanDerWaalsContact NH2-CB 3.29Å; R125-Y373 PolarHBondContact NE-OH 3.34Å; R125-Y373 PolarHBondContact NH2-OH 3.08Å
126A95.5Very high95Very high45 Ų4533.8 Ų33.837%0.37217%0.169SC..Hα-helixtrans-61.3-42.4177.200000111.4N124 L129 M130 L443N124-A126 VanDerWaalsContact C-N 3.27Å; N124-A126 PolarHBondContact O-N 3.35Å; N124-A126 PolarHBondContact OD1-N 2.72Å; A126-L129 PolarHBondContact O-N 3.26Å; A126-M130 VanDerWaalsContact O-CG 3.28Å; A126-M130 WeakPolarHBondContact O-CG 3.35Å; A126-M130 PolarHBondContact O-N 3.5Å; A126-L443 HydrophobicContact CB-CD1 4.41Å
127T95.1Very high95Very high0 Ų037.3 Ų37.30%019%0.19CC..Hα-helixtrans-65.6-40.6178.4-49.90000111.5L119 F123 N124 R125 G131 L427L119-T127 HydrophobicContact CB-CG2 4.07Å; L119-T127 HydrophobicContact CD1-CG2 4.34Å; L119-T127 HydrophobicContact CD2-CG2 4.48Å; F123-T127 HydrophobicContact CB-CG2 4.28Å; F123-T127 HydrophobicContact CD2-CG2 3.97Å; F123-T127 HydrophobicContact CG-CG2 4.45Å; N124-T127 PolarHBondContact O-N 3.01Å; N124-T127 VanDerWaalsContact O-N 3.11Å; N124-T127 WeakPolarHBondContact OD1-CB 3.28Å; N124-T127 PolarHBondContact OD1-N 2.66Å; N124-T127 PolarHBondContact OD1-OG1 2.76Å; R125-T127 VanDerWaalsContact C-N 3.32Å; R125-T127 PolarHBondContact O-N 2.85Å; T127-G131 PolarHBondContact O-N 3.4Å; T127-L427 HydrophobicContact CG2-CD1 3.88Å; T127-L427 HydrophobicContact CG2-CD2 3.97Å; T127-L427 HydrophobicContact CG2-CG 4.4Å
128R95.3Very high95.1Very high18 Ų1834.9 Ų34.97%0.06818%0.179CC..Hα-helixtrans-57.7-55.8171.8174177.4-171.9179.24.4111.4Y116 E120 N124 R125 M130 G131 T132 E367 D368Y116-R128 WeakPolarHBondContact O-CG 3.27Å; E120-R128 HydrophobicContact CB-CB 3.8Å; E120-R128 HydrophobicContact CB-CG 4.36Å; E120-R128 WeakPolarHBondContact OE2-CD 3.09Å; E120-R128 IonicContact OE2-CZ 3.54Å; E120-R128 IonicContact OE2-NE 3.65Å; E120-R128 IonicContact OE2-NH1 2.68Å; E120-R128 PolarHBondContact OE2-NH1 2.94Å; N124-R128 PolarHBondContact O-N 2.93Å; R125-R128 PolarHBondContact O-N 2.88Å; R128-M130 VanDerWaalsContact C-N 3.33Å; R128-M130 PolarHBondContact O-N 3.02Å; R128-G131 PolarHBondContact O-N 3.01Å; R128-T132 WeakPolarHBondContact O-CB 3.31Å; R128-T132 PolarHBondContact O-N 3.12Å; R128-T132 PolarHBondContact O-OG1 3.19Å; R128-E367 PolarHBondContact NH2-O 3.38Å; R128-D368 IonicContact CZ-OD1 3.17Å; R128-D368 IonicContact NE-OD1 2.85Å; R128-D368 PolarHBondContact NE-OD1 2.83Å; R128-D368 IonicContact NH2-OD1 3.72Å; R128-D368 PolarHBondContact NH2-OD1 3.18Å
129L95.6Very high95.1Very high41 Ų4135.1 Ų35.122%0.21518%0.18CC..Hα-helixtrans-61.1-38.8-176.9-68.3176.4000112.8R125 A126 M133R125-L129 HydrophobicContact CG-CD1 4.29Å; R125-L129 HydrophobicContact CG-CG 4.44Å; R125-L129 WeakPolarHBondContact O-CG 3.48Å; R125-L129 PolarHBondContact O-N 2.9Å; A126-L129 PolarHBondContact O-N 3.26Å; L129-M133 WeakPolarHBondContact O-CB 3.47Å; L129-M133 VanDerWaalsContact O-CG 3.27Å; L129-M133 WeakPolarHBondContact O-CG 3.42Å; L129-M133 PolarHBondContact O-N 3.42Å
130M95.9Very high95Very high70 Ų7036 Ų3635%0.34519%0.185SC..Hα-helixtrans-66.4-44175.5-67.2-59.290.100112.2A126 R128 M133 L134 L443 L446 F447A126-M130 VanDerWaalsContact O-CG 3.28Å; A126-M130 WeakPolarHBondContact O-CG 3.35Å; A126-M130 PolarHBondContact O-N 3.5Å; R128-M130 VanDerWaalsContact C-N 3.33Å; R128-M130 PolarHBondContact O-N 3.02Å; M130-M133 PolarHBondContact O-N 3.43Å; M130-L134 WeakPolarHBondContact O-CG 3.45Å; M130-L134 PolarHBondContact O-N 3.14Å; M130-L443 HydrophobicContact CG-CD2 4.23Å; M130-L446 HydrophobicContact CB-CD2 4.14Å; M130-F447 HydrophobicContact SD-CZ 4.27Å
131G95.8Very high94.9Very high0 Ų035.9 Ų35.90%019%0.186CC..Hα-helixtrans-59.6-46.7174.400000112.3Y116 T127 R128 L134 F135Y116-G131 VanDerWaalsContact CD1-C 3.46Å; Y116-G131 WeakPolarHBondContact CE1-O 3.32Å; T127-G131 PolarHBondContact O-N 3.4Å; R128-G131 PolarHBondContact O-N 3.01Å; G131-L134 PolarHBondContact O-N 3.49Å; G131-F135 WeakPolarHBondContact O-CB 3.46Å; G131-F135 PolarHBondContact O-N 3.48Å
132T96.1Very high94.8Very high0 Ų032.1 Ų32.10%017%0.166CC..Hα-helixtrans-58.6-47176.5-61.10000112.1Y116 R128 F135 I136 V364 D368 I369Y116-T132 WeakPolarHBondContact CB-OG1 3.43Å; R128-T132 WeakPolarHBondContact O-CB 3.31Å; R128-T132 PolarHBondContact O-N 3.12Å; R128-T132 PolarHBondContact O-OG1 3.19Å; T132-F135 WeakPolarHBondContact O-CB 3.35Å; T132-F135 PolarHBondContact O-N 3.47Å; T132-I136 HydrophobicContact CG2-CD1 3.8Å; T132-I136 HydrophobicContact CG2-CG1 4.48Å; T132-I136 VanDerWaalsContact O-CG1 3.3Å; T132-I136 WeakPolarHBondContact O-CG1 3.46Å; T132-I136 PolarHBondContact O-N 2.93Å; T132-V364 HydrophobicContact CG2-CG1 3.39Å; T132-D368 HydrophobicContact CG2-CB 4.02Å; T132-D368 PolarHBondContact OG1-OD2 3.2Å; T132-I369 HydrophobicContact CG2-CD1 4.17Å; T132-I369 HydrophobicContact CG2-CG1 4.35Å
133M96Very high94.7Very high95 Ų9531.5 Ų31.547%0.46816%0.163SC..Hα-helixtrans-65.6-43.4-179.5-73.9-64.4177.500112.4L129 M130 F135 I136 V137 I369L129-M133 WeakPolarHBondContact O-CB 3.47Å; L129-M133 VanDerWaalsContact O-CG 3.27Å; L129-M133 WeakPolarHBondContact O-CG 3.42Å; L129-M133 PolarHBondContact O-N 3.42Å; M130-M133 PolarHBondContact O-N 3.43Å; M133-F135 VanDerWaalsContact C-N 3.3Å; M133-F135 PolarHBondContact O-N 2.8Å; M133-I136 PolarHBondContact O-N 3.36Å; M133-V137 WeakPolarHBondContact O-CG2 3.4Å; M133-V137 PolarHBondContact O-N 3.3Å; M133-I369 HydrophobicContact CE-CD1 4.05Å
134L96Very high94.6Very high37 Ų3730.5 Ų30.519%0.19416%0.159CC..Hα-helixtrans-61.4-41.1176.1-72.1175.1000111.5M130 G131 Q138 I420 L424 L446 M450M130-L134 WeakPolarHBondContact O-CG 3.45Å; M130-L134 PolarHBondContact O-N 3.14Å; G131-L134 PolarHBondContact O-N 3.49Å; L134-Q138 WeakPolarHBondContact O-CB 3.45Å; L134-Q138 PolarHBondContact O-N 3.35Å; L134-I420 HydrophobicContact CB-CG2 4.08Å; L134-I420 HydrophobicContact CD2-CG2 4.38Å; L134-L424 HydrophobicContact CB-CD1 4.1Å; L134-L424 HydrophobicContact CB-CD2 4.22Å; L134-L424 HydrophobicContact CB-CG 4.43Å; L134-L424 HydrophobicContact CD1-CD2 3.99Å; L134-L424 HydrophobicContact CD1-CG 4.4Å; L134-L446 HydrophobicContact CD1-CD1 3.8Å; L134-L446 HydrophobicContact CD1-CD2 3.92Å; L134-L446 HydrophobicContact CD1-CG 4.09Å; L134-M450 HydrophobicContact CD2-CE 3.84Å; L134-M450 HydrophobicContact CD2-SD 4.32Å
135F96.1Very high94.4Very high1 Ų128 Ų280%0.00415%0.145CC..Hα-helixtrans-62.4-45.2174.4170.1-100.9000113.2Y116 G131 T132 M133 Q138 T139 Q262 A360 L361 V364Y116-F135 HydrophobicContact CE1-CB 4.25Å; Y116-F135 HydrophobicContact CE2-CB 3.72Å; Y116-F135 AromaticContact CE2-CD1 3.9Å; Y116-F135 HydrophobicContact CE2-CD1 3.9Å; Y116-F135 HydrophobicContact CE2-CD2 4.25Å; Y116-F135 AromaticContact CE2-CG 3.66Å; Y116-F135 HydrophobicContact CE2-CG 3.66Å; Y116-F135 VanDerWaalsContact CZ-CB 3.41Å; Y116-F135 AromaticContact CZ-CG 3.69Å; Y116-F135 WeakPolarHBondContact OH-CB 3.46Å; Y116-F135 WeakPolarHBondContact OH-CD2 3.42Å; Y116-F135 WeakPolarHBondContact OH-CG 3.32Å; G131-F135 WeakPolarHBondContact O-CB 3.46Å; G131-F135 PolarHBondContact O-N 3.48Å; T132-F135 WeakPolarHBondContact O-CB 3.35Å; T132-F135 PolarHBondContact O-N 3.47Å; M133-F135 VanDerWaalsContact C-N 3.3Å; M133-F135 PolarHBondContact O-N 2.8Å; F135-Q138 PolarHBondContact O-N 3.44Å; F135-T139 WeakPolarHBondContact CD2-OG1 3.38Å; F135-T139 WeakPolarHBondContact CE2-OG1 3.32Å; F135-T139 HydrophobicContact CZ-CG2 4.42Å; F135-T139 WeakPolarHBondContact CZ-OG1 2.97Å; F135-T139 WeakPolarHBondContact O-CB 3.42Å; F135-T139 PolarHBondContact O-N 3.41Å; F135-T139 PolarHBondContact O-OG1 2.85Å; F135-Q262 HydrophobicContact CE1-CB 4.09Å; F135-Q262 HydrophobicContact CE2-CB 3.85Å; F135-Q262 HydrophobicContact CZ-CB 3.59Å; F135-Q262 HydrophobicContact CZ-CG 4.41Å; F135-A360 HydrophobicContact CZ-CB 3.88Å; F135-L361 HydrophobicContact CE1-CD2 4.2Å; F135-V364 HydrophobicContact CD1-CB 4.34Å; F135-V364 HydrophobicContact CD1-CG1 4.02Å; F135-V364 HydrophobicContact CD1-CG2 4.19Å; F135-V364 HydrophobicContact CE1-CB 4.17Å; F135-V364 HydrophobicContact CE1-CG1 4.34Å; F135-V364 HydrophobicContact CE1-CG2 3.93Å
136I96.5Very high94.2Very high15 Ų1523.8 Ų23.88%0.07713%0.129CC..Hα-helixtrans-59-50.9178.6-72.9167.9000109.5T132 M133 T139 I140 L361 I369 Y392T132-I136 HydrophobicContact CG2-CD1 3.8Å; T132-I136 HydrophobicContact CG2-CG1 4.48Å; T132-I136 VanDerWaalsContact O-CG1 3.3Å; T132-I136 WeakPolarHBondContact O-CG1 3.46Å; T132-I136 PolarHBondContact O-N 2.93Å; M133-I136 PolarHBondContact O-N 3.36Å; I136-T139 PolarHBondContact O-N 3.18Å; I136-I140 HydrophobicContact CG2-CD1 3.51Å; I136-I140 HydrophobicContact CG2-CG1 4.45Å; I136-I140 VanDerWaalsContact O-CB 3.3Å; I136-I140 WeakPolarHBondContact O-CB 3.32Å; I136-I140 WeakPolarHBondContact O-CD1 3.45Å; I136-I140 WeakPolarHBondContact O-CG1 3.17Å; I136-I140 PolarHBondContact O-N 3.15Å; I136-L361 HydrophobicContact CB-CD2 4.1Å; I136-L361 HydrophobicContact CG1-CD2 3.93Å; I136-L361 HydrophobicContact CG2-CD2 4.12Å; I136-I369 HydrophobicContact CD1-CD1 4.03Å; I136-Y392 HydrophobicContact CG2-CE1 4.19Å
137V94.8Very high94.1Very high76 Ų7621.7 Ų21.746%0.46111%0.112SC..Hα-helixtrans-60.9-49.8179172.10000111.5M133 T139 I140 L141M133-V137 WeakPolarHBondContact O-CG2 3.4Å; M133-V137 PolarHBondContact O-N 3.3Å; V137-T139 VanDerWaalsContact C-N 3.33Å; V137-T139 PolarHBondContact O-N 3.4Å; V137-I140 PolarHBondContact O-N 3.08Å; V137-L141 HydrophobicContact CG1-CD1 3.79Å; V137-L141 HydrophobicContact CG1-CG 4.48Å; V137-L141 WeakPolarHBondContact O-CB 3.32Å; V137-L141 VanDerWaalsContact O-CG 3.29Å; V137-L141 WeakPolarHBondContact O-CG 3.47Å; V137-L141 PolarHBondContact O-N 3.42Å
138Q94.1Very high93.8Very high5 Ų522.4 Ų22.42%0.02312%0.115CC..Hα-helixtrans-57.1-47.3179.2-178.2-175-20.600111.8L134 F135 L141 Y142 I416 I420L134-Q138 WeakPolarHBondContact O-CB 3.45Å; L134-Q138 PolarHBondContact O-N 3.35Å; F135-Q138 PolarHBondContact O-N 3.44Å; Q138-L141 PolarHBondContact O-N 3.01Å; Q138-Y142 WeakPolarHBondContact O-CB 3.3Å; Q138-Y142 PolarHBondContact O-N 3.29Å; Q138-I416 HydrophobicContact CG-CG2 3.78Å; Q138-I420 HydrophobicContact CB-CB 4.19Å; Q138-I420 HydrophobicContact CB-CD1 3.93Å; Q138-I420 HydrophobicContact CB-CG2 3.99Å; Q138-I420 HydrophobicContact CG-CB 4.07Å; Q138-I420 HydrophobicContact CG-CD1 4.3Å; Q138-I420 HydrophobicContact CG-CG2 4.34Å
139T94.3Very high93.4Very high5 Ų522.1 Ų22.13%0.03112%0.116CC..Hα-helixtrans-68.8-44.6-175.4-57.20000110.6F135 I136 V137 L141 Y142 T143 L361F135-T139 WeakPolarHBondContact CD2-OG1 3.38Å; F135-T139 WeakPolarHBondContact CE2-OG1 3.32Å; F135-T139 HydrophobicContact CZ-CG2 4.42Å; F135-T139 WeakPolarHBondContact CZ-OG1 2.97Å; F135-T139 WeakPolarHBondContact O-CB 3.42Å; F135-T139 PolarHBondContact O-N 3.41Å; F135-T139 PolarHBondContact O-OG1 2.85Å; I136-T139 PolarHBondContact O-N 3.18Å; V137-T139 VanDerWaalsContact C-N 3.33Å; V137-T139 PolarHBondContact O-N 3.4Å; T139-L141 PolarHBondContact O-N 2.7Å; T139-Y142 PolarHBondContact O-N 2.94Å; T139-T143 WeakPolarHBondContact O-CB 3.45Å; T139-T143 PolarHBondContact O-N 2.85Å; T139-T143 PolarHBondContact O-OG1 2.99Å; T139-L361 HydrophobicContact CG2-CD1 3.9Å; T139-L361 HydrophobicContact CG2-CD2 4.18Å; T139-L361 HydrophobicContact CG2-CG 3.84Å
140I94.2Very high93.1Very high18 Ų1820.1 Ų20.19%0.09211%0.106CC..Hα-helixtrans-56.9-48175.6-76169.8000111.7I136 V137 T143 G144 L361 Y392 L395 M399I136-I140 HydrophobicContact CG2-CD1 3.51Å; I136-I140 HydrophobicContact CG2-CG1 4.45Å; I136-I140 VanDerWaalsContact O-CB 3.3Å; I136-I140 WeakPolarHBondContact O-CB 3.32Å; I136-I140 WeakPolarHBondContact O-CD1 3.45Å; I136-I140 WeakPolarHBondContact O-CG1 3.17Å; I136-I140 PolarHBondContact O-N 3.15Å; V137-I140 PolarHBondContact O-N 3.08Å; I140-T143 PolarHBondContact O-N 3.37Å; I140-G144 PolarHBondContact O-N 2.94Å; I140-G144 VanDerWaalsContact O-N 3.08Å; I140-L361 HydrophobicContact CG1-CD1 4.04Å; I140-L361 HydrophobicContact CG1-CD2 4.35Å; I140-Y392 HydrophobicContact CD1-CD1 4.15Å; I140-Y392 HydrophobicContact CD1-CE1 3.93Å; I140-Y392 HydrophobicContact CG1-CD1 4.38Å; I140-L395 HydrophobicContact CB-CD2 4.19Å; I140-L395 HydrophobicContact CD1-CD1 4.3Å; I140-L395 HydrophobicContact CD1-CD2 3.69Å; I140-L395 HydrophobicContact CG1-CD2 3.87Å; I140-L395 HydrophobicContact CG2-CD2 3.24Å; I140-M399 HydrophobicContact CG2-CG 3.39Å; I140-M399 HydrophobicContact CG2-SD 4.04Å
141L91.9Very high92.7Very high57 Ų5716.8 Ų16.830%0.2989%0.089SC..Hα-helixtrans-60.5-49.1178.4-72.8166.7000111.1V137 Q138 T139 G144 I145 M399 I416V137-L141 HydrophobicContact CG1-CD1 3.79Å; V137-L141 HydrophobicContact CG1-CG 4.48Å; V137-L141 WeakPolarHBondContact O-CB 3.32Å; V137-L141 VanDerWaalsContact O-CG 3.29Å; V137-L141 WeakPolarHBondContact O-CG 3.47Å; V137-L141 PolarHBondContact O-N 3.42Å; Q138-L141 PolarHBondContact O-N 3.01Å; T139-L141 PolarHBondContact O-N 2.7Å; L141-G144 PolarHBondContact O-N 3.19Å; L141-I145 WeakPolarHBondContact O-CG1 3.34Å; L141-I145 PolarHBondContact O-N 3.4Å; L141-M399 HydrophobicContact CD2-CE 3.6Å; L141-I416 HydrophobicContact CB-CD1 4.1Å
142Y91.5Very high92.2Very high12 Ų1219.1 Ų19.15%0.04710%0.102CC..Hα-helixtrans-63.8-45.5179.8173.9-111.7000112.5F65 S67 I69 Q138 T139 G144 I145 V146 T353 A413 F417F65-Y142 AromaticContact CD1-CE1 3.74Å; F65-Y142 HydrophobicContact CD1-CE1 3.74Å; F65-Y142 HydrophobicContact CE1-CD1 4.1Å; F65-Y142 AromaticContact CE1-CE1 3.48Å; F65-Y142 HydrophobicContact CE1-CE1 3.48Å; F65-Y142 VanDerWaalsContact CE1-CE1 3.48Å; S67-Y142 PolarHBondContact OG-OH 2.85Å; I69-Y142 HydrophobicContact CD1-CE2 4.38Å; Q138-Y142 WeakPolarHBondContact O-CB 3.3Å; Q138-Y142 PolarHBondContact O-N 3.29Å; T139-Y142 PolarHBondContact O-N 2.94Å; Y142-G144 VanDerWaalsContact C-N 3.32Å; Y142-G144 PolarHBondContact O-N 3.05Å; Y142-I145 WeakPolarHBondContact O-CB 3.41Å; Y142-I145 PolarHBondContact O-N 2.92Å; Y142-V146 HydrophobicContact CD1-CG2 4.15Å; Y142-V146 HydrophobicContact CD2-CG2 4.04Å; Y142-V146 HydrophobicContact CE1-CG2 3.7Å; Y142-V146 HydrophobicContact CE2-CG2 3.56Å; Y142-V146 HydrophobicContact CG-CG2 4.32Å; Y142-V146 WeakPolarHBondContact O-CG2 3.36Å; Y142-V146 PolarHBondContact O-N 3.36Å; Y142-T353 HydrophobicContact CD1-CG2 4.39Å; Y142-T353 HydrophobicContact CE1-CG2 3.38Å; Y142-A413 HydrophobicContact CD2-CB 4.15Å; Y142-A413 HydrophobicContact CE2-CB 4.12Å; Y142-F417 AromaticContact CD1-CE2 3.75Å; Y142-F417 HydrophobicContact CD1-CE2 3.75Å; Y142-F417 AromaticContact CD1-CZ 3.93Å; Y142-F417 HydrophobicContact CD1-CZ 3.93Å; Y142-F417 HydrophobicContact CD2-CD2 4.2Å; Y142-F417 AromaticContact CD2-CE2 3.52Å; Y142-F417 HydrophobicContact CD2-CE2 3.52Å; Y142-F417 HydrophobicContact CD2-CZ 4.47Å; Y142-F417 AromaticContact CE1-CE2 3.88Å; Y142-F417 HydrophobicContact CE1-CE2 3.88Å; Y142-F417 HydrophobicContact CE1-CZ 4.16Å; Y142-F417 HydrophobicContact CE2-CD2 4.37Å; Y142-F417 AromaticContact CE2-CE2 3.67Å; Y142-F417 HydrophobicContact CE2-CE2 3.67Å; Y142-F417 AromaticContact CG-CE2 3.55Å; Y142-F417 HydrophobicContact CG-CE2 3.55Å; Y142-F417 HydrophobicContact CG-CZ 4.08Å; Y142-F417 AromaticContact CZ-CE2 3.84Å
143T92.1Very high91.6Very high0 Ų019.3 Ų19.30%010%0.103CC..Hα-helixtrans-62.5-38.9-179.5-550000111.8T139 I140 I145 V146 I147 V354 S357 C396T139-T143 WeakPolarHBondContact O-CB 3.45Å; T139-T143 PolarHBondContact O-N 2.85Å; T139-T143 PolarHBondContact O-OG1 2.99Å; I140-T143 PolarHBondContact O-N 3.37Å; T143-I145 VanDerWaalsContact C-N 3.34Å; T143-I145 PolarHBondContact O-N 3.42Å; T143-V146 PolarHBondContact O-N 3.45Å; T143-I147 HydrophobicContact CG2-CD1 4.2Å; T143-I147 WeakPolarHBondContact O-CG1 3.47Å; T143-I147 PolarHBondContact O-N 3.07Å; T143-V354 HydrophobicContact CG2-CB 4.07Å; T143-V354 HydrophobicContact CG2-CG1 3.79Å; T143-V354 HydrophobicContact CG2-CG2 3.81Å; T143-S357 WeakPolarHBondContact OG1-CB 3.35Å; T143-S357 PolarHBondContact OG1-OG 2.82Å; T143-C396 HydrophobicContact CG2-CB 3.77Å; T143-C396 VanDerWaalsContact CG2-SG 3.59Å
144G91.6Very high90.9Very high0 Ų014.8 Ų14.80%08%0.081CC..Hα-helixtrans-58.5-45.8173.900000112.3I140 L141 Y142 V146 I147 Y148 A400I140-G144 PolarHBondContact O-N 2.94Å; I140-G144 VanDerWaalsContact O-N 3.08Å; L141-G144 PolarHBondContact O-N 3.19Å; Y142-G144 VanDerWaalsContact C-N 3.32Å; Y142-G144 PolarHBondContact O-N 3.05Å; G144-V146 VanDerWaalsContact C-N 3.35Å; G144-V146 PolarHBondContact O-N 3.09Å; G144-I147 PolarHBondContact O-N 3.2Å; G144-Y148 PolarHBondContact O-N 3.36Å; G144-Y148 VanDerWaalsContact O-N 3.1Å; G144-A400 WeakPolarHBondContact O-CA 3.46Å; G144-A400 WeakPolarHBondContact O-CB 3.1Å
145I89.8Confident90.2Very high4 Ų414.5 Ų14.52%0.0218%0.08CC..Hα-helixtrans-61.9-42.7176.5-64.3172.9000111.1I69 L141 Y142 T143 I147 Y148 A149 A403 M406 I409 A412 A413 I416I69-I145 HydrophobicContact CD1-CG2 4.4Å; L141-I145 WeakPolarHBondContact O-CG1 3.34Å; L141-I145 PolarHBondContact O-N 3.4Å; Y142-I145 WeakPolarHBondContact O-CB 3.41Å; Y142-I145 PolarHBondContact O-N 2.92Å; T143-I145 VanDerWaalsContact C-N 3.34Å; T143-I145 PolarHBondContact O-N 3.42Å; I145-I147 VanDerWaalsContact C-N 3.32Å; I145-I147 PolarHBondContact O-N 2.91Å; I145-Y148 PolarHBondContact O-N 3.2Å; I145-A149 VanDerWaalsContact O-CB 3.26Å; I145-A149 WeakPolarHBondContact O-CB 3.48Å; I145-A149 PolarHBondContact O-N 3.5Å; I145-A403 HydrophobicContact CG1-CB 4.08Å; I145-M406 HydrophobicContact CD1-CE 4.25Å; I145-M406 HydrophobicContact CD1-SD 4.48Å; I145-I409 HydrophobicContact CG2-CG2 3.42Å; I145-I409 VanDerWaalsContact CG2-CG2 3.42Å; I145-A412 HydrophobicContact CD1-CB 4.38Å; I145-A413 HydrophobicContact CG2-CB 3.99Å; I145-I416 HydrophobicContact CD1-CD1 3.4Å
146V91.1Very high88.5Confident0 Ų021.2 Ų21.20%011%0.111CC..Hα-helixtrans-65.3-32.4179.9171.30000113I69 Y142 T143 G144 P150 S350 T353 V354I69-V146 HydrophobicContact CD1-CG2 4.03Å; Y142-V146 HydrophobicContact CD1-CG2 4.15Å; Y142-V146 HydrophobicContact CD2-CG2 4.04Å; Y142-V146 HydrophobicContact CE1-CG2 3.7Å; Y142-V146 HydrophobicContact CE2-CG2 3.56Å; Y142-V146 HydrophobicContact CG-CG2 4.32Å; Y142-V146 WeakPolarHBondContact O-CG2 3.36Å; Y142-V146 PolarHBondContact O-N 3.36Å; T143-V146 PolarHBondContact O-N 3.45Å; G144-V146 VanDerWaalsContact C-N 3.35Å; G144-V146 PolarHBondContact O-N 3.09Å; V146-P150 WeakPolarHBondContact O-CD 3.35Å; V146-S350 WeakPolarHBondContact O-CB 3.38Å; V146-S350 PolarHBondContact O-OG 3.45Å; V146-T353 HydrophobicContact CB-CG2 4.48Å; V146-T353 HydrophobicContact CG1-CG2 3.94Å; V146-T353 HydrophobicContact CG2-CG2 4.01Å; V146-V354 HydrophobicContact CG1-CG2 4.02Å
147I91.7Very high86.7Confident1 Ų124 Ų241%0.00514%0.137CC..Hα-helixtrans-71.6-41.9174-66.9168.6000110.2T143 G144 I145 V167 V354 C396 A400T143-I147 HydrophobicContact CG2-CD1 4.2Å; T143-I147 WeakPolarHBondContact O-CG1 3.47Å; T143-I147 PolarHBondContact O-N 3.07Å; G144-I147 PolarHBondContact O-N 3.2Å; I145-I147 VanDerWaalsContact C-N 3.32Å; I145-I147 PolarHBondContact O-N 2.91Å; I147-V167 HydrophobicContact CG2-CB 4.47Å; I147-V167 HydrophobicContact CG2-CG1 3.88Å; I147-V354 HydrophobicContact CD1-CG1 4.13Å; I147-V354 HydrophobicContact CD1-CG2 4.16Å; I147-V354 HydrophobicContact CG1-CG1 4.32Å; I147-V354 HydrophobicContact CG1-CG2 3.5Å; I147-V354 VanDerWaalsContact CG1-CG2 3.5Å; I147-C396 HydrophobicContact CD1-CB 3.97Å; I147-A400 HydrophobicContact CB-CB 3.89Å; I147-A400 HydrophobicContact CG2-CB 3.76Å
148Y89.4Confident85.2Confident15 Ų1520.8 Ų20.86%0.05912%0.117CC..Hα-helixtrans-78.1-40.6-174.2-177.8-114.3000113.9G144 I145 A151 L152 L163 V167 A403 S404 I409G144-Y148 PolarHBondContact O-N 3.36Å; G144-Y148 VanDerWaalsContact O-N 3.1Å; I145-Y148 PolarHBondContact O-N 3.2Å; Y148-A151 WeakPolarHBondContact O-CB 3.49Å; Y148-A151 PolarHBondContact O-N 2.88Å; Y148-A151 VanDerWaalsContact O-N 3.09Å; Y148-L152 HydrophobicContact CE1-CB 4.15Å; Y148-L152 HydrophobicContact CE1-CD2 4Å; Y148-L152 PolarHBondContact O-N 3.23Å; Y148-L163 HydrophobicContact CE2-CD1 4.11Å; Y148-L163 HydrophobicContact CE2-CD2 4.2Å; Y148-L163 HydrophobicContact CE2-CG 4.46Å; Y148-V167 HydrophobicContact CD2-CG2 4.28Å; Y148-A403 HydrophobicContact CD1-CB 4.22Å; Y148-A403 HydrophobicContact CG-CB 4.4Å; Y148-S404 VanDerWaalsContact CE1-CA 3.44Å; Y148-S404 VanDerWaalsContact CZ-CA 3.4Å; Y148-S404 VanDerWaalsContact CZ-CB 3.43Å; Y148-S404 WeakPolarHBondContact OH-CB 3.36Å; Y148-I409 HydrophobicContact CD1-CD1 3.61Å; Y148-I409 HydrophobicContact CD1-CG1 4.46Å; Y148-I409 HydrophobicContact CE1-CD1 3.53Å
149A87.2Confident84Confident12 Ų1220.6 Ų20.610%0.09912%0.116CC..Hα-helixtrans-50-54.3-175.200000114.9I69 I145 A151 L152 A153 I409I69-A149 HydrophobicContact CG1-CB 4.16Å; I145-A149 VanDerWaalsContact O-CB 3.26Å; I145-A149 WeakPolarHBondContact O-CB 3.48Å; I145-A149 PolarHBondContact O-N 3.5Å; A149-A151 VanDerWaalsContact C-N 3.29Å; A149-A151 PolarHBondContact O-N 2.62Å; A149-L152 PolarHBondContact O-N 3.26Å; A149-A153 WeakPolarHBondContact O-CB 3.21Å; A149-A153 PolarHBondContact O-N 2.9Å; A149-A153 VanDerWaalsContact O-N 3.08Å; A149-I409 HydrophobicContact CB-CG2 3.56Å
150P88.3Confident83Confident0 Ų021.6 Ų21.60%013%0.127CC..Hα-helixtrans-64.7-35.4179.526.8-35.9000112.2A68 V146 A153 L154 T346 Y347A68-P150 HydrophobicContact CB-CB 3.68Å; A68-P150 HydrophobicContact CB-CG 4Å; V146-P150 WeakPolarHBondContact O-CD 3.35Å; P150-A153 PolarHBondContact O-N 3.43Å; P150-L154 WeakPolarHBondContact O-CB 3.22Å; P150-L154 VanDerWaalsContact O-CG 3.29Å; P150-L154 WeakPolarHBondContact O-CG 3.42Å; P150-L154 PolarHBondContact O-N 3.46Å; P150-T346 HydrophobicContact CB-CG2 3.83Å; P150-Y347 HydrophobicContact CB-CE1 4.15Å; P150-Y347 HydrophobicContact CB-CE2 4.32Å; P150-Y347 HydrophobicContact CG-CD1 4.32Å; P150-Y347 HydrophobicContact CG-CE1 3.92Å
151A88.8Confident82.2Confident0 Ų021.5 Ų21.50%013%0.127CC..Hα-helixtrans-67.2-39.8-178.900000111.1Y148 A149 N155 L163 A166 V167 Y347Y148-A151 WeakPolarHBondContact O-CB 3.49Å; Y148-A151 PolarHBondContact O-N 2.88Å; Y148-A151 VanDerWaalsContact O-N 3.09Å; A149-A151 VanDerWaalsContact C-N 3.29Å; A149-A151 PolarHBondContact O-N 2.62Å; A151-N155 WeakPolarHBondContact O-CA 3.34Å; A151-N155 WeakPolarHBondContact O-CB 3.2Å; A151-N155 PolarHBondContact O-N 3.15Å; A151-N155 VanDerWaalsContact O-N 3.09Å; A151-L163 HydrophobicContact CB-CD1 3.67Å; A151-L163 WeakPolarHBondContact O-CD1 3.46Å; A151-A166 HydrophobicContact CB-CB 4.29Å; A151-V167 HydrophobicContact CB-CG2 3.51Å; A151-Y347 VanDerWaalsContact CA-OH 3.23Å; A151-Y347 WeakPolarHBondContact CA-OH 3.47Å; A151-Y347 WeakPolarHBondContact CB-OH 3.18Å; A151-Y347 PolarHBondContact N-OH 3.15Å
152L85.5Confident81.9Confident49 Ų4923.2 Ų23.226%0.25714%0.136SC..Hα-helixtrans-66.8-45.2174.4-177.265.1000112Y148 A149 L154 N155 L163 I409Y148-L152 HydrophobicContact CE1-CB 4.15Å; Y148-L152 HydrophobicContact CE1-CD2 4Å; Y148-L152 PolarHBondContact O-N 3.23Å; A149-L152 PolarHBondContact O-N 3.26Å; L152-L154 VanDerWaalsContact C-N 3.3Å; L152-L154 PolarHBondContact O-N 3.41Å; L152-N155 WeakPolarHBondContact O-CB 3.3Å; L152-N155 VanDerWaalsContact O-CG 3.24Å; L152-N155 PolarHBondContact O-N 3.35Å; L152-N155 PolarHBondContact O-ND2 2.85Å; L152-L163 HydrophobicContact CB-CD1 4.37Å; L152-I409 HydrophobicContact CB-CD1 4.38Å; L152-I409 HydrophobicContact CD2-CD1 3.34Å; L152-I409 HydrophobicContact CG-CD1 4.47Å
153A82.9Confident81.7Confident3 Ų324.3 Ų24.33%0.02514%0.143CC..Hα-helixtrans-67.1-32.9-178.300000112.7L72 A149 P150 P325L72-A153 HydrophobicContact CD1-CB 3.48Å; L72-A153 VanDerWaalsContact CD1-CB 3.48Å; A149-A153 WeakPolarHBondContact O-CB 3.21Å; A149-A153 PolarHBondContact O-N 2.9Å; A149-A153 VanDerWaalsContact O-N 3.08Å; P150-A153 PolarHBondContact O-N 3.43Å; A153-P325 HydrophobicContact CB-CG 4.38Å
154L82Confident81.5Confident1 Ų129.8 Ų29.81%0.00516%0.164CC..THydrogen-bonded Turntrans-100.715.8-179.2-61.7171000112.7P150 L152 T159 P325 V343 T346 Y347P150-L154 WeakPolarHBondContact O-CB 3.22Å; P150-L154 VanDerWaalsContact O-CG 3.29Å; P150-L154 WeakPolarHBondContact O-CG 3.42Å; P150-L154 PolarHBondContact O-N 3.46Å; L152-L154 VanDerWaalsContact C-N 3.3Å; L152-L154 PolarHBondContact O-N 3.41Å; L154-T159 HydrophobicContact CB-CG2 4.19Å; L154-T159 HydrophobicContact CD2-CG2 3.9Å; L154-T159 PolarHBondContact O-OG1 3.11Å; L154-P325 HydrophobicContact CD2-CB 3.7Å; L154-P325 HydrophobicContact CD2-CG 3.55Å; L154-P325 HydrophobicContact CG-CG 4.39Å; L154-V343 HydrophobicContact CD1-CB 4.21Å; L154-V343 HydrophobicContact CD1-CG1 3.95Å; L154-V343 HydrophobicContact CD1-CG2 3.72Å; L154-V343 HydrophobicContact CD2-CG2 3.65Å; L154-V343 HydrophobicContact CG-CG2 4.24Å; L154-T346 HydrophobicContact CD1-CG2 3.99Å; L154-Y347 HydrophobicContact CD1-CD2 4.02Å; L154-Y347 HydrophobicContact CD1-CE2 3.57Å
155N81.6Confident81.4Confident31 Ų3131.4 Ų31.417%0.16618%0.18CC..BIsolated β-bridgetrans-64.2179.8-174.575.65.6000112.9A151 L152 A157 V158 T159 L161 L163A151-N155 WeakPolarHBondContact O-CA 3.34Å; A151-N155 WeakPolarHBondContact O-CB 3.2Å; A151-N155 PolarHBondContact O-N 3.15Å; A151-N155 VanDerWaalsContact O-N 3.09Å; L152-N155 WeakPolarHBondContact O-CB 3.3Å; L152-N155 VanDerWaalsContact O-CG 3.24Å; L152-N155 PolarHBondContact O-N 3.35Å; L152-N155 PolarHBondContact O-ND2 2.85Å; N155-A157 PolarHBondContact O-N 3.33Å; N155-A157 WeakPolarHBondContact OD1-CB 3.42Å; N155-A157 PolarHBondContact OD1-N 3.48Å; N155-V158 PolarHBondContact O-N 2.97Å; N155-T159 PolarHBondContact O-N 3.47Å; N155-T159 VanDerWaalsContact O-N 3.11Å; N155-L161 CarbonylContact C-O 3.18Å; N155-L163 HydrophobicContact CB-CD1 4.4Å
156Q59Low81.2Confident141 Ų14131.4 Ų31.466%0.65918%0.181SC*.THydrogen-bonded Turntrans-53.5-28.1-174.6-166.3174.92.300114.4V158 G160 L161Q156-V158 PolarHBondContact O-N 3.43Å; Q156-G160 PolarHBondContact O-N 3.24Å; Q156-L161 WeakPolarHBondContact CA-O 3.38Å; Q156-L161 PolarHBondContact N-O 3.44Å
157A58.3Low81.2Confident75 Ų7531.5 Ų31.562%0.6218%0.181SC*.THydrogen-bonded Turntrans-65.9-23.8179.300000113.1N155N155-A157 PolarHBondContact O-N 3.33Å; N155-A157 WeakPolarHBondContact OD1-CB 3.42Å; N155-A157 PolarHBondContact OD1-N 3.48Å
158V64.4Low81.1Confident7 Ų735.7 Ų35.74%0.04220%0.203CC..THydrogen-bonded Turntrans-112.9-48.6-177.4-171.60000112.3N155 Q156 Q322 P325 M329N155-V158 PolarHBondContact O-N 2.97Å; Q156-V158 PolarHBondContact O-N 3.43Å; V158-Q322 HydrophobicContact CG2-CB 4.16Å; V158-Q322 HydrophobicContact CG2-CG 4.31Å; V158-P325 HydrophobicContact CB-CB 4.35Å; V158-P325 VanDerWaalsContact CG1-C 3.47Å; V158-P325 HydrophobicContact CG1-CB 3.6Å; V158-M329 HydrophobicContact CG1-CG 4.2Å; V158-M329 WeakPolarHBondContact O-CG 3.39Å
159T69.5Low81Confident2 Ų236.9 Ų36.91%0.01221%0.213CC..THydrogen-bonded Turntrans-110-18.8-17371.50000114.5F10 L154 N155 L161 V343F10-T159 HydrophobicContact CD1-CG2 4.47Å; F10-T159 VanDerWaalsContact CD1-O 3.24Å; F10-T159 WeakPolarHBondContact CD1-O 3.14Å; F10-T159 VanDerWaalsContact CE1-CB 3.42Å; F10-T159 HydrophobicContact CE1-CG2 3.71Å; F10-T159 WeakPolarHBondContact CG-O 3.4Å; F10-T159 HydrophobicContact CZ-CG2 3.93Å; F10-T159 PolarHBondContact N-O 3Å; L154-T159 HydrophobicContact CB-CG2 4.19Å; L154-T159 HydrophobicContact CD2-CG2 3.9Å; L154-T159 PolarHBondContact O-OG1 3.11Å; N155-T159 PolarHBondContact O-N 3.47Å; N155-T159 VanDerWaalsContact O-N 3.11Å; T159-L161 WeakPolarHBondContact OG1-CB 3.47Å; T159-L161 WeakPolarHBondContact OG1-CG 3.46Å; T159-L161 PolarHBondContact OG1-N 3.19Å; T159-L161 VanDerWaalsContact OG1-N 3.13Å; T159-V343 HydrophobicContact CG2-CG2 4.47Å
160G72.8Confident81Confident26 Ų2636.4 Ų36.427%0.26821%0.209SC..  trans86.23.6-168.700000114.9Q156Q156-G160 PolarHBondContact O-N 3.24Å
161L76.6Confident81Confident15 Ų1536.4 Ų36.48%0.07921%0.209CC..BIsolated β-bridgetrans-75.3135.3175.9-75.7165.1000112.5F10 Y15 N155 Q156 T159 L163 V343F10-L161 HydrophobicContact CD2-CD1 4.36Å; F10-L161 HydrophobicContact CD2-CG 4.2Å; F10-L161 HydrophobicContact CE2-CD1 3.72Å; F10-L161 HydrophobicContact CE2-CG 4.06Å; F10-L161 HydrophobicContact CZ-CD1 4.31Å; Y15-L161 HydrophobicContact CD1-CD2 4.03Å; Y15-L161 HydrophobicContact CE1-CD2 3.5Å; Y15-L161 VanDerWaalsContact CE1-CD2 3.5Å; Y15-L161 HydrophobicContact CE1-CG 4.34Å; N155-L161 CarbonylContact C-O 3.18Å; Q156-L161 WeakPolarHBondContact CA-O 3.38Å; Q156-L161 PolarHBondContact N-O 3.44Å; T159-L161 WeakPolarHBondContact OG1-CB 3.47Å; T159-L161 WeakPolarHBondContact OG1-CG 3.46Å; T159-L161 PolarHBondContact OG1-N 3.19Å; T159-L161 VanDerWaalsContact OG1-N 3.13Å; L161-L163 PolarHBondContact O-N 3.43Å; L161-V343 HydrophobicContact CD1-CG1 4.08Å
162D86.1Confident81Confident94 Ų9440.2 Ų40.250%0.50323%0.232SC..  trans-67.5125.7170.117955.8000110.7W164 G165 A166D162-W164 PolarHBondContact O-N 3.29Å; D162-W164 PolarHBondContact OD2-N 2.9Å; D162-G165 WeakPolarHBondContact OD2-CA 3.37Å; D162-G165 PolarHBondContact OD2-N 2.8Å; D162-A166 WeakPolarHBondContact O-CB 3.46Å; D162-A166 PolarHBondContact O-N 3.38Å
163L86Confident81.1Confident34 Ų3439.4 Ų39.418%0.17823%0.229CC..Hα-helixtrans-57.4-52.7-175.7175.467.2000111.4Y148 A151 L152 N155 L161 A166 V167Y148-L163 HydrophobicContact CE2-CD1 4.11Å; Y148-L163 HydrophobicContact CE2-CD2 4.2Å; Y148-L163 HydrophobicContact CE2-CG 4.46Å; A151-L163 HydrophobicContact CB-CD1 3.67Å; A151-L163 WeakPolarHBondContact O-CD1 3.46Å; L152-L163 HydrophobicContact CB-CD1 4.37Å; N155-L163 HydrophobicContact CB-CD1 4.4Å; L161-L163 PolarHBondContact O-N 3.43Å; L163-A166 PolarHBondContact O-N 3.3Å; L163-V167 WeakPolarHBondContact O-CG2 3.27Å; L163-V167 PolarHBondContact O-N 3.45Å
164W89.5Confident81.3Confident116 Ų11639.2 Ų39.244%0.43923%0.228SC..Hα-helixtrans-76.1-35.3-173.9-72.5106.7000112.3D162 A166 V167 I168D162-W164 PolarHBondContact O-N 3.29Å; D162-W164 PolarHBondContact OD2-N 2.9Å; W164-A166 VanDerWaalsContact C-N 3.28Å; W164-A166 PolarHBondContact O-N 3.43Å; W164-V167 HydrophobicContact CE3-CB 4.49Å; W164-V167 HydrophobicContact CE3-CG1 4.34Å; W164-V167 PolarHBondContact O-N 3.47Å; W164-I168 WeakPolarHBondContact O-CB 3.35Å; W164-I168 VanDerWaalsContact O-CG1 3.26Å; W164-I168 WeakPolarHBondContact O-CG1 3.39Å; W164-I168 PolarHBondContact O-N 3.21Å
165G88Confident81.6Confident34 Ų3439.5 Ų39.535%0.35123%0.23SC..Hα-helixtrans-57.6-41.717000000111.7D162 S169D162-G165 WeakPolarHBondContact OD2-CA 3.37Å; D162-G165 PolarHBondContact OD2-N 2.8Å; G165-S169 WeakPolarHBondContact O-CB 3.25Å; G165-S169 PolarHBondContact O-N 3.3Å; G165-S169 PolarHBondContact O-OG 2.85Å
166A87Confident81.9Confident4 Ų443 Ų433%0.03324%0.244CC..Hα-helixtrans-71.2-40177.400000113A151 D162 L163 W164 S169 T170 Y347A151-A166 HydrophobicContact CB-CB 4.29Å; D162-A166 WeakPolarHBondContact O-CB 3.46Å; D162-A166 PolarHBondContact O-N 3.38Å; L163-A166 PolarHBondContact O-N 3.3Å; W164-A166 VanDerWaalsContact C-N 3.28Å; W164-A166 PolarHBondContact O-N 3.43Å; A166-S169 WeakPolarHBondContact CA-OG 3.44Å; A166-S169 PolarHBondContact O-OG 3.13Å; A166-S169 VanDerWaalsContact O-OG 3.12Å; A166-T170 VanDerWaalsContact O-CB 3.25Å; A166-T170 WeakPolarHBondContact O-CB 3.14Å; A166-T170 PolarHBondContact O-N 3.28Å; A166-T170 VanDerWaalsContact O-N 3.1Å; A166-T170 PolarHBondContact O-OG1 2.84Å; A166-Y347 WeakPolarHBondContact CB-OH 3.32Å
167V90.1Very high83.1Confident1 Ų136.3 Ų36.31%0.00621%0.212CC..Hα-helixtrans-59.7-52.8172.6165.90000111.3I147 Y148 A151 L163 W164 G171 A400I147-V167 HydrophobicContact CG2-CB 4.47Å; I147-V167 HydrophobicContact CG2-CG1 3.88Å; Y148-V167 HydrophobicContact CD2-CG2 4.28Å; A151-V167 HydrophobicContact CB-CG2 3.51Å; L163-V167 WeakPolarHBondContact O-CG2 3.27Å; L163-V167 PolarHBondContact O-N 3.45Å; W164-V167 HydrophobicContact CE3-CB 4.49Å; W164-V167 HydrophobicContact CE3-CG1 4.34Å; W164-V167 PolarHBondContact O-N 3.47Å; V167-G171 PolarHBondContact O-N 2.89Å; V167-A400 HydrophobicContact CG1-CB 4.12Å
168I90.6Very high84.3Confident90 Ų9032.8 Ų32.846%0.46218%0.183SC..Hα-helixtrans-67-46.6-175.9-67.4168.8000110.3W164 T170 G171 V172W164-I168 WeakPolarHBondContact O-CB 3.35Å; W164-I168 VanDerWaalsContact O-CG1 3.26Å; W164-I168 WeakPolarHBondContact O-CG1 3.39Å; W164-I168 PolarHBondContact O-N 3.21Å; I168-T170 PolarHBondContact O-N 3.11Å; I168-G171 PolarHBondContact O-N 2.98Å; I168-V172 HydrophobicContact CG2-CG2 4.05Å; I168-V172 VanDerWaalsContact O-CB 3.31Å; I168-V172 WeakPolarHBondContact O-CB 3.45Å; I168-V172 WeakPolarHBondContact O-CG2 3.06Å; I168-V172 PolarHBondContact O-N 3.26Å
169S87.6Confident85.2Confident40 Ų4033.6 Ų33.628%0.2819%0.188SC..Hα-helixtrans-60.4-47.1179.957.40000112G165 A166 V172 V173G165-S169 WeakPolarHBondContact O-CB 3.25Å; G165-S169 PolarHBondContact O-N 3.3Å; G165-S169 PolarHBondContact O-OG 2.85Å; A166-S169 WeakPolarHBondContact CA-OG 3.44Å; A166-S169 PolarHBondContact O-OG 3.13Å; A166-S169 VanDerWaalsContact O-OG 3.12Å; S169-V172 PolarHBondContact O-N 3.08Å; S169-V173 WeakPolarHBondContact O-CB 3.26Å; S169-V173 VanDerWaalsContact O-CG2 3.24Å; S169-V173 WeakPolarHBondContact O-CG2 3.3Å; S169-V173 PolarHBondContact O-N 3.36Å
170T85.7Confident85.6Confident1 Ų136.2 Ų36.21%0.00620%0.201CC..Hα-helixtrans-62.3-46.6178.4-56.60000111.3A166 I168 C174 Y347 L351A166-T170 VanDerWaalsContact O-CB 3.25Å; A166-T170 WeakPolarHBondContact O-CB 3.14Å; A166-T170 PolarHBondContact O-N 3.28Å; A166-T170 VanDerWaalsContact O-N 3.1Å; A166-T170 PolarHBondContact O-OG1 2.84Å; I168-T170 PolarHBondContact O-N 3.11Å; T170-C174 WeakPolarHBondContact O-CB 3.27Å; T170-C174 PolarHBondContact O-N 3.19Å; T170-Y347 HydrophobicContact CG2-CD1 3.73Å; T170-Y347 HydrophobicContact CG2-CE1 4.11Å; T170-Y347 WeakPolarHBondContact OG1-CD1 3.32Å; T170-Y347 WeakPolarHBondContact OG1-CE1 3.43Å; T170-L351 HydrophobicContact CG2-CD2 3.56Å; T170-L351 HydrophobicContact CG2-CG 4.01Å
171G88.1Confident85.6Confident0 Ų035.3 Ų35.30%019%0.192CC..Hα-helixtrans-63.2-44.817900000112.9V167 I168 T175V167-G171 PolarHBondContact O-N 2.89Å; I168-G171 PolarHBondContact O-N 2.98Å; G171-T175 VanDerWaalsContact O-CB 3.3Å; G171-T175 WeakPolarHBondContact O-CB 3.42Å; G171-T175 PolarHBondContact O-N 3.33Å; G171-T175 PolarHBondContact O-OG1 3.49Å
172V89.8Confident85.8Confident80 Ų8034.7 Ų34.749%0.48519%0.189SC..Hα-helixtrans-66.7-47.9179.9169.70000111.1I168 S169 C174 T175 F176I168-V172 HydrophobicContact CG2-CG2 4.05Å; I168-V172 VanDerWaalsContact O-CB 3.31Å; I168-V172 WeakPolarHBondContact O-CB 3.45Å; I168-V172 WeakPolarHBondContact O-CG2 3.06Å; I168-V172 PolarHBondContact O-N 3.26Å; S169-V172 PolarHBondContact O-N 3.08Å; V172-C174 VanDerWaalsContact C-N 3.32Å; V172-C174 PolarHBondContact O-N 2.94Å; V172-T175 PolarHBondContact O-N 3.3Å; V172-F176 VanDerWaalsContact O-CB 3.28Å; V172-F176 WeakPolarHBondContact O-CB 3.49Å; V172-F176 PolarHBondContact O-N 2.83Å
173V87.7Confident85.6Confident32 Ų3230.4 Ų30.419%0.19417%0.166CC..Hα-helixtrans-59.8-45.9177.8170.60000110.2L22 A26 S169 F176 Y177L22-V173 HydrophobicContact CB-CG1 4.42Å; L22-V173 HydrophobicContact CD2-CG1 4.35Å; A26-V173 HydrophobicContact CB-CG1 4.48Å; S169-V173 WeakPolarHBondContact O-CB 3.26Å; S169-V173 VanDerWaalsContact O-CG2 3.24Å; S169-V173 WeakPolarHBondContact O-CG2 3.3Å; S169-V173 PolarHBondContact O-N 3.36Å; V173-F176 PolarHBondContact O-N 2.81Å; V173-Y177 HydrophobicContact CG1-CD1 4.17Å; V173-Y177 HydrophobicContact CG1-CE1 4.41Å; V173-Y177 WeakPolarHBondContact O-CD1 3.42Å; V173-Y177 PolarHBondContact O-N 2.87Å; V173-Y177 VanDerWaalsContact O-N 3.13Å
174C86.4Confident85.3Confident0 Ų030.5 Ų30.50%017%0.165CC..Hα-helixtrans-60.6-50.6178.2-164.80000112.3T170 V172 F176 Y177 C178 L351 V354 S355T170-C174 WeakPolarHBondContact O-CB 3.27Å; T170-C174 PolarHBondContact O-N 3.19Å; V172-C174 VanDerWaalsContact C-N 3.32Å; V172-C174 PolarHBondContact O-N 2.94Å; C174-F176 VanDerWaalsContact C-N 3.26Å; C174-F176 PolarHBondContact O-N 2.93Å; C174-Y177 VanDerWaalsContact CA-CE1 3.43Å; C174-Y177 HydrophobicContact CB-CE1 4.21Å; C174-Y177 PolarHBondContact O-N 3.49Å; C174-Y177 PolarHBondContact SG-OH 3.01Å; C174-C178 VanDerWaalsContact O-CB 3.29Å; C174-C178 WeakPolarHBondContact O-CB 3.12Å; C174-C178 PolarHBondContact O-N 2.97Å; C174-C178 PolarHBondContact O-SG 3.31Å; C174-L351 HydrophobicContact CB-CD2 3.75Å; C174-V354 HydrophobicContact CB-CG1 4.04Å; C174-V354 WeakPolarHBondContact SG-CG1 3.38Å; C174-S355 PolarHBondContact SG-N 2.83Å; C174-S355 VanDerWaalsContact SG-N 3.4Å
175T89.1Confident85.1Confident7 Ų725 Ų254%0.04314%0.144CC..Hα-helixtrans-58-42.2179-57.50000111.1G171 V172 T179 F390 G393G171-T175 VanDerWaalsContact O-CB 3.3Å; G171-T175 WeakPolarHBondContact O-CB 3.42Å; G171-T175 PolarHBondContact O-N 3.33Å; G171-T175 PolarHBondContact O-OG1 3.49Å; V172-T175 PolarHBondContact O-N 3.3Å; T175-T179 VanDerWaalsContact O-CB 3.25Å; T175-T179 WeakPolarHBondContact O-CB 3.04Å; T175-T179 PolarHBondContact O-N 3.44Å; T175-T179 PolarHBondContact O-OG1 3.49Å; T175-F390 HydrophobicContact CG2-CD2 3.85Å; T175-G393 VanDerWaalsContact OG1-CA 3.25Å; T175-G393 WeakPolarHBondContact OG1-CA 3.45Å
176F87.8Confident85Confident105 Ų10523.4 Ų23.446%0.46113%0.127SC..Hα-helixtrans-60.8-56.4-179.9177.6-100.5000112.2V30 V172 V173 C174 C178 T179 M180V30-F176 HydrophobicContact CG2-CE1 3.89Å; V30-F176 HydrophobicContact CG2-CZ 4.26Å; V172-F176 VanDerWaalsContact O-CB 3.28Å; V172-F176 WeakPolarHBondContact O-CB 3.49Å; V172-F176 PolarHBondContact O-N 2.83Å; V173-F176 PolarHBondContact O-N 2.81Å; C174-F176 VanDerWaalsContact C-N 3.26Å; C174-F176 PolarHBondContact O-N 2.93Å; F176-C178 VanDerWaalsContact C-N 3.34Å; F176-C178 PolarHBondContact O-N 3.36Å; F176-T179 PolarHBondContact O-N 2.69Å; F176-M180 HydrophobicContact CD1-SD 4.33Å; F176-M180 HydrophobicContact CD2-SD 4.23Å; F176-M180 HydrophobicContact CE1-SD 3.67Å; F176-M180 HydrophobicContact CE2-SD 3.55Å; F176-M180 VanDerWaalsContact CE2-SD 3.55Å; F176-M180 HydrophobicContact CZ-SD 3.24Å; F176-M180 WeakPolarHBondContact CZ-SD 3.48Å; F176-M180 WeakPolarHBondContact O-CG 3.48Å; F176-M180 PolarHBondContact O-N 3.27Å; F176-M180 VanDerWaalsContact O-N 3.16Å
177Y83.4Confident85Confident0 Ų023.2 Ų23.20%013%0.126CC..Hα-helixtrans-71-30.1-176.175.4-111.3000112.8V173 C174 M180 G181 T189 L351 S355V173-Y177 HydrophobicContact CG1-CD1 4.17Å; V173-Y177 HydrophobicContact CG1-CE1 4.41Å; V173-Y177 WeakPolarHBondContact O-CD1 3.42Å; V173-Y177 PolarHBondContact O-N 2.87Å; V173-Y177 VanDerWaalsContact O-N 3.13Å; C174-Y177 VanDerWaalsContact CA-CE1 3.43Å; C174-Y177 HydrophobicContact CB-CE1 4.21Å; C174-Y177 PolarHBondContact O-N 3.49Å; C174-Y177 PolarHBondContact SG-OH 3.01Å; Y177-M180 PolarHBondContact O-N 3.22Å; Y177-G181 PolarHBondContact O-N 3.16Å; Y177-T189 HydrophobicContact CD2-CG2 4.39Å; Y177-T189 HydrophobicContact CE2-CG2 4.38Å; Y177-L351 HydrophobicContact CE1-CD2 4.4Å; Y177-L351 PolarHBondContact OH-O 3.09Å; Y177-L351 VanDerWaalsContact OH-O 3.08Å; Y177-S355 WeakPolarHBondContact OH-CB 3.04Å
178C83.1Confident84.9Confident1 Ų128.4 Ų28.41%0.00715%0.145CC..Hα-helixtrans-66.9-42.4174.8-67.10000112.1C174 F176 M180 S355 I358C174-C178 VanDerWaalsContact O-CB 3.29Å; C174-C178 WeakPolarHBondContact O-CB 3.12Å; C174-C178 PolarHBondContact O-N 2.97Å; C174-C178 PolarHBondContact O-SG 3.31Å; F176-C178 VanDerWaalsContact C-N 3.34Å; F176-C178 PolarHBondContact O-N 3.36Å; C178-M180 VanDerWaalsContact C-N 3.26Å; C178-M180 PolarHBondContact O-N 3.08Å; C178-S355 WeakPolarHBondContact SG-CA 3.44Å; C178-S355 WeakPolarHBondContact SG-CB 3.16Å; C178-I358 HydrophobicContact CB-CG2 4.13Å
179T84.3Confident84.8Confident24 Ų2424.1 Ų24.115%0.14712%0.124CC..Hα-helixtrans-64.6-34.3178-59.30000111.3T175 F176 K386 F390T175-T179 VanDerWaalsContact O-CB 3.25Å; T175-T179 WeakPolarHBondContact O-CB 3.04Å; T175-T179 PolarHBondContact O-N 3.44Å; T175-T179 PolarHBondContact O-OG1 3.49Å; F176-T179 PolarHBondContact O-N 2.69Å; T179-K386 HydrophobicContact CG2-CB 4.05Å; T179-K386 WeakPolarHBondContact CG2-O 3.19Å; T179-K386 WeakPolarHBondContact O-CD 3.41Å; T179-K386 WeakPolarHBondContact O-CE 3.1Å; T179-K386 VanDerWaalsContact O-CG 3.31Å; T179-K386 WeakPolarHBondContact O-CG 3.41Å; T179-F390 HydrophobicContact CG2-CB 4.42Å
180M78.4Confident85Confident56 Ų5622.2 Ų22.228%0.27611%0.11SC..Hα-helixtrans-82.9-45.9-177.9-70.6-170.967.200113.7V30 A33 F176 Y177 C178V30-M180 HydrophobicContact CB-CE 4.49Å; V30-M180 HydrophobicContact CG1-CE 4.49Å; V30-M180 HydrophobicContact CG2-CE 4Å; V30-M180 HydrophobicContact CG2-SD 4.15Å; A33-M180 HydrophobicContact CB-CB 3.93Å; A33-M180 HydrophobicContact CB-CE 3.99Å; A33-M180 WeakPolarHBondContact CB-O 3.44Å; F176-M180 HydrophobicContact CD1-SD 4.33Å; F176-M180 HydrophobicContact CD2-SD 4.23Å; F176-M180 HydrophobicContact CE1-SD 3.67Å; F176-M180 HydrophobicContact CE2-SD 3.55Å; F176-M180 VanDerWaalsContact CE2-SD 3.55Å; F176-M180 HydrophobicContact CZ-SD 3.24Å; F176-M180 WeakPolarHBondContact CZ-SD 3.48Å; F176-M180 WeakPolarHBondContact O-CG 3.48Å; F176-M180 PolarHBondContact O-N 3.27Å; F176-M180 VanDerWaalsContact O-N 3.16Å; Y177-M180 PolarHBondContact O-N 3.22Å; C178-M180 VanDerWaalsContact C-N 3.26Å; C178-M180 PolarHBondContact O-N 3.08Å
181G72.5Confident85.2Confident8 Ų823.5 Ų23.58%0.08212%0.118CC..Hα-helixtrans-99.1-16.6-159.500000117.6Y177 A185Y177-G181 PolarHBondContact O-N 3.16Å; G181-A185 VanDerWaalsContact C-CB 3.44Å; G181-A185 VanDerWaalsContact CA-CB 3.4Å; G181-A185 VanDerWaalsContact O-CB 3.29Å; G181-A185 WeakPolarHBondContact O-CB 3.29Å
182G79.9Confident85.4Confident1 Ų126.7 Ų26.71%0.0113%0.134CC..Hα-helixtrans62.6-168.4-179.500000114.2F45 K184 A185 V186F45-G182 VanDerWaalsContact CE2-N 3.31Å; G182-K184 VanDerWaalsContact C-N 3.33Å; G182-K184 PolarHBondContact O-N 3.48Å; G182-A185 PolarHBondContact O-N 3.41Å; G182-V186 WeakPolarHBondContact O-CG2 3.39Å; G182-V186 PolarHBondContact O-N 3.48Å; G182-V186 VanDerWaalsContact O-N 3.15Å
183L81.6Confident85.5Confident4 Ų422.9 Ų22.92%0.02111%0.111CC..Hα-helixtrans-58.9-39.2-171.4-175.769.9000113.2F45 L46 A185 V186 V187 Q266 R267 A270F45-L183 PolarHBondContact O-N 3.37Å; L46-L183 WeakPolarHBondContact O-CD2 3.28Å; L183-A185 PolarHBondContact O-N 3.03Å; L183-V186 PolarHBondContact O-N 3.35Å; L183-V187 HydrophobicContact CD1-CG2 4.45Å; L183-V187 HydrophobicContact CG-CG2 4.36Å; L183-V187 VanDerWaalsContact O-CG2 3.31Å; L183-V187 WeakPolarHBondContact O-CG2 3.35Å; L183-V187 PolarHBondContact O-N 3.49Å; L183-Q266 HydrophobicContact CD2-CG 4.32Å; L183-R267 HydrophobicContact CD1-CG 4.3Å; L183-A270 HydrophobicContact CD2-CB 3.89Å
184K81.8Confident85.7Confident36 Ų3622 Ų2216%0.15711%0.106CC..Hα-helixtrans-62.9-44.2-179.8-65.4-173.4-161.5154.80112F32 D36 G48 G182 V186 V187 W188F32-K184 HydrophobicContact CD1-CB 4.32Å; F32-K184 HydrophobicContact CE1-CB 4.48Å; D36-K184 IonicContact OD1-NZ 2.69Å; D36-K184 WeakPolarHBondContact OD2-CD 3.39Å; D36-K184 IonicContact OD2-NZ 2.8Å; D36-K184 PolarHBondContact OD2-NZ 2.97Å; G48-K184 WeakPolarHBondContact O-CE 3.26Å; G182-K184 VanDerWaalsContact C-N 3.33Å; G182-K184 PolarHBondContact O-N 3.48Å; K184-V186 VanDerWaalsContact C-N 3.34Å; K184-V187 PolarHBondContact O-N 3.44Å; K184-W188 VanDerWaalsContact O-CD1 3.31Å; K184-W188 PolarHBondContact O-N 2.94Å; K184-W188 VanDerWaalsContact O-N 3.13Å
185A84.3Confident86Confident0 Ų025 Ų250%013%0.13CC..Hα-helixtrans-63.3-44.5178.100000110.8F32 G181 G182 L183 V187 W188 T189F32-A185 HydrophobicContact CB-CB 3.87Å; F32-A185 HydrophobicContact CD2-CB 4.07Å; F32-A185 HydrophobicContact CG-CB 4.2Å; G181-A185 VanDerWaalsContact C-CB 3.44Å; G181-A185 VanDerWaalsContact CA-CB 3.4Å; G181-A185 VanDerWaalsContact O-CB 3.29Å; G181-A185 WeakPolarHBondContact O-CB 3.29Å; G182-A185 PolarHBondContact O-N 3.41Å; L183-A185 PolarHBondContact O-N 3.03Å; A185-V187 VanDerWaalsContact C-N 3.32Å; A185-V187 PolarHBondContact O-N 3.41Å; A185-W188 PolarHBondContact O-N 2.76Å; A185-T189 WeakPolarHBondContact O-CG2 3.4Å; A185-T189 PolarHBondContact O-N 3.48Å; A185-T189 PolarHBondContact O-OG1 2.95Å; A185-T189 VanDerWaalsContact O-OG1 3.12Å
186V85.9Confident86.2Confident1 Ų126 Ų261%0.00614%0.136CC..Hα-helixtrans-56.3-47.5176.5173.80000110.8G182 L183 K184 W188 T189 D190G182-V186 WeakPolarHBondContact O-CG2 3.39Å; G182-V186 PolarHBondContact O-N 3.48Å; G182-V186 VanDerWaalsContact O-N 3.15Å; L183-V186 PolarHBondContact O-N 3.35Å; K184-V186 VanDerWaalsContact C-N 3.34Å; V186-W188 VanDerWaalsContact C-N 3.34Å; V186-W188 PolarHBondContact O-N 3.38Å; V186-T189 WeakPolarHBondContact CA-OG1 3.43Å; V186-T189 PolarHBondContact O-N 3.1Å; V186-T189 PolarHBondContact O-OG1 2.82Å; V186-D190 WeakPolarHBondContact O-CB 3.37Å; V186-D190 PolarHBondContact O-N 3.11Å
187V87.6Confident86.4Confident0 Ų021 Ų210%011%0.114CC..Hα-helixtrans-59.9-42.2178.81690000112.1L52 P56 L183 K184 A185 D190 V191L52-V187 HydrophobicContact CD1-CG2 4.22Å; P56-V187 HydrophobicContact CB-CG1 3.97Å; L183-V187 HydrophobicContact CD1-CG2 4.45Å; L183-V187 HydrophobicContact CG-CG2 4.36Å; L183-V187 VanDerWaalsContact O-CG2 3.31Å; L183-V187 WeakPolarHBondContact O-CG2 3.35Å; L183-V187 PolarHBondContact O-N 3.49Å; K184-V187 PolarHBondContact O-N 3.44Å; A185-V187 VanDerWaalsContact C-N 3.32Å; A185-V187 PolarHBondContact O-N 3.41Å; V187-D190 PolarHBondContact O-N 2.73Å; V187-V191 WeakPolarHBondContact O-CG2 3.17Å; V187-V191 PolarHBondContact O-N 3.34Å
188W87.1Confident86.8Confident110 Ų11024 Ų2442%0.41713%0.127SC..Hα-helixtrans-76.6-34.3-179.8-80.7104.9000113.7V28 F32 P56 K184 A185 V186 D190 V191 I192V28-W188 HydrophobicContact CG1-CB 4.14Å; F32-W188 HydrophobicContact CE2-CB 3.74Å; F32-W188 AromaticContact CE2-CD1 3.59Å; F32-W188 AromaticContact CE2-CG 3.77Å; F32-W188 HydrophobicContact CE2-CG 3.77Å; F32-W188 HydrophobicContact CZ-CB 4.26Å; F32-W188 AromaticContact CZ-CD1 3.21Å; F32-W188 AromaticContact CZ-CG 3.77Å; F32-W188 HydrophobicContact CZ-CG 3.77Å; F32-W188 AromaticContact CZ-NE1 3.69Å; P56-W188 HydrophobicContact CG-CZ2 4.41Å; K184-W188 VanDerWaalsContact O-CD1 3.31Å; K184-W188 PolarHBondContact O-N 2.94Å; K184-W188 VanDerWaalsContact O-N 3.13Å; A185-W188 PolarHBondContact O-N 2.76Å; V186-W188 VanDerWaalsContact C-N 3.34Å; V186-W188 PolarHBondContact O-N 3.38Å; W188-D190 VanDerWaalsContact C-N 3.26Å; W188-D190 PolarHBondContact O-N 2.68Å; W188-V191 PolarHBondContact O-N 3.04Å; W188-I192 PolarHBondContact O-N 3.02Å
189T89.4Confident87.4Confident1 Ų125.6 Ų25.61%0.00614%0.141CC..Hα-helixtrans-62.1-4017150.10000110.6V28 Y177 A185 V186 V191 I192 Q193V28-T189 HydrophobicContact CB-CG2 3.77Å; V28-T189 HydrophobicContact CG1-CG2 3.66Å; Y177-T189 HydrophobicContact CD2-CG2 4.39Å; Y177-T189 HydrophobicContact CE2-CG2 4.38Å; A185-T189 WeakPolarHBondContact O-CG2 3.4Å; A185-T189 PolarHBondContact O-N 3.48Å; A185-T189 PolarHBondContact O-OG1 2.95Å; A185-T189 VanDerWaalsContact O-OG1 3.12Å; V186-T189 WeakPolarHBondContact CA-OG1 3.43Å; V186-T189 PolarHBondContact O-N 3.1Å; V186-T189 PolarHBondContact O-OG1 2.82Å; T189-V191 VanDerWaalsContact C-N 3.31Å; T189-V191 PolarHBondContact O-N 3.12Å; T189-I192 PolarHBondContact O-N 3.23Å; T189-Q193 WeakPolarHBondContact O-CB 3.5Å; T189-Q193 VanDerWaalsContact O-CG 3.26Å; T189-Q193 WeakPolarHBondContact O-CG 3.32Å; T189-Q193 PolarHBondContact O-N 3.18Å
190D91.2Very high87.8Confident0 Ų024.5 Ų24.50%013%0.134CC..Hα-helixtrans-63.2-37179.2-67.8-11000112.3S60 A63 S64 V186 V187 W188 I192 Q193 L194 R267 S352S60-D190 PolarHBondContact OG-OD2 2.97Å; A63-D190 HydrophobicContact CB-CB 3.9Å; S64-D190 PolarHBondContact OG-OD2 2.88Å; V186-D190 WeakPolarHBondContact O-CB 3.37Å; V186-D190 PolarHBondContact O-N 3.11Å; V187-D190 PolarHBondContact O-N 2.73Å; W188-D190 VanDerWaalsContact C-N 3.26Å; W188-D190 PolarHBondContact O-N 2.68Å; D190-I192 VanDerWaalsContact C-N 3.34Å; D190-I192 PolarHBondContact O-N 2.65Å; D190-Q193 PolarHBondContact O-N 2.98Å; D190-L194 VanDerWaalsContact O-CB 3.31Å; D190-L194 WeakPolarHBondContact O-CB 3.45Å; D190-L194 PolarHBondContact O-N 3.45Å; D190-R267 IonicContact OD2-CZ 2.86Å; D190-R267 IonicContact OD2-NE 3.96Å; D190-R267 IonicContact OD2-NH2 3.64Å; D190-R267 PolarHBondContact OD2-NH2 3.41Å; D190-S352 WeakPolarHBondContact OD1-CA 3.16Å; D190-S352 VanDerWaalsContact OD1-CB 3.28Å; D190-S352 WeakPolarHBondContact OD1-CB 3.28Å
191V90.9Very high88.6Confident28 Ų2822 Ų2217%0.1712%0.121CC..Hα-helixtrans-59.8-45.6176170.20000111M59 V187 W188 T189 A195M59-V191 HydrophobicContact CB-CG2 3.77Å; M59-V191 HydrophobicContact CG-CG2 4.5Å; M59-V191 HydrophobicContact SD-CB 4.35Å; M59-V191 HydrophobicContact SD-CG1 3.69Å; M59-V191 HydrophobicContact SD-CG2 3.92Å; V187-V191 WeakPolarHBondContact O-CG2 3.17Å; V187-V191 PolarHBondContact O-N 3.34Å; W188-V191 PolarHBondContact O-N 3.04Å; T189-V191 VanDerWaalsContact C-N 3.31Å; T189-V191 PolarHBondContact O-N 3.12Å; V191-A195 PolarHBondContact O-N 3.43Å
192I91.4Very high89.6Confident66 Ų6626.2 Ų26.234%0.33814%0.142SC..Hα-helixtrans-66.9-45.8178.5-63.9170.6000109.8V24 V28 W188 T189 D190 L194 A195 V196V24-I192 HydrophobicContact CG1-CD1 4.18Å; V24-I192 HydrophobicContact CG1-CG2 4.28Å; V28-I192 HydrophobicContact CG2-CD1 3.8Å; W188-I192 PolarHBondContact O-N 3.02Å; T189-I192 PolarHBondContact O-N 3.23Å; D190-I192 VanDerWaalsContact C-N 3.34Å; D190-I192 PolarHBondContact O-N 2.65Å; I192-L194 VanDerWaalsContact C-N 3.31Å; I192-L194 PolarHBondContact O-N 3.22Å; I192-A195 WeakPolarHBondContact O-CB 3.25Å; I192-A195 PolarHBondContact O-N 3.16Å; I192-A195 VanDerWaalsContact O-N 3.1Å; I192-V196 HydrophobicContact CG2-CG2 4.46Å; I192-V196 WeakPolarHBondContact O-CG2 3.46Å; I192-V196 PolarHBondContact O-N 3.42Å
193Q91.6Very high90.3Very high0 Ų027.5 Ų27.50%015%0.149CC..Hα-helixtrans-60.8-39.5-179.9-76168.9-6.400112.1S25 T189 D190 A195 V196 M197 S348 S352S25-Q193 PolarHBondContact OG-NE2 3.28Å; T189-Q193 WeakPolarHBondContact O-CB 3.5Å; T189-Q193 VanDerWaalsContact O-CG 3.26Å; T189-Q193 WeakPolarHBondContact O-CG 3.32Å; T189-Q193 PolarHBondContact O-N 3.18Å; D190-Q193 PolarHBondContact O-N 2.98Å; Q193-A195 VanDerWaalsContact C-N 3.34Å; Q193-A195 PolarHBondContact O-N 3.46Å; Q193-V196 PolarHBondContact O-N 3.46Å; Q193-M197 VanDerWaalsContact O-CG 3.28Å; Q193-M197 WeakPolarHBondContact O-CG 3.47Å; Q193-M197 PolarHBondContact O-N 2.93Å; Q193-S348 PolarHBondContact OE1-O 3.14Å; Q193-S352 VanDerWaalsContact OE1-CA 3.26Å; Q193-S352 VanDerWaalsContact OE1-CB 3.26Å; Q193-S352 VanDerWaalsContact OE1-N 3.14Å
194L91.6Very high91Very high15 Ų1527.3 Ų27.38%0.07915%0.148CC..Hα-helixtrans-59.6-43.6173.2-177.163.2000112M59 A63 D190 I192 M197 F198 I291M59-L194 HydrophobicContact CB-CD2 3.87Å; M59-L194 HydrophobicContact CG-CD2 4.09Å; A63-L194 HydrophobicContact CB-CB 4.23Å; D190-L194 VanDerWaalsContact O-CB 3.31Å; D190-L194 WeakPolarHBondContact O-CB 3.45Å; D190-L194 PolarHBondContact O-N 3.45Å; I192-L194 VanDerWaalsContact C-N 3.31Å; I192-L194 PolarHBondContact O-N 3.22Å; L194-M197 WeakPolarHBondContact O-CB 3.48Å; L194-M197 PolarHBondContact O-N 3.1Å; L194-F198 HydrophobicContact CD1-CD2 4.13Å; L194-F198 HydrophobicContact CD1-CE2 3.69Å; L194-F198 HydrophobicContact CD2-CE2 4.5Å; L194-F198 HydrophobicContact CG-CD2 4.11Å; L194-F198 HydrophobicContact CG-CE2 3.92Å; L194-F198 VanDerWaalsContact O-CD2 3.27Å; L194-F198 WeakPolarHBondContact O-CD2 3.34Å; L194-F198 PolarHBondContact O-N 3.24Å; L194-F198 VanDerWaalsContact O-N 3.1Å; L194-I291 HydrophobicContact CD1-CD1 3.66Å; L194-I291 HydrophobicContact CD1-CG1 4.37Å
195A92.7Very high91.7Very high62 Ų6226.7 Ų26.751%0.51215%0.146SC..Hα-helixtrans-64.8-41.9177.800000111.8V191 I192 Q193 M197 F198 A199V191-A195 PolarHBondContact O-N 3.43Å; I192-A195 WeakPolarHBondContact O-CB 3.25Å; I192-A195 PolarHBondContact O-N 3.16Å; I192-A195 VanDerWaalsContact O-N 3.1Å; Q193-A195 VanDerWaalsContact C-N 3.34Å; Q193-A195 PolarHBondContact O-N 3.46Å; A195-M197 VanDerWaalsContact C-N 3.33Å; A195-M197 PolarHBondContact O-N 3.11Å; A195-F198 PolarHBondContact O-N 3.39Å; A195-A199 PolarHBondContact O-N 3.38Å
196V93.4Very high92.3Very high27 Ų2731.1 Ų31.116%0.16417%0.169CC..Hα-helixtrans-62.9-40.9175.5-179.60000110.7I192 Q193 F198 A199 G200 L341 A344 A345I192-V196 HydrophobicContact CG2-CG2 4.46Å; I192-V196 WeakPolarHBondContact O-CG2 3.46Å; I192-V196 PolarHBondContact O-N 3.42Å; Q193-V196 PolarHBondContact O-N 3.46Å; V196-F198 PolarHBondContact O-N 3.18Å; V196-A199 PolarHBondContact O-N 2.81Å; V196-G200 PolarHBondContact O-N 2.9Å; V196-L341 HydrophobicContact CG1-CD1 4.31Å; V196-A344 HydrophobicContact CG1-CB 4.05Å; V196-A345 HydrophobicContact CG1-CB 4.41Å; V196-A345 WeakPolarHBondContact O-CB 3.32Å
197M92.1Very high92.7Very high1 Ų134 Ų341%0.00518%0.18CC..Hα-helixtrans-57.7-48.6175-73.9172.471.700112.5M66 V71 Q193 L194 A195 A199 G200 F201 A345M66-M197 HydrophobicContact CB-CE 3.99Å; M66-M197 WeakPolarHBondContact O-CE 3.33Å; V71-M197 HydrophobicContact CG2-CE 3.85Å; Q193-M197 VanDerWaalsContact O-CG 3.28Å; Q193-M197 WeakPolarHBondContact O-CG 3.47Å; Q193-M197 PolarHBondContact O-N 2.93Å; L194-M197 WeakPolarHBondContact O-CB 3.48Å; L194-M197 PolarHBondContact O-N 3.1Å; A195-M197 VanDerWaalsContact C-N 3.33Å; A195-M197 PolarHBondContact O-N 3.11Å; M197-A199 VanDerWaalsContact C-N 3.34Å; M197-A199 PolarHBondContact O-N 3.39Å; M197-G200 PolarHBondContact O-N 3.47Å; M197-F201 PolarHBondContact O-N 2.87Å; M197-F201 VanDerWaalsContact O-N 3.12Å; M197-A345 VanDerWaalsContact CG-O 3.3Å; M197-A345 WeakPolarHBondContact CG-O 3.3Å
198F92.6Very high93.1Very high62 Ų6234 Ų3427%0.27218%0.18SC..Hα-helixtrans-62.1-41.1176.6-83.5-67.4000112.4L194 A195 V196 G200 F201 L202 I291L194-F198 HydrophobicContact CD1-CD2 4.13Å; L194-F198 HydrophobicContact CD1-CE2 3.69Å; L194-F198 HydrophobicContact CD2-CE2 4.5Å; L194-F198 HydrophobicContact CG-CD2 4.11Å; L194-F198 HydrophobicContact CG-CE2 3.92Å; L194-F198 VanDerWaalsContact O-CD2 3.27Å; L194-F198 WeakPolarHBondContact O-CD2 3.34Å; L194-F198 PolarHBondContact O-N 3.24Å; L194-F198 VanDerWaalsContact O-N 3.1Å; A195-F198 PolarHBondContact O-N 3.39Å; V196-F198 PolarHBondContact O-N 3.18Å; F198-G200 VanDerWaalsContact C-N 3.33Å; F198-G200 PolarHBondContact O-N 2.77Å; F198-F201 PolarHBondContact O-N 3.26Å; F198-L202 VanDerWaalsContact O-CB 3.3Å; F198-L202 WeakPolarHBondContact O-CB 3.46Å; F198-L202 PolarHBondContact O-N 3.4Å; F198-I291 HydrophobicContact CE1-CG1 4.11Å; F198-I291 HydrophobicContact CE2-CG1 4.09Å; F198-I291 HydrophobicContact CZ-CG1 3.59Å
199A94.5Very high93.6Very high36 Ų3630.2 Ų30.230%0.29817%0.169SC..Hα-helixtrans-61.4-41177.200000112.2A195 V196 M197 L202 T203 L341A195-A199 PolarHBondContact O-N 3.38Å; V196-A199 PolarHBondContact O-N 2.81Å; M197-A199 VanDerWaalsContact C-N 3.34Å; M197-A199 PolarHBondContact O-N 3.39Å; A199-L202 PolarHBondContact O-N 3.09Å; A199-T203 WeakPolarHBondContact O-CB 3.23Å; A199-T203 PolarHBondContact O-N 3.28Å; A199-T203 PolarHBondContact O-OG1 3.18Å; A199-L341 HydrophobicContact CB-CD1 4.45Å; A199-L341 HydrophobicContact CB-CD2 4.32Å
200G93.9Very high93.9Very high0 Ų034.6 Ų34.60%020%0.195CC..Hα-helixtrans-62.3-48.5175.800000112.8V196 M197 F198 L202 T203 V204V196-G200 PolarHBondContact O-N 2.9Å; M197-G200 PolarHBondContact O-N 3.47Å; F198-G200 VanDerWaalsContact C-N 3.33Å; F198-G200 PolarHBondContact O-N 2.77Å; G200-L202 PolarHBondContact O-N 2.89Å; G200-T203 PolarHBondContact O-N 3.22Å; G200-V204 PolarHBondContact O-N 3.34Å
201F93.6Very high94Very high3 Ų337.7 Ų37.71%0.01321%0.212CC..Hα-helixtrans-59.5-47.9174.6-84.4-58.2000112V71 P75 M197 F198 T203 V204 I205 I291 A298V71-F201 HydrophobicContact CB-CZ 4.22Å; V71-F201 HydrophobicContact CG1-CE1 4.35Å; V71-F201 HydrophobicContact CG1-CZ 4.14Å; V71-F201 HydrophobicContact CG2-CE2 4.1Å; V71-F201 HydrophobicContact CG2-CZ 4.13Å; P75-F201 HydrophobicContact CG-CE1 4.41Å; M197-F201 PolarHBondContact O-N 2.87Å; M197-F201 VanDerWaalsContact O-N 3.12Å; F198-F201 PolarHBondContact O-N 3.26Å; F201-T203 VanDerWaalsContact C-N 3.26Å; F201-T203 PolarHBondContact O-N 3.3Å; F201-V204 PolarHBondContact O-N 3.47Å; F201-I205 HydrophobicContact CB-CD1 4.38Å; F201-I205 WeakPolarHBondContact O-CB 2.99Å; F201-I205 VanDerWaalsContact O-CG1 3.24Å; F201-I205 WeakPolarHBondContact O-CG1 3.44Å; F201-I205 PolarHBondContact O-N 3.32Å; F201-I291 HydrophobicContact CE2-CG2 4.31Å; F201-A298 HydrophobicContact CD1-CB 4.03Å; F201-A298 HydrophobicContact CE1-CB 4.23Å
202L95.3Very high94.2Very high98 Ų9838.4 Ų38.451%0.51321%0.213SC..Hα-helixtrans-61.5-37.8-176.1-173.463000111.5F198 A199 G200 I205 I206F198-L202 VanDerWaalsContact O-CB 3.3Å; F198-L202 WeakPolarHBondContact O-CB 3.46Å; F198-L202 PolarHBondContact O-N 3.4Å; A199-L202 PolarHBondContact O-N 3.09Å; G200-L202 PolarHBondContact O-N 2.89Å; L202-I205 PolarHBondContact O-N 3.21Å; L202-I206 HydrophobicContact CD1-CD1 3.83Å; L202-I206 HydrophobicContact CD1-CG1 3.98Å; L202-I206 HydrophobicContact CD2-CD1 4.2Å; L202-I206 HydrophobicContact CG-CD1 3.6Å; L202-I206 HydrophobicContact CG-CG1 4.15Å; L202-I206 WeakPolarHBondContact O-CB 3.31Å; L202-I206 WeakPolarHBondContact O-CG1 3.25Å; L202-I206 PolarHBondContact O-N 3.2Å
203T94.9Very high94.4Very high27 Ų2738.2 Ų38.217%0.16623%0.228CC..Hα-helixtrans-62.8-47.7178.8-60.10000111.5A199 G200 F201 R207 L332 L338A199-T203 WeakPolarHBondContact O-CB 3.23Å; A199-T203 PolarHBondContact O-N 3.28Å; A199-T203 PolarHBondContact O-OG1 3.18Å; G200-T203 PolarHBondContact O-N 3.22Å; F201-T203 VanDerWaalsContact C-N 3.26Å; F201-T203 PolarHBondContact O-N 3.3Å; T203-R207 WeakPolarHBondContact O-CB 3.3Å; T203-R207 PolarHBondContact O-N 3.47Å; T203-R207 VanDerWaalsContact O-N 3.11Å; T203-L332 HydrophobicContact CG2-CD1 3.83Å; T203-L332 HydrophobicContact CG2-CD2 4.06Å; T203-L338 HydrophobicContact CG2-CB 4.05Å; T203-L338 HydrophobicContact CG2-CD1 4.02Å; T203-L338 HydrophobicContact CG2-CD2 3.98Å; T203-L338 HydrophobicContact CG2-CG 4.24Å
204V95Very high94.5Very high0 Ų039.4 Ų39.40%024%0.24CC..Hα-helixtrans-65.9-42.7178.1179.50000111.1G200 F201 R207 S208 M324 L327 V328 I331 L332 F342G200-V204 PolarHBondContact O-N 3.34Å; F201-V204 PolarHBondContact O-N 3.47Å; V204-R207 PolarHBondContact O-N 2.92Å; V204-S208 WeakPolarHBondContact O-CB 3.3Å; V204-S208 PolarHBondContact O-N 3.11Å; V204-S208 PolarHBondContact O-OG 3.5Å; V204-M324 HydrophobicContact CG1-CE 3.99Å; V204-L327 HydrophobicContact CG1-CD2 3.85Å; V204-V328 HydrophobicContact CG2-CG2 3.54Å; V204-I331 HydrophobicContact CG1-CD1 4.32Å; V204-L332 HydrophobicContact CG2-CD1 4.14Å; V204-F342 HydrophobicContact CG2-CD2 3.53Å; V204-F342 HydrophobicContact CG2-CE2 3.93Å; V204-F342 HydrophobicContact CG2-CG 4.28Å
205I96.8Very high94.8Very high23 Ų2341.6 Ų41.612%0.11825%0.254CS..Hα-helixtrans-62-52.2179.1-73.3170.3000110.9F201 L202 R207 S208 V209 F297 A298F201-I205 HydrophobicContact CB-CD1 4.38Å; F201-I205 WeakPolarHBondContact O-CB 2.99Å; F201-I205 VanDerWaalsContact O-CG1 3.24Å; F201-I205 WeakPolarHBondContact O-CG1 3.44Å; F201-I205 PolarHBondContact O-N 3.32Å; L202-I205 PolarHBondContact O-N 3.21Å; I205-R207 VanDerWaalsContact C-N 3.32Å; I205-R207 PolarHBondContact O-N 3.27Å; I205-S208 PolarHBondContact O-N 3.17Å; I205-V209 HydrophobicContact CG2-CG2 4.42Å; I205-V209 VanDerWaalsContact O-CG2 3.26Å; I205-V209 WeakPolarHBondContact O-CG2 3.32Å; I205-V209 PolarHBondContact O-N 3.19Å; I205-F297 HydrophobicContact CB-CD1 4.4Å; I205-F297 HydrophobicContact CD1-CD1 4.07Å; I205-F297 HydrophobicContact CG1-CD1 3.98Å; I205-F297 HydrophobicContact CG2-CD1 3.62Å; I205-F297 HydrophobicContact CG2-CE1 3.62Å; I205-A298 HydrophobicContact CD1-CB 4.45Å; I205-A298 HydrophobicContact CG1-CB 4.22Å
206I96.3Very high95Very high93 Ų9345.2 Ų45.248%0.47726%0.263SS..Hα-helixtrans-58.4-47.6-179.5-71.4172.2000110L202 S208 V209 V210L202-I206 HydrophobicContact CD1-CD1 3.83Å; L202-I206 HydrophobicContact CD1-CG1 3.98Å; L202-I206 HydrophobicContact CD2-CD1 4.2Å; L202-I206 HydrophobicContact CG-CD1 3.6Å; L202-I206 HydrophobicContact CG-CG1 4.15Å; L202-I206 WeakPolarHBondContact O-CB 3.31Å; L202-I206 WeakPolarHBondContact O-CG1 3.25Å; L202-I206 PolarHBondContact O-N 3.2Å; I206-S208 VanDerWaalsContact C-N 3.35Å; I206-S208 PolarHBondContact O-N 3.21Å; I206-V209 PolarHBondContact O-N 3.02Å; I206-V210 WeakPolarHBondContact O-CG2 3.32Å; I206-V210 PolarHBondContact O-N 3.45Å
207R95.7Very high95.1Very high63 Ų6347.5 Ų47.524%0.23827%0.274CS..Hα-helixtrans-62.7-42.7-179.2-177.359.9176.8156.70.4111.9T203 V204 I205 V210 L211 I331 L332T203-R207 WeakPolarHBondContact O-CB 3.3Å; T203-R207 PolarHBondContact O-N 3.47Å; T203-R207 VanDerWaalsContact O-N 3.11Å; V204-R207 PolarHBondContact O-N 2.92Å; I205-R207 VanDerWaalsContact C-N 3.32Å; I205-R207 PolarHBondContact O-N 3.27Å; R207-V210 PolarHBondContact O-N 3.44Å; R207-L211 HydrophobicContact CG-CD1 4.22Å; R207-L211 WeakPolarHBondContact O-CG 3.39Å; R207-L211 PolarHBondContact O-N 3.33Å; R207-I331 HydrophobicContact CB-CD1 3.98Å; R207-I331 HydrophobicContact CG-CB 4.04Å; R207-I331 HydrophobicContact CG-CD1 3.76Å; R207-I331 HydrophobicContact CG-CG1 4Å; R207-I331 PolarHBondContact NE-O 3.25Å; R207-L332 HydrophobicContact CB-CD2 3.87Å; R207-L332 HydrophobicContact CB-CG 4.41Å; R207-L332 HydrophobicContact CG-CD2 3.78Å; R207-L332 HydrophobicContact CG-CG 4.2Å
208S95.6Very high95.3Very high0 Ų047.5 Ų47.50%027%0.274CS..Hα-helixtrans-63.5-42.2177.9-57.60000112.1V204 I205 I206 V210 L211 Q212 I331V204-S208 WeakPolarHBondContact O-CB 3.3Å; V204-S208 PolarHBondContact O-N 3.11Å; V204-S208 PolarHBondContact O-OG 3.5Å; I205-S208 PolarHBondContact O-N 3.17Å; I206-S208 VanDerWaalsContact C-N 3.35Å; I206-S208 PolarHBondContact O-N 3.21Å; S208-V210 VanDerWaalsContact C-N 3.34Å; S208-V210 PolarHBondContact O-N 3.34Å; S208-L211 PolarHBondContact O-N 3.41Å; S208-Q212 WeakPolarHBondContact O-CB 3.31Å; S208-Q212 WeakPolarHBondContact O-CG 3.46Å; S208-Q212 PolarHBondContact O-N 2.83Å; S208-I331 WeakPolarHBondContact OG-CD1 3.47Å
209V96.8Very high95.5Very high29 Ų2947.8 Ų47.818%0.17628%0.278CS..Hα-helixtrans-61.4-42.5176.6169.90000111.4I205 I206 G213 G214 V215 I218 F297I205-V209 HydrophobicContact CG2-CG2 4.42Å; I205-V209 VanDerWaalsContact O-CG2 3.26Å; I205-V209 WeakPolarHBondContact O-CG2 3.32Å; I205-V209 PolarHBondContact O-N 3.19Å; I206-V209 PolarHBondContact O-N 3.02Å; V209-G213 PolarHBondContact O-N 2.54Å; V209-G214 PolarHBondContact O-N 3.21Å; V209-V215 HydrophobicContact CG1-CG2 3.83Å; V209-V215 HydrophobicContact CG2-CG2 3.82Å; V209-I218 HydrophobicContact CB-CD1 4.4Å; V209-I218 HydrophobicContact CG2-CD1 3.78Å; V209-F297 HydrophobicContact CG2-CE1 4.04Å; V209-F297 HydrophobicContact CG2-CZ 4.33Å
210V95.9Very high95.6Very high93 Ų9348.3 Ų48.356%0.56428%0.279SS*.Hα-helixtrans-64-44176.6171.80000111I206 R207 S208 Q212 G213I206-V210 WeakPolarHBondContact O-CG2 3.32Å; I206-V210 PolarHBondContact O-N 3.45Å; R207-V210 PolarHBondContact O-N 3.44Å; S208-V210 VanDerWaalsContact C-N 3.34Å; S208-V210 PolarHBondContact O-N 3.34Å; V210-Q212 PolarHBondContact O-N 3.33Å; V210-G213 PolarHBondContact O-N 3.31Å
211L94.5Very high95.6Very high66 Ų6649 Ų4935%0.34628%0.283SS..Hα-helixtrans-64.8-39179.8-74.3173.8000113R207 S208 G213 I331R207-L211 HydrophobicContact CG-CD1 4.22Å; R207-L211 WeakPolarHBondContact O-CG 3.39Å; R207-L211 PolarHBondContact O-N 3.33Å; S208-L211 PolarHBondContact O-N 3.41Å; L211-G213 VanDerWaalsContact C-N 3.25Å; L211-G213 PolarHBondContact O-N 2.9Å; L211-I331 HydrophobicContact CD1-CB 3.58Å; L211-I331 HydrophobicContact CD1-CD1 4.48Å; L211-I331 HydrophobicContact CD1-CG2 3.4Å
212Q95Very high95.7Very high42 Ų4248.9 Ų48.920%0.19628%0.282CS..THydrogen-bonded Turntrans-83.30.4179.8-65.2-61.7-23.200113.4S208 V210 G214 N217 I218 S304 V305S208-Q212 WeakPolarHBondContact O-CB 3.31Å; S208-Q212 WeakPolarHBondContact O-CG 3.46Å; S208-Q212 PolarHBondContact O-N 2.83Å; V210-Q212 PolarHBondContact O-N 3.33Å; Q212-G214 VanDerWaalsContact C-N 3.31Å; Q212-G214 PolarHBondContact O-N 3.44Å; Q212-N217 WeakPolarHBondContact O-CB 3.43Å; Q212-N217 PolarHBondContact O-ND2 2.83Å; Q212-I218 HydrophobicContact CB-CD1 4.16Å; Q212-I218 HydrophobicContact CB-CG1 3.75Å; Q212-I218 HydrophobicContact CG-CD1 4.32Å; Q212-I218 HydrophobicContact CG-CG1 3.88Å; Q212-S304 VanDerWaalsContact CD-OG 3.27Å; Q212-S304 WeakPolarHBondContact CG-OG 3.05Å; Q212-S304 PolarHBondContact NE2-O 3.15Å; Q212-S304 PolarHBondContact OE1-OG 3.33Å; Q212-V305 HydrophobicContact CG-CG2 4.41Å
213G94.3Very high95.6Very high63 Ų6350.4 Ų50.465%0.64929%0.287SS*.THydrogen-bonded Turntrans71.522.8179.500000114.1V209 V210 L211V209-G213 PolarHBondContact O-N 2.54Å; V210-G213 PolarHBondContact O-N 3.31Å; L211-G213 VanDerWaalsContact C-N 3.25Å; L211-G213 PolarHBondContact O-N 2.9Å
214G94.8Very high95.6Very high24 Ų2456.3 Ų56.325%0.24731%0.313CS..SBendtrans131162.5174.700000114.8V209 Q212 I216 N217V209-G214 PolarHBondContact O-N 3.21Å; Q212-G214 VanDerWaalsContact C-N 3.31Å; Q212-G214 PolarHBondContact O-N 3.44Å; G214-I216 VanDerWaalsContact C-N 3.3Å; G214-I216 PolarHBondContact O-N 3.22Å; G214-N217 PolarHBondContact O-N 3.24Å
215V96.4Very high95.3Very high62 Ų6257.1 Ų57.138%0.37632%0.321SS..Hα-helixtrans-64.4-34.3-179.3173.70000112.1V209 N217 I218 I219 F297V209-V215 HydrophobicContact CG1-CG2 3.83Å; V209-V215 HydrophobicContact CG2-CG2 3.82Å; V215-N217 VanDerWaalsContact C-N 3.29Å; V215-N217 PolarHBondContact O-N 3.4Å; V215-I218 PolarHBondContact O-N 2.84Å; V215-I219 HydrophobicContact CG1-CD1 3.75Å; V215-I219 HydrophobicContact CG1-CG1 4.24Å; V215-I219 WeakPolarHBondContact O-CG1 3.37Å; V215-I219 PolarHBondContact O-N 2.8Å; V215-F297 HydrophobicContact CB-CZ 4.5Å; V215-F297 HydrophobicContact CG1-CE2 3.97Å; V215-F297 HydrophobicContact CG1-CZ 3.82Å; V215-F297 HydrophobicContact CG2-CZ 4.21Å
216I96.8Very high95.1Very high137 Ų13756.7 Ų56.770%0.70332%0.322SS*.Hα-helixtrans-62.3-38.6-177.2-62.2173.8000111G214 I219 S220G214-I216 VanDerWaalsContact C-N 3.3Å; G214-I216 PolarHBondContact O-N 3.22Å; I216-I219 PolarHBondContact O-N 3.24Å; I216-S220 WeakPolarHBondContact O-CB 3.41Å; I216-S220 PolarHBondContact O-N 3.15Å
217N96.2Very high94.9Very high76 Ų7652.4 Ų52.441%0.40630%0.3SS..Hα-helixtrans-66.2-41178.7-67.5-11.8000111.2Q212 G214 V215 I219 S220 D221Q212-N217 WeakPolarHBondContact O-CB 3.43Å; Q212-N217 PolarHBondContact O-ND2 2.83Å; G214-N217 PolarHBondContact O-N 3.24Å; V215-N217 VanDerWaalsContact C-N 3.29Å; V215-N217 PolarHBondContact O-N 3.4Å; N217-I219 VanDerWaalsContact C-N 3.35Å; N217-I219 PolarHBondContact O-N 3.31Å; N217-S220 PolarHBondContact O-N 3.34Å; N217-D221 WeakPolarHBondContact O-CB 3.35Å; N217-D221 PolarHBondContact O-N 3.01Å
218I96.8Very high94.7Very high0 Ų051.7 Ų51.70%030%0.301CS..Hα-helixtrans-62.5-42.9176.7-65.2166.4000111.3V209 Q212 V215 S222 M300V209-I218 HydrophobicContact CB-CD1 4.4Å; V209-I218 HydrophobicContact CG2-CD1 3.78Å; Q212-I218 HydrophobicContact CB-CD1 4.16Å; Q212-I218 HydrophobicContact CB-CG1 3.75Å; Q212-I218 HydrophobicContact CG-CD1 4.32Å; Q212-I218 HydrophobicContact CG-CG1 3.88Å; V215-I218 PolarHBondContact O-N 2.84Å; I218-S222 VanDerWaalsContact O-CB 3.3Å; I218-S222 WeakPolarHBondContact O-CB 3.36Å; I218-S222 PolarHBondContact O-N 3.26Å; I218-S222 PolarHBondContact O-OG 3.41Å; I218-M300 HydrophobicContact CG2-CB 4.01Å
219I95.9Very high94.2Very high69 Ų6957.3 Ų57.335%0.35433%0.331SS..Hα-helixtrans-65.6-46.1177.2-66.9174000110.2V215 I216 N217 S222 Q223 L228V215-I219 HydrophobicContact CG1-CD1 3.75Å; V215-I219 HydrophobicContact CG1-CG1 4.24Å; V215-I219 WeakPolarHBondContact O-CG1 3.37Å; V215-I219 PolarHBondContact O-N 2.8Å; I216-I219 PolarHBondContact O-N 3.24Å; N217-I219 VanDerWaalsContact C-N 3.35Å; N217-I219 PolarHBondContact O-N 3.31Å; I219-S222 PolarHBondContact O-N 3.12Å; I219-Q223 WeakPolarHBondContact O-CB 3.36Å; I219-Q223 PolarHBondContact O-N 3.16Å; I219-L228 HydrophobicContact CG2-CD1 3.79Å; I219-L228 WeakPolarHBondContact O-CD1 3.26Å
220S96.3Very high93.4Very high46 Ų4658.9 Ų58.932%0.32234%0.338SS..Hα-helixtrans-60.6-47.1178.4-174.70000111.7I216 N217 S222 Q223 Q224I216-S220 WeakPolarHBondContact O-CB 3.41Å; I216-S220 PolarHBondContact O-N 3.15Å; N217-S220 PolarHBondContact O-N 3.34Å; S220-S222 VanDerWaalsContact C-N 3.35Å; S220-S222 PolarHBondContact O-N 3.47Å; S220-Q223 WeakPolarHBondContact O-CB 3.41Å; S220-Q223 PolarHBondContact O-N 3.44Å; S220-Q224 VanDerWaalsContact O-CG 3.3Å; S220-Q224 WeakPolarHBondContact O-CG 3.32Å; S220-Q224 PolarHBondContact O-N 3.4Å; S220-Q224 PolarHBondContact OG-NE2 3.29Å; S220-Q224 VanDerWaalsContact OG-NE2 3.12Å
221D94.9Very high92.4Very high15 Ų1561.6 Ų61.68%0.0835%0.349CS..Hα-helixtrans-58.2-48.2175.5-74.4-16.7000110.9N217 Q223 Q224 G225 F303 S304 K307N217-D221 WeakPolarHBondContact O-CB 3.35Å; N217-D221 PolarHBondContact O-N 3.01Å; D221-Q223 VanDerWaalsContact C-N 3.29Å; D221-Q223 PolarHBondContact O-N 3.22Å; D221-Q224 PolarHBondContact O-N 3.07Å; D221-G225 PolarHBondContact O-N 3.14Å; D221-F303 WeakPolarHBondContact O-CE1 3.17Å; D221-S304 PolarHBondContact OD2-OG 3.08Å; D221-K307 HydrophobicContact CB-CD 4.23Å; D221-K307 IonicContact OD1-NZ 3.75Å; D221-K307 PolarHBondContact OD1-NZ 3.2Å; D221-K307 WeakPolarHBondContact OD2-CD 3.34Å; D221-K307 IonicContact OD2-NZ 3.26Å; D221-K307 PolarHBondContact OD2-NZ 3.35Å
222S95.1Very high91.7Very high0 Ų060.6 Ų60.60%034%0.344CS..Hα-helixtrans-64.2-33.9179.3-59.70000112.4I218 I219 S220 G226 R227 L228 M300I218-S222 VanDerWaalsContact O-CB 3.3Å; I218-S222 WeakPolarHBondContact O-CB 3.36Å; I218-S222 PolarHBondContact O-N 3.26Å; I218-S222 PolarHBondContact O-OG 3.41Å; I219-S222 PolarHBondContact O-N 3.12Å; S220-S222 VanDerWaalsContact C-N 3.35Å; S220-S222 PolarHBondContact O-N 3.47Å; S222-G226 PolarHBondContact O-N 3.08Å; S222-R227 WeakPolarHBondContact O-CB 3.44Å; S222-R227 PolarHBondContact O-N 3.33Å; S222-L228 PolarHBondContact O-N 2.93Å; S222-M300 WeakPolarHBondContact OG-CB 3.35Å
223Q94.4Very high91.4Very high130 Ų13063.3 Ų63.361%0.60736%0.355SS*.Hα-helixtrans-68.9-46.7174.9-168.3171.9-4.500111.4I219 S220 D221 G225 G226 L228I219-Q223 WeakPolarHBondContact O-CB 3.36Å; I219-Q223 PolarHBondContact O-N 3.16Å; S220-Q223 WeakPolarHBondContact O-CB 3.41Å; S220-Q223 PolarHBondContact O-N 3.44Å; D221-Q223 VanDerWaalsContact C-N 3.29Å; D221-Q223 PolarHBondContact O-N 3.22Å; Q223-G225 VanDerWaalsContact C-N 3.29Å; Q223-G225 PolarHBondContact O-N 3.13Å; Q223-G226 PolarHBondContact O-N 3.05Å; Q223-L228 HydrophobicContact CB-CD1 4.1Å
224Q93.4Very high91.1Very high151 Ų15163.2 Ų63.271%0.70634%0.339SS*.Hα-helixtrans-63.3-37.2177.3-69.4172.530.100111.7S220 D221 G226S220-Q224 VanDerWaalsContact O-CG 3.3Å; S220-Q224 WeakPolarHBondContact O-CG 3.32Å; S220-Q224 PolarHBondContact O-N 3.4Å; S220-Q224 PolarHBondContact OG-NE2 3.29Å; S220-Q224 VanDerWaalsContact OG-NE2 3.12Å; D221-Q224 PolarHBondContact O-N 3.07Å; Q224-G226 PolarHBondContact O-N 3.24Å
225G90.3Very high90.7Very high18 Ų1866.6 Ų66.619%0.18636%0.357CS..THydrogen-bonded Turntrans-72.8-4.1172.700000114.4D221 Q223 R227D221-G225 PolarHBondContact O-N 3.14Å; Q223-G225 VanDerWaalsContact C-N 3.29Å; Q223-G225 PolarHBondContact O-N 3.13Å; G225-R227 VanDerWaalsContact O-CD 3.25Å; G225-R227 WeakPolarHBondContact O-CD 3.33Å; G225-R227 PolarHBondContact O-N 2.97Å; G225-R227 PolarHBondContact O-NH1 2.99Å
226G91.1Very high90.4Very high13 Ų1366 Ų6613%0.13435%0.352CS..THydrogen-bonded Turntrans73.48.9-178.200000115S222 Q223 Q224 L228 N229S222-G226 PolarHBondContact O-N 3.08Å; Q223-G226 PolarHBondContact O-N 3.05Å; Q224-G226 PolarHBondContact O-N 3.24Å; G226-L228 PolarHBondContact O-N 2.78Å; G226-N229 WeakPolarHBondContact O-CB 3.5Å; G226-N229 PolarHBondContact O-N 2.91Å; G226-N229 PolarHBondContact O-ND2 3.32Å
227R93.4Very high89.9Confident4 Ų462.2 Ų62.22%0.01534%0.336CS..THydrogen-bonded Turntrans-71.7-20.6179.4-79.768.6-177.6160.5-1.3112.2Y79 G82 A83 S222 G225 F303 L473 P474Y79-R227 PolarHBondContact O-NE 3.27Å; Y79-R227 PolarHBondContact O-NH2 3.44Å; G82-R227 WeakPolarHBondContact CA-O 3.24Å; A83-R227 WeakPolarHBondContact CB-O 3.31Å; A83-R227 PolarHBondContact N-O 2.89Å; S222-R227 WeakPolarHBondContact O-CB 3.44Å; S222-R227 PolarHBondContact O-N 3.33Å; G225-R227 VanDerWaalsContact O-CD 3.25Å; G225-R227 WeakPolarHBondContact O-CD 3.33Å; G225-R227 PolarHBondContact O-N 2.97Å; G225-R227 PolarHBondContact O-NH1 2.99Å; R227-F303 HydrophobicContact CG-CD1 4.38Å; R227-F303 HydrophobicContact CG-CG 4.31Å; R227-F303 VanDerWaalsContact NE-CE2 3.26Å; R227-F303 VanDerWaalsContact NH2-CE2 3.34Å; R227-L473 HydrophobicContact CB-CD1 4.45Å; R227-L473 HydrophobicContact CG-CD1 3.81Å; R227-P474 PolarHBondContact NH1-O 3.29Å; R227-P474 PolarHBondContact NH2-O 3.46Å
228L91.3Very high89.5Confident48 Ų4860.3 Ų60.325%0.25133%0.325SS..THydrogen-bonded Turntrans-92.511.5176.7-71178.3000114.1A83 I219 S222 Q223 G226 L230 M300A83-L228 HydrophobicContact CB-CD2 4.18Å; I219-L228 HydrophobicContact CG2-CD1 3.79Å; I219-L228 WeakPolarHBondContact O-CD1 3.26Å; S222-L228 PolarHBondContact O-N 2.93Å; Q223-L228 HydrophobicContact CB-CD1 4.1Å; G226-L228 PolarHBondContact O-N 2.78Å; L228-L230 PolarHBondContact O-N 3.46Å; L228-M300 HydrophobicContact CD2-SD 3.53Å; L228-M300 VanDerWaalsContact CD2-SD 3.53Å; L228-M300 HydrophobicContact CG-SD 4.3Å
229N85Confident89Confident118 Ų11861 Ų6163%0.63133%0.328SS*.  trans-7577.6174.4-71.3-20.1000110.7G226 L231G226-N229 WeakPolarHBondContact O-CB 3.5Å; G226-N229 PolarHBondContact O-N 2.91Å; G226-N229 PolarHBondContact O-ND2 3.32Å; N229-L231 VanDerWaalsContact C-N 3.29Å; N229-L231 PolarHBondContact O-N 2.97Å
230L80Confident88.6Confident62 Ų6258.8 Ų58.833%0.32532%0.315SS..  trans-77.6-10.7-179.4-62.7176.5000113.4A83 F87 L228 D232A83-L230 VanDerWaalsContact C-CD2 3.42Å; A83-L230 HydrophobicContact CB-CD2 3.88Å; A83-L230 VanDerWaalsContact O-CD2 3.28Å; A83-L230 WeakPolarHBondContact O-CD2 3.33Å; F87-L230 HydrophobicContact CE2-CB 4.42Å; F87-L230 WeakPolarHBondContact CE2-O 3.32Å; F87-L230 HydrophobicContact CZ-CB 4.21Å; F87-L230 WeakPolarHBondContact CZ-O 3.03Å; L228-L230 PolarHBondContact O-N 3.46Å; L230-D232 VanDerWaalsContact C-N 3.31Å; L230-D232 PolarHBondContact O-N 3.1Å
231L74.1Confident88.3Confident150 Ų15057.3 Ų57.379%0.78530%0.303SS*.  trans-91.942.6-171.1-58.3173.1000113.2N229 F233N229-L231 VanDerWaalsContact C-N 3.29Å; N229-L231 PolarHBondContact O-N 2.97Å; L231-F233 HydrophobicContact CB-CD2 4.49Å; L231-F233 HydrophobicContact CB-CE2 4.3Å; L231-F233 HydrophobicContact CD2-CE2 3.75Å; L231-F233 PolarHBondContact O-N 3.03Å
232D80.5Confident88.1Confident45 Ų4556.6 Ų56.624%0.24130%0.3CS..  trans-92.192.6170-169.9-4.3000110.5L230 D234 R239 F243L230-D232 VanDerWaalsContact C-N 3.31Å; L230-D232 PolarHBondContact O-N 3.1Å; D232-D234 WeakPolarHBondContact OD1-CB 3.39Å; D232-D234 PolarHBondContact OD1-N 3.47Å; D232-D234 VanDerWaalsContact OD1-N 3.16Å; D232-R239 IonicContact OD2-CZ 3.97Å; D232-R239 IonicContact OD2-NE 3.99Å; D232-R239 IonicContact OD2-NH2 3.89Å; D232-R239 PolarHBondContact OD2-NH2 3Å; D232-F243 PolarHBondContact O-N 3.39Å
233F87.8Confident88Confident99 Ų9958.7 Ų58.743%0.43431%0.309SS..  trans-98.118.6178.7-71.6-83.6000113.3L231 P235 F243 W244L231-F233 HydrophobicContact CB-CD2 4.49Å; L231-F233 HydrophobicContact CB-CE2 4.3Å; L231-F233 HydrophobicContact CD2-CE2 3.75Å; L231-F233 PolarHBondContact O-N 3.03Å; F233-P235 WeakPolarHBondContact O-CD 3.35Å; F233-F243 HydrophobicContact CD1-CB 3.64Å; F233-F243 AromaticContact CD1-CD1 3.65Å; F233-F243 HydrophobicContact CD1-CD1 3.65Å; F233-F243 HydrophobicContact CD1-CD2 4.35Å; F233-F243 HydrophobicContact CD1-CE1 4.41Å; F233-F243 AromaticContact CD1-CG 3.61Å; F233-F243 HydrophobicContact CD1-CG 3.61Å; F233-F243 HydrophobicContact CE1-CB 3.81Å; F233-F243 AromaticContact CE1-CD1 3.63Å; F233-F243 HydrophobicContact CE1-CD1 3.63Å; F233-F243 AromaticContact CE1-CD2 3.68Å; F233-F243 HydrophobicContact CE1-CD2 3.68Å; F233-F243 HydrophobicContact CE1-CE1 4.09Å; F233-F243 HydrophobicContact CE1-CE2 4.14Å; F233-F243 AromaticContact CE1-CG 3.4Å; F233-F243 HydrophobicContact CE1-CG 3.4Å; F233-F243 HydrophobicContact CE1-CZ 4.33Å; F233-F243 HydrophobicContact CG-CB 4.36Å; F233-F243 HydrophobicContact CZ-CD2 4.35Å; F233-F243 HydrophobicContact CZ-CG 4.38Å; F233-W244 PolarHBondContact O-NE1 3.45Å; F233-W244 VanDerWaalsContact O-NE1 3.07Å
234D88.1Confident87.9Confident60 Ų6057.1 Ų57.132%0.32130%0.297SS..  trans-59.2119176-175.1-6000110.4D232 N236 R239 T242D232-D234 WeakPolarHBondContact OD1-CB 3.39Å; D232-D234 PolarHBondContact OD1-N 3.47Å; D232-D234 VanDerWaalsContact OD1-N 3.16Å; D234-N236 PolarHBondContact O-N 3.47Å; D234-N236 WeakPolarHBondContact OD1-CB 3.48Å; D234-N236 PolarHBondContact OD1-N 2.91Å; D234-R239 IonicContact OD2-NE 3.64Å; D234-T242 HydrophobicContact CB-CG2 4.29Å; D234-T242 WeakPolarHBondContact O-CB 3.25Å; D234-T242 WeakPolarHBondContact O-CG2 3.37Å; D234-T242 PolarHBondContact O-OG1 3.25Å
235P88.1Confident87.8Confident95 Ų9550 Ų5062%0.61726%0.264SS*.  trans-75.6-2.1179.633-37000113.5F233 P237F233-P235 WeakPolarHBondContact O-CD 3.35Å; P235-P237 VanDerWaalsContact O-CD 3.32Å; P235-P237 WeakPolarHBondContact O-CD 3.08Å
236N88.4Confident88Confident51 Ų5149.1 Ų49.127%0.27326%0.255SS..  trans-60.7115.2-179.6-179.3-0.8000111.7D234 L238 R239D234-N236 PolarHBondContact O-N 3.47Å; D234-N236 WeakPolarHBondContact OD1-CB 3.48Å; D234-N236 PolarHBondContact OD1-N 2.91Å; N236-L238 PolarHBondContact O-N 3.48Å; N236-L238 VanDerWaalsContact OD1-CB 3.32Å; N236-L238 WeakPolarHBondContact OD1-CB 3.49Å; N236-L238 WeakPolarHBondContact OD1-CG 3.29Å; N236-L238 PolarHBondContact OD1-N 3.49Å; N236-R239 HydrophobicContact CB-CG 3.8Å; N236-R239 WeakPolarHBondContact O-CB 3.42Å; N236-R239 WeakPolarHBondContact O-CG 3.24Å; N236-R239 PolarHBondContact O-N 3.21Å
237P86.5Confident88.1Confident56 Ų5648.8 Ų48.836%0.36425%0.25SS..THydrogen-bonded Turntrans-73.4-9.8-175.232.3-37.5000113.9P235 R239 L520 S521 Y524P235-P237 VanDerWaalsContact O-CD 3.32Å; P235-P237 WeakPolarHBondContact O-CD 3.08Å; P237-R239 VanDerWaalsContact C-N 3.31Å; P237-L520 HydrophobicContact CB-CD1 3.93Å; P237-L520 HydrophobicContact CG-CD1 4.49Å; P237-S521 PolarHBondContact O-N 3.38Å; P237-S521 VanDerWaalsContact O-N 3.07Å; P237-Y524 HydrophobicContact CB-CD2 3.76Å; P237-Y524 HydrophobicContact CB-CE2 3.69Å
238L88.4Confident88.1Confident36 Ų3651.9 Ų51.919%0.18827%0.267CS..THydrogen-bonded Turntrans-81.5-13.9176-50.4-177.5000112.4N236 L469 D516 S519 L520N236-L238 PolarHBondContact O-N 3.48Å; N236-L238 VanDerWaalsContact OD1-CB 3.32Å; N236-L238 WeakPolarHBondContact OD1-CB 3.49Å; N236-L238 WeakPolarHBondContact OD1-CG 3.29Å; N236-L238 PolarHBondContact OD1-N 3.49Å; L238-L469 HydrophobicContact CB-CD1 4.26Å; L238-L469 HydrophobicContact CB-CD2 4.23Å; L238-D516 HydrophobicContact CD1-CB 4.34Å; L238-D516 WeakPolarHBondContact CD2-O 3.46Å; L238-S519 WeakPolarHBondContact CA-O 3.39Å; L238-S519 VanDerWaalsContact O-O 3.05Å; L238-L520 HydrophobicContact CD2-CB 4.4Å; L238-L520 HydrophobicContact CD2-CD1 4.4Å
239R87.1Confident88.3Confident15 Ų1549.6 Ų49.66%0.05726%0.255CS..SBendtrans-70.8134.4176-65.4-81.1-66.8143.4-1.4109.6D232 D234 N236 P237 T242 T245 L469 Q471 S521D232-R239 IonicContact OD2-CZ 3.97Å; D232-R239 IonicContact OD2-NE 3.99Å; D232-R239 IonicContact OD2-NH2 3.89Å; D232-R239 PolarHBondContact OD2-NH2 3Å; D234-R239 IonicContact OD2-NE 3.64Å; N236-R239 HydrophobicContact CB-CG 3.8Å; N236-R239 WeakPolarHBondContact O-CB 3.42Å; N236-R239 WeakPolarHBondContact O-CG 3.24Å; N236-R239 PolarHBondContact O-N 3.21Å; P237-R239 VanDerWaalsContact C-N 3.31Å; R239-T242 HydrophobicContact CB-CG2 3.47Å; R239-T242 VanDerWaalsContact CB-CG2 3.47Å; R239-T242 HydrophobicContact CG-CG2 4Å; R239-T245 VanDerWaalsContact O-CG2 3.29Å; R239-T245 WeakPolarHBondContact O-CG2 3.14Å; R239-L469 PolarHBondContact NH1-O 2.89Å; R239-L469 VanDerWaalsContact NH1-O 3.11Å; R239-Q471 VanDerWaalsContact CZ-CD 3.41Å; R239-Q471 VanDerWaalsContact CZ-OE1 3.31Å; R239-Q471 VanDerWaalsContact NH2-CD 3.28Å; R239-S521 WeakPolarHBondContact O-CB 3.4Å
240R86.6Confident88.7Confident23 Ų2344 Ų449%0.08723%0.225CC..SBendtrans-56.5-60.2-179.4-176.2-177.4178.784-3.5110.9E77 T245 L469 S521 Y522E77-R240 IonicContact OE1-CZ 2.69Å; E77-R240 IonicContact OE1-NH2 3.75Å; E77-R240 PolarHBondContact OE1-NH2 3.48Å; E77-R240 IonicContact OE2-NE 2.54Å; E77-R240 IonicContact OE2-NH2 3.16Å; R240-T245 PolarHBondContact O-OG1 3.47Å; R240-L469 PolarHBondContact N-O 3.49Å; R240-S521 PolarHBondContact O-OG 2.98Å; R240-Y522 HydrophobicContact CG-CE1 4.15Å
241H89.4Confident89.4Confident15 Ų1541.6 Ų41.67%0.06921%0.214CC..SBendtrans-129119-178.4-64160.1000110.7E77 T245 L246 Y522E77-H241 IonicContact OE2-CE1 2.83Å; E77-H241 PolarHBondContact OE2-CE1 3.41Å; E77-H241 VanDerWaalsContact OE2-CE1 3.26Å; H241-T245 WeakPolarHBondContact CA-OG1 3.3Å; H241-L246 HydrophobicContact CB-CD1 4.06Å; H241-L246 HydrophobicContact CB-CG 4.44Å; H241-Y522 AromaticContact NE2-CE1 3.94Å; H241-Y522 AromaticContact NE2-CZ 3.9Å; H241-Y522 PolarHBondContact NE2-OH 2.94Å
242T91.3Very high90.5Very high0 Ų037.2 Ų37.20%019%0.189CC..  trans-138.7172.1167.367.90000107.8D234 R239 W244 T245 L246D234-T242 HydrophobicContact CB-CG2 4.29Å; D234-T242 WeakPolarHBondContact O-CB 3.25Å; D234-T242 WeakPolarHBondContact O-CG2 3.37Å; D234-T242 PolarHBondContact O-OG1 3.25Å; R239-T242 HydrophobicContact CB-CG2 3.47Å; R239-T242 VanDerWaalsContact CB-CG2 3.47Å; R239-T242 HydrophobicContact CG-CG2 4Å; T242-W244 PolarHBondContact O-N 2.97Å; T242-W244 PolarHBondContact OG1-N 3.44Å; T242-T245 PolarHBondContact N-OG1 3.49Å; T242-T245 PolarHBondContact O-N 3.25Å; T242-T245 PolarHBondContact O-OG1 2.78Å; T242-T245 WeakPolarHBondContact OG1-CG2 3.36Å; T242-T245 PolarHBondContact OG1-N 3.26Å; T242-L246 WeakPolarHBondContact O-CB 3.17Å; T242-L246 PolarHBondContact O-N 2.84Å; T242-L246 VanDerWaalsContact O-N 3.1Å
243F92.3Very high91.1Very high44 Ų4435.3 Ų35.319%0.19318%0.178CC..Hα-helixtrans-49.9-42.9171.1175.1-98.7000112F87 D232 F233 S247F87-F243 AromaticContact CD1-CD2 3.63Å; F87-F243 HydrophobicContact CD1-CD2 3.63Å; F87-F243 AromaticContact CD1-CE2 3.97Å; F87-F243 HydrophobicContact CD1-CE2 3.97Å; F87-F243 HydrophobicContact CD2-CD2 4.27Å; F87-F243 AromaticContact CE1-CD2 3.6Å; F87-F243 HydrophobicContact CE1-CD2 3.6Å; F87-F243 HydrophobicContact CE1-CE2 4.03Å; F87-F243 HydrophobicContact CE2-CB 4.39Å; F87-F243 HydrophobicContact CE2-CD2 4.23Å; F87-F243 AromaticContact CG-CD2 3.99Å; F87-F243 HydrophobicContact CG-CD2 3.99Å; F87-F243 AromaticContact CZ-CD2 3.91Å; F87-F243 HydrophobicContact CZ-CD2 3.91Å; D232-F243 PolarHBondContact O-N 3.39Å; F233-F243 HydrophobicContact CD1-CB 3.64Å; F233-F243 AromaticContact CD1-CD1 3.65Å; F233-F243 HydrophobicContact CD1-CD1 3.65Å; F233-F243 HydrophobicContact CD1-CD2 4.35Å; F233-F243 HydrophobicContact CD1-CE1 4.41Å; F233-F243 AromaticContact CD1-CG 3.61Å; F233-F243 HydrophobicContact CD1-CG 3.61Å; F233-F243 HydrophobicContact CE1-CB 3.81Å; F233-F243 AromaticContact CE1-CD1 3.63Å; F233-F243 HydrophobicContact CE1-CD1 3.63Å; F233-F243 AromaticContact CE1-CD2 3.68Å; F233-F243 HydrophobicContact CE1-CD2 3.68Å; F233-F243 HydrophobicContact CE1-CE1 4.09Å; F233-F243 HydrophobicContact CE1-CE2 4.14Å; F233-F243 AromaticContact CE1-CG 3.4Å; F233-F243 HydrophobicContact CE1-CG 3.4Å; F233-F243 HydrophobicContact CE1-CZ 4.33Å; F233-F243 HydrophobicContact CG-CB 4.36Å; F233-F243 HydrophobicContact CZ-CD2 4.35Å; F233-F243 HydrophobicContact CZ-CG 4.38Å; F243-S247 WeakPolarHBondContact O-CB 3.4Å; F243-S247 PolarHBondContact O-N 3.18Å; F243-S247 PolarHBondContact O-OG 3.21Å
244W93Very high91.4Very high97 Ų9731.9 Ų31.937%0.36716%0.163SC..Hα-helixtrans-74.4-44.3-176.3-60.1107000113.2F233 T242 L246 S247 I248 Y524F233-W244 PolarHBondContact O-NE1 3.45Å; F233-W244 VanDerWaalsContact O-NE1 3.07Å; T242-W244 PolarHBondContact O-N 2.97Å; T242-W244 PolarHBondContact OG1-N 3.44Å; W244-L246 VanDerWaalsContact C-N 3.32Å; W244-L246 PolarHBondContact O-N 2.96Å; W244-S247 PolarHBondContact O-N 2.78Å; W244-I248 HydrophobicContact CE3-CD1 3.64Å; W244-I248 HydrophobicContact CE3-CG1 4.31Å; W244-I248 HydrophobicContact CZ3-CD1 4.17Å; W244-I248 WeakPolarHBondContact O-CB 3.43Å; W244-I248 PolarHBondContact O-N 2.97Å; W244-Y524 PolarHBondContact O-OH 2.91Å
245T92.1Very high91.8Very high0 Ų029.7 Ų29.70%015%0.151CC..Iπ-helixtrans-65.9-40.2-178.870.20000110.4R239 R240 H241 T242 G249 G250 Y524R239-T245 VanDerWaalsContact O-CG2 3.29Å; R239-T245 WeakPolarHBondContact O-CG2 3.14Å; R240-T245 PolarHBondContact O-OG1 3.47Å; H241-T245 WeakPolarHBondContact CA-OG1 3.3Å; T242-T245 PolarHBondContact N-OG1 3.49Å; T242-T245 PolarHBondContact O-N 3.25Å; T242-T245 PolarHBondContact O-OG1 2.78Å; T242-T245 WeakPolarHBondContact OG1-CG2 3.36Å; T242-T245 PolarHBondContact OG1-N 3.26Å; T245-G249 WeakPolarHBondContact O-CA 3.46Å; T245-G249 PolarHBondContact O-N 2.81Å; T245-G250 PolarHBondContact O-N 2.69Å; T245-Y524 HydrophobicContact CG2-CD2 4.08Å; T245-Y524 HydrophobicContact CG2-CE2 3.41Å; T245-Y524 VanDerWaalsContact CG2-CE2 3.41Å
246L93.1Very high92.2Very high0 Ų025.3 Ų25.30%012%0.122CC..Iπ-helixtrans-74-40.6178.8-72.1166.3000112.8S84 F87 Y88 S91 H241 T242 W244 G250 L523S84-L246 VanDerWaalsContact C-CD1 3.48Å; S84-L246 WeakPolarHBondContact O-CD1 3.36Å; F87-L246 HydrophobicContact CB-CB 3.93Å; F87-L246 HydrophobicContact CB-CD1 4.27Å; F87-L246 HydrophobicContact CD2-CD1 4.46Å; Y88-L246 HydrophobicContact CD2-CD2 4.1Å; Y88-L246 HydrophobicContact CE1-CD2 4.27Å; Y88-L246 HydrophobicContact CE2-CD2 3.7Å; S91-L246 PolarHBondContact OG-O 3.17Å; H241-L246 HydrophobicContact CB-CD1 4.06Å; H241-L246 HydrophobicContact CB-CG 4.44Å; T242-L246 WeakPolarHBondContact O-CB 3.17Å; T242-L246 PolarHBondContact O-N 2.84Å; T242-L246 VanDerWaalsContact O-N 3.1Å; W244-L246 VanDerWaalsContact C-N 3.32Å; W244-L246 PolarHBondContact O-N 2.96Å; L246-G250 VanDerWaalsContact O-CA 3.25Å; L246-G250 WeakPolarHBondContact O-CA 3.38Å; L246-G250 PolarHBondContact O-N 3.43Å; L246-L523 HydrophobicContact CD2-CD1 3.65Å; L246-L523 HydrophobicContact CG-CD1 4.18Å
247S93.9Very high92.4Very high6 Ų623.1 Ų23.14%0.04211%0.111CC..Iπ-helixtrans-78.9-45.3-177.9-57.30000113S91 F243 W244 A251S91-S247 VanDerWaalsContact OG-C 3.3Å; S91-S247 WeakPolarHBondContact OG-CA 3.07Å; S91-S247 PolarHBondContact OG-O 3.31Å; F243-S247 WeakPolarHBondContact O-CB 3.4Å; F243-S247 PolarHBondContact O-N 3.18Å; F243-S247 PolarHBondContact O-OG 3.21Å; W244-S247 PolarHBondContact O-N 2.78Å; S247-A251 WeakPolarHBondContact O-CB 3.43Å; S247-A251 PolarHBondContact O-N 3.07Å
248I94.4Very high92.8Very high70 Ų7020.5 Ų20.536%0.3599%0.094SC..Iπ-helixtrans-86.8-54.4-178.7-60.2179.9000110.1W244 G250 A251 F252 Y524W244-I248 HydrophobicContact CE3-CD1 3.64Å; W244-I248 HydrophobicContact CE3-CG1 4.31Å; W244-I248 HydrophobicContact CZ3-CD1 4.17Å; W244-I248 WeakPolarHBondContact O-CB 3.43Å; W244-I248 PolarHBondContact O-N 2.97Å; I248-G250 VanDerWaalsContact C-N 3.33Å; I248-G250 PolarHBondContact O-N 2.74Å; I248-A251 PolarHBondContact O-N 3.4Å; I248-A251 VanDerWaalsContact O-N 3.17Å; I248-F252 HydrophobicContact CG2-CD2 4.38Å; I248-F252 HydrophobicContact CG2-CE2 4.27Å; I248-F252 WeakPolarHBondContact O-CD2 3.29Å; I248-F252 PolarHBondContact O-N 2.7Å; I248-Y524 HydrophobicContact CB-CE1 4.38Å; I248-Y524 HydrophobicContact CG2-CE1 4.19Å
249G93.4Very high93.1Very high0 Ų018.8 Ų18.80%09%0.085CC..Iπ-helixtrans-60.2-45.8179.300000111.6T245 A251 F252 I253 L523T245-G249 WeakPolarHBondContact O-CA 3.46Å; T245-G249 PolarHBondContact O-N 2.81Å; G249-A251 PolarHBondContact O-N 2.63Å; G249-F252 PolarHBondContact O-N 2.79Å; G249-I253 PolarHBondContact O-N 2.92Å; G249-L523 CarbonylContact C-O 3.58Å; G249-L523 VanDerWaalsContact CA-O 3.26Å; G249-L523 WeakPolarHBondContact CA-O 3.45Å
250G93.6Very high93.5Very high0 Ų018.3 Ų18.30%08%0.083CC..Hα-helixtrans-58.7-43172.800000113.4T245 L246 I248 F252 I253 W254T245-G250 PolarHBondContact O-N 2.69Å; L246-G250 VanDerWaalsContact O-CA 3.25Å; L246-G250 WeakPolarHBondContact O-CA 3.38Å; L246-G250 PolarHBondContact O-N 3.43Å; I248-G250 VanDerWaalsContact C-N 3.33Å; I248-G250 PolarHBondContact O-N 2.74Å; G250-F252 VanDerWaalsContact C-N 3.33Å; G250-F252 PolarHBondContact O-N 2.77Å; G250-I253 PolarHBondContact O-N 3.38Å; G250-W254 WeakPolarHBondContact O-CB 3.36Å; G250-W254 PolarHBondContact O-N 3.15Å
251A95.8Very high93.9Very high12 Ų1217.5 Ų17.510%0.0998%0.081CC..Hα-helixtrans-59.8-40.6178.900000112.6S91 F94 T95 S247 I248 G249 L255S91-A251 PolarHBondContact OG-N 2.87Å; F94-A251 HydrophobicContact CB-CB 4.2Å; T95-A251 PolarHBondContact OG1-O 3.32Å; S247-A251 WeakPolarHBondContact O-CB 3.43Å; S247-A251 PolarHBondContact O-N 3.07Å; I248-A251 PolarHBondContact O-N 3.4Å; I248-A251 VanDerWaalsContact O-N 3.17Å; G249-A251 PolarHBondContact O-N 2.63Å; A251-L255 WeakPolarHBondContact O-CB 3.33Å; A251-L255 PolarHBondContact O-N 3.08Å
252F96.4Very high94.1Very high57 Ų5716.8 Ų16.825%0.258%0.077CC..Hα-helixtrans-68.3-41.6177.3-85.4-106.3000112.5I248 G249 G250 L255 S256 L425 S526 P527 T530I248-F252 HydrophobicContact CG2-CD2 4.38Å; I248-F252 HydrophobicContact CG2-CE2 4.27Å; I248-F252 WeakPolarHBondContact O-CD2 3.29Å; I248-F252 PolarHBondContact O-N 2.7Å; G249-F252 PolarHBondContact O-N 2.79Å; G250-F252 VanDerWaalsContact C-N 3.33Å; G250-F252 PolarHBondContact O-N 2.77Å; F252-L255 PolarHBondContact O-N 3.39Å; F252-S256 PolarHBondContact O-N 3.22Å; F252-L425 HydrophobicContact CD1-CD2 4.06Å; F252-S526 PolarHBondContact O-OG 3.34Å; F252-P527 HydrophobicContact CB-CG 3.65Å; F252-P527 HydrophobicContact CD1-CB 4.29Å; F252-P527 HydrophobicContact CD1-CG 4.23Å; F252-P527 HydrophobicContact CD2-CB 4.38Å; F252-P527 HydrophobicContact CD2-CG 3.88Å; F252-P527 HydrophobicContact CG-CB 4.18Å; F252-P527 HydrophobicContact CG-CG 3.67Å; F252-T530 HydrophobicContact CD1-CG2 3.95Å; F252-T530 HydrophobicContact CE1-CG2 3.67Å
253I93.7Very high94.1Very high5 Ų517 Ų173%0.0268%0.079CC..Hα-helixtrans-59.5-53.1175.2-71.6174.7000110.1G249 G250 L255 S256 I257 I414 F417 L523G249-I253 PolarHBondContact O-N 2.92Å; G250-I253 PolarHBondContact O-N 3.38Å; I253-L255 VanDerWaalsContact C-N 3.29Å; I253-L255 PolarHBondContact O-N 3.32Å; I253-S256 WeakPolarHBondContact O-CB 3.22Å; I253-S256 PolarHBondContact O-N 2.93Å; I253-S256 VanDerWaalsContact O-N 3.09Å; I253-S256 PolarHBondContact O-OG 3.48Å; I253-I257 HydrophobicContact CG2-CD1 4.22Å; I253-I257 PolarHBondContact O-N 3.32Å; I253-I414 HydrophobicContact CD1-CG2 3.88Å; I253-F417 HydrophobicContact CG2-CB 4.29Å; I253-L523 HydrophobicContact CD1-CB 4.37Å; I253-L523 HydrophobicContact CD1-CD2 3.67Å
254W94.6Very high94.1Very high27 Ų2714.9 Ų14.910%0.1027%0.07CC..Hα-helixtrans-67.7-30.8-178.3-73113.1000112.3F65 M66 Y88 Y92 T95 G250 I257 Y258F65-W254 HydrophobicContact CB-CZ3 4.23Å; M66-W254 HydrophobicContact CE-CH2 3.54Å; M66-W254 HydrophobicContact CE-CZ2 4.07Å; M66-W254 HydrophobicContact CE-CZ3 4.21Å; Y88-W254 AromaticContact CD1-CD1 3.91Å; Y88-W254 AromaticContact CD1-NE1 3.51Å; Y88-W254 AromaticContact CE1-NE1 3.59Å; Y92-W254 HydrophobicContact CD1-CD2 4.18Å; Y92-W254 HydrophobicContact CD1-CG 4.08Å; Y92-W254 AromaticContact CE1-CD1 3.77Å; Y92-W254 AromaticContact CE1-CD2 3.56Å; Y92-W254 HydrophobicContact CE1-CD2 3.56Å; Y92-W254 AromaticContact CE1-CE2 3.37Å; Y92-W254 HydrophobicContact CE1-CE3 4.1Å; Y92-W254 AromaticContact CE1-CG 3.84Å; Y92-W254 HydrophobicContact CE1-CG 3.84Å; Y92-W254 HydrophobicContact CE1-CH2 4.27Å; Y92-W254 AromaticContact CE1-CZ2 3.76Å; Y92-W254 HydrophobicContact CE1-CZ2 3.76Å; Y92-W254 HydrophobicContact CE1-CZ3 4.42Å; Y92-W254 AromaticContact CE1-NE1 3.5Å; Y92-W254 WeakPolarHBondContact OH-CZ2 3.44Å; T95-W254 VanDerWaalsContact CG2-C 3.41Å; T95-W254 HydrophobicContact CG2-CB 3.93Å; T95-W254 WeakPolarHBondContact CG2-O 3.06Å; T95-W254 WeakPolarHBondContact OG1-CB 3.32Å; G250-W254 WeakPolarHBondContact O-CB 3.36Å; G250-W254 PolarHBondContact O-N 3.15Å; W254-I257 HydrophobicContact CD2-CD1 4.3Å; W254-I257 HydrophobicContact CE3-CB 4.36Å; W254-I257 HydrophobicContact CE3-CD1 3.71Å; W254-I257 HydrophobicContact CE3-CG2 4.43Å; W254-I257 HydrophobicContact CZ3-CD1 3.9Å; W254-I257 PolarHBondContact O-N 2.95Å; W254-I257 VanDerWaalsContact O-N 3.16Å; W254-Y258 HydrophobicContact CE3-CD2 4.17Å; W254-Y258 AromaticContact CE3-CE2 3.8Å; W254-Y258 HydrophobicContact CE3-CE2 3.8Å; W254-Y258 HydrophobicContact CZ3-CE2 4.1Å; W254-Y258 PolarHBondContact O-N 3.27Å
255L96.4Very high94.2Very high14 Ų1410.3 Ų10.37%0.0735%0.052CC..Hα-helixtrans-67.5-34.4171.2-172.362.7000112.4T95 I98 F103 A251 F252 I253 I257 G259 L425T95-L255 HydrophobicContact CG2-CB 4.48Å; I98-L255 HydrophobicContact CB-CD1 3.9Å; I98-L255 HydrophobicContact CB-CD2 4.38Å; I98-L255 HydrophobicContact CD1-CD2 4.25Å; I98-L255 HydrophobicContact CG2-CD1 3.72Å; I98-L255 HydrophobicContact CG2-CD2 3.78Å; I98-L255 HydrophobicContact CG2-CG 4.42Å; F103-L255 HydrophobicContact CD2-CD1 4.15Å; F103-L255 HydrophobicContact CE2-CD1 3.81Å; F103-L255 HydrophobicContact CE2-CD2 4.19Å; F103-L255 HydrophobicContact CE2-CG 4.11Å; A251-L255 WeakPolarHBondContact O-CB 3.33Å; A251-L255 PolarHBondContact O-N 3.08Å; F252-L255 PolarHBondContact O-N 3.39Å; I253-L255 VanDerWaalsContact C-N 3.29Å; I253-L255 PolarHBondContact O-N 3.32Å; L255-I257 PolarHBondContact O-N 3.42Å; L255-G259 WeakPolarHBondContact O-CA 3.33Å; L255-G259 PolarHBondContact O-N 3.46Å; L255-L425 HydrophobicContact CB-CD2 4.18Å; L255-L425 HydrophobicContact CD2-CD1 4.19Å; L255-L425 HydrophobicContact CD2-CD2 4.15Å; L255-L425 HydrophobicContact CG-CD1 3.93Å; L255-L425 HydrophobicContact CG-CD2 4.18Å
256S95.3Very high94.1Very high3 Ų310.4 Ų10.42%0.0215%0.053CC..Iπ-helixtrans-64.6-33170.980.40000111.8F252 I253 I260 N261F252-S256 PolarHBondContact O-N 3.22Å; I253-S256 WeakPolarHBondContact O-CB 3.22Å; I253-S256 PolarHBondContact O-N 2.93Å; I253-S256 VanDerWaalsContact O-N 3.09Å; I253-S256 PolarHBondContact O-OG 3.48Å; S256-I260 WeakPolarHBondContact O-CG1 3.4Å; S256-N261 PolarHBondContact O-N 3.2Å
257I94Very high94Very high6 Ų610.5 Ų10.53%0.0315%0.053CC..Iπ-helixtrans-75.9-52.8179.2-65.1168.3000111.2F65 I253 W254 L255 N261 Q264 F417F65-I257 HydrophobicContact CB-CG2 4.33Å; F65-I257 HydrophobicContact CD1-CG2 4.36Å; F65-I257 HydrophobicContact CD2-CG2 3.43Å; F65-I257 VanDerWaalsContact CD2-CG2 3.43Å; F65-I257 HydrophobicContact CE2-CG2 3.75Å; F65-I257 HydrophobicContact CG-CG2 3.78Å; F65-I257 HydrophobicContact CZ-CG2 4.35Å; I253-I257 HydrophobicContact CG2-CD1 4.22Å; I253-I257 PolarHBondContact O-N 3.32Å; W254-I257 HydrophobicContact CD2-CD1 4.3Å; W254-I257 HydrophobicContact CE3-CB 4.36Å; W254-I257 HydrophobicContact CE3-CD1 3.71Å; W254-I257 HydrophobicContact CE3-CG2 4.43Å; W254-I257 HydrophobicContact CZ3-CD1 3.9Å; W254-I257 PolarHBondContact O-N 2.95Å; W254-I257 VanDerWaalsContact O-N 3.16Å; L255-I257 PolarHBondContact O-N 3.42Å; I257-N261 WeakPolarHBondContact O-CB 3.25Å; I257-Q264 HydrophobicContact CG2-CG 3.97Å; I257-Q264 WeakPolarHBondContact O-CB 3.23Å; I257-Q264 VanDerWaalsContact O-CG 3.3Å; I257-Q264 WeakPolarHBondContact O-CG 3.35Å; I257-F417 HydrophobicContact CD1-CD1 4.07Å; I257-F417 HydrophobicContact CD1-CD2 4.48Å; I257-F417 HydrophobicContact CD1-CE1 4.33Å; I257-F417 HydrophobicContact CD1-CG 4.2Å; I257-F417 HydrophobicContact CG1-CD1 3.6Å; I257-F417 HydrophobicContact CG1-CE1 3.74Å; I257-F417 HydrophobicContact CG1-CG 4.22Å; I257-F417 HydrophobicContact CG1-CZ 4.42Å
258Y95.1Very high93.9Very high1 Ų110.2 Ų10.20%0.0045%0.051CC..Iπ-helixtrans-85.7-31.1-175.6-79-85.2000113.5L61 T95 M96 T99 W254 Q264 Y268 L281 N284 L288L61-Y258 HydrophobicContact CB-CE1 4.3Å; L61-Y258 HydrophobicContact CD2-CE1 4.39Å; L61-Y258 PolarHBondContact O-OH 2.86Å; T95-Y258 HydrophobicContact CG2-CD2 4.09Å; T95-Y258 HydrophobicContact CG2-CG 4.3Å; M96-Y258 HydrophobicContact CE-CD1 3.73Å; M96-Y258 HydrophobicContact CE-CD2 3.52Å; M96-Y258 HydrophobicContact CE-CE1 3.88Å; M96-Y258 HydrophobicContact CE-CE2 3.64Å; M96-Y258 HydrophobicContact CE-CG 3.55Å; M96-Y258 HydrophobicContact SD-CD1 4.22Å; M96-Y258 HydrophobicContact SD-CG 4.4Å; T99-Y258 WeakPolarHBondContact CG2-O 3.23Å; W254-Y258 HydrophobicContact CE3-CD2 4.17Å; W254-Y258 AromaticContact CE3-CE2 3.8Å; W254-Y258 HydrophobicContact CE3-CE2 3.8Å; W254-Y258 HydrophobicContact CZ3-CE2 4.1Å; W254-Y258 PolarHBondContact O-N 3.27Å; Y258-Q264 HydrophobicContact CD1-CB 4.33Å; Y258-Q264 HydrophobicContact CD1-CG 4.23Å; Y258-Q264 HydrophobicContact CE1-CG 4.38Å; Y258-Y268 WeakPolarHBondContact O-CE1 3.42Å; Y258-Y268 PolarHBondContact O-OH 3.33Å; Y258-L281 HydrophobicContact CD1-CD2 4.38Å; Y258-N284 VanDerWaalsContact CE1-ND2 3.27Å; Y258-N284 WeakPolarHBondContact CE1-ND2 3.4Å; Y258-N284 PolarHBondContact OH-ND2 2.85Å; Y258-N284 PolarHBondContact OH-OD1 3.15Å; Y258-L288 HydrophobicContact CE2-CD1 4.23Å
259G94.7Very high93.7Very high0 Ų07.1 Ų7.10%04%0.035CC..Iπ-helixtrans-75.5-41.6-176.300000113F103 F107 L255F103-G259 WeakPolarHBondContact CB-O 3.14Å; F107-G259 WeakPolarHBondContact CE2-O 3.3Å; L255-G259 WeakPolarHBondContact O-CA 3.33Å; L255-G259 PolarHBondContact O-N 3.46Å
260I95.1Very high93.4Very high4 Ų47.1 Ų7.12%0.0214%0.035CC..Iπ-helixtrans-136.3-12.1-168.363.9154.5000115.5F103 S256 Q262 L424 L425 F428F103-I260 HydrophobicContact CD1-CG2 3.72Å; F103-I260 HydrophobicContact CE1-CG2 3.49Å; F103-I260 VanDerWaalsContact CE1-CG2 3.49Å; F103-I260 HydrophobicContact CZ-CG2 4.34Å; S256-I260 WeakPolarHBondContact O-CG1 3.4Å; I260-Q262 PolarHBondContact O-N 3.02Å; I260-L424 VanDerWaalsContact CD1-C 3.43Å; I260-L424 HydrophobicContact CD1-CB 3.64Å; I260-L425 HydrophobicContact CD1-CB 4.11Å; I260-L425 VanDerWaalsContact CD1-N 3.28Å; I260-L425 HydrophobicContact CG2-CD1 4.27Å; I260-F428 HydrophobicContact CB-CD2 3.89Å; I260-F428 HydrophobicContact CB-CE2 4.23Å; I260-F428 HydrophobicContact CB-CG 4.19Å; I260-F428 HydrophobicContact CD1-CD2 3.84Å; I260-F428 HydrophobicContact CD1-CE2 4.32Å; I260-F428 HydrophobicContact CG1-CD2 4.49Å; I260-F428 HydrophobicContact CG2-CB 3.58Å; I260-F428 HydrophobicContact CG2-CD1 4.26Å; I260-F428 HydrophobicContact CG2-CD2 3.8Å; I260-F428 HydrophobicContact CG2-CG 3.63Å
261N94.2Very high93.2Very high7 Ų77.1 Ų7.14%0.0374%0.035CC..  trans-71.2127.7179.5-170.6-61.9000110S256 I257 A263 Q264 V265S256-N261 PolarHBondContact O-N 3.2Å; I257-N261 WeakPolarHBondContact O-CB 3.25Å; N261-A263 PolarHBondContact O-N 3.44Å; N261-A263 VanDerWaalsContact O-N 3.12Å; N261-A263 WeakPolarHBondContact OD1-CB 3.17Å; N261-A263 PolarHBondContact OD1-N 3.05Å; N261-Q264 PolarHBondContact O-N 3.45Å; N261-V265 VanDerWaalsContact O-CG2 3.25Å; N261-V265 WeakPolarHBondContact O-CG2 3.12Å; N261-V265 PolarHBondContact O-N 3.26Å
262Q93.6Very high92.8Very high0 Ų011.6 Ų11.60%05%0.052CC..Hα-helixtrans-49.6-43-179.2178.168.612.900113.2T113 T115 F135 I260 Q264 V265 Q266 A360 V364T113-Q262 PolarHBondContact O-NE2 3.37Å; T115-Q262 PolarHBondContact OG1-OE1 2.73Å; F135-Q262 HydrophobicContact CE1-CB 4.09Å; F135-Q262 HydrophobicContact CE2-CB 3.85Å; F135-Q262 HydrophobicContact CZ-CB 3.59Å; F135-Q262 HydrophobicContact CZ-CG 4.41Å; I260-Q262 PolarHBondContact O-N 3.02Å; Q262-Q264 PolarHBondContact O-N 3.1Å; Q262-V265 PolarHBondContact O-N 3.26Å; Q262-Q266 VanDerWaalsContact NE2-OE1 3.09Å; Q262-Q266 WeakPolarHBondContact O-CB 3.29Å; Q262-Q266 PolarHBondContact O-N 2.9Å; Q262-A360 HydrophobicContact CB-CB 4.09Å; Q262-A360 HydrophobicContact CG-CB 3.75Å; Q262-V364 HydrophobicContact CB-CG2 3.93Å; Q262-V364 HydrophobicContact CG-CG2 3.49Å; Q262-V364 VanDerWaalsContact CG-CG2 3.49Å
263A91Very high92.5Very high4 Ų410.1 Ų10.13%0.0335%0.049CC..Hα-helixtrans-63-28.2-175.400000113.4F65 N261 R267 A360F65-A263 HydrophobicContact CE2-CB 4.14Å; F65-A263 HydrophobicContact CZ-CB 4.39Å; N261-A263 PolarHBondContact O-N 3.44Å; N261-A263 VanDerWaalsContact O-N 3.12Å; N261-A263 WeakPolarHBondContact OD1-CB 3.17Å; N261-A263 PolarHBondContact OD1-N 3.05Å; A263-R267 PolarHBondContact O-NH1 2.92Å; A263-A360 HydrophobicContact CB-CB 3.84Å
264Q93.4Very high92.2Very high0 Ų011.4 Ų11.40%06%0.056CC..Hα-helixtrans-91.3-45.6175.4-61-52.2-62.100111.1L61 S64 F65 I257 Y258 N261 Q262 Q266 R267 Y268L61-Q264 HydrophobicContact CD2-CB 4.28Å; S64-Q264 VanDerWaalsContact CB-NE2 3.32Å; F65-Q264 HydrophobicContact CD2-CG 3.84Å; F65-Q264 HydrophobicContact CE2-CG 3.74Å; F65-Q264 VanDerWaalsContact CE2-NE2 3.27Å; I257-Q264 HydrophobicContact CG2-CG 3.97Å; I257-Q264 WeakPolarHBondContact O-CB 3.23Å; I257-Q264 VanDerWaalsContact O-CG 3.3Å; I257-Q264 WeakPolarHBondContact O-CG 3.35Å; Y258-Q264 HydrophobicContact CD1-CB 4.33Å; Y258-Q264 HydrophobicContact CD1-CG 4.23Å; Y258-Q264 HydrophobicContact CE1-CG 4.38Å; N261-Q264 PolarHBondContact O-N 3.45Å; Q262-Q264 PolarHBondContact O-N 3.1Å; Q264-Q266 VanDerWaalsContact C-N 3.3Å; Q264-Q266 PolarHBondContact O-N 2.88Å; Q264-R267 WeakPolarHBondContact O-CB 3.39Å; Q264-R267 PolarHBondContact O-N 2.95Å; Q264-R267 VanDerWaalsContact O-N 3.08Å; Q264-Y268 WeakPolarHBondContact O-CD1 3.34Å; Q264-Y268 WeakPolarHBondContact O-CE1 3.21Å; Q264-Y268 PolarHBondContact O-N 3.46Å
265V94.1Very high91.9Very high0 Ų014.4 Ų14.40%08%0.077CC..Hα-helixtrans-55.4-47.7-179.2178.20000111.1F107 T115 N261 Q262 R267 Y268 I269F107-V265 HydrophobicContact CB-CG1 4.37Å; F107-V265 HydrophobicContact CD2-CG1 3.79Å; F107-V265 HydrophobicContact CD2-CG2 4.41Å; F107-V265 HydrophobicContact CE2-CG1 4.39Å; F107-V265 HydrophobicContact CE2-CG2 4.32Å; F107-V265 HydrophobicContact CG-CG1 4.28Å; T115-V265 HydrophobicContact CG2-CB 4.42Å; T115-V265 HydrophobicContact CG2-CG1 4.1Å; T115-V265 HydrophobicContact CG2-CG2 4Å; T115-V265 WeakPolarHBondContact OG1-CB 3.45Å; T115-V265 WeakPolarHBondContact OG1-CG1 3.46Å; N261-V265 VanDerWaalsContact O-CG2 3.25Å; N261-V265 WeakPolarHBondContact O-CG2 3.12Å; N261-V265 PolarHBondContact O-N 3.26Å; Q262-V265 PolarHBondContact O-N 3.26Å; V265-R267 PolarHBondContact O-N 2.58Å; V265-R267 VanDerWaalsContact O-N 3.15Å; V265-Y268 VanDerWaalsContact CA-CZ 3.42Å; V265-Y268 HydrophobicContact CB-CE2 4.42Å; V265-Y268 HydrophobicContact CG1-CE2 4.1Å; V265-Y268 HydrophobicContact CG2-CE1 4.49Å; V265-Y268 VanDerWaalsContact CG2-OH 3.27Å; V265-Y268 WeakPolarHBondContact CG2-OH 3.2Å; V265-Y268 WeakPolarHBondContact O-CD2 3.26Å; V265-Y268 PolarHBondContact O-N 3.41Å; V265-I269 HydrophobicContact CG1-CD1 4.37Å; V265-I269 HydrophobicContact CG1-CG2 4.33Å; V265-I269 VanDerWaalsContact O-CG1 3.29Å; V265-I269 WeakPolarHBondContact O-CG1 3.15Å; V265-I269 WeakPolarHBondContact O-CG2 3.37Å; V265-I269 PolarHBondContact O-N 2.92Å
266Q90.7Very high91.7Very high2 Ų215.8 Ų15.81%0.0098%0.083CC..Hα-helixtrans-59-28.8-179.1-171.8171.7-2.400113.6L46 L183 Q262 Q264 I269 A270 N359L46-Q266 PolarHBondContact O-NE2 3.5Å; L183-Q266 HydrophobicContact CD2-CG 4.32Å; Q262-Q266 VanDerWaalsContact NE2-OE1 3.09Å; Q262-Q266 WeakPolarHBondContact O-CB 3.29Å; Q262-Q266 PolarHBondContact O-N 2.9Å; Q264-Q266 VanDerWaalsContact C-N 3.3Å; Q264-Q266 PolarHBondContact O-N 2.88Å; Q266-I269 WeakPolarHBondContact O-CG1 3.22Å; Q266-A270 WeakPolarHBondContact O-CB 3.34Å; Q266-A270 PolarHBondContact O-N 3.31Å; Q266-N359 PolarHBondContact NE2-ND2 2.9Å
267R90.9Very high91.5Very high2 Ų215.7 Ų15.71%0.0088%0.082CC..Hα-helixtrans-77.3-49.7-178.2-76.3-179.9164.6109.4-5.2112.8V57 S60 L61 S64 L183 D190 A263 Q264 V265 I269 A270 S356V57-R267 HydrophobicContact CG1-CB 4.19Å; V57-R267 WeakPolarHBondContact CG1-O 3.18Å; S60-R267 PolarHBondContact OG-NE 2.77Å; S60-R267 PolarHBondContact OG-NH2 3.46Å; L61-R267 HydrophobicContact CD2-CB 3.75Å; L61-R267 HydrophobicContact CD2-CG 4.45Å; L61-R267 HydrophobicContact CG-CB 4.29Å; S64-R267 VanDerWaalsContact CB-NH1 3.3Å; S64-R267 PolarHBondContact OG-NH1 3.38Å; S64-R267 PolarHBondContact OG-NH2 2.86Å; L183-R267 HydrophobicContact CD1-CG 4.3Å; D190-R267 IonicContact OD2-CZ 2.86Å; D190-R267 IonicContact OD2-NE 3.96Å; D190-R267 IonicContact OD2-NH2 3.64Å; D190-R267 PolarHBondContact OD2-NH2 3.41Å; A263-R267 PolarHBondContact O-NH1 2.92Å; Q264-R267 WeakPolarHBondContact O-CB 3.39Å; Q264-R267 PolarHBondContact O-N 2.95Å; Q264-R267 VanDerWaalsContact O-N 3.08Å; V265-R267 PolarHBondContact O-N 2.58Å; V265-R267 VanDerWaalsContact O-N 3.15Å; R267-I269 VanDerWaalsContact C-N 3.34Å; R267-A270 WeakPolarHBondContact O-CB 3.26Å; R267-A270 PolarHBondContact O-N 3.21Å; R267-S356 VanDerWaalsContact CZ-OG 3.27Å; R267-S356 PolarHBondContact NH1-OG 2.69Å; R267-S356 PolarHBondContact NH2-OG 3.23Å
268Y91.4Very high91.5Very high0 Ų017.4 Ų17.40%09%0.088CC..Hα-helixtrans-75.3-25.3-177.655.6-115.1000112.4L61 T99 L104 Y258 Q264 V265 A270 C271 A277 L281L61-Y268 HydrophobicContact CD2-CD1 4.35Å; T99-Y268 HydrophobicContact CG2-CE1 4.23Å; L104-Y268 HydrophobicContact CB-CE2 4.38Å; L104-Y268 HydrophobicContact CD1-CD2 3.25Å; L104-Y268 HydrophobicContact CD1-CE2 3.53Å; L104-Y268 HydrophobicContact CD1-CG 4.17Å; Y258-Y268 WeakPolarHBondContact O-CE1 3.42Å; Y258-Y268 PolarHBondContact O-OH 3.33Å; Q264-Y268 WeakPolarHBondContact O-CD1 3.34Å; Q264-Y268 WeakPolarHBondContact O-CE1 3.21Å; Q264-Y268 PolarHBondContact O-N 3.46Å; V265-Y268 VanDerWaalsContact CA-CZ 3.42Å; V265-Y268 HydrophobicContact CB-CE2 4.42Å; V265-Y268 HydrophobicContact CG1-CE2 4.1Å; V265-Y268 HydrophobicContact CG2-CE1 4.49Å; V265-Y268 VanDerWaalsContact CG2-OH 3.27Å; V265-Y268 WeakPolarHBondContact CG2-OH 3.2Å; V265-Y268 WeakPolarHBondContact O-CD2 3.26Å; V265-Y268 PolarHBondContact O-N 3.41Å; Y268-A270 PolarHBondContact O-N 3.48Å; Y268-C271 VanDerWaalsContact O-CB 3.31Å; Y268-C271 WeakPolarHBondContact O-CB 3.32Å; Y268-C271 PolarHBondContact O-N 2.9Å; Y268-A277 WeakPolarHBondContact O-CB 3.06Å; Y268-L281 HydrophobicContact CD1-CD2 3.8Å; Y268-L281 HydrophobicContact CE1-CD2 4.23Å; Y268-L281 HydrophobicContact CG-CD2 4.48Å
269I90.4Very high91.5Very high6 Ų621.1 Ų21.13%0.03111%0.108CC..THydrogen-bonded Turntrans-76.3-13.4170.872.2-176.6000112.8F107 I112 V265 Q266 R267 C271F107-I269 HydrophobicContact CB-CG2 4.35Å; I112-I269 VanDerWaalsContact O-CD1 3.32Å; I112-I269 WeakPolarHBondContact O-CD1 3.09Å; V265-I269 HydrophobicContact CG1-CD1 4.37Å; V265-I269 HydrophobicContact CG1-CG2 4.33Å; V265-I269 VanDerWaalsContact O-CG1 3.29Å; V265-I269 WeakPolarHBondContact O-CG1 3.15Å; V265-I269 WeakPolarHBondContact O-CG2 3.37Å; V265-I269 PolarHBondContact O-N 2.92Å; Q266-I269 WeakPolarHBondContact O-CG1 3.22Å; R267-I269 VanDerWaalsContact C-N 3.34Å; I269-C271 PolarHBondContact O-N 2.86Å
270A87.6Confident91.5Very high0 Ų021.1 Ų21.10%011%0.108CC..THydrogen-bonded Turntrans-78.3-2.2170.300000113.3T47 R50 R51 L52 L183 Q266 R267 Y268T47-A270 WeakPolarHBondContact O-CB 3.32Å; R50-A270 CarbonylContact C-O 3.6Å; R50-A270 WeakPolarHBondContact CA-O 3.36Å; R51-A270 PolarHBondContact N-O 3.36Å; L52-A270 WeakPolarHBondContact CB-O 3.21Å; L52-A270 HydrophobicContact CD1-CB 3.96Å; L52-A270 PolarHBondContact N-O 3.39Å; L52-A270 VanDerWaalsContact N-O 3.15Å; L183-A270 HydrophobicContact CD2-CB 3.89Å; Q266-A270 WeakPolarHBondContact O-CB 3.34Å; Q266-A270 PolarHBondContact O-N 3.31Å; R267-A270 WeakPolarHBondContact O-CB 3.26Å; R267-A270 PolarHBondContact O-N 3.21Å; Y268-A270 PolarHBondContact O-N 3.48Å
271C89.4Confident91.5Very high0 Ų020.9 Ų20.90%011%0.107CC..BIsolated β-bridgetrans-71147.6172.3-76.70000111.7L52 Y108 Y268 I269 S273 Q276 A277L52-C271 WeakPolarHBondContact O-CA 3.31Å; Y108-C271 PolarHBondContact OH-O 2.92Å; Y268-C271 VanDerWaalsContact O-CB 3.31Å; Y268-C271 WeakPolarHBondContact O-CB 3.32Å; Y268-C271 PolarHBondContact O-N 2.9Å; I269-C271 PolarHBondContact O-N 2.86Å; C271-S273 VanDerWaalsContact C-N 3.26Å; C271-S273 PolarHBondContact O-N 3.45Å; C271-Q276 HydrophobicContact CB-CB 4Å; C271-A277 HydrophobicContact CB-CB 3.99Å
272K87.2Confident91.5Very high105 Ų10524.3 Ų24.346%0.45712%0.121SC..SBendtrans-63.6-25179.964.9179.9179.9178.80115.5R50 L52 Y108 Q276R50-K272 VanDerWaalsContact O-CA 3.27Å; R50-K272 WeakPolarHBondContact O-CA 3.34Å; L52-K272 PolarHBondContact O-N 3.36Å; L52-K272 VanDerWaalsContact O-N 3.07Å; Y108-K272 PolarHBondContact OH-O 2.91Å; K272-Q276 HydrophobicContact CD-CG 4.49Å; K272-Q276 HydrophobicContact CG-CB 4.41Å; K272-Q276 HydrophobicContact CG-CG 3.93Å
273S89.3Confident91.6Very high26 Ų2626.5 Ų26.518%0.18213%0.133CC..SBendtrans-147.8155.9179.672.30000111.4Y108 C271 T275 Q276 A277Y108-S273 VanDerWaalsContact OH-C 3.23Å; Y108-S273 WeakPolarHBondContact OH-CA 3.48Å; Y108-S273 PolarHBondContact OH-N 3.45Å; C271-S273 VanDerWaalsContact C-N 3.26Å; C271-S273 PolarHBondContact O-N 3.45Å; S273-T275 PolarHBondContact O-N 3.01Å; S273-Q276 WeakPolarHBondContact O-CB 3.44Å; S273-Q276 PolarHBondContact O-N 3.46Å; S273-Q276 VanDerWaalsContact OG-CG 3.32Å; S273-Q276 WeakPolarHBondContact OG-CG 3.3Å; S273-Q276 PolarHBondContact OG-N 2.82Å; S273-A277 PolarHBondContact O-N 2.74Å
274M87.9Confident91.8Very high33 Ų3326.3 Ų26.316%0.16313%0.131CC..Hα-helixtrans-54.2-39.2174.9-176.17377.100112L104 P105 Y108 Q276 A277 R278L104-M274 HydrophobicContact CD1-SD 4.4Å; L104-M274 HydrophobicContact CD2-SD 4.21Å; L104-M274 HydrophobicContact CG-SD 3.91Å; P105-M274 HydrophobicContact CB-CE 4.45Å; Y108-M274 HydrophobicContact CD1-CB 4.36Å; Y108-M274 HydrophobicContact CD1-CE 3.6Å; Y108-M274 HydrophobicContact CD1-SD 4.18Å; Y108-M274 HydrophobicContact CD2-SD 4.38Å; Y108-M274 HydrophobicContact CE1-CB 4.31Å; Y108-M274 HydrophobicContact CG-CE 3.72Å; Y108-M274 HydrophobicContact CG-SD 3.88Å; Y108-M274 PolarHBondContact OH-N 3.13Å; M274-Q276 VanDerWaalsContact C-N 3.33Å; M274-Q276 PolarHBondContact O-N 3.02Å; M274-A277 WeakPolarHBondContact O-CB 3.21Å; M274-A277 PolarHBondContact O-N 3.16Å; M274-R278 WeakPolarHBondContact O-CG 3.18Å; M274-R278 PolarHBondContact O-N 2.73Å
275T88.9Confident91.9Very high90 Ų9027.1 Ų27.155%0.55214%0.135SC*.Hα-helixtrans-64.1-39.5177.6-48.20000111.6S273 L279S273-T275 PolarHBondContact O-N 3.01Å; T275-L279 WeakPolarHBondContact O-CB 3.29Å; T275-L279 PolarHBondContact O-N 3.2Å
276Q90.8Very high91.9Very high43 Ų4332 Ų3220%0.20116%0.161CC..Hα-helixtrans-68.9-37.4175.6-68-75.2-45.200111.3A54 C271 K272 S273 M274 L279 S280A54-Q276 HydrophobicContact CB-CB 4.46Å; A54-Q276 WeakPolarHBondContact CB-O 3.39Å; C271-Q276 HydrophobicContact CB-CB 4Å; K272-Q276 HydrophobicContact CD-CG 4.49Å; K272-Q276 HydrophobicContact CG-CB 4.41Å; K272-Q276 HydrophobicContact CG-CG 3.93Å; S273-Q276 WeakPolarHBondContact O-CB 3.44Å; S273-Q276 PolarHBondContact O-N 3.46Å; S273-Q276 VanDerWaalsContact OG-CG 3.32Å; S273-Q276 WeakPolarHBondContact OG-CG 3.3Å; S273-Q276 PolarHBondContact OG-N 2.82Å; M274-Q276 VanDerWaalsContact C-N 3.33Å; M274-Q276 PolarHBondContact O-N 3.02Å; Q276-L279 PolarHBondContact O-N 3.13Å; Q276-S280 WeakPolarHBondContact O-CB 3.43Å; Q276-S280 PolarHBondContact O-N 2.75Å
277A91.9Very high92Very high0 Ų032.5 Ų32.50%017%0.167CC..Hα-helixtrans-61-49.8173.200000111.7L104 Y108 Y268 C271 S273 M274 L279 S280 L281L104-A277 HydrophobicContact CD1-CB 3.77Å; L104-A277 HydrophobicContact CD2-CB 4.09Å; Y108-A277 HydrophobicContact CD2-CB 4.15Å; Y108-A277 HydrophobicContact CE2-CB 4.2Å; Y268-A277 WeakPolarHBondContact O-CB 3.06Å; C271-A277 HydrophobicContact CB-CB 3.99Å; S273-A277 PolarHBondContact O-N 2.74Å; M274-A277 WeakPolarHBondContact O-CB 3.21Å; M274-A277 PolarHBondContact O-N 3.16Å; A277-L279 PolarHBondContact O-N 2.94Å; A277-S280 WeakPolarHBondContact O-CB 3.25Å; A277-S280 PolarHBondContact O-N 3.21Å; A277-S280 PolarHBondContact O-OG 3.21Å; A277-L281 PolarHBondContact O-N 3.37Å
278R94Very high92.2Very high42 Ų4232.4 Ų32.416%0.15817%0.167CC..Hα-helixtrans-59.8-48175.3-73.7-175.3172.7132.8-5.4112.2L104 M274 S280 L281 F282 D561 T563L104-R278 HydrophobicContact CD2-CB 4.31Å; L104-R278 HydrophobicContact CD2-CG 3.4Å; L104-R278 VanDerWaalsContact CD2-CG 3.4Å; M274-R278 WeakPolarHBondContact O-CG 3.18Å; M274-R278 PolarHBondContact O-N 2.73Å; R278-S280 PolarHBondContact O-N 2.61Å; R278-L281 PolarHBondContact O-N 3.33Å; R278-L281 VanDerWaalsContact O-N 3.14Å; R278-F282 WeakPolarHBondContact O-CD2 3.39Å; R278-F282 PolarHBondContact O-N 3.45Å; R278-D561 PolarHBondContact NH2-O 3.42Å; R278-T563 VanDerWaalsContact CZ-CG2 3.44Å
279L94.1Very high92.3Very high79 Ų7936.6 Ų36.641%0.41418%0.182SC..Hα-helixtrans-58.9-37.8177.9-177.363.1000111.2A54 T275 Q276 A277 L281 F282 I283A54-L279 HydrophobicContact CB-CB 3.92Å; A54-L279 HydrophobicContact CB-CD2 3.79Å; A54-L279 HydrophobicContact CB-CG 3.82Å; T275-L279 WeakPolarHBondContact O-CB 3.29Å; T275-L279 PolarHBondContact O-N 3.2Å; Q276-L279 PolarHBondContact O-N 3.13Å; A277-L279 PolarHBondContact O-N 2.94Å; L279-L281 VanDerWaalsContact C-N 3.33Å; L279-L281 PolarHBondContact O-N 3.42Å; L279-F282 PolarHBondContact O-N 3.23Å; L279-I283 HydrophobicContact CD1-CD1 3.99Å; L279-I283 HydrophobicContact CD1-CG1 4.06Å; L279-I283 HydrophobicContact CD2-CD1 4.26Å; L279-I283 HydrophobicContact CG-CD1 3.71Å; L279-I283 HydrophobicContact CG-CG1 4.2Å; L279-I283 VanDerWaalsContact O-CG1 3.31Å; L279-I283 WeakPolarHBondContact O-CG1 3.47Å; L279-I283 PolarHBondContact O-N 2.82Å
280S95.2Very high92.5Very high0 Ų039 Ų390%020%0.2CC..Hα-helixtrans-62.6-38177.7780000112.9A54 S58 Q276 A277 R278 N284A54-S280 WeakPolarHBondContact O-CB 3.22Å; S58-S280 VanDerWaalsContact CB-O 3.26Å; S58-S280 WeakPolarHBondContact CB-O 3.26Å; S58-S280 PolarHBondContact OG-O 3.28Å; Q276-S280 WeakPolarHBondContact O-CB 3.43Å; Q276-S280 PolarHBondContact O-N 2.75Å; A277-S280 WeakPolarHBondContact O-CB 3.25Å; A277-S280 PolarHBondContact O-N 3.21Å; A277-S280 PolarHBondContact O-OG 3.21Å; R278-S280 PolarHBondContact O-N 2.61Å; S280-N284 WeakPolarHBondContact O-CB 3.46Å; S280-N284 PolarHBondContact O-N 2.87Å
281L95.4Very high92.8Very high0 Ų039.1 Ų39.10%020%0.2CC..Hα-helixtrans-66.9-41.1175.9-67.4173.1000111.8L61 M96 T99 L104 Y258 Y268 A277 R278 L279 N284 L285L61-L281 HydrophobicContact CD1-CD2 4.21Å; M96-L281 HydrophobicContact SD-CB 4.23Å; M96-L281 HydrophobicContact SD-CD2 4.17Å; T99-L281 HydrophobicContact CG2-CD1 3.86Å; T99-L281 HydrophobicContact CG2-CD2 4.25Å; L104-L281 HydrophobicContact CD2-CD1 3.95Å; Y258-L281 HydrophobicContact CD1-CD2 4.38Å; Y268-L281 HydrophobicContact CD1-CD2 3.8Å; Y268-L281 HydrophobicContact CE1-CD2 4.23Å; Y268-L281 HydrophobicContact CG-CD2 4.48Å; A277-L281 PolarHBondContact O-N 3.37Å; R278-L281 PolarHBondContact O-N 3.33Å; R278-L281 VanDerWaalsContact O-N 3.14Å; L279-L281 VanDerWaalsContact C-N 3.33Å; L279-L281 PolarHBondContact O-N 3.42Å; L281-N284 WeakPolarHBondContact O-CB 3.23Å; L281-N284 PolarHBondContact O-N 2.76Å; L281-L285 PolarHBondContact O-N 2.73Å; L281-L285 VanDerWaalsContact O-N 3.07Å
282F95.4Very high93Very high78 Ų7839.1 Ų39.134%0.34220%0.201SC..Hα-helixtrans-75.6-34.8179.6-71-65000113.5L97 R278 L279 N284 L285L97-F282 HydrophobicContact CD2-CE1 3.9Å; L97-F282 HydrophobicContact CD2-CZ 4.07Å; R278-F282 WeakPolarHBondContact O-CD2 3.39Å; R278-F282 PolarHBondContact O-N 3.45Å; L279-F282 PolarHBondContact O-N 3.23Å; F282-N284 VanDerWaalsContact C-N 3.25Å; F282-L285 WeakPolarHBondContact O-CB 3.21Å; F282-L285 PolarHBondContact O-N 3.42Å
283I95.3Very high93.3Very high46 Ų4639.2 Ų39.224%0.23621%0.205CC..Hα-helixtrans-66.6-35.5169.8-61.5170.6000109.3A54 L55 S58 L279 L285 L286 G287A54-I283 HydrophobicContact CB-CD1 4.37Å; L55-I283 HydrophobicContact CD1-CG2 4.15Å; S58-I283 VanDerWaalsContact OG-CB 3.22Å; S58-I283 WeakPolarHBondContact OG-CB 3.4Å; S58-I283 WeakPolarHBondContact OG-CG2 3.38Å; L279-I283 HydrophobicContact CD1-CD1 3.99Å; L279-I283 HydrophobicContact CD1-CG1 4.06Å; L279-I283 HydrophobicContact CD2-CD1 4.26Å; L279-I283 HydrophobicContact CG-CD1 3.71Å; L279-I283 HydrophobicContact CG-CG1 4.2Å; L279-I283 VanDerWaalsContact O-CG1 3.31Å; L279-I283 WeakPolarHBondContact O-CG1 3.47Å; L279-I283 PolarHBondContact O-N 2.82Å; I283-L285 VanDerWaalsContact C-N 3.27Å; I283-L285 PolarHBondContact O-N 3.33Å; I283-L286 WeakPolarHBondContact O-CB 3.44Å; I283-L286 PolarHBondContact O-N 2.85Å; I283-L286 VanDerWaalsContact O-N 3.08Å; I283-G287 PolarHBondContact O-N 3.44Å
284N94.9Very high93.6Very high0 Ų039.3 Ų39.30%021%0.206CC..Hα-helixtrans-62.1-37.1177.516670.4000111.2S58 L61 S62 M96 Y258 S280 L281 F282 L286 G287 L288S58-N284 VanDerWaalsContact OG-CA 3.25Å; S58-N284 WeakPolarHBondContact OG-CA 3.48Å; S58-N284 PolarHBondContact OG-N 3.36Å; L61-N284 HydrophobicContact CB-CB 4.13Å; L61-N284 HydrophobicContact CD1-CB 4.4Å; S62-N284 WeakPolarHBondContact CA-OD1 3.47Å; S62-N284 WeakPolarHBondContact CB-OD1 3.37Å; S62-N284 PolarHBondContact N-OD1 3.35Å; S62-N284 PolarHBondContact OG-O 2.98Å; S62-N284 PolarHBondContact OG-OD1 2.93Å; M96-N284 WeakPolarHBondContact CE-ND2 3.43Å; Y258-N284 VanDerWaalsContact CE1-ND2 3.27Å; Y258-N284 WeakPolarHBondContact CE1-ND2 3.4Å; Y258-N284 PolarHBondContact OH-ND2 2.85Å; Y258-N284 PolarHBondContact OH-OD1 3.15Å; S280-N284 WeakPolarHBondContact O-CB 3.46Å; S280-N284 PolarHBondContact O-N 2.87Å; L281-N284 WeakPolarHBondContact O-CB 3.23Å; L281-N284 PolarHBondContact O-N 2.76Å; F282-N284 VanDerWaalsContact C-N 3.25Å; N284-L286 PolarHBondContact O-N 3.47Å; N284-G287 WeakPolarHBondContact O-CA 3.15Å; N284-G287 PolarHBondContact O-N 3.2Å; N284-L288 WeakPolarHBondContact ND2-CD1 3.3Å; N284-L288 WeakPolarHBondContact O-CG 3.4Å; N284-L288 PolarHBondContact O-N 2.86Å
285L95.4Very high93.9Very high17 Ų1737.7 Ų37.79%0.08920%0.198CC..Hα-helixtrans-53-42.2173.4-177.758.5000112.4Y92 V93 M96 L281 F282 I283 L288 W289Y92-L285 VanDerWaalsContact CB-CD1 3.48Å; V93-L285 HydrophobicContact CG2-CD1 4.32Å; V93-L285 HydrophobicContact CG2-CD2 4.21Å; M96-L285 HydrophobicContact CG-CB 4.13Å; M96-L285 HydrophobicContact CG-CD1 4.26Å; L281-L285 PolarHBondContact O-N 2.73Å; L281-L285 VanDerWaalsContact O-N 3.07Å; F282-L285 WeakPolarHBondContact O-CB 3.21Å; F282-L285 PolarHBondContact O-N 3.42Å; I283-L285 VanDerWaalsContact C-N 3.27Å; I283-L285 PolarHBondContact O-N 3.33Å; L285-L288 PolarHBondContact O-N 3.37Å; L285-W289 HydrophobicContact CD1-CD2 4.36Å; L285-W289 HydrophobicContact CD1-CZ2 4.29Å; L285-W289 HydrophobicContact CD2-CH2 4.43Å; L285-W289 HydrophobicContact CD2-CZ2 4.3Å; L285-W289 HydrophobicContact CG-CD2 4.28Å; L285-W289 HydrophobicContact CG-CZ2 4.32Å; L285-W289 PolarHBondContact O-N 3.12Å
286L94.8Very high94.2Very high102 Ų10233.9 Ų33.953%0.53418%0.175SC..Hα-helixtrans-65.8-40.5177.3-58177.9000111.5I283 N284 W289 S290I283-L286 WeakPolarHBondContact O-CB 3.44Å; I283-L286 PolarHBondContact O-N 2.85Å; I283-L286 VanDerWaalsContact O-N 3.08Å; N284-L286 PolarHBondContact O-N 3.47Å; L286-W289 HydrophobicContact CD2-CE3 4.22Å; L286-W289 HydrophobicContact CD2-CZ3 4.44Å; L286-W289 PolarHBondContact O-N 3.48Å; L286-S290 WeakPolarHBondContact O-CB 3.1Å; L286-S290 PolarHBondContact O-N 3.37Å; L286-S290 PolarHBondContact O-OG 3.46Å
287G92.6Very high94.5Very high14 Ų1433.9 Ų33.914%0.14417%0.174CC..Hα-helixtrans-60.2-46.6174.100000112.4I283 N284 S290 I291I283-G287 PolarHBondContact O-N 3.44Å; N284-G287 WeakPolarHBondContact O-CA 3.15Å; N284-G287 PolarHBondContact O-N 3.2Å; G287-S290 PolarHBondContact O-N 2.99Å; G287-I291 WeakPolarHBondContact O-CG1 3.5Å; G287-I291 PolarHBondContact O-N 2.71Å
288L93.5Very high94.8Very high0 Ų033.9 Ų33.90%017%0.174CC..Hα-helixtrans-63.2-43.4178.2-64.2174.3000112.4M66 Y92 M96 Y258 N284 L285 L292M66-L288 HydrophobicContact CE-CD2 3.26Å; M66-L288 HydrophobicContact CG-CD2 4.03Å; M66-L288 HydrophobicContact SD-CD2 4.39Å; Y92-L288 HydrophobicContact CD1-CD1 3.98Å; Y92-L288 HydrophobicContact CD2-CB 3.77Å; Y92-L288 HydrophobicContact CD2-CD1 4.42Å; Y92-L288 HydrophobicContact CE1-CD1 4.33Å; Y92-L288 HydrophobicContact CE2-CB 3.88Å; Y92-L288 HydrophobicContact CG-CB 4.23Å; Y92-L288 HydrophobicContact CG-CD1 4.04Å; M96-L288 HydrophobicContact CE-CD1 3.73Å; Y258-L288 HydrophobicContact CE2-CD1 4.23Å; N284-L288 WeakPolarHBondContact ND2-CD1 3.3Å; N284-L288 WeakPolarHBondContact O-CG 3.4Å; N284-L288 PolarHBondContact O-N 2.86Å; L285-L288 PolarHBondContact O-N 3.37Å; L288-L292 VanDerWaalsContact O-CB 3.23Å; L288-L292 WeakPolarHBondContact O-CB 3.14Å; L288-L292 PolarHBondContact O-N 2.9Å
289W94.9Very high94.9Very high87 Ų8731.9 Ų31.933%0.3317%0.167SC..Hα-helixtrans-62.4-45.4174.8-76.3-10.8000112A89 Y92 V93 L285 L286 I291 L292 L293A89-W289 PolarHBondContact O-NE1 2.73Å; Y92-W289 AromaticContact CD2-CD1 3.99Å; V93-W289 HydrophobicContact CG2-CH2 4.19Å; V93-W289 HydrophobicContact CG2-CZ2 3.35Å; L285-W289 HydrophobicContact CD1-CD2 4.36Å; L285-W289 HydrophobicContact CD1-CZ2 4.29Å; L285-W289 HydrophobicContact CD2-CH2 4.43Å; L285-W289 HydrophobicContact CD2-CZ2 4.3Å; L285-W289 HydrophobicContact CG-CD2 4.28Å; L285-W289 HydrophobicContact CG-CZ2 4.32Å; L285-W289 PolarHBondContact O-N 3.12Å; L286-W289 HydrophobicContact CD2-CE3 4.22Å; L286-W289 HydrophobicContact CD2-CZ3 4.44Å; L286-W289 PolarHBondContact O-N 3.48Å; W289-I291 PolarHBondContact O-N 3.04Å; W289-L292 PolarHBondContact O-N 2.97Å; W289-L293 WeakPolarHBondContact O-CB 3.33Å; W289-L293 VanDerWaalsContact O-CG 3.24Å; W289-L293 WeakPolarHBondContact O-CG 3.42Å; W289-L293 PolarHBondContact O-N 2.68Å
290S93.9Very high95Very high57 Ų5729 Ų2940%0.39915%0.151SC..Hα-helixtrans-61.2-44.4178.8-680000112.1L286 G287 S294L286-S290 WeakPolarHBondContact O-CB 3.1Å; L286-S290 PolarHBondContact O-N 3.37Å; L286-S290 PolarHBondContact O-OG 3.46Å; G287-S290 PolarHBondContact O-N 2.99Å; S290-S294 VanDerWaalsContact O-CB 3.31Å; S290-S294 WeakPolarHBondContact O-CB 3.45Å; S290-S294 PolarHBondContact O-N 3.37Å; S290-S294 PolarHBondContact O-OG 3.05Å
291I93Very high95.1Very high2 Ų229 Ų291%0.0115%0.151CC..Hα-helixtrans-64.9-47.2176.2-66.4167.8000110.6M66 T70 L194 F198 F201 G287 W289 L293 S294 S295M66-I291 HydrophobicContact CB-CD1 3.92Å; M66-I291 HydrophobicContact CG-CD1 3.7Å; M66-I291 HydrophobicContact CG-CG2 4.34Å; M66-I291 HydrophobicContact SD-CG2 4Å; T70-I291 HydrophobicContact CG2-CG2 3.91Å; L194-I291 HydrophobicContact CD1-CD1 3.66Å; L194-I291 HydrophobicContact CD1-CG1 4.37Å; F198-I291 HydrophobicContact CE1-CG1 4.11Å; F198-I291 HydrophobicContact CE2-CG1 4.09Å; F198-I291 HydrophobicContact CZ-CG1 3.59Å; F201-I291 HydrophobicContact CE2-CG2 4.31Å; G287-I291 WeakPolarHBondContact O-CG1 3.5Å; G287-I291 PolarHBondContact O-N 2.71Å; W289-I291 PolarHBondContact O-N 3.04Å; I291-L293 PolarHBondContact O-N 2.99Å; I291-S294 PolarHBondContact O-N 3.42Å; I291-S295 WeakPolarHBondContact O-CB 3.49Å; I291-S295 PolarHBondContact O-N 3.03Å; I291-S295 PolarHBondContact O-OG 3.44Å
292L93.8Very high95.1Very high1 Ų129 Ų291%0.00515%0.151CC..Hα-helixtrans-59.2-51.3-179.3177.564.2000111A89 Y92 L288 W289 S294 S295 V296A89-L292 HydrophobicContact CB-CD2 4.03Å; Y92-L292 HydrophobicContact CD2-CD2 4.44Å; Y92-L292 HydrophobicContact CE2-CB 4.28Å; Y92-L292 HydrophobicContact CE2-CD2 3.88Å; L288-L292 VanDerWaalsContact O-CB 3.23Å; L288-L292 WeakPolarHBondContact O-CB 3.14Å; L288-L292 PolarHBondContact O-N 2.9Å; W289-L292 PolarHBondContact O-N 2.97Å; L292-S294 VanDerWaalsContact C-N 3.32Å; L292-S294 PolarHBondContact O-N 3.31Å; L292-S295 PolarHBondContact O-N 2.9Å; L292-S295 VanDerWaalsContact O-N 3.16Å; L292-S295 PolarHBondContact O-OG 3.4Å; L292-V296 HydrophobicContact CD1-CG2 4.25Å; L292-V296 WeakPolarHBondContact O-CG2 3.43Å; L292-V296 PolarHBondContact O-N 3.34Å
293L94.6Very high95.1Very high106 Ų10625.8 Ų25.856%0.55514%0.137SC*.Hα-helixtrans-62.6-39.6179.8-68.1173.8000111.8W289 I291 V296 F297W289-L293 WeakPolarHBondContact O-CB 3.33Å; W289-L293 VanDerWaalsContact O-CG 3.24Å; W289-L293 WeakPolarHBondContact O-CG 3.42Å; W289-L293 PolarHBondContact O-N 2.68Å; I291-L293 PolarHBondContact O-N 2.99Å; L293-V296 PolarHBondContact O-N 3.16Å; L293-F297 WeakPolarHBondContact O-CB 3.5Å; L293-F297 PolarHBondContact O-N 3.42Å
294S95.2Very high95.1Very high28 Ų2823.7 Ų23.720%0.19613%0.126CC..Hα-helixtrans-61.8-43.8174.1-57.70000111.4S290 I291 L292 F297 A298S290-S294 VanDerWaalsContact O-CB 3.31Å; S290-S294 WeakPolarHBondContact O-CB 3.45Å; S290-S294 PolarHBondContact O-N 3.37Å; S290-S294 PolarHBondContact O-OG 3.05Å; I291-S294 PolarHBondContact O-N 3.42Å; L292-S294 VanDerWaalsContact C-N 3.32Å; L292-S294 PolarHBondContact O-N 3.31Å; S294-F297 PolarHBondContact O-N 3.35Å; S294-A298 WeakPolarHBondContact O-CB 3.24Å; S294-A298 PolarHBondContact O-N 3.44Å
295S94.6Very high95.1Very high0 Ų025.3 Ų25.30%014%0.136CC..Hα-helixtrans-66.1-39.317874.50000112.5N74 I291 L292 A298 G299N74-S295 PolarHBondContact ND2-OG 3.44Å; I291-S295 WeakPolarHBondContact O-CB 3.49Å; I291-S295 PolarHBondContact O-N 3.03Å; I291-S295 PolarHBondContact O-OG 3.44Å; L292-S295 PolarHBondContact O-N 2.9Å; L292-S295 VanDerWaalsContact O-N 3.16Å; L292-S295 PolarHBondContact O-OG 3.4Å; S295-A298 PolarHBondContact O-N 3.39Å; S295-G299 PolarHBondContact O-N 3.39Å
296V95.6Very high95Very high10 Ų1025.3 Ų25.36%0.06114%0.135CC..Hα-helixtrans-66.2-44.7176.8171.20000110.5V78 A83 I85 A86 L292 L293 G299 M300V78-V296 HydrophobicContact CG2-CB 4.39Å; V78-V296 HydrophobicContact CG2-CG1 4.29Å; V78-V296 HydrophobicContact CG2-CG2 4.18Å; A83-V296 HydrophobicContact CB-CG1 3.88Å; I85-V296 HydrophobicContact CG2-CG2 3.66Å; A86-V296 HydrophobicContact CB-CG2 4.3Å; L292-V296 HydrophobicContact CD1-CG2 4.25Å; L292-V296 WeakPolarHBondContact O-CG2 3.43Å; L292-V296 PolarHBondContact O-N 3.34Å; L293-V296 PolarHBondContact O-N 3.16Å; V296-G299 PolarHBondContact O-N 2.99Å; V296-M300 HydrophobicContact CG1-CE 4.45Å; V296-M300 PolarHBondContact O-N 3.44Å
297F97Very high94.8Very high42 Ų4224.3 Ų24.318%0.18413%0.127CC..Hα-helixtrans-65.1-39.5177.3-165.1-98000112.3I205 V209 V215 L293 S294 G299 M300 C301I205-F297 HydrophobicContact CB-CD1 4.4Å; I205-F297 HydrophobicContact CD1-CD1 4.07Å; I205-F297 HydrophobicContact CG1-CD1 3.98Å; I205-F297 HydrophobicContact CG2-CD1 3.62Å; I205-F297 HydrophobicContact CG2-CE1 3.62Å; V209-F297 HydrophobicContact CG2-CE1 4.04Å; V209-F297 HydrophobicContact CG2-CZ 4.33Å; V215-F297 HydrophobicContact CB-CZ 4.5Å; V215-F297 HydrophobicContact CG1-CE2 3.97Å; V215-F297 HydrophobicContact CG1-CZ 3.82Å; V215-F297 HydrophobicContact CG2-CZ 4.21Å; L293-F297 WeakPolarHBondContact O-CB 3.5Å; L293-F297 PolarHBondContact O-N 3.42Å; S294-F297 PolarHBondContact O-N 3.35Å; F297-G299 VanDerWaalsContact C-N 3.31Å; F297-G299 PolarHBondContact O-N 3.09Å; F297-M300 HydrophobicContact CB-CE 4.24Å; F297-M300 HydrophobicContact CD2-CE 3.41Å; F297-M300 VanDerWaalsContact CD2-CE 3.41Å; F297-M300 HydrophobicContact CE2-CE 4.08Å; F297-M300 HydrophobicContact CG-CE 4.2Å; F297-M300 PolarHBondContact O-N 3.4Å; F297-C301 VanDerWaalsContact CE1-SG 3.52Å; F297-C301 PolarHBondContact O-N 3.42Å; F297-C301 PolarHBondContact O-SG 2.69Å
298A96.7Very high94.6Very high0 Ų026.7 Ų26.70%014%0.141CC..Hα-helixtrans-60.8-39.3172.400000112.1P75 F201 I205 S294 S295 C301 L302 M324P75-A298 HydrophobicContact CG-CB 4.29Å; F201-A298 HydrophobicContact CD1-CB 4.03Å; F201-A298 HydrophobicContact CE1-CB 4.23Å; I205-A298 HydrophobicContact CD1-CB 4.45Å; I205-A298 HydrophobicContact CG1-CB 4.22Å; S294-A298 WeakPolarHBondContact O-CB 3.24Å; S294-A298 PolarHBondContact O-N 3.44Å; S295-A298 PolarHBondContact O-N 3.39Å; A298-C301 WeakPolarHBondContact O-CB 3.34Å; A298-C301 PolarHBondContact O-N 3.44Å; A298-L302 WeakPolarHBondContact O-CB 3.47Å; A298-L302 PolarHBondContact O-N 3.41Å; A298-M324 HydrophobicContact CB-CE 4.27Å
299G96Very high94.4Very high0 Ų028.4 Ų28.40%015%0.152CC..Hα-helixtrans-65.4-36.3174.100000113.9S295 V296 F297 L302 F303S295-G299 PolarHBondContact O-N 3.39Å; V296-G299 PolarHBondContact O-N 2.99Å; F297-G299 VanDerWaalsContact C-N 3.31Å; F297-G299 PolarHBondContact O-N 3.09Å; G299-L302 WeakPolarHBondContact O-CB 3.32Å; G299-L302 PolarHBondContact O-N 3.41Å; G299-F303 PolarHBondContact O-N 2.93Å
300M96.7Very high94.1Very high18 Ų1824.2 Ų24.29%0.08914%0.137CC..Hα-helixtrans-67.4-39.6171.6-68.7-171-66.200112.1V78 I218 S222 L228 V296 F297 F303 S304V78-M300 HydrophobicContact CG1-CG 4.1Å; I218-M300 HydrophobicContact CG2-CB 4.01Å; S222-M300 WeakPolarHBondContact OG-CB 3.35Å; L228-M300 HydrophobicContact CD2-SD 3.53Å; L228-M300 VanDerWaalsContact CD2-SD 3.53Å; L228-M300 HydrophobicContact CG-SD 4.3Å; V296-M300 HydrophobicContact CG1-CE 4.45Å; V296-M300 PolarHBondContact O-N 3.44Å; F297-M300 HydrophobicContact CB-CE 4.24Å; F297-M300 HydrophobicContact CD2-CE 3.41Å; F297-M300 VanDerWaalsContact CD2-CE 3.41Å; F297-M300 HydrophobicContact CE2-CE 4.08Å; F297-M300 HydrophobicContact CG-CE 4.2Å; F297-M300 PolarHBondContact O-N 3.4Å; M300-F303 PolarHBondContact O-N 3.49Å; M300-S304 PolarHBondContact O-N 3.22Å
301C96.9Very high93.8Very high0 Ų021.6 Ų21.60%012%0.118CC..Hα-helixtrans-59-48173-67.70000111F297 A298 F303 S304 V305F297-C301 VanDerWaalsContact CE1-SG 3.52Å; F297-C301 PolarHBondContact O-N 3.42Å; F297-C301 PolarHBondContact O-SG 2.69Å; A298-C301 WeakPolarHBondContact O-CB 3.34Å; A298-C301 PolarHBondContact O-N 3.44Å; C301-F303 VanDerWaalsContact C-N 3.29Å; C301-F303 PolarHBondContact O-N 3.02Å; C301-S304 PolarHBondContact O-N 3.25Å; C301-V305 WeakPolarHBondContact O-CG2 3.11Å; C301-V305 PolarHBondContact O-N 2.82Å
302L95.6Very high93.4Very high0 Ų024.7 Ų24.70%013%0.13CC..Hα-helixtrans-55.6-44.3175.6176.869.3000111.4Y79 A298 G299 Y306 L323 M324 L327Y79-L302 HydrophobicContact CD2-CB 4.43Å; Y79-L302 HydrophobicContact CD2-CD2 3.98Å; Y79-L302 HydrophobicContact CD2-CG 3.73Å; Y79-L302 HydrophobicContact CE2-CG 4.29Å; Y79-L302 HydrophobicContact CG-CD2 4.12Å; Y79-L302 HydrophobicContact CG-CG 4.37Å; A298-L302 WeakPolarHBondContact O-CB 3.47Å; A298-L302 PolarHBondContact O-N 3.41Å; G299-L302 WeakPolarHBondContact O-CB 3.32Å; G299-L302 PolarHBondContact O-N 3.41Å; L302-Y306 HydrophobicContact CD1-CD2 3.65Å; L302-Y306 HydrophobicContact CD1-CE2 3.71Å; L302-Y306 HydrophobicContact CG-CD2 4.48Å; L302-Y306 PolarHBondContact O-N 3.4Å; L302-Y306 VanDerWaalsContact O-N 3.15Å; L302-L323 HydrophobicContact CD1-CB 4.17Å; L302-L323 HydrophobicContact CD2-CB 3.74Å; L302-L323 HydrophobicContact CD2-CD1 4.35Å; L302-M324 HydrophobicContact CB-SD 4.27Å; L302-M324 HydrophobicContact CD2-CG 4.3Å; L302-M324 HydrophobicContact CD2-SD 4.15Å; L302-L327 HydrophobicContact CB-CD2 4.11Å; L302-L327 HydrophobicContact CD1-CB 3.75Å; L302-L327 HydrophobicContact CD1-CD1 4.43Å; L302-L327 HydrophobicContact CD1-CD2 3.83Å; L302-L327 HydrophobicContact CD1-CG 4.21Å
303F95.8Very high93Very high12 Ų1228.3 Ų28.35%0.05315%0.152CC..Hα-helixtrans-64.9-48176.2179.6-104.1000112.9Y79 D221 R227 G299 M300 C301 V305 Y306 K307Y79-F303 HydrophobicContact CD2-CB 3.85Å; Y79-F303 HydrophobicContact CD2-CD2 4.13Å; Y79-F303 HydrophobicContact CE2-CB 4.23Å; Y79-F303 AromaticContact CE2-CD2 3.99Å; Y79-F303 HydrophobicContact CE2-CD2 3.99Å; D221-F303 WeakPolarHBondContact O-CE1 3.17Å; R227-F303 HydrophobicContact CG-CD1 4.38Å; R227-F303 HydrophobicContact CG-CG 4.31Å; R227-F303 VanDerWaalsContact NE-CE2 3.26Å; R227-F303 VanDerWaalsContact NH2-CE2 3.34Å; G299-F303 PolarHBondContact O-N 2.93Å; M300-F303 PolarHBondContact O-N 3.49Å; C301-F303 VanDerWaalsContact C-N 3.29Å; C301-F303 PolarHBondContact O-N 3.02Å; F303-V305 VanDerWaalsContact C-N 3.28Å; F303-V305 PolarHBondContact O-N 3.22Å; F303-Y306 CarbonylContact O-C 3.43Å; F303-Y306 PolarHBondContact O-N 3.45Å; F303-K307 HydrophobicContact CE1-CB 4.38Å; F303-K307 HydrophobicContact CZ-CB 4.22Å; F303-K307 WeakPolarHBondContact O-CA 3.45Å; F303-K307 WeakPolarHBondContact O-CB 3.42Å; F303-K307 PolarHBondContact O-N 3.39Å
304S95.7Very high92.6Very high1 Ų125.1 Ų25.11%0.00714%0.137CC..Hα-helixtrans-60.9-36.8-179.6174.50000112.4Q212 D221 M300 C301Q212-S304 VanDerWaalsContact CD-OG 3.27Å; Q212-S304 WeakPolarHBondContact CG-OG 3.05Å; Q212-S304 PolarHBondContact NE2-O 3.15Å; Q212-S304 PolarHBondContact OE1-OG 3.33Å; D221-S304 PolarHBondContact OD2-OG 3.08Å; M300-S304 PolarHBondContact O-N 3.22Å; C301-S304 PolarHBondContact O-N 3.25Å
305V94.3Very high92Very high34 Ų3426.6 Ų26.621%0.20616%0.157CC..Hα-helixtrans-66.6-44.3174.6175.10000112.1Q212 C301 F303 L327Q212-V305 HydrophobicContact CG-CG2 4.41Å; C301-V305 WeakPolarHBondContact O-CG2 3.11Å; C301-V305 PolarHBondContact O-N 2.82Å; F303-V305 VanDerWaalsContact C-N 3.28Å; F303-V305 PolarHBondContact O-N 3.22Å; V305-L327 HydrophobicContact CB-CD1 3.94Å; V305-L327 HydrophobicContact CG1-CD1 3.68Å; V305-L327 HydrophobicContact CG2-CD1 4.09Å
306Y93.8Very high91.4Very high17 Ų1730.5 Ų30.57%0.06718%0.177CC..THydrogen-bonded Turntrans-103.621.1-174.9-62.8-53.3000114.7L302 F303 S308 C309 P311 Y326 L327 D330L302-Y306 HydrophobicContact CD1-CD2 3.65Å; L302-Y306 HydrophobicContact CD1-CE2 3.71Å; L302-Y306 HydrophobicContact CG-CD2 4.48Å; L302-Y306 PolarHBondContact O-N 3.4Å; L302-Y306 VanDerWaalsContact O-N 3.15Å; F303-Y306 CarbonylContact O-C 3.43Å; F303-Y306 PolarHBondContact O-N 3.45Å; Y306-S308 PolarHBondContact O-N 2.87Å; Y306-C309 WeakPolarHBondContact CB-O 3.33Å; Y306-C309 CarbonylContact O-C 3.43Å; Y306-C309 PolarHBondContact O-N 2.99Å; Y306-P311 HydrophobicContact CD1-CG 4.4Å; Y306-P311 HydrophobicContact CD2-CG 4.12Å; Y306-P311 HydrophobicContact CE2-CG 4.25Å; Y306-P311 HydrophobicContact CG-CG 4.21Å; Y306-Y326 HydrophobicContact CE1-CE1 4.11Å; Y306-Y326 HydrophobicContact CE2-CD1 4.17Å; Y306-Y326 AromaticContact CZ-CD1 3.77Å; Y306-Y326 AromaticContact CZ-CE1 3.78Å; Y306-Y326 VanDerWaalsContact OH-CD1 3.31Å; Y306-Y326 WeakPolarHBondContact OH-CD1 3.02Å; Y306-Y326 WeakPolarHBondContact OH-CE1 3.48Å; Y306-L327 HydrophobicContact CD2-CD1 4.47Å; Y306-L327 HydrophobicContact CE2-CB 3.99Å; Y306-L327 HydrophobicContact CE2-CD1 3.64Å; Y306-L327 HydrophobicContact CE2-CG 4.41Å; Y306-L327 WeakPolarHBondContact OH-CA 3.48Å; Y306-D330 WeakPolarHBondContact CE1-OD2 3.15Å; Y306-D330 WeakPolarHBondContact OH-CB 3.49Å; Y306-D330 PolarHBondContact OH-OD2 2.84Å
307K91.1Very high90.9Very high82 Ų8230.3 Ų30.336%0.35718%0.176SC..SBendtrans-59.6-32.2-175.671-172.1179.7-166.50113.8D221 F303D221-K307 HydrophobicContact CB-CD 4.23Å; D221-K307 IonicContact OD1-NZ 3.75Å; D221-K307 PolarHBondContact OD1-NZ 3.2Å; D221-K307 WeakPolarHBondContact OD2-CD 3.34Å; D221-K307 IonicContact OD2-NZ 3.26Å; D221-K307 PolarHBondContact OD2-NZ 3.35Å; F303-K307 HydrophobicContact CE1-CB 4.38Å; F303-K307 HydrophobicContact CZ-CB 4.22Å; F303-K307 WeakPolarHBondContact O-CA 3.45Å; F303-K307 WeakPolarHBondContact O-CB 3.42Å; F303-K307 PolarHBondContact O-N 3.39Å
308S87.4Confident90Very high64 Ų6433.6 Ų33.645%0.44820%0.204SC..SBendtrans-103.8-14.4-177.4-56.20000113.4Y306 G479Y306-S308 PolarHBondContact O-N 2.87Å; S308-G479 VanDerWaalsContact O-CA 3.24Å; S308-G479 WeakPolarHBondContact O-CA 3.45Å; S308-G479 PolarHBondContact O-N 3.12Å
309C89Confident89.3Confident35 Ų3534.9 Ų34.924%0.23622%0.215CC..  trans-146.795.7179.6-1770000109.8Y306 P311 C480Y306-C309 WeakPolarHBondContact CB-O 3.33Å; Y306-C309 CarbonylContact O-C 3.43Å; Y306-C309 PolarHBondContact O-N 2.99Å; C309-P311 WeakPolarHBondContact O-CD 3.43Å; C309-C480 WeakPolarHBondContact CA-SG 3.27Å; C309-C480 HydrophobicContact CB-CB 4.15Å; C309-C480 WeakPolarHBondContact CB-SG 3.31Å; C309-C480 WeakPolarHBondContact SG-CA 3.23Å; C309-C480 WeakPolarHBondContact SG-CB 3.28Å; C309-C480 CovalentContact SG-SG 2.04Å; C309-C480 PolarHBondContact SG-SG 2.6Å
310D90.1Very high88.7Confident0 Ų036.1 Ų36.10%022%0.223CC..  trans-76.2117.3176.717236.7000111.4Y79 W312 T313 T314 L475 S476Y79-D310 WeakPolarHBondContact OH-CB 3.14Å; Y79-D310 PolarHBondContact OH-OD1 2.7Å; Y79-D310 VanDerWaalsContact OH-OD1 3.06Å; D310-W312 PolarHBondContact O-N 3.16Å; D310-W312 PolarHBondContact OD1-N 2.96Å; D310-W312 VanDerWaalsContact OD1-N 3.08Å; D310-T313 VanDerWaalsContact OD2-CB 3.22Å; D310-T313 WeakPolarHBondContact OD2-CB 3.17Å; D310-T313 WeakPolarHBondContact OD2-CG2 3.48Å; D310-T313 PolarHBondContact OD2-N 3.2Å; D310-T313 PolarHBondContact OD2-OG1 2.91Å; D310-T314 WeakPolarHBondContact O-CB 3.27Å; D310-T314 WeakPolarHBondContact O-CG2 3.43Å; D310-T314 PolarHBondContact O-N 3.15Å; D310-T314 PolarHBondContact O-OG1 2.93Å; D310-L475 HydrophobicContact CB-CB 4.18Å; D310-L475 WeakPolarHBondContact OD2-CD1 3.47Å; D310-S476 PolarHBondContact N-O 3.3Å
311P86.4Confident88Confident1 Ų137.2 Ų37.21%0.00623%0.229CC..THydrogen-bonded Turntrans-69-19.5179.229.1-35.9000113.2Y306 C309 T314 L316 I317 L323 Y326Y306-P311 HydrophobicContact CD1-CG 4.4Å; Y306-P311 HydrophobicContact CD2-CG 4.12Å; Y306-P311 HydrophobicContact CE2-CG 4.25Å; Y306-P311 HydrophobicContact CG-CG 4.21Å; C309-P311 WeakPolarHBondContact O-CD 3.43Å; P311-T314 VanDerWaalsContact C-OG1 3.28Å; P311-T314 VanDerWaalsContact CA-OG1 3.26Å; P311-T314 WeakPolarHBondContact CA-OG1 3.46Å; P311-T314 PolarHBondContact O-OG1 3.23Å; P311-T314 VanDerWaalsContact O-OG1 3.11Å; P311-L316 HydrophobicContact CB-CB 4.28Å; P311-L316 HydrophobicContact CB-CD1 4.21Å; P311-L316 WeakPolarHBondContact O-CB 3.33Å; P311-L316 PolarHBondContact O-N 3.07Å; P311-L316 VanDerWaalsContact O-N 3.1Å; P311-I317 HydrophobicContact CG-CD1 4.41Å; P311-I317 PolarHBondContact O-N 2.85Å; P311-L323 HydrophobicContact CG-CD2 3.69Å; P311-Y326 HydrophobicContact CB-CD1 3.96Å; P311-Y326 HydrophobicContact CB-CE1 3.75Å; P311-Y326 HydrophobicContact CG-CD1 4.02Å; P311-Y326 HydrophobicContact CG-CE1 4.16Å
312W86.3Confident87.6Confident68 Ų6837.6 Ų37.626%0.25823%0.231SC..THydrogen-bonded Turntrans-79.7-53.9-178.7179.145.7000112.6R80 D310 T314 G315 I317 P320 L323 L475R80-W312 VanDerWaalsContact NH2-CH2 3.26Å; D310-W312 PolarHBondContact O-N 3.16Å; D310-W312 PolarHBondContact OD1-N 2.96Å; D310-W312 VanDerWaalsContact OD1-N 3.08Å; W312-T314 PolarHBondContact O-N 3.3Å; W312-G315 PolarHBondContact O-N 3.07Å; W312-I317 HydrophobicContact CB-CD1 4.05Å; W312-I317 HydrophobicContact CB-CG1 3.98Å; W312-P320 HydrophobicContact CD2-CG 4.26Å; W312-P320 HydrophobicContact CH2-CG 4.46Å; W312-P320 HydrophobicContact CZ2-CG 3.94Å; W312-L323 HydrophobicContact CB-CD2 4.33Å; W312-L475 HydrophobicContact CE3-CD1 3.86Å; W312-L475 HydrophobicContact CZ3-CD1 4.07Å
313T85.2Confident87.3Confident76 Ų7637.6 Ų37.647%0.46623%0.231SC..THydrogen-bonded Turntrans-69.2-19.417951.70000113.5D310 G315 L475 T477D310-T313 VanDerWaalsContact OD2-CB 3.22Å; D310-T313 WeakPolarHBondContact OD2-CB 3.17Å; D310-T313 WeakPolarHBondContact OD2-CG2 3.48Å; D310-T313 PolarHBondContact OD2-N 3.2Å; D310-T313 PolarHBondContact OD2-OG1 2.91Å; T313-G315 VanDerWaalsContact C-N 3.28Å; T313-L475 HydrophobicContact CG2-CD1 4.18Å; T313-T477 VanDerWaalsContact OG1-CG2 3.23Å; T313-T477 WeakPolarHBondContact OG1-CG2 3.46Å
314T84.9Confident87.1Confident40 Ų4037 Ų3725%0.24523%0.228CC..THydrogen-bonded Turntrans-78-10.3170.3510000114.1D310 P311 W312 L316 T477 C480 F482D310-T314 WeakPolarHBondContact O-CB 3.27Å; D310-T314 WeakPolarHBondContact O-CG2 3.43Å; D310-T314 PolarHBondContact O-N 3.15Å; D310-T314 PolarHBondContact O-OG1 2.93Å; P311-T314 VanDerWaalsContact C-OG1 3.28Å; P311-T314 VanDerWaalsContact CA-OG1 3.26Å; P311-T314 WeakPolarHBondContact CA-OG1 3.46Å; P311-T314 PolarHBondContact O-OG1 3.23Å; P311-T314 VanDerWaalsContact O-OG1 3.11Å; W312-T314 PolarHBondContact O-N 3.3Å; T314-L316 VanDerWaalsContact C-N 3.34Å; T314-T477 HydrophobicContact CG2-CG2 3.67Å; T314-C480 HydrophobicContact CG2-CB 4.16Å; T314-C480 WeakPolarHBondContact CG2-SG 3.16Å; T314-F482 HydrophobicContact CG2-CE2 3.76Å; T314-F482 HydrophobicContact CG2-CZ 4.12Å
315G82.6Confident86.9Confident59 Ų5937 Ų3761%0.60823%0.228SC*.THydrogen-bonded Turntrans78.911.6-179.600000114.9W312 T313 I317W312-G315 PolarHBondContact O-N 3.07Å; T313-G315 VanDerWaalsContact C-N 3.28Å; G315-I317 PolarHBondContact O-N 2.76Å
316L82.1Confident86.8Confident82 Ų8237.3 Ų37.343%0.42923%0.226SC..SBendtrans-66.3-31.2171.9-69.6173.9000111.9P311 T314 F482P311-L316 HydrophobicContact CB-CB 4.28Å; P311-L316 HydrophobicContact CB-CD1 4.21Å; P311-L316 WeakPolarHBondContact O-CB 3.33Å; P311-L316 PolarHBondContact O-N 3.07Å; P311-L316 VanDerWaalsContact O-N 3.1Å; T314-L316 VanDerWaalsContact C-N 3.34Å; L316-F482 HydrophobicContact CD1-CE1 3.85Å; L316-F482 HydrophobicContact CD1-CZ 3.72Å; L316-F482 HydrophobicContact CD2-CE1 3.84Å; L316-F482 HydrophobicContact CD2-CZ 4.19Å; L316-F482 HydrophobicContact CG-CE1 4.07Å; L316-F482 HydrophobicContact CG-CZ 3.93Å
317I84.6Confident86.7Confident6 Ų636.5 Ų36.53%0.03122%0.222CC..SBendtrans-125147.7172.661.3174.6000110.5P311 W312 G315 Q322 L323 Y326P311-I317 HydrophobicContact CG-CD1 4.41Å; P311-I317 PolarHBondContact O-N 2.85Å; W312-I317 HydrophobicContact CB-CD1 4.05Å; W312-I317 HydrophobicContact CB-CG1 3.98Å; G315-I317 PolarHBondContact O-N 2.76Å; I317-Q322 HydrophobicContact CB-CB 4.1Å; I317-Q322 HydrophobicContact CD1-CB 4.24Å; I317-Q322 HydrophobicContact CG2-CB 4.29Å; I317-L323 HydrophobicContact CD1-CB 4.29Å; I317-L323 HydrophobicContact CD1-CD2 3.52Å; I317-L323 HydrophobicContact CD1-CG 3.64Å; I317-Y326 HydrophobicContact CG2-CD2 3.73Å; I317-Y326 HydrophobicContact CG2-CE2 4.49Å; I317-Y326 HydrophobicContact CG2-CG 3.97Å
318S80Confident86.8Confident110 Ų11032.7 Ų32.777%0.76921%0.206SC*.SBendtrans-87.4-24.6-174.8-50.80000113
319A81.5Confident86.9Confident28 Ų2830 Ų3023%0.23119%0.187CC..SBendtrans-136.3146.8-174.800000112.6D321 Q322A319-D321 PolarHBondContact O-N 3.23Å; A319-Q322 HydrophobicContact CB-CG 4.37Å; A319-Q322 WeakPolarHBondContact O-CB 3.21Å; A319-Q322 PolarHBondContact O-N 3.36Å
320P82.9Confident87Confident26 Ų2632.6 Ų32.617%0.16920%0.198CC..G310 helixtrans-56.4-34.7175.6-24.332.1000114.1R80 W312 Q322 L323R80-P320 VanDerWaalsContact NH1-CG 3.26Å; W312-P320 HydrophobicContact CD2-CG 4.26Å; W312-P320 HydrophobicContact CH2-CG 4.46Å; W312-P320 HydrophobicContact CZ2-CG 3.94Å; P320-Q322 PolarHBondContact O-N 3.08Å; P320-Q322 VanDerWaalsContact O-N 3.12Å; P320-L323 HydrophobicContact CB-CD1 4.48Å; P320-L323 VanDerWaalsContact O-CB 3.24Å; P320-L323 WeakPolarHBondContact O-CB 3.44Å; P320-L323 WeakPolarHBondContact O-CD1 3.42Å; P320-L323 WeakPolarHBondContact O-CG 3.42Å; P320-L323 PolarHBondContact O-N 3.4Å
321D82.4Confident87Confident41 Ų4133.1 Ų33.122%0.21920%0.201CC..G310 helixtrans-66.7-13.5-179.1-60.5-34.6000112.7A319A319-D321 PolarHBondContact O-N 3.23Å
322Q88Confident87.3Confident8 Ų833.2 Ų33.24%0.03720%0.201CC..G310 helixtrans-85.5-7.5175.1-64.9177.7-33.100113.1V158 I317 A319 P320 M324 P325 Y326V158-Q322 HydrophobicContact CG2-CB 4.16Å; V158-Q322 HydrophobicContact CG2-CG 4.31Å; I317-Q322 HydrophobicContact CB-CB 4.1Å; I317-Q322 HydrophobicContact CD1-CB 4.24Å; I317-Q322 HydrophobicContact CG2-CB 4.29Å; A319-Q322 HydrophobicContact CB-CG 4.37Å; A319-Q322 WeakPolarHBondContact O-CB 3.21Å; A319-Q322 PolarHBondContact O-N 3.36Å; P320-Q322 PolarHBondContact O-N 3.08Å; P320-Q322 VanDerWaalsContact O-N 3.12Å; Q322-M324 PolarHBondContact O-N 3.35Å; Q322-P325 WeakPolarHBondContact O-CD 3.27Å; Q322-Y326 VanDerWaalsContact O-CB 3.24Å; Q322-Y326 WeakPolarHBondContact O-CB 3.2Å; Q322-Y326 PolarHBondContact O-N 3.3Å
323L90.3Very high87.3Confident0 Ų030.9 Ų30.90%020%0.199CC..Hα-helixtrans-58.7-46.7-178.7-78.1166.1000112.8A76 Y79 L302 P311 W312 I317 P320 Y326 L327A76-L323 HydrophobicContact CB-CD1 4.37Å; Y79-L323 HydrophobicContact CD1-CD1 3.64Å; Y79-L323 HydrophobicContact CE1-CD1 4.1Å; Y79-L323 HydrophobicContact CE1-CD2 4.38Å; Y79-L323 HydrophobicContact CG-CD1 4.09Å; L302-L323 HydrophobicContact CD1-CB 4.17Å; L302-L323 HydrophobicContact CD2-CB 3.74Å; L302-L323 HydrophobicContact CD2-CD1 4.35Å; P311-L323 HydrophobicContact CG-CD2 3.69Å; W312-L323 HydrophobicContact CB-CD2 4.33Å; I317-L323 HydrophobicContact CD1-CB 4.29Å; I317-L323 HydrophobicContact CD1-CD2 3.52Å; I317-L323 HydrophobicContact CD1-CG 3.64Å; P320-L323 HydrophobicContact CB-CD1 4.48Å; P320-L323 VanDerWaalsContact O-CB 3.24Å; P320-L323 WeakPolarHBondContact O-CB 3.44Å; P320-L323 WeakPolarHBondContact O-CD1 3.42Å; P320-L323 WeakPolarHBondContact O-CG 3.42Å; P320-L323 PolarHBondContact O-N 3.4Å; L323-Y326 PolarHBondContact O-N 3Å; L323-L327 WeakPolarHBondContact O-CB 3.45Å; L323-L327 PolarHBondContact O-N 2.76Å
324M91.7Very high87.4Confident0 Ų030.7 Ų30.70%021%0.211CC..Hα-helixtrans-67.1-48.6-179.7-82.8-62.2-59.700112.8L72 P75 V204 A298 L302 Q322 Y326 L327 V328 F342L72-M324 HydrophobicContact CD2-CB 4.28Å; P75-M324 HydrophobicContact CB-CG 3.45Å; P75-M324 VanDerWaalsContact CB-CG 3.45Å; P75-M324 HydrophobicContact CB-SD 3.57Å; P75-M324 VanDerWaalsContact CB-SD 3.57Å; P75-M324 HydrophobicContact CG-CE 4.48Å; P75-M324 HydrophobicContact CG-CG 3.85Å; P75-M324 HydrophobicContact CG-SD 4.07Å; V204-M324 HydrophobicContact CG1-CE 3.99Å; A298-M324 HydrophobicContact CB-CE 4.27Å; L302-M324 HydrophobicContact CB-SD 4.27Å; L302-M324 HydrophobicContact CD2-CG 4.3Å; L302-M324 HydrophobicContact CD2-SD 4.15Å; Q322-M324 PolarHBondContact O-N 3.35Å; M324-Y326 VanDerWaalsContact C-N 3.28Å; M324-Y326 PolarHBondContact O-N 3.3Å; M324-L327 WeakPolarHBondContact O-CB 3.36Å; M324-L327 PolarHBondContact O-N 3.19Å; M324-L327 HydrophobicContact SD-CD2 4.32Å; M324-V328 VanDerWaalsContact O-CG2 3.23Å; M324-V328 WeakPolarHBondContact O-CG2 3.15Å; M324-V328 PolarHBondContact O-N 2.56Å; M324-F342 HydrophobicContact CB-CZ 4.14Å; M324-F342 HydrophobicContact CE-CE2 3.81Å; M324-F342 HydrophobicContact CE-CZ 3.83Å
325P91.1Very high87.6Confident1 Ų133.9 Ų33.91%0.00622%0.22CC..Hα-helixtrans-53.6-43.5170.1-34.140.8000113.6L72 A153 L154 V158 Q322 V328 M329L72-P325 HydrophobicContact CD2-CG 3.63Å; A153-P325 HydrophobicContact CB-CG 4.38Å; L154-P325 HydrophobicContact CD2-CB 3.7Å; L154-P325 HydrophobicContact CD2-CG 3.55Å; L154-P325 HydrophobicContact CG-CG 4.39Å; V158-P325 HydrophobicContact CB-CB 4.35Å; V158-P325 VanDerWaalsContact CG1-C 3.47Å; V158-P325 HydrophobicContact CG1-CB 3.6Å; Q322-P325 WeakPolarHBondContact O-CD 3.27Å; P325-V328 WeakPolarHBondContact O-CB 3.31Å; P325-V328 PolarHBondContact O-N 2.79Å; P325-M329 WeakPolarHBondContact O-CG 3.37Å; P325-M329 PolarHBondContact O-N 2.84Å; P325-M329 VanDerWaalsContact O-N 3.08Å
326Y90.6Very high88Confident39 Ų3935.2 Ų35.215%0.15322%0.218CC..Hα-helixtrans-63.6-46.6179.4-178.4-92000111T7 Y306 P311 I317 Q322 L323 M324 V328 M329 D330T7-Y326 HydrophobicContact CG2-CE2 4.06Å; Y306-Y326 HydrophobicContact CE1-CE1 4.11Å; Y306-Y326 HydrophobicContact CE2-CD1 4.17Å; Y306-Y326 AromaticContact CZ-CD1 3.77Å; Y306-Y326 AromaticContact CZ-CE1 3.78Å; Y306-Y326 VanDerWaalsContact OH-CD1 3.31Å; Y306-Y326 WeakPolarHBondContact OH-CD1 3.02Å; Y306-Y326 WeakPolarHBondContact OH-CE1 3.48Å; P311-Y326 HydrophobicContact CB-CD1 3.96Å; P311-Y326 HydrophobicContact CB-CE1 3.75Å; P311-Y326 HydrophobicContact CG-CD1 4.02Å; P311-Y326 HydrophobicContact CG-CE1 4.16Å; I317-Y326 HydrophobicContact CG2-CD2 3.73Å; I317-Y326 HydrophobicContact CG2-CE2 4.49Å; I317-Y326 HydrophobicContact CG2-CG 3.97Å; Q322-Y326 VanDerWaalsContact O-CB 3.24Å; Q322-Y326 WeakPolarHBondContact O-CB 3.2Å; Q322-Y326 PolarHBondContact O-N 3.3Å; L323-Y326 PolarHBondContact O-N 3Å; M324-Y326 VanDerWaalsContact C-N 3.28Å; M324-Y326 PolarHBondContact O-N 3.3Å; Y326-V328 VanDerWaalsContact C-N 3.32Å; Y326-V328 PolarHBondContact O-N 2.73Å; Y326-M329 PolarHBondContact O-N 3.48Å; Y326-D330 WeakPolarHBondContact O-CB 3.05Å; Y326-D330 PolarHBondContact O-N 3.18Å
327L92.3Very high88.3Confident0 Ų031.8 Ų31.80%020%0.202CC..Hα-helixtrans-52.9-52.1173.3-179.268.4000110.9V204 L302 V305 Y306 L323 M324 M329 D330 I331V204-L327 HydrophobicContact CG1-CD2 3.85Å; L302-L327 HydrophobicContact CB-CD2 4.11Å; L302-L327 HydrophobicContact CD1-CB 3.75Å; L302-L327 HydrophobicContact CD1-CD1 4.43Å; L302-L327 HydrophobicContact CD1-CD2 3.83Å; L302-L327 HydrophobicContact CD1-CG 4.21Å; V305-L327 HydrophobicContact CB-CD1 3.94Å; V305-L327 HydrophobicContact CG1-CD1 3.68Å; V305-L327 HydrophobicContact CG2-CD1 4.09Å; Y306-L327 HydrophobicContact CD2-CD1 4.47Å; Y306-L327 HydrophobicContact CE2-CB 3.99Å; Y306-L327 HydrophobicContact CE2-CD1 3.64Å; Y306-L327 HydrophobicContact CE2-CG 4.41Å; Y306-L327 WeakPolarHBondContact OH-CA 3.48Å; L323-L327 WeakPolarHBondContact O-CB 3.45Å; L323-L327 PolarHBondContact O-N 2.76Å; M324-L327 WeakPolarHBondContact O-CB 3.36Å; M324-L327 PolarHBondContact O-N 3.19Å; M324-L327 HydrophobicContact SD-CD2 4.32Å; L327-M329 VanDerWaalsContact C-N 3.29Å; L327-M329 PolarHBondContact O-N 3.15Å; L327-D330 WeakPolarHBondContact O-CB 3.44Å; L327-D330 PolarHBondContact O-N 3.42Å; L327-D330 VanDerWaalsContact O-N 3.1Å; L327-I331 HydrophobicContact CD1-CD1 4.23Å; L327-I331 HydrophobicContact CD1-CG1 4.38Å; L327-I331 HydrophobicContact CD1-CG2 3.84Å; L327-I331 HydrophobicContact CD2-CD1 4.47Å; L327-I331 HydrophobicContact CG-CD1 4.06Å; L327-I331 HydrophobicContact CG-CG1 4.24Å; L327-I331 VanDerWaalsContact O-CG1 3.24Å; L327-I331 WeakPolarHBondContact O-CG1 3.31Å; L327-I331 PolarHBondContact O-N 3.15Å
328V92.9Very high88.7Confident3 Ų334.3 Ų34.32%0.01822%0.215CC..Hα-helixtrans-54.3-46.6-179168.80000111.2V204 M324 P325 Y326 L332 P339 F342V204-V328 HydrophobicContact CG2-CG2 3.54Å; M324-V328 VanDerWaalsContact O-CG2 3.23Å; M324-V328 WeakPolarHBondContact O-CG2 3.15Å; M324-V328 PolarHBondContact O-N 2.56Å; P325-V328 WeakPolarHBondContact O-CB 3.31Å; P325-V328 PolarHBondContact O-N 2.79Å; Y326-V328 VanDerWaalsContact C-N 3.32Å; Y326-V328 PolarHBondContact O-N 2.73Å; V328-L332 HydrophobicContact CG1-CD1 4.24Å; V328-L332 WeakPolarHBondContact O-CA 3.43Å; V328-L332 WeakPolarHBondContact O-CB 3.46Å; V328-L332 PolarHBondContact O-N 3.46Å; V328-P339 HydrophobicContact CG1-CB 4.06Å; V328-F342 HydrophobicContact CB-CD1 4.23Å; V328-F342 HydrophobicContact CB-CG 4.41Å; V328-F342 HydrophobicContact CG1-CB 3.93Å; V328-F342 HydrophobicContact CG1-CD1 4.2Å; V328-F342 HydrophobicContact CG1-CG 4.17Å; V328-F342 HydrophobicContact CG2-CB 4.1Å; V328-F342 HydrophobicContact CG2-CD1 3.49Å; V328-F342 VanDerWaalsContact CG2-CD1 3.49Å; V328-F342 HydrophobicContact CG2-CD2 3.8Å; V328-F342 HydrophobicContact CG2-CE1 3.78Å; V328-F342 HydrophobicContact CG2-CE2 4.07Å; V328-F342 HydrophobicContact CG2-CG 3.49Å; V328-F342 VanDerWaalsContact CG2-CG 3.49Å; V328-F342 HydrophobicContact CG2-CZ 4.06Å
329M90.4Very high89.3Confident7 Ų729.1 Ų29.13%0.03418%0.179CC..Hα-helixtrans-66.9-39.5179.1-64.1-50-6500112.4S8 F10 V158 P325 Y326 L327 G333 P339S8-M329 WeakPolarHBondContact O-CE 3.45Å; F10-M329 HydrophobicContact CD1-CE 3.75Å; F10-M329 HydrophobicContact CD1-SD 3.91Å; F10-M329 HydrophobicContact CE1-CE 4.06Å; F10-M329 HydrophobicContact CE1-SD 3.56Å; F10-M329 VanDerWaalsContact CE1-SD 3.56Å; V158-M329 HydrophobicContact CG1-CG 4.2Å; V158-M329 WeakPolarHBondContact O-CG 3.39Å; P325-M329 WeakPolarHBondContact O-CG 3.37Å; P325-M329 PolarHBondContact O-N 2.84Å; P325-M329 VanDerWaalsContact O-N 3.08Å; Y326-M329 PolarHBondContact O-N 3.48Å; L327-M329 VanDerWaalsContact C-N 3.29Å; L327-M329 PolarHBondContact O-N 3.15Å; M329-G333 WeakPolarHBondContact O-CA 3.49Å; M329-G333 PolarHBondContact O-N 3.22Å; M329-P339 HydrophobicContact SD-CB 3.74Å; M329-P339 HydrophobicContact SD-CG 4.32Å
330D90.3Very high89.7Confident89 Ų8927.8 Ų27.848%0.47617%0.168SC..Hα-helixtrans-64.4-47178.4-171.823.9000112Y306 Y326 L327Y306-D330 WeakPolarHBondContact CE1-OD2 3.15Å; Y306-D330 WeakPolarHBondContact OH-CB 3.49Å; Y306-D330 PolarHBondContact OH-OD2 2.84Å; Y326-D330 WeakPolarHBondContact O-CB 3.05Å; Y326-D330 PolarHBondContact O-N 3.18Å; L327-D330 WeakPolarHBondContact O-CB 3.44Å; L327-D330 PolarHBondContact O-N 3.42Å; L327-D330 VanDerWaalsContact O-N 3.1Å
331I91.7Very high90.3Very high12 Ų1228.4 Ų28.46%0.06217%0.17CC..Hα-helixtrans-94.7-21.3-172.569.3165.1000114.8V204 R207 S208 L211 L327V204-I331 HydrophobicContact CG1-CD1 4.32Å; R207-I331 HydrophobicContact CB-CD1 3.98Å; R207-I331 HydrophobicContact CG-CB 4.04Å; R207-I331 HydrophobicContact CG-CD1 3.76Å; R207-I331 HydrophobicContact CG-CG1 4Å; R207-I331 PolarHBondContact NE-O 3.25Å; S208-I331 WeakPolarHBondContact OG-CD1 3.47Å; L211-I331 HydrophobicContact CD1-CB 3.58Å; L211-I331 HydrophobicContact CD1-CD1 4.48Å; L211-I331 HydrophobicContact CD1-CG2 3.4Å; L327-I331 HydrophobicContact CD1-CD1 4.23Å; L327-I331 HydrophobicContact CD1-CG1 4.38Å; L327-I331 HydrophobicContact CD1-CG2 3.84Å; L327-I331 HydrophobicContact CD2-CD1 4.47Å; L327-I331 HydrophobicContact CG-CD1 4.06Å; L327-I331 HydrophobicContact CG-CG1 4.24Å; L327-I331 VanDerWaalsContact O-CG1 3.24Å; L327-I331 WeakPolarHBondContact O-CG1 3.31Å; L327-I331 PolarHBondContact O-N 3.15Å
332L91.4Very high90.8Very high2 Ų226.5 Ų26.51%0.0116%0.16CC..Hα-helixtrans-119.1-5-176.4-65.2160.7000114.4T203 V204 R207 V328 G334 Y335 L338 P339T203-L332 HydrophobicContact CG2-CD1 3.83Å; T203-L332 HydrophobicContact CG2-CD2 4.06Å; V204-L332 HydrophobicContact CG2-CD1 4.14Å; R207-L332 HydrophobicContact CB-CD2 3.87Å; R207-L332 HydrophobicContact CB-CG 4.41Å; R207-L332 HydrophobicContact CG-CD2 3.78Å; R207-L332 HydrophobicContact CG-CG 4.2Å; V328-L332 HydrophobicContact CG1-CD1 4.24Å; V328-L332 WeakPolarHBondContact O-CA 3.43Å; V328-L332 WeakPolarHBondContact O-CB 3.46Å; V328-L332 PolarHBondContact O-N 3.46Å; L332-G334 PolarHBondContact O-N 3.44Å; L332-Y335 HydrophobicContact CD2-CD2 4.34Å; L332-Y335 PolarHBondContact O-N 3.21Å; L332-L338 HydrophobicContact CB-CB 4.42Å; L332-L338 HydrophobicContact CD2-CB 4.17Å; L332-L338 HydrophobicContact CD2-CD1 3.81Å; L332-P339 HydrophobicContact CB-CG 4.08Å; L332-P339 WeakPolarHBondContact O-CG 3.28Å
333G86.5Confident90.9Very high20 Ų2026.2 Ų26.221%0.20616%0.158CC..THydrogen-bonded Turntrans-56.2-27.7-178.800000114.5M329 Y335M329-G333 WeakPolarHBondContact O-CA 3.49Å; M329-G333 PolarHBondContact O-N 3.22Å; G333-Y335 VanDerWaalsContact C-N 3.27Å; G333-Y335 PolarHBondContact O-N 3Å
334G87.2Confident91Very high71 Ų7126.3 Ų26.373%0.73216%0.159SC*.THydrogen-bonded Turntrans-75.8-3.5174.200000115.9L332 P336L332-G334 PolarHBondContact O-N 3.44Å; G334-P336 WeakPolarHBondContact O-CD 3.39Å
335Y90.3Very high91.1Very high108 Ų10826.3 Ų26.342%0.42416%0.159SC..SBendtrans-120.386.1-178-59.1-86.3000110.3L332 G333 G337 L338 P339L332-Y335 HydrophobicContact CD2-CD2 4.34Å; L332-Y335 PolarHBondContact O-N 3.21Å; G333-Y335 VanDerWaalsContact C-N 3.27Å; G333-Y335 PolarHBondContact O-N 3Å; Y335-G337 PolarHBondContact O-N 3.27Å; Y335-L338 HydrophobicContact CG-CD1 4.24Å; Y335-L338 PolarHBondContact O-N 3.38Å; Y335-L338 VanDerWaalsContact O-N 3.15Å; Y335-P339 VanDerWaalsContact O-CD 3.25Å; Y335-P339 WeakPolarHBondContact O-CD 3.44Å
336P89.1Confident91.1Very high87 Ų8726.3 Ų26.357%0.56516%0.159SC*.THydrogen-bonded Turntrans-53.2129.7-175.2-26.534.1000112.5A11 A13 G334A11-P336 HydrophobicContact CB-CB 4.1Å; A13-P336 HydrophobicContact CB-CB 3.81Å; G334-P336 WeakPolarHBondContact O-CD 3.39Å
337G89.7Confident91.2Very high10 Ų1024.5 Ų24.510%0.10315%0.152CC..THydrogen-bonded Turntrans99.2-26.1-179.700000114.3D14 Y335 G340 L341D14-G337 WeakPolarHBondContact OD1-CA 3.48Å; D14-G337 PolarHBondContact OD1-N 3.31Å; Y335-G337 PolarHBondContact O-N 3.27Å; G337-G340 PolarHBondContact O-N 3.37Å; G337-L341 PolarHBondContact O-N 3.14Å
338L92.8Very high91.1Very high59 Ų5924.5 Ų24.531%0.30915%0.152SC..Hα-helixtrans-73.3-42.3178-64.4-174.2000113T203 L332 Y335 G340 L341 F342T203-L338 HydrophobicContact CG2-CB 4.05Å; T203-L338 HydrophobicContact CG2-CD1 4.02Å; T203-L338 HydrophobicContact CG2-CD2 3.98Å; T203-L338 HydrophobicContact CG2-CG 4.24Å; L332-L338 HydrophobicContact CB-CB 4.42Å; L332-L338 HydrophobicContact CD2-CB 4.17Å; L332-L338 HydrophobicContact CD2-CD1 3.81Å; Y335-L338 HydrophobicContact CG-CD1 4.24Å; Y335-L338 PolarHBondContact O-N 3.38Å; Y335-L338 VanDerWaalsContact O-N 3.15Å; L338-G340 VanDerWaalsContact C-N 3.3Å; L338-G340 PolarHBondContact O-N 3.47Å; L338-L341 HydrophobicContact CD2-CD2 4.47Å; L338-L341 WeakPolarHBondContact O-CB 3.31Å; L338-L341 PolarHBondContact O-N 3.3Å; L338-F342 PolarHBondContact O-N 3.42Å; L338-F342 VanDerWaalsContact O-N 3.15Å
339P92Very high91Very high0 Ų024.3 Ų24.30%015%0.151CC..Hα-helixtrans-57-43.1167.4-25.734.2000112.8F10 D14 V328 M329 L332 Y335 L341 F342 V343F10-P339 HydrophobicContact CE1-CB 4.06Å; D14-P339 VanDerWaalsContact OD1-CD 3.31Å; D14-P339 WeakPolarHBondContact OD1-CD 3.45Å; V328-P339 HydrophobicContact CG1-CB 4.06Å; M329-P339 HydrophobicContact SD-CB 3.74Å; M329-P339 HydrophobicContact SD-CG 4.32Å; L332-P339 HydrophobicContact CB-CG 4.08Å; L332-P339 WeakPolarHBondContact O-CG 3.28Å; Y335-P339 VanDerWaalsContact O-CD 3.25Å; Y335-P339 WeakPolarHBondContact O-CD 3.44Å; P339-L341 VanDerWaalsContact C-N 3.3Å; P339-L341 PolarHBondContact O-N 3.45Å; P339-F342 PolarHBondContact O-N 3.14Å; P339-V343 PolarHBondContact O-N 2.9Å
340G91.3Very high91.1Very high0 Ų024 Ų240%015%0.15CC..Hα-helixtrans-59.9-36.5174.200000113.6D14 G337 L338 V343 A344D14-G340 PolarHBondContact OD1-N 3.19Å; G337-G340 PolarHBondContact O-N 3.37Å; L338-G340 VanDerWaalsContact C-N 3.3Å; L338-G340 PolarHBondContact O-N 3.47Å; G340-V343 PolarHBondContact O-N 2.81Å; G340-A344 WeakPolarHBondContact O-CB 3.21Å; G340-A344 PolarHBondContact O-N 2.77Å
341L93.9Very high91.1Very high40 Ų4019.8 Ų19.821%0.20913%0.127CC..Hα-helixtrans-65.2-40.6174.8179.663.7000112.1V17 V196 A199 G337 L338 P339 A344 A345V17-L341 HydrophobicContact CG1-CB 4.21Å; V196-L341 HydrophobicContact CG1-CD1 4.31Å; A199-L341 HydrophobicContact CB-CD1 4.45Å; A199-L341 HydrophobicContact CB-CD2 4.32Å; G337-L341 PolarHBondContact O-N 3.14Å; L338-L341 HydrophobicContact CD2-CD2 4.47Å; L338-L341 WeakPolarHBondContact O-CB 3.31Å; L338-L341 PolarHBondContact O-N 3.3Å; P339-L341 VanDerWaalsContact C-N 3.3Å; P339-L341 PolarHBondContact O-N 3.45Å; L341-A344 WeakPolarHBondContact O-CB 3.1Å; L341-A344 PolarHBondContact O-N 3.19Å; L341-A345 WeakPolarHBondContact O-CB 3.28Å; L341-A345 PolarHBondContact O-N 3.26Å
342F92.6Very high91.1Very high1 Ų119.2 Ų19.20%0.00412%0.124CC..Hα-helixtrans-66.2-38.7175.7-178.7-94.5000112.1V71 L72 V204 M324 V328 L338 P339 A345 T346V71-F342 HydrophobicContact CG1-CE2 4.11Å; V71-F342 HydrophobicContact CG1-CZ 4.02Å; L72-F342 HydrophobicContact CD2-CE1 3.99Å; L72-F342 HydrophobicContact CD2-CZ 4.15Å; V204-F342 HydrophobicContact CG2-CD2 3.53Å; V204-F342 HydrophobicContact CG2-CE2 3.93Å; V204-F342 HydrophobicContact CG2-CG 4.28Å; M324-F342 HydrophobicContact CB-CZ 4.14Å; M324-F342 HydrophobicContact CE-CE2 3.81Å; M324-F342 HydrophobicContact CE-CZ 3.83Å; V328-F342 HydrophobicContact CB-CD1 4.23Å; V328-F342 HydrophobicContact CB-CG 4.41Å; V328-F342 HydrophobicContact CG1-CB 3.93Å; V328-F342 HydrophobicContact CG1-CD1 4.2Å; V328-F342 HydrophobicContact CG1-CG 4.17Å; V328-F342 HydrophobicContact CG2-CB 4.1Å; V328-F342 HydrophobicContact CG2-CD1 3.49Å; V328-F342 VanDerWaalsContact CG2-CD1 3.49Å; V328-F342 HydrophobicContact CG2-CD2 3.8Å; V328-F342 HydrophobicContact CG2-CE1 3.78Å; V328-F342 HydrophobicContact CG2-CE2 4.07Å; V328-F342 HydrophobicContact CG2-CG 3.49Å; V328-F342 VanDerWaalsContact CG2-CG 3.49Å; V328-F342 HydrophobicContact CG2-CZ 4.06Å; L338-F342 PolarHBondContact O-N 3.42Å; L338-F342 VanDerWaalsContact O-N 3.15Å; P339-F342 PolarHBondContact O-N 3.14Å; F342-A345 WeakPolarHBondContact O-CB 3.17Å; F342-A345 PolarHBondContact O-N 3.28Å; F342-T346 PolarHBondContact O-N 2.64Å; F342-T346 PolarHBondContact O-OG1 3.02Å
343V90.9Very high91.1Very high2 Ų219.1 Ų19.11%0.01212%0.123CC..Hα-helixtrans-65.2-43.2172.6165.50000111.2F10 F18 L154 T159 L161 P339 G340 A345 T346 Y347F10-V343 HydrophobicContact CE1-CG2 4.47Å; F10-V343 HydrophobicContact CE2-CG2 4.23Å; F10-V343 HydrophobicContact CZ-CB 4.16Å; F10-V343 HydrophobicContact CZ-CG2 3.51Å; F18-V343 HydrophobicContact CD2-CG1 3.87Å; F18-V343 HydrophobicContact CE2-CG1 4.16Å; F18-V343 HydrophobicContact CG-CG1 4.14Å; L154-V343 HydrophobicContact CD1-CB 4.21Å; L154-V343 HydrophobicContact CD1-CG1 3.95Å; L154-V343 HydrophobicContact CD1-CG2 3.72Å; L154-V343 HydrophobicContact CD2-CG2 3.65Å; L154-V343 HydrophobicContact CG-CG2 4.24Å; T159-V343 HydrophobicContact CG2-CG2 4.47Å; L161-V343 HydrophobicContact CD1-CG1 4.08Å; P339-V343 PolarHBondContact O-N 2.9Å; G340-V343 PolarHBondContact O-N 2.81Å; V343-A345 VanDerWaalsContact C-N 3.29Å; V343-A345 PolarHBondContact O-N 2.94Å; V343-T346 PolarHBondContact O-N 3.23Å; V343-Y347 HydrophobicContact CG1-CD2 3.74Å; V343-Y347 HydrophobicContact CG1-CE2 3.95Å; V343-Y347 WeakPolarHBondContact O-CD2 3.43Å; V343-Y347 PolarHBondContact O-N 3.44Å
344A92.4Very high91.4Very high1 Ų118.2 Ų18.21%0.00811%0.114CC..Hα-helixtrans-58.7-40.9173.500000111.9F18 M21 V196 G340 L341 S348F18-A344 HydrophobicContact CD2-CB 4.47Å; M21-A344 HydrophobicContact CB-CB 3.96Å; M21-A344 HydrophobicContact CE-CB 4.23Å; M21-A344 HydrophobicContact CG-CB 4.1Å; V196-A344 HydrophobicContact CG1-CB 4.05Å; G340-A344 WeakPolarHBondContact O-CB 3.21Å; G340-A344 PolarHBondContact O-N 2.77Å; L341-A344 WeakPolarHBondContact O-CB 3.1Å; L341-A344 PolarHBondContact O-N 3.19Å; A344-S348 WeakPolarHBondContact O-CB 3.42Å; A344-S348 PolarHBondContact O-N 2.93Å; A344-S348 PolarHBondContact O-OG 3.5Å
345A93.1Very high91.6Very high1 Ų114.9 Ų14.91%0.0088%0.079CC..Hα-helixtrans-61.4-46.2174.100000112.3V196 M197 L341 F342 V343 S348 G349V196-A345 HydrophobicContact CG1-CB 4.41Å; V196-A345 WeakPolarHBondContact O-CB 3.32Å; M197-A345 VanDerWaalsContact CG-O 3.3Å; M197-A345 WeakPolarHBondContact CG-O 3.3Å; L341-A345 WeakPolarHBondContact O-CB 3.28Å; L341-A345 PolarHBondContact O-N 3.26Å; F342-A345 WeakPolarHBondContact O-CB 3.17Å; F342-A345 PolarHBondContact O-N 3.28Å; V343-A345 VanDerWaalsContact C-N 3.29Å; V343-A345 PolarHBondContact O-N 2.94Å; A345-S348 WeakPolarHBondContact O-CB 3.35Å; A345-S348 PolarHBondContact O-N 3.06Å; A345-G349 PolarHBondContact O-N 2.96Å
346T92.3Very high91.7Very high0 Ų09.8 Ų9.80%06%0.06CC..Hα-helixtrans-61.4-50.6178.8-58.60000111A68 L72 P150 L154 F342 V343 S348 G349 S350A68-T346 HydrophobicContact CB-CG2 3.57Å; A68-T346 WeakPolarHBondContact CB-O 3.45Å; L72-T346 HydrophobicContact CD1-CG2 3.56Å; L72-T346 HydrophobicContact CD2-CG2 4.1Å; L72-T346 HydrophobicContact CG-CG2 3.79Å; P150-T346 HydrophobicContact CB-CG2 3.83Å; L154-T346 HydrophobicContact CD1-CG2 3.99Å; F342-T346 PolarHBondContact O-N 2.64Å; F342-T346 PolarHBondContact O-OG1 3.02Å; V343-T346 PolarHBondContact O-N 3.23Å; T346-S348 VanDerWaalsContact C-N 3.33Å; T346-S348 PolarHBondContact O-N 3.47Å; T346-G349 PolarHBondContact O-N 3Å; T346-S350 PolarHBondContact O-N 2.95Å
347Y91.5Very high91.9Very high1 Ų15.7 Ų5.70%0.0043%0.033CC..Hα-helixtrans-68.5-30.3177.8-85.2-81.6000113.2F18 P150 A151 L154 A166 T170 V343 G349 S350 L351F18-Y347 HydrophobicContact CD2-CD2 4.39Å; F18-Y347 HydrophobicContact CE2-CD1 4.37Å; F18-Y347 AromaticContact CE2-CD2 3.47Å; F18-Y347 HydrophobicContact CE2-CD2 3.47Å; F18-Y347 VanDerWaalsContact CE2-CD2 3.47Å; F18-Y347 HydrophobicContact CE2-CE2 4.2Å; F18-Y347 AromaticContact CE2-CG 3.57Å; F18-Y347 HydrophobicContact CE2-CG 3.57Å; F18-Y347 HydrophobicContact CZ-CD1 4.27Å; F18-Y347 AromaticContact CZ-CD2 3.72Å; F18-Y347 HydrophobicContact CZ-CD2 3.72Å; F18-Y347 HydrophobicContact CZ-CE2 4.02Å; F18-Y347 AromaticContact CZ-CG 3.86Å; F18-Y347 HydrophobicContact CZ-CG 3.86Å; P150-Y347 HydrophobicContact CB-CE1 4.15Å; P150-Y347 HydrophobicContact CB-CE2 4.32Å; P150-Y347 HydrophobicContact CG-CD1 4.32Å; P150-Y347 HydrophobicContact CG-CE1 3.92Å; A151-Y347 VanDerWaalsContact CA-OH 3.23Å; A151-Y347 WeakPolarHBondContact CA-OH 3.47Å; A151-Y347 WeakPolarHBondContact CB-OH 3.18Å; A151-Y347 PolarHBondContact N-OH 3.15Å; L154-Y347 HydrophobicContact CD1-CD2 4.02Å; L154-Y347 HydrophobicContact CD1-CE2 3.57Å; A166-Y347 WeakPolarHBondContact CB-OH 3.32Å; T170-Y347 HydrophobicContact CG2-CD1 3.73Å; T170-Y347 HydrophobicContact CG2-CE1 4.11Å; T170-Y347 WeakPolarHBondContact OG1-CD1 3.32Å; T170-Y347 WeakPolarHBondContact OG1-CE1 3.43Å; V343-Y347 HydrophobicContact CG1-CD2 3.74Å; V343-Y347 HydrophobicContact CG1-CE2 3.95Å; V343-Y347 WeakPolarHBondContact O-CD2 3.43Å; V343-Y347 PolarHBondContact O-N 3.44Å; Y347-G349 VanDerWaalsContact C-N 3.3Å; Y347-G349 PolarHBondContact O-N 3.09Å; Y347-S350 PolarHBondContact O-N 3.17Å; Y347-S350 VanDerWaalsContact O-N 3.16Å; Y347-L351 WeakPolarHBondContact O-CB 3.49Å; Y347-L351 VanDerWaalsContact O-CG 3.24Å; Y347-L351 WeakPolarHBondContact O-CG 3.44Å; Y347-L351 PolarHBondContact O-N 3.1Å
348S91.4Very high92Very high0 Ų05.2 Ų5.20%03%0.028CC..Hα-helixtrans-57.7-43.6174.6-70.40000111.4Q193 A344 A345 T346 L351 S352Q193-S348 PolarHBondContact OE1-O 3.14Å; A344-S348 WeakPolarHBondContact O-CB 3.42Å; A344-S348 PolarHBondContact O-N 2.93Å; A344-S348 PolarHBondContact O-OG 3.5Å; A345-S348 WeakPolarHBondContact O-CB 3.35Å; A345-S348 PolarHBondContact O-N 3.06Å; T346-S348 VanDerWaalsContact C-N 3.33Å; T346-S348 PolarHBondContact O-N 3.47Å; S348-L351 PolarHBondContact O-N 2.96Å; S348-S352 PolarHBondContact O-N 3.12Å; S348-S352 PolarHBondContact O-OG 3.36Å
349G90.6Very high91.9Very high0 Ų02.7 Ų2.70%02%0.015CC..Hα-helixtrans-65.3-38.4175.100000113.2M66 S67 A345 T346 Y347 S352 T353M66-G349 WeakPolarHBondContact O-CA 3.4Å; S67-G349 WeakPolarHBondContact CA-O 3.25Å; A345-G349 PolarHBondContact O-N 2.96Å; T346-G349 PolarHBondContact O-N 3Å; Y347-G349 VanDerWaalsContact C-N 3.3Å; Y347-G349 PolarHBondContact O-N 3.09Å; G349-S352 PolarHBondContact O-OG 3.1Å; G349-T353 WeakPolarHBondContact O-CB 3.39Å; G349-T353 PolarHBondContact O-N 3.26Å; G349-T353 PolarHBondContact O-OG1 3.11Å
350S91.3Very high91.9Very high1 Ų12.7 Ų2.71%0.0072%0.015CC..Hα-helixtrans-67.5-42.4174.2-77.60000112.1A68 V146 T346 Y347 T353 V354A68-S350 WeakPolarHBondContact CB-OG 3.41Å; V146-S350 WeakPolarHBondContact O-CB 3.38Å; V146-S350 PolarHBondContact O-OG 3.45Å; T346-S350 PolarHBondContact O-N 2.95Å; Y347-S350 PolarHBondContact O-N 3.17Å; Y347-S350 VanDerWaalsContact O-N 3.16Å; S350-T353 PolarHBondContact O-N 2.96Å; S350-V354 WeakPolarHBondContact O-CB 3.5Å; S350-V354 WeakPolarHBondContact O-CG2 3.16Å; S350-V354 PolarHBondContact O-N 3.42Å
351L91Very high92.1Very high0 Ų02.7 Ų2.70%02%0.015CC..Hα-helixtrans-62.7-43.4-179.7-74.4167.9000112.5M21 L22 T170 C174 Y177 Y347 S348 T353 V354 S355M21-L351 HydrophobicContact CE-CD1 3.98Å; M21-L351 HydrophobicContact SD-CD1 3.75Å; L22-L351 HydrophobicContact CD2-CD1 3.67Å; T170-L351 HydrophobicContact CG2-CD2 3.56Å; T170-L351 HydrophobicContact CG2-CG 4.01Å; C174-L351 HydrophobicContact CB-CD2 3.75Å; Y177-L351 HydrophobicContact CE1-CD2 4.4Å; Y177-L351 PolarHBondContact OH-O 3.09Å; Y177-L351 VanDerWaalsContact OH-O 3.08Å; Y347-L351 WeakPolarHBondContact O-CB 3.49Å; Y347-L351 VanDerWaalsContact O-CG 3.24Å; Y347-L351 WeakPolarHBondContact O-CG 3.44Å; Y347-L351 PolarHBondContact O-N 3.1Å; S348-L351 PolarHBondContact O-N 2.96Å; L351-T353 VanDerWaalsContact C-N 3.25Å; L351-T353 PolarHBondContact O-N 3.2Å; L351-V354 PolarHBondContact O-N 2.79Å; L351-S355 VanDerWaalsContact O-CB 3.3Å; L351-S355 WeakPolarHBondContact O-CB 3.25Å; L351-S355 PolarHBondContact O-N 3.28Å; L351-S355 PolarHBondContact O-OG 3.37Å
352S91Very high92Very high0 Ų00.8 Ų0.80%01%0.005CC..Hα-helixtrans-61.5-36.4175.658.90000111.8A63 D190 Q193 S348 G349 S355 S356A63-S352 PolarHBondContact O-OG 2.86Å; D190-S352 WeakPolarHBondContact OD1-CA 3.16Å; D190-S352 VanDerWaalsContact OD1-CB 3.28Å; D190-S352 WeakPolarHBondContact OD1-CB 3.28Å; Q193-S352 VanDerWaalsContact OE1-CA 3.26Å; Q193-S352 VanDerWaalsContact OE1-CB 3.26Å; Q193-S352 VanDerWaalsContact OE1-N 3.14Å; S348-S352 PolarHBondContact O-N 3.12Å; S348-S352 PolarHBondContact O-OG 3.36Å; G349-S352 PolarHBondContact O-OG 3.1Å; S352-S355 WeakPolarHBondContact CA-OG 3.36Å; S352-S355 PolarHBondContact O-OG 3.14Å; S352-S356 WeakPolarHBondContact O-CB 3.04Å; S352-S356 PolarHBondContact O-N 3.4Å; S352-S356 PolarHBondContact O-OG 3.34Å
353T92.3Very high91.9Very high0 Ų00.7 Ų0.70%00%0.004CC..Hα-helixtrans-75.3-43.5-179.3-57.40000111.8S64 F65 S67 Y142 V146 G349 S350 L351 S356 S357S64-T353 VanDerWaalsContact O-CA 3.24Å; S64-T353 WeakPolarHBondContact O-CA 3.24Å; S64-T353 WeakPolarHBondContact O-CB 3.46Å; S64-T353 PolarHBondContact O-OG1 3.47Å; S64-T353 VanDerWaalsContact O-OG1 3.08Å; F65-T353 HydrophobicContact CD1-CG2 4.48Å; S67-T353 WeakPolarHBondContact CB-OG1 3.14Å; Y142-T353 HydrophobicContact CD1-CG2 4.39Å; Y142-T353 HydrophobicContact CE1-CG2 3.38Å; V146-T353 HydrophobicContact CB-CG2 4.48Å; V146-T353 HydrophobicContact CG1-CG2 3.94Å; V146-T353 HydrophobicContact CG2-CG2 4.01Å; G349-T353 WeakPolarHBondContact O-CB 3.39Å; G349-T353 PolarHBondContact O-N 3.26Å; G349-T353 PolarHBondContact O-OG1 3.11Å; S350-T353 PolarHBondContact O-N 2.96Å; L351-T353 VanDerWaalsContact C-N 3.25Å; L351-T353 PolarHBondContact O-N 3.2Å; T353-S356 WeakPolarHBondContact O-CB 3.09Å; T353-S357 WeakPolarHBondContact O-CB 3.4Å; T353-S357 PolarHBondContact O-N 2.88Å; T353-S357 PolarHBondContact O-OG 3.1Å
354V92.6Very high92.1Very high1 Ų10.6 Ų0.61%0.0060%0.004CC..Hα-helixtrans-66.2-42.4178.3176.60000110.3T143 V146 I147 C174 S350 L351 S356 S357 I358T143-V354 HydrophobicContact CG2-CB 4.07Å; T143-V354 HydrophobicContact CG2-CG1 3.79Å; T143-V354 HydrophobicContact CG2-CG2 3.81Å; V146-V354 HydrophobicContact CG1-CG2 4.02Å; I147-V354 HydrophobicContact CD1-CG1 4.13Å; I147-V354 HydrophobicContact CD1-CG2 4.16Å; I147-V354 HydrophobicContact CG1-CG1 4.32Å; I147-V354 HydrophobicContact CG1-CG2 3.5Å; I147-V354 VanDerWaalsContact CG1-CG2 3.5Å; C174-V354 HydrophobicContact CB-CG1 4.04Å; C174-V354 WeakPolarHBondContact SG-CG1 3.38Å; S350-V354 WeakPolarHBondContact O-CB 3.5Å; S350-V354 WeakPolarHBondContact O-CG2 3.16Å; S350-V354 PolarHBondContact O-N 3.42Å; L351-V354 PolarHBondContact O-N 2.79Å; V354-S356 PolarHBondContact O-N 2.64Å; V354-S357 PolarHBondContact O-N 2.88Å; V354-I358 HydrophobicContact CG1-CD1 3.74Å; V354-I358 HydrophobicContact CG1-CG1 4.32Å; V354-I358 WeakPolarHBondContact O-CG1 3.37Å; V354-I358 PolarHBondContact O-N 3.28Å
355S91.6Very high92.2Very high0 Ų01 Ų10%01%0.006CC..Hα-helixtrans-63.6-44.217961.20000112.6C174 Y177 C178 L351 S352 S357 I358 N359C174-S355 PolarHBondContact SG-N 2.83Å; C174-S355 VanDerWaalsContact SG-N 3.4Å; Y177-S355 WeakPolarHBondContact OH-CB 3.04Å; C178-S355 WeakPolarHBondContact SG-CA 3.44Å; C178-S355 WeakPolarHBondContact SG-CB 3.16Å; L351-S355 VanDerWaalsContact O-CB 3.3Å; L351-S355 WeakPolarHBondContact O-CB 3.25Å; L351-S355 PolarHBondContact O-N 3.28Å; L351-S355 PolarHBondContact O-OG 3.37Å; S352-S355 WeakPolarHBondContact CA-OG 3.36Å; S352-S355 PolarHBondContact O-OG 3.14Å; S355-S357 VanDerWaalsContact C-N 3.29Å; S355-S357 PolarHBondContact O-N 2.82Å; S355-I358 PolarHBondContact O-N 3.4Å; S355-N359 WeakPolarHBondContact O-CB 3.24Å; S355-N359 PolarHBondContact O-N 2.7Å
356S91.9Very high92.1Very high2 Ų20.9 Ų0.91%0.0141%0.005CC..Hα-helixtrans-54.3-47.4172.8-620000111.8S64 R267 S352 T353 V354 A360S64-S356 WeakPolarHBondContact CB-OG 3.36Å; S64-S356 PolarHBondContact OG-OG 3.4Å; R267-S356 VanDerWaalsContact CZ-OG 3.27Å; R267-S356 PolarHBondContact NH1-OG 2.69Å; R267-S356 PolarHBondContact NH2-OG 3.23Å; S352-S356 WeakPolarHBondContact O-CB 3.04Å; S352-S356 PolarHBondContact O-N 3.4Å; S352-S356 PolarHBondContact O-OG 3.34Å; T353-S356 WeakPolarHBondContact O-CB 3.09Å; V354-S356 PolarHBondContact O-N 2.64Å; S356-A360 VanDerWaalsContact O-CB 3.25Å; S356-A360 WeakPolarHBondContact O-CB 3.33Å; S356-A360 PolarHBondContact O-N 2.78Å
357S93.2Very high92Very high1 Ų11.4 Ų1.41%0.0071%0.008CC..Hα-helixtrans-67.7-47.7-175.8-61.30000111.3T143 T353 V354 S355 N359 A360 L361T143-S357 WeakPolarHBondContact OG1-CB 3.35Å; T143-S357 PolarHBondContact OG1-OG 2.82Å; T353-S357 WeakPolarHBondContact O-CB 3.4Å; T353-S357 PolarHBondContact O-N 2.88Å; T353-S357 PolarHBondContact O-OG 3.1Å; V354-S357 PolarHBondContact O-N 2.88Å; S355-S357 VanDerWaalsContact C-N 3.29Å; S355-S357 PolarHBondContact O-N 2.82Å; S357-N359 PolarHBondContact O-N 2.92Å; S357-A360 PolarHBondContact O-N 2.79Å; S357-L361 WeakPolarHBondContact O-CB 3.18Å; S357-L361 VanDerWaalsContact O-CG 3.22Å; S357-L361 WeakPolarHBondContact O-CG 3.29Å; S357-L361 PolarHBondContact O-N 2.97Å
358I92.9Very high92.1Very high0 Ų01.4 Ų1.40%01%0.008CC..Hα-helixtrans-60-46.9177.5-69.5172.3000110.7C178 V354 S355 A360 L361 A362 S389C178-I358 HydrophobicContact CB-CG2 4.13Å; V354-I358 HydrophobicContact CG1-CD1 3.74Å; V354-I358 HydrophobicContact CG1-CG1 4.32Å; V354-I358 WeakPolarHBondContact O-CG1 3.37Å; V354-I358 PolarHBondContact O-N 3.28Å; S355-I358 PolarHBondContact O-N 3.4Å; I358-A360 PolarHBondContact O-N 3.01Å; I358-L361 PolarHBondContact O-N 3.49Å; I358-A362 WeakPolarHBondContact O-CB 3.41Å; I358-A362 PolarHBondContact O-N 3.4Å; I358-S389 VanDerWaalsContact CG2-O 3.3Å; I358-S389 WeakPolarHBondContact CG2-O 3.41Å
359N90.4Very high92.1Very high5 Ų53.8 Ų3.83%0.0272%0.02CC..Hα-helixtrans-63.1-42.5179.1-17977.4000111.9Q266 S355 S357 A362 A363Q266-N359 PolarHBondContact NE2-ND2 2.9Å; S355-N359 WeakPolarHBondContact O-CB 3.24Å; S355-N359 PolarHBondContact O-N 2.7Å; S357-N359 PolarHBondContact O-N 2.92Å; N359-A362 PolarHBondContact O-N 3Å; N359-A363 WeakPolarHBondContact O-CB 3.42Å; N359-A363 PolarHBondContact O-N 2.73Å
360A92.6Very high92.2Very high0 Ų05.4 Ų5.40%03%0.028CC..Hα-helixtrans-66.5-42178.100000112.5F135 Q262 A263 S356 S357 I358 A363 V364F135-A360 HydrophobicContact CZ-CB 3.88Å; Q262-A360 HydrophobicContact CB-CB 4.09Å; Q262-A360 HydrophobicContact CG-CB 3.75Å; A263-A360 HydrophobicContact CB-CB 3.84Å; S356-A360 VanDerWaalsContact O-CB 3.25Å; S356-A360 WeakPolarHBondContact O-CB 3.33Å; S356-A360 PolarHBondContact O-N 2.78Å; S357-A360 PolarHBondContact O-N 2.79Å; I358-A360 PolarHBondContact O-N 3.01Å; A360-A363 PolarHBondContact O-N 3.1Å; A360-V364 WeakPolarHBondContact O-CB 3.38Å; A360-V364 WeakPolarHBondContact O-CG2 3.48Å; A360-V364 PolarHBondContact O-N 3.12Å
361L94.7Very high92.1Very high0 Ų010.3 Ų10.30%05%0.047CC..Hα-helixtrans-60.9-45.3175.3-76.6168.8000111.8F135 I136 T139 I140 S357 I358 T365 Y392F135-L361 HydrophobicContact CE1-CD2 4.2Å; I136-L361 HydrophobicContact CB-CD2 4.1Å; I136-L361 HydrophobicContact CG1-CD2 3.93Å; I136-L361 HydrophobicContact CG2-CD2 4.12Å; T139-L361 HydrophobicContact CG2-CD1 3.9Å; T139-L361 HydrophobicContact CG2-CD2 4.18Å; T139-L361 HydrophobicContact CG2-CG 3.84Å; I140-L361 HydrophobicContact CG1-CD1 4.04Å; I140-L361 HydrophobicContact CG1-CD2 4.35Å; S357-L361 WeakPolarHBondContact O-CB 3.18Å; S357-L361 VanDerWaalsContact O-CG 3.22Å; S357-L361 WeakPolarHBondContact O-CG 3.29Å; S357-L361 PolarHBondContact O-N 2.97Å; I358-L361 PolarHBondContact O-N 3.49Å; L361-T365 WeakPolarHBondContact O-CB 3.24Å; L361-T365 PolarHBondContact O-N 2.94Å; L361-T365 PolarHBondContact O-OG1 3.04Å; L361-Y392 HydrophobicContact CB-CD1 4.21Å; L361-Y392 HydrophobicContact CB-CD2 3.57Å; L361-Y392 HydrophobicContact CB-CE1 4.43Å; L361-Y392 HydrophobicContact CB-CE2 3.79Å; L361-Y392 HydrophobicContact CB-CG 3.78Å; L361-Y392 HydrophobicContact CD1-CD1 3.91Å; L361-Y392 HydrophobicContact CD1-CG 3.96Å; L361-Y392 HydrophobicContact CD2-CD1 4.47Å; L361-Y392 HydrophobicContact CD2-CE1 4.27Å; L361-Y392 HydrophobicContact CG-CD1 4.44Å; L361-Y392 HydrophobicContact CG-CG 4.41Å
362A92.6Very high91.9Very high0 Ų012.6 Ų12.60%06%0.062CC..Hα-helixtrans-62.6-47.3175.800000111.3I358 N359 T365 V366 M388 S389I358-A362 WeakPolarHBondContact O-CB 3.41Å; I358-A362 PolarHBondContact O-N 3.4Å; N359-A362 PolarHBondContact O-N 3Å; A362-T365 PolarHBondContact O-N 3.13Å; A362-V366 WeakPolarHBondContact O-CB 3.35Å; A362-V366 WeakPolarHBondContact O-CG2 3.38Å; A362-V366 PolarHBondContact O-N 3.28Å; A362-M388 HydrophobicContact CB-CB 4.05Å; A362-S389 VanDerWaalsContact CB-OG 3.3Å; A362-S389 WeakPolarHBondContact CB-OG 3.47Å
363A90.3Very high91.8Very high0 Ų019.5 Ų19.50%09%0.089CC..Hα-helixtrans-57.9-51.4178.700000112.2L46 N359 A360 T365 V366 E367L46-A363 HydrophobicContact CD2-CB 3.77Å; N359-A363 WeakPolarHBondContact O-CB 3.42Å; N359-A363 PolarHBondContact O-N 2.73Å; A360-A363 PolarHBondContact O-N 3.1Å; A363-T365 PolarHBondContact O-N 2.93Å; A363-V366 PolarHBondContact O-N 3.49Å; A363-E367 WeakPolarHBondContact O-CB 3.37Å; A363-E367 WeakPolarHBondContact O-CG 3.24Å; A363-E367 PolarHBondContact O-N 2.9Å
364V94.1Very high91.6Very high0 Ų021.3 Ų21.30%010%0.1CC..Hα-helixtrans-64.1-41.9-178.7159.90000111.5Y116 T132 F135 Q262 A360 V366 D368Y116-V364 HydrophobicContact CD2-CG1 4.2Å; Y116-V364 HydrophobicContact CD2-CG2 4.09Å; Y116-V364 HydrophobicContact CE2-CG1 4.44Å; Y116-V364 HydrophobicContact CE2-CG2 4.1Å; T132-V364 HydrophobicContact CG2-CG1 3.39Å; F135-V364 HydrophobicContact CD1-CB 4.34Å; F135-V364 HydrophobicContact CD1-CG1 4.02Å; F135-V364 HydrophobicContact CD1-CG2 4.19Å; F135-V364 HydrophobicContact CE1-CB 4.17Å; F135-V364 HydrophobicContact CE1-CG1 4.34Å; F135-V364 HydrophobicContact CE1-CG2 3.93Å; Q262-V364 HydrophobicContact CB-CG2 3.93Å; Q262-V364 HydrophobicContact CG-CG2 3.49Å; Q262-V364 VanDerWaalsContact CG-CG2 3.49Å; A360-V364 WeakPolarHBondContact O-CB 3.38Å; A360-V364 WeakPolarHBondContact O-CG2 3.48Å; A360-V364 PolarHBondContact O-N 3.12Å; V364-V366 PolarHBondContact O-N 3.47Å; V364-D368 WeakPolarHBondContact CG1-OD2 3.29Å; V364-D368 WeakPolarHBondContact O-CB 3.28Å; V364-D368 PolarHBondContact O-N 2.95Å
365T94.4Very high91.2Very high8 Ų829.5 Ų29.55%0.04914%0.144CC..Iπ-helixtrans-66.3-42.1178.9-54.10000111.5L361 A362 A363 I369 I370 M388 Y392L361-T365 WeakPolarHBondContact O-CB 3.24Å; L361-T365 PolarHBondContact O-N 2.94Å; L361-T365 PolarHBondContact O-OG1 3.04Å; A362-T365 PolarHBondContact O-N 3.13Å; A363-T365 PolarHBondContact O-N 2.93Å; T365-I369 HydrophobicContact CG2-CB 4.31Å; T365-I369 HydrophobicContact CG2-CD1 4.23Å; T365-I369 WeakPolarHBondContact O-CA 3.37Å; T365-I369 VanDerWaalsContact O-CB 3.32Å; T365-I369 WeakPolarHBondContact O-CB 3.38Å; T365-I369 PolarHBondContact O-N 3.11Å; T365-I370 HydrophobicContact CG2-CD1 4.33Å; T365-I370 PolarHBondContact O-N 2.96Å; T365-I370 VanDerWaalsContact O-N 3.09Å; T365-M388 HydrophobicContact CG2-CE 3.61Å; T365-M388 HydrophobicContact CG2-SD 4.32Å; T365-Y392 VanDerWaalsContact OG1-CE2 3.26Å; T365-Y392 WeakPolarHBondContact OG1-CE2 3.39Å; T365-Y392 PolarHBondContact OG1-OH 2.84Å
366V91.9Very high91Very high0 Ų032.7 Ų32.70%016%0.157CC..Iπ-helixtrans-64-48.7178.5170.70000111A362 A363 V364 I370 R371 L381 I384 M388A362-V366 WeakPolarHBondContact O-CB 3.35Å; A362-V366 WeakPolarHBondContact O-CG2 3.38Å; A362-V366 PolarHBondContact O-N 3.28Å; A363-V366 PolarHBondContact O-N 3.49Å; V364-V366 PolarHBondContact O-N 3.47Å; V366-I370 HydrophobicContact CG2-CD1 4.47Å; V366-I370 PolarHBondContact O-N 3.09Å; V366-R371 VanDerWaalsContact O-CB 3.28Å; V366-R371 WeakPolarHBondContact O-CB 3.38Å; V366-R371 PolarHBondContact O-N 3.32Å; V366-L381 HydrophobicContact CG1-CD1 3.43Å; V366-L381 VanDerWaalsContact CG1-CD1 3.43Å; V366-L381 HydrophobicContact CG1-CD2 4.1Å; V366-L381 HydrophobicContact CG1-CG 3.62Å; V366-I384 HydrophobicContact CG2-CG2 4.23Å; V366-M388 HydrophobicContact CG2-CG 4.29Å
367E90Very high90.7Very high10 Ų1036.1 Ų36.15%0.04718%0.181CC..Iπ-helixtrans-77.6-36.8-175.1-69.1-62.415600113.8L46 T113 R128 A363 R371 P372L46-E367 HydrophobicContact CD1-CG 4.4Å; T113-E367 HydrophobicContact CG2-CG 3.73Å; R128-E367 PolarHBondContact NH2-O 3.38Å; A363-E367 WeakPolarHBondContact O-CB 3.37Å; A363-E367 WeakPolarHBondContact O-CG 3.24Å; A363-E367 PolarHBondContact O-N 2.9Å; E367-R371 IonicContact OE1-CZ 2.66Å; E367-R371 IonicContact OE1-NH1 2.73Å; E367-R371 PolarHBondContact OE1-NH1 3.34Å; E367-R371 VanDerWaalsContact OE1-NH1 3.16Å; E367-R371 WeakPolarHBondContact OE2-CD 3.43Å; E367-R371 IonicContact OE2-CZ 2.83Å; E367-R371 IonicContact OE2-NE 3.87Å; E367-R371 IonicContact OE2-NH1 2.74Å; E367-R371 PolarHBondContact OE2-NH1 3.02Å; E367-P372 VanDerWaalsContact O-CD 3.24Å; E367-P372 WeakPolarHBondContact O-CD 3.26Å; E367-P372 VanDerWaalsContact O-CG 3.3Å; E367-P372 WeakPolarHBondContact O-CG 3.31Å
368D92.3Very high90.2Very high1 Ų139.5 Ų39.51%0.00520%0.197CC..Iπ-helixtrans-95.1-29.3-173.5-60.1-23.5000113.5S114 R128 T132 V364S114-D368 WeakPolarHBondContact CB-OD1 3.34Å; S114-D368 VanDerWaalsContact OG-CG 3.23Å; S114-D368 PolarHBondContact OG-OD1 3.28Å; S114-D368 PolarHBondContact OG-OD2 3Å; R128-D368 IonicContact CZ-OD1 3.17Å; R128-D368 IonicContact NE-OD1 2.85Å; R128-D368 PolarHBondContact NE-OD1 2.83Å; R128-D368 IonicContact NH2-OD1 3.72Å; R128-D368 PolarHBondContact NH2-OD1 3.18Å; T132-D368 HydrophobicContact CG2-CB 4.02Å; T132-D368 PolarHBondContact OG1-OD2 3.2Å; V364-D368 WeakPolarHBondContact CG1-OD2 3.29Å; V364-D368 WeakPolarHBondContact O-CB 3.28Å; V364-D368 PolarHBondContact O-N 2.95Å
369I93.1Very high89.7Confident51 Ų5145.7 Ų45.726%0.26222%0.224SC..Iπ-helixtrans-112.1-36.3-172-57.1177000112T132 M133 I136 T365 Y373T132-I369 HydrophobicContact CG2-CD1 4.17Å; T132-I369 HydrophobicContact CG2-CG1 4.35Å; M133-I369 HydrophobicContact CE-CD1 4.05Å; I136-I369 HydrophobicContact CD1-CD1 4.03Å; T365-I369 HydrophobicContact CG2-CB 4.31Å; T365-I369 HydrophobicContact CG2-CD1 4.23Å; T365-I369 WeakPolarHBondContact O-CA 3.37Å; T365-I369 VanDerWaalsContact O-CB 3.32Å; T365-I369 WeakPolarHBondContact O-CB 3.38Å; T365-I369 PolarHBondContact O-N 3.11Å; I369-Y373 WeakPolarHBondContact O-CD2 3.21Å
370I91.9Very high89.5Confident33 Ų3352.1 Ų52.117%0.16925%0.248CC..Iπ-helixtrans-96.6-55.8-173-59.3177.1000111.5T365 V366 P372 Y373 T374 F376 I384 M388T365-I370 HydrophobicContact CG2-CD1 4.33Å; T365-I370 PolarHBondContact O-N 2.96Å; T365-I370 VanDerWaalsContact O-N 3.09Å; V366-I370 HydrophobicContact CG2-CD1 4.47Å; V366-I370 PolarHBondContact O-N 3.09Å; I370-P372 VanDerWaalsContact C-CD 3.47Å; I370-Y373 PolarHBondContact O-N 2.59Å; I370-T374 PolarHBondContact O-N 3.49Å; I370-T374 PolarHBondContact O-OG1 2.9Å; I370-F376 HydrophobicContact CG2-CD2 4.45Å; I370-F376 HydrophobicContact CG2-CE2 4.32Å; I370-I384 HydrophobicContact CD1-CG2 3.45Å; I370-I384 VanDerWaalsContact CD1-CG2 3.45Å; I370-I384 HydrophobicContact CG2-CD1 4.46Å; I370-I384 HydrophobicContact CG2-CG2 4.45Å; I370-M388 HydrophobicContact CD1-CG 4.29Å; I370-M388 HydrophobicContact CD1-SD 4.33Å
371R88.8Confident89.2Confident104 Ų10452.3 Ų52.339%0.39225%0.249SC..G310 helixtrans-56.9-40.3-175.7-164.8179.4-162.8-176.95.7113.4V366 E367 Y373 T374 E378V366-R371 VanDerWaalsContact O-CB 3.28Å; V366-R371 WeakPolarHBondContact O-CB 3.38Å; V366-R371 PolarHBondContact O-N 3.32Å; E367-R371 IonicContact OE1-CZ 2.66Å; E367-R371 IonicContact OE1-NH1 2.73Å; E367-R371 PolarHBondContact OE1-NH1 3.34Å; E367-R371 VanDerWaalsContact OE1-NH1 3.16Å; E367-R371 WeakPolarHBondContact OE2-CD 3.43Å; E367-R371 IonicContact OE2-CZ 2.83Å; E367-R371 IonicContact OE2-NE 3.87Å; E367-R371 IonicContact OE2-NH1 2.74Å; E367-R371 PolarHBondContact OE2-NH1 3.02Å; R371-Y373 PolarHBondContact O-N 3.41Å; R371-Y373 VanDerWaalsContact O-N 3.09Å; R371-T374 PolarHBondContact O-N 2.84Å; R371-E378 IonicContact NH2-OE1 3.66Å
372P87.9Confident88.7Confident49 Ų4953.3 Ų53.332%0.31826%0.255SS..G310 helixtrans-68.3-11.3-178.3-25.539.2000115.2R125 E367 I370R125-P372 VanDerWaalsContact NH2-CB 3.29Å; E367-P372 VanDerWaalsContact O-CD 3.24Å; E367-P372 WeakPolarHBondContact O-CD 3.26Å; E367-P372 VanDerWaalsContact O-CG 3.3Å; E367-P372 WeakPolarHBondContact O-CG 3.31Å; I370-P372 VanDerWaalsContact C-CD 3.47Å
373Y87.4Confident88.4Confident145 Ų14562 Ų6257%0.56929%0.288SS*.G310 helixtrans-1172.1178.4-56.6-86000112.7R125 I369 I370 R371R125-Y373 PolarHBondContact NE-OH 3.34Å; R125-Y373 PolarHBondContact NH2-OH 3.08Å; I369-Y373 WeakPolarHBondContact O-CD2 3.21Å; I370-Y373 PolarHBondContact O-N 2.59Å; R371-Y373 PolarHBondContact O-N 3.41Å; R371-Y373 VanDerWaalsContact O-N 3.09Å
374T88.4Confident88.5Confident38 Ų3863.8 Ų63.823%0.23330%0.297CS..  trans-141.9134.3-173.662.60000112I370 R371 F376I370-T374 PolarHBondContact O-N 3.49Å; I370-T374 PolarHBondContact O-OG1 2.9Å; R371-T374 PolarHBondContact O-N 2.84Å; T374-F376 HydrophobicContact CG2-CD2 4.2Å; T374-F376 HydrophobicContact CG2-CE1 4.38Å; T374-F376 HydrophobicContact CG2-CE2 3.56Å; T374-F376 HydrophobicContact CG2-CZ 3.67Å; T374-F376 PolarHBondContact O-N 3.1Å; T374-F376 VanDerWaalsContact OG1-CD2 3.32Å; T374-F376 WeakPolarHBondContact OG1-CD2 3.42Å
375N85.1Confident88.2Confident173 Ų17363.8 Ų63.893%0.92530%0.297SS*.  trans-98.263.7172.5-75.2-15.9000110.2
376F86.9Confident87.9Confident66 Ų6666.1 Ų66.129%0.28931%0.307SS..  trans-84150.7178.6-65.8-31.8000112.5I370 T374 R380 I384I370-F376 HydrophobicContact CG2-CD2 4.45Å; I370-F376 HydrophobicContact CG2-CE2 4.32Å; T374-F376 HydrophobicContact CG2-CD2 4.2Å; T374-F376 HydrophobicContact CG2-CE1 4.38Å; T374-F376 HydrophobicContact CG2-CE2 3.56Å; T374-F376 HydrophobicContact CG2-CZ 3.67Å; T374-F376 PolarHBondContact O-N 3.1Å; T374-F376 VanDerWaalsContact OG1-CD2 3.32Å; T374-F376 WeakPolarHBondContact OG1-CD2 3.42Å; F376-R380 HydrophobicContact CB-CB 4.24Å; F376-R380 HydrophobicContact CB-CG 4.24Å; F376-R380 VanDerWaalsContact CE1-NH1 3.3Å; F376-R380 HydrophobicContact CG-CG 4.22Å; F376-I384 HydrophobicContact CD2-CD1 3.43Å; F376-I384 VanDerWaalsContact CD2-CD1 3.43Å; F376-I384 HydrophobicContact CE2-CD1 3.63Å; F376-I384 HydrophobicContact CG-CD1 4.43Å
377S86Confident87.9Confident74 Ų7468 Ų6852%0.51733%0.327SS..  trans-67.8151.9172.466.20000111.4K379 R380 L381S377-K379 PolarHBondContact O-N 3.49Å; S377-K379 VanDerWaalsContact O-N 3.11Å; S377-R380 WeakPolarHBondContact O-CA 3.49Å; S377-R380 WeakPolarHBondContact O-CB 3.22Å; S377-R380 PolarHBondContact O-N 3.16Å; S377-L381 PolarHBondContact O-N 3.41Å
378E82.2Confident88.1Confident73 Ų7369.1 Ų69.134%0.34133%0.332SS..Hα-helixtrans-51.3-37.1177.9-73.4-64.3133.200113.3A42 R371 L381 T382A42-E378 VanDerWaalsContact CB-OE2 3.24Å; A42-E378 WeakPolarHBondContact CB-OE2 3.42Å; A42-E378 PolarHBondContact N-OE2 3.28Å; R371-E378 IonicContact NH2-OE1 3.66Å; E378-L381 PolarHBondContact O-N 2.91Å; E378-T382 WeakPolarHBondContact O-CB 3.35Å; E378-T382 PolarHBondContact O-N 3.45Å; E378-T382 PolarHBondContact O-OG1 2.84Å
379K82.8Confident88Confident130 Ų13069.1 Ų69.157%0.56533%0.332SS*.Hα-helixtrans-63.6-44.8175.3-69179.6-177.6172.50111.6S377 T382 W383S377-K379 PolarHBondContact O-N 3.49Å; S377-K379 VanDerWaalsContact O-N 3.11Å; K379-T382 PolarHBondContact O-N 2.92Å; K379-W383 PolarHBondContact O-N 3.43Å; K379-W383 VanDerWaalsContact O-N 3.16Å
380R86.9Confident88.1Confident140 Ų14072.2 Ų72.253%0.52834%0.344SS..Hα-helixtrans-68.8-40.3178.8-175.4173.2-178.21752110.7F376 S377 T382 W383 I384F376-R380 HydrophobicContact CB-CB 4.24Å; F376-R380 HydrophobicContact CB-CG 4.24Å; F376-R380 VanDerWaalsContact CE1-NH1 3.3Å; F376-R380 HydrophobicContact CG-CG 4.22Å; S377-R380 WeakPolarHBondContact O-CA 3.49Å; S377-R380 WeakPolarHBondContact O-CB 3.22Å; S377-R380 PolarHBondContact O-N 3.16Å; R380-T382 VanDerWaalsContact C-N 3.3Å; R380-T382 PolarHBondContact O-N 3.39Å; R380-W383 PolarHBondContact O-N 2.8Å; R380-I384 HydrophobicContact CG-CD1 4.05Å; R380-I384 VanDerWaalsContact O-CG1 3.3Å; R380-I384 WeakPolarHBondContact O-CG1 3.41Å; R380-I384 PolarHBondContact O-N 2.72Å
381L85.6Confident88.2Confident4 Ų475.6 Ų75.62%0.02136%0.358CS..Hα-helixtrans-62.2-38.5175.8-16166.8000111.8A42 V366 S377 E378 I384 S385A42-L381 HydrophobicContact CB-CB 3.98Å; A42-L381 HydrophobicContact CB-CD2 3.87Å; A42-L381 HydrophobicContact CB-CG 4.06Å; V366-L381 HydrophobicContact CG1-CD1 3.43Å; V366-L381 VanDerWaalsContact CG1-CD1 3.43Å; V366-L381 HydrophobicContact CG1-CD2 4.1Å; V366-L381 HydrophobicContact CG1-CG 3.62Å; S377-L381 PolarHBondContact O-N 3.41Å; E378-L381 PolarHBondContact O-N 2.91Å; L381-I384 PolarHBondContact O-N 3.06Å; L381-S385 WeakPolarHBondContact O-CB 3.24Å; L381-S385 PolarHBondContact O-N 3.29Å
382T83.8Confident88.5Confident20 Ų2071.3 Ų71.312%0.12334%0.341CS..Hα-helixtrans-62-45.7173.2-56.40000111.8A42 E378 K379 R380 I384 S385 K386A42-T382 WeakPolarHBondContact CA-OG1 3.4Å; A42-T382 PolarHBondContact N-OG1 3.35Å; E378-T382 WeakPolarHBondContact O-CB 3.35Å; E378-T382 PolarHBondContact O-N 3.45Å; E378-T382 PolarHBondContact O-OG1 2.84Å; K379-T382 PolarHBondContact O-N 2.92Å; R380-T382 VanDerWaalsContact C-N 3.3Å; R380-T382 PolarHBondContact O-N 3.39Å; T382-I384 VanDerWaalsContact C-N 3.35Å; T382-I384 PolarHBondContact O-N 3.38Å; T382-S385 PolarHBondContact O-N 3.48Å; T382-K386 WeakPolarHBondContact O-CG 3.34Å; T382-K386 PolarHBondContact O-N 3.48Å
383W87.6Confident88.8Confident182 Ų18269 Ų6969%0.68933%0.327SS*.Hα-helixtrans-63.8-39.5176.5-81.9111.5000112.7K379 R380 K386 G387K379-W383 PolarHBondContact O-N 3.43Å; K379-W383 VanDerWaalsContact O-N 3.16Å; R380-W383 PolarHBondContact O-N 2.8Å; W383-K386 PolarHBondContact O-N 3.33Å; W383-G387 PolarHBondContact O-N 3.49Å
384I90.9Very high89.1Confident39 Ų3966.6 Ų66.620%0.232%0.323CS..Hα-helixtrans-62.4-46.8174.1-68.6167.4000110V366 I370 F376 R380 L381 T382 K386 G387 M388V366-I384 HydrophobicContact CG2-CG2 4.23Å; I370-I384 HydrophobicContact CD1-CG2 3.45Å; I370-I384 VanDerWaalsContact CD1-CG2 3.45Å; I370-I384 HydrophobicContact CG2-CD1 4.46Å; I370-I384 HydrophobicContact CG2-CG2 4.45Å; F376-I384 HydrophobicContact CD2-CD1 3.43Å; F376-I384 VanDerWaalsContact CD2-CD1 3.43Å; F376-I384 HydrophobicContact CE2-CD1 3.63Å; F376-I384 HydrophobicContact CG-CD1 4.43Å; R380-I384 HydrophobicContact CG-CD1 4.05Å; R380-I384 VanDerWaalsContact O-CG1 3.3Å; R380-I384 WeakPolarHBondContact O-CG1 3.41Å; R380-I384 PolarHBondContact O-N 2.72Å; L381-I384 PolarHBondContact O-N 3.06Å; T382-I384 VanDerWaalsContact C-N 3.35Å; T382-I384 PolarHBondContact O-N 3.38Å; I384-K386 VanDerWaalsContact C-N 3.32Å; I384-K386 PolarHBondContact O-N 2.84Å; I384-G387 CarbonylContact O-C 3.48Å; I384-G387 WeakPolarHBondContact O-CA 3.33Å; I384-G387 PolarHBondContact O-N 2.97Å; I384-G387 VanDerWaalsContact O-N 3.08Å; I384-M388 HydrophobicContact CG2-CG 4.27Å; I384-M388 WeakPolarHBondContact O-CG 3.4Å; I384-M388 PolarHBondContact O-N 3.2Å
385S88.2Confident89.4Confident0 Ų067.2 Ų67.20%032%0.324CS..Hα-helixtrans-56.9-45.1177.1-175.80000112L381 T382 G387 M388 S389L381-S385 WeakPolarHBondContact O-CB 3.24Å; L381-S385 PolarHBondContact O-N 3.29Å; T382-S385 PolarHBondContact O-N 3.48Å; S385-G387 PolarHBondContact O-N 2.82Å; S385-M388 PolarHBondContact O-N 3.13Å; S385-S389 PolarHBondContact O-N 3.36Å; S385-S389 PolarHBondContact O-OG 3.37Å
386K88.9Confident89.8Confident56 Ų5659 Ų5924%0.24328%0.28CS..Hα-helixtrans-61-43.6173.5-68.4-171.6171.7-169.30112.6F45 T179 T382 W383 I384 M388 S389 F390F45-K386 HydrophobicContact CE1-CG 4.44Å; F45-K386 HydrophobicContact CE2-CG 4.29Å; F45-K386 HydrophobicContact CZ-CG 3.93Å; T179-K386 HydrophobicContact CG2-CB 4.05Å; T179-K386 WeakPolarHBondContact CG2-O 3.19Å; T179-K386 WeakPolarHBondContact O-CD 3.41Å; T179-K386 WeakPolarHBondContact O-CE 3.1Å; T179-K386 VanDerWaalsContact O-CG 3.31Å; T179-K386 WeakPolarHBondContact O-CG 3.41Å; T382-K386 WeakPolarHBondContact O-CG 3.34Å; T382-K386 PolarHBondContact O-N 3.48Å; W383-K386 PolarHBondContact O-N 3.33Å; I384-K386 VanDerWaalsContact C-N 3.32Å; I384-K386 PolarHBondContact O-N 2.84Å; K386-M388 VanDerWaalsContact C-N 3.32Å; K386-M388 PolarHBondContact O-N 3.27Å; K386-S389 PolarHBondContact O-N 2.95Å; K386-F390 PolarHBondContact O-N 3.34Å
387G92.1Very high90.1Very high41 Ų4157.7 Ų57.742%0.42328%0.276SS..Hα-helixtrans-60.6-40.3174.500000112.7W383 I384 S385 F390 F391W383-G387 PolarHBondContact O-N 3.49Å; I384-G387 CarbonylContact O-C 3.48Å; I384-G387 WeakPolarHBondContact O-CA 3.33Å; I384-G387 PolarHBondContact O-N 2.97Å; I384-G387 VanDerWaalsContact O-N 3.08Å; S385-G387 PolarHBondContact O-N 2.82Å; G387-F390 PolarHBondContact O-N 3.12Å; G387-F391 WeakPolarHBondContact O-CB 3.23Å; G387-F391 PolarHBondContact O-N 3.36Å
388M92.8Very high90.4Very high33 Ų3356.2 Ų56.216%0.16327%0.273CS..Hα-helixtrans-67.1-41.2175.9-67.9-51.2-51.200112A362 T365 V366 I370 I384 S385 K386 F390 F391 Y392A362-M388 HydrophobicContact CB-CB 4.05Å; T365-M388 HydrophobicContact CG2-CE 3.61Å; T365-M388 HydrophobicContact CG2-SD 4.32Å; V366-M388 HydrophobicContact CG2-CG 4.29Å; I370-M388 HydrophobicContact CD1-CG 4.29Å; I370-M388 HydrophobicContact CD1-SD 4.33Å; I384-M388 HydrophobicContact CG2-CG 4.27Å; I384-M388 WeakPolarHBondContact O-CG 3.4Å; I384-M388 PolarHBondContact O-N 3.2Å; S385-M388 PolarHBondContact O-N 3.13Å; K386-M388 VanDerWaalsContact C-N 3.32Å; K386-M388 PolarHBondContact O-N 3.27Å; M388-F390 VanDerWaalsContact C-N 3.3Å; M388-F390 PolarHBondContact O-N 3.41Å; M388-F391 HydrophobicContact CE-CD1 3.84Å; M388-F391 HydrophobicContact CE-CE1 4.45Å; M388-F391 PolarHBondContact O-N 3.02Å; M388-Y392 HydrophobicContact CB-CD2 4.48Å; M388-Y392 HydrophobicContact CE-CD2 4.08Å; M388-Y392 HydrophobicContact CE-CE2 3.45Å; M388-Y392 VanDerWaalsContact CE-CE2 3.45Å; M388-Y392 WeakPolarHBondContact O-CD2 3.22Å; M388-Y392 PolarHBondContact O-N 3.3Å
389S91.4Very high90.8Very high0 Ų054.5 Ų54.50%027%0.265CS..Hα-helixtrans-58.4-43.3173.5-64.70000111.6I358 A362 S385 K386 G393I358-S389 VanDerWaalsContact CG2-O 3.3Å; I358-S389 WeakPolarHBondContact CG2-O 3.41Å; A362-S389 VanDerWaalsContact CB-OG 3.3Å; A362-S389 WeakPolarHBondContact CB-OG 3.47Å; S385-S389 PolarHBondContact O-N 3.36Å; S385-S389 PolarHBondContact O-OG 3.37Å; K386-S389 PolarHBondContact O-N 2.95Å; S389-G393 PolarHBondContact O-N 3.31Å
390F93.6Very high91.2Very high116 Ų11648.3 Ų48.351%0.50924%0.238SC..Hα-helixtrans-64.6-45.9176.4-177.4-104.4000112.1T175 T179 K386 G387 M388 G393 I394T175-F390 HydrophobicContact CG2-CD2 3.85Å; T179-F390 HydrophobicContact CG2-CB 4.42Å; K386-F390 PolarHBondContact O-N 3.34Å; G387-F390 PolarHBondContact O-N 3.12Å; M388-F390 VanDerWaalsContact C-N 3.3Å; M388-F390 PolarHBondContact O-N 3.41Å; F390-G393 PolarHBondContact O-N 2.85Å; F390-I394 HydrophobicContact CD1-CD1 4Å; F390-I394 HydrophobicContact CE1-CD1 3.42Å; F390-I394 VanDerWaalsContact CE1-CD1 3.42Å; F390-I394 HydrophobicContact CE1-CG1 4.45Å; F390-I394 HydrophobicContact CE2-CD1 4.43Å; F390-I394 HydrophobicContact CZ-CD1 3.68Å; F390-I394 HydrophobicContact CZ-CG1 4.43Å; F390-I394 PolarHBondContact O-N 3.42Å; F390-I394 VanDerWaalsContact O-N 3.12Å
391F95.3Very high91.3Very high105 Ų10542.3 Ų42.346%0.46122%0.22SC..Hα-helixtrans-58.1-49.9176.9170.4-101.6000112.3G387 M388 G393 I394 L395G387-F391 WeakPolarHBondContact O-CB 3.23Å; G387-F391 PolarHBondContact O-N 3.36Å; M388-F391 HydrophobicContact CE-CD1 3.84Å; M388-F391 HydrophobicContact CE-CE1 4.45Å; M388-F391 PolarHBondContact O-N 3.02Å; F391-G393 VanDerWaalsContact C-N 3.3Å; F391-G393 PolarHBondContact O-N 2.79Å; F391-I394 PolarHBondContact O-N 3.11Å; F391-L395 HydrophobicContact CE1-CD1 3.86Å; F391-L395 HydrophobicContact CZ-CD1 3.77Å; F391-L395 WeakPolarHBondContact O-CB 3.41Å; F391-L395 PolarHBondContact O-N 3.04Å
392Y95.1Very high91.4Very high13 Ų1347 Ų475%0.05124%0.244CC..Hα-helixtrans-67.6-31.3178.4-76.2-60.2000112.6I136 I140 L361 T365 M388 L395 C396I136-Y392 HydrophobicContact CG2-CE1 4.19Å; I140-Y392 HydrophobicContact CD1-CD1 4.15Å; I140-Y392 HydrophobicContact CD1-CE1 3.93Å; I140-Y392 HydrophobicContact CG1-CD1 4.38Å; L361-Y392 HydrophobicContact CB-CD1 4.21Å; L361-Y392 HydrophobicContact CB-CD2 3.57Å; L361-Y392 HydrophobicContact CB-CE1 4.43Å; L361-Y392 HydrophobicContact CB-CE2 3.79Å; L361-Y392 HydrophobicContact CB-CG 3.78Å; L361-Y392 HydrophobicContact CD1-CD1 3.91Å; L361-Y392 HydrophobicContact CD1-CG 3.96Å; L361-Y392 HydrophobicContact CD2-CD1 4.47Å; L361-Y392 HydrophobicContact CD2-CE1 4.27Å; L361-Y392 HydrophobicContact CG-CD1 4.44Å; L361-Y392 HydrophobicContact CG-CG 4.41Å; T365-Y392 VanDerWaalsContact OG1-CE2 3.26Å; T365-Y392 WeakPolarHBondContact OG1-CE2 3.39Å; T365-Y392 PolarHBondContact OG1-OH 2.84Å; M388-Y392 HydrophobicContact CB-CD2 4.48Å; M388-Y392 HydrophobicContact CE-CD2 4.08Å; M388-Y392 HydrophobicContact CE-CE2 3.45Å; M388-Y392 VanDerWaalsContact CE-CE2 3.45Å; M388-Y392 WeakPolarHBondContact O-CD2 3.22Å; M388-Y392 PolarHBondContact O-N 3.3Å; Y392-L395 PolarHBondContact O-N 3.12Å; Y392-C396 WeakPolarHBondContact O-CB 3.49Å; Y392-C396 PolarHBondContact O-N 3.09Å; Y392-C396 PolarHBondContact O-SG 3.4Å
393G93.3Very high91.4Very high1 Ų146.1 Ų46.11%0.0124%0.24CC..Hα-helixtrans-57.7-49.6171.100000112.7T175 S389 F390 F391 L395 C396 I397T175-G393 VanDerWaalsContact OG1-CA 3.25Å; T175-G393 WeakPolarHBondContact OG1-CA 3.45Å; S389-G393 PolarHBondContact O-N 3.31Å; F390-G393 PolarHBondContact O-N 2.85Å; F391-G393 VanDerWaalsContact C-N 3.3Å; F391-G393 PolarHBondContact O-N 2.79Å; G393-L395 VanDerWaalsContact C-N 3.35Å; G393-L395 PolarHBondContact O-N 3.47Å; G393-C396 PolarHBondContact O-N 3.42Å; G393-I397 WeakPolarHBondContact O-CG1 3.3Å; G393-I397 PolarHBondContact O-N 3.17Å; G393-I397 VanDerWaalsContact O-N 3.13Å
394I94.3Very high91.1Very high95 Ų9539 Ų3949%0.48722%0.218SC..Hα-helixtrans-60.9-45.3175.2-66.9171.8000110.9F390 F391 C396 I397 G398F390-I394 HydrophobicContact CD1-CD1 4Å; F390-I394 HydrophobicContact CE1-CD1 3.42Å; F390-I394 VanDerWaalsContact CE1-CD1 3.42Å; F390-I394 HydrophobicContact CE1-CG1 4.45Å; F390-I394 HydrophobicContact CE2-CD1 4.43Å; F390-I394 HydrophobicContact CZ-CD1 3.68Å; F390-I394 HydrophobicContact CZ-CG1 4.43Å; F390-I394 PolarHBondContact O-N 3.42Å; F390-I394 VanDerWaalsContact O-N 3.12Å; F391-I394 PolarHBondContact O-N 3.11Å; I394-C396 PolarHBondContact O-N 2.58Å; I394-I397 PolarHBondContact O-N 3.08Å; I394-G398 PolarHBondContact O-N 3.24Å
395L95.1Very high90.6Very high51 Ų5145.6 Ų45.627%0.26725%0.245SC..Hα-helixtrans-62.4-44.4-178-162.8159.1000111.2I140 F391 Y392 G393 I397 G398 M399I140-L395 HydrophobicContact CB-CD2 4.19Å; I140-L395 HydrophobicContact CD1-CD1 4.3Å; I140-L395 HydrophobicContact CD1-CD2 3.69Å; I140-L395 HydrophobicContact CG1-CD2 3.87Å; I140-L395 HydrophobicContact CG2-CD2 3.24Å; F391-L395 HydrophobicContact CE1-CD1 3.86Å; F391-L395 HydrophobicContact CZ-CD1 3.77Å; F391-L395 WeakPolarHBondContact O-CB 3.41Å; F391-L395 PolarHBondContact O-N 3.04Å; Y392-L395 PolarHBondContact O-N 3.12Å; G393-L395 VanDerWaalsContact C-N 3.35Å; G393-L395 PolarHBondContact O-N 3.47Å; L395-I397 VanDerWaalsContact C-N 3.34Å; L395-I397 PolarHBondContact O-N 2.87Å; L395-G398 PolarHBondContact O-N 3.26Å; L395-G398 VanDerWaalsContact O-N 3.15Å; L395-M399 HydrophobicContact CD2-CG 3.95Å; L395-M399 WeakPolarHBondContact O-CG 3.32Å; L395-M399 PolarHBondContact O-N 3.32Å
396C93.3Very high89.7Confident0 Ų049.5 Ų49.50%026%0.264CS..Hα-helixtrans-63-36.4176.2-710000112.9T143 I147 Y392 G393 I394 M399 A400T143-C396 HydrophobicContact CG2-CB 3.77Å; T143-C396 VanDerWaalsContact CG2-SG 3.59Å; I147-C396 HydrophobicContact CD1-CB 3.97Å; Y392-C396 WeakPolarHBondContact O-CB 3.49Å; Y392-C396 PolarHBondContact O-N 3.09Å; Y392-C396 PolarHBondContact O-SG 3.4Å; G393-C396 PolarHBondContact O-N 3.42Å; I394-C396 PolarHBondContact O-N 2.58Å; C396-M399 PolarHBondContact O-N 3.46Å; C396-A400 PolarHBondContact O-N 3.06Å
397I92.7Very high88.3Confident38 Ų3850 Ų5020%0.19529%0.285CS..Hα-helixtrans-64.6-43.5172.4-65.2165.9000110.5G393 I394 L395 M399 A400 G401G393-I397 WeakPolarHBondContact O-CG1 3.3Å; G393-I397 PolarHBondContact O-N 3.17Å; G393-I397 VanDerWaalsContact O-N 3.13Å; I394-I397 PolarHBondContact O-N 3.08Å; L395-I397 VanDerWaalsContact C-N 3.34Å; L395-I397 PolarHBondContact O-N 2.87Å; I397-M399 VanDerWaalsContact C-N 3.3Å; I397-M399 PolarHBondContact O-N 2.59Å; I397-A400 VanDerWaalsContact O-CB 3.31Å; I397-A400 WeakPolarHBondContact O-CB 3.05Å; I397-A400 PolarHBondContact O-N 2.98Å; I397-A400 VanDerWaalsContact O-N 3.14Å; I397-G401 PolarHBondContact O-N 3.11Å
398G92.3Very high86.9Confident44 Ų4450.7 Ų50.745%0.45429%0.292SS..Hα-helixtrans-58.7-41.917400000112.4I394 L395 A400 G401 L402I394-G398 PolarHBondContact O-N 3.24Å; L395-G398 PolarHBondContact O-N 3.26Å; L395-G398 VanDerWaalsContact O-N 3.15Å; G398-A400 VanDerWaalsContact C-N 3.33Å; G398-A400 PolarHBondContact O-N 2.98Å; G398-G401 PolarHBondContact O-N 3.41Å; G398-G401 VanDerWaalsContact O-N 3.11Å; G398-L402 PolarHBondContact O-N 3.27Å
399M92.1Very high85.7Confident37 Ų3749.7 Ų49.718%0.18229%0.288CS..Hα-helixtrans-66.2-31.5175-69.7-56.1-51.600113.7I140 L141 L395 C396 I397 G401 L402 A403I140-M399 HydrophobicContact CG2-CG 3.39Å; I140-M399 HydrophobicContact CG2-SD 4.04Å; L141-M399 HydrophobicContact CD2-CE 3.6Å; L395-M399 HydrophobicContact CD2-CG 3.95Å; L395-M399 WeakPolarHBondContact O-CG 3.32Å; L395-M399 PolarHBondContact O-N 3.32Å; C396-M399 PolarHBondContact O-N 3.46Å; I397-M399 VanDerWaalsContact C-N 3.3Å; I397-M399 PolarHBondContact O-N 2.59Å; M399-G401 PolarHBondContact O-N 3.35Å; M399-L402 HydrophobicContact CE-CB 4.39Å; M399-L402 HydrophobicContact CE-CD1 3.98Å; M399-L402 PolarHBondContact O-N 2.93Å; M399-L402 VanDerWaalsContact O-N 3.15Å; M399-L402 HydrophobicContact SD-CD1 3.75Å; M399-A403 WeakPolarHBondContact O-CB 3.26Å; M399-A403 PolarHBondContact O-N 2.96Å
400A90.4Very high84.2Confident0 Ų050.3 Ų50.30%029%0.291CS..Hα-helixtrans-60.8-36.317200000111G144 I147 V167 C396 I397 G398 A403 S404G144-A400 WeakPolarHBondContact O-CA 3.46Å; G144-A400 WeakPolarHBondContact O-CB 3.1Å; I147-A400 HydrophobicContact CB-CB 3.89Å; I147-A400 HydrophobicContact CG2-CB 3.76Å; V167-A400 HydrophobicContact CG1-CB 4.12Å; C396-A400 PolarHBondContact O-N 3.06Å; I397-A400 VanDerWaalsContact O-CB 3.31Å; I397-A400 WeakPolarHBondContact O-CB 3.05Å; I397-A400 PolarHBondContact O-N 2.98Å; I397-A400 VanDerWaalsContact O-N 3.14Å; G398-A400 VanDerWaalsContact C-N 3.33Å; G398-A400 PolarHBondContact O-N 2.98Å; A400-A403 WeakPolarHBondContact O-CB 3.05Å; A400-A403 PolarHBondContact O-N 3.4Å; A400-S404 PolarHBondContact O-N 3.39Å
401G88.4Confident83Confident14 Ų1447 Ų4714%0.14428%0.277CS..Hα-helixtrans-65.5-39.6172.600000113.3I397 G398 M399 S404I397-G401 PolarHBondContact O-N 3.11Å; G398-G401 PolarHBondContact O-N 3.41Å; G398-G401 VanDerWaalsContact O-N 3.11Å; M399-G401 PolarHBondContact O-N 3.35Å; G401-S404 WeakPolarHBondContact O-CB 3.44Å; G401-S404 PolarHBondContact O-N 3.42Å; G401-S404 PolarHBondContact O-OG 2.94Å
402L87.4Confident81.9Confident101 Ų10142.5 Ų42.553%0.52926%0.259SS..Hα-helixtrans-67.5-36.1173.2-65.3179.6000112.4G398 M399 S404 F405G398-L402 PolarHBondContact O-N 3.27Å; M399-L402 HydrophobicContact CE-CB 4.39Å; M399-L402 HydrophobicContact CE-CD1 3.98Å; M399-L402 PolarHBondContact O-N 2.93Å; M399-L402 VanDerWaalsContact O-N 3.15Å; M399-L402 HydrophobicContact SD-CD1 3.75Å; L402-S404 PolarHBondContact O-N 2.7Å; L402-F405 PolarHBondContact O-N 3.33Å; L402-F405 VanDerWaalsContact O-N 3.13Å
403A84.1Confident81Confident3 Ų341.9 Ų41.93%0.02526%0.257CS..Hα-helixtrans-61.9-22.3175.400000112.5I145 Y148 M399 A400 F405 M406I145-A403 HydrophobicContact CG1-CB 4.08Å; Y148-A403 HydrophobicContact CD1-CB 4.22Å; Y148-A403 HydrophobicContact CG-CB 4.4Å; M399-A403 WeakPolarHBondContact O-CB 3.26Å; M399-A403 PolarHBondContact O-N 2.96Å; A400-A403 WeakPolarHBondContact O-CB 3.05Å; A400-A403 PolarHBondContact O-N 3.4Å; A403-F405 PolarHBondContact O-N 3.17Å; A403-M406 HydrophobicContact CB-SD 4.39Å; A403-M406 WeakPolarHBondContact O-CB 3.31Å; A403-M406 PolarHBondContact O-N 2.93Å
404S82.4Confident80.2Confident33 Ų3343.6 Ų43.623%0.23127%0.265CS..THydrogen-bonded Turntrans-63.8-22.5175.177.90000114.6Y148 A400 G401 L402Y148-S404 VanDerWaalsContact CE1-CA 3.44Å; Y148-S404 VanDerWaalsContact CZ-CA 3.4Å; Y148-S404 VanDerWaalsContact CZ-CB 3.43Å; Y148-S404 WeakPolarHBondContact OH-CB 3.36Å; A400-S404 PolarHBondContact O-N 3.39Å; G401-S404 WeakPolarHBondContact O-CB 3.44Å; G401-S404 PolarHBondContact O-N 3.42Å; G401-S404 PolarHBondContact O-OG 2.94Å; L402-S404 PolarHBondContact O-N 2.7Å
405F80.1Confident79.7Confident177 Ų17739.2 Ų39.278%0.77624%0.243SC*.THydrogen-bonded Turntrans-88-6.3174.1-59-75.3000112.8L402 A403L402-F405 PolarHBondContact O-N 3.33Å; L402-F405 VanDerWaalsContact O-N 3.13Å; A403-F405 PolarHBondContact O-N 3.17Å
406M68.4Low79.4Confident81 Ų8137.8 Ų37.840%0.39924%0.236SC..  trans-89119.4179.2-58.6177.967.600109.9I145 A403 A412I145-M406 HydrophobicContact CD1-CE 4.25Å; I145-M406 HydrophobicContact CD1-SD 4.48Å; A403-M406 HydrophobicContact CB-SD 4.39Å; A403-M406 WeakPolarHBondContact O-CB 3.31Å; A403-M406 PolarHBondContact O-N 2.93Å; M406-A412 HydrophobicContact CE-CB 4.07Å
407G59.2Low79.1Confident66 Ų6638.2 Ų38.268%0.6824%0.238SC*.SBendtrans-72.3151.6166.700000111.5
408G63.7Low78.9Confident56 Ų5636.4 Ų36.458%0.57723%0.228SC*.  trans67.448.9170.300000115.4L410 Q411 A412G408-L410 VanDerWaalsContact C-N 3.34Å; G408-L410 PolarHBondContact O-N 3.26Å; G408-Q411 PolarHBondContact O-N 2.8Å; G408-A412 PolarHBondContact O-N 3Å; G408-A412 VanDerWaalsContact O-N 3.08Å
409I66.8Low79Confident12 Ų1235.2 Ų35.26%0.06221%0.212CC..Hα-helixtrans-49-44.6-172.1-62.7173.3000114I145 Y148 A149 L152 A412 A413I145-I409 HydrophobicContact CG2-CG2 3.42Å; I145-I409 VanDerWaalsContact CG2-CG2 3.42Å; Y148-I409 HydrophobicContact CD1-CD1 3.61Å; Y148-I409 HydrophobicContact CD1-CG1 4.46Å; Y148-I409 HydrophobicContact CE1-CD1 3.53Å; A149-I409 HydrophobicContact CB-CG2 3.56Å; L152-I409 HydrophobicContact CB-CD1 4.38Å; L152-I409 HydrophobicContact CD2-CD1 3.34Å; L152-I409 HydrophobicContact CG-CD1 4.47Å; I409-A412 PolarHBondContact O-N 3.22Å; I409-A413 PolarHBondContact O-N 3.07Å
410L60.4Low79.1Confident13 Ų1334.1 Ų34.17%0.06821%0.206CC..Hα-helixtrans-62.6-51.4-177.7177.861.3000112.5I69 E77 G408 A412 A413 I414I69-L410 HydrophobicContact CB-CD1 4.06Å; I69-L410 HydrophobicContact CG1-CD1 4.38Å; I69-L410 HydrophobicContact CG2-CD1 3.14Å; E77-L410 HydrophobicContact CG-CD2 3.97Å; G408-L410 VanDerWaalsContact C-N 3.34Å; G408-L410 PolarHBondContact O-N 3.26Å; L410-A412 VanDerWaalsContact C-N 3.32Å; L410-A412 PolarHBondContact O-N 2.85Å; L410-A413 PolarHBondContact O-N 2.78Å; L410-I414 PolarHBondContact O-N 3.25Å
411Q69.1Low79.3Confident47 Ų4734.2 Ų34.222%0.2221%0.207CC..Hα-helixtrans-67.9-36.5179.7-177.7171.7-2700111G408 A413 I414 S415 Y522G408-Q411 PolarHBondContact O-N 2.8Å; Q411-A413 PolarHBondContact O-N 3.01Å; Q411-I414 PolarHBondContact O-N 3.42Å; Q411-S415 VanDerWaalsContact O-CB 3.27Å; Q411-S415 WeakPolarHBondContact O-CB 3.19Å; Q411-S415 PolarHBondContact O-N 2.96Å; Q411-S415 PolarHBondContact O-OG 3.42Å; Q411-Y522 HydrophobicContact CG-CD1 4.44Å; Q411-Y522 HydrophobicContact CG-CG 4.34Å
412A72.5Confident79.6Confident11 Ų1133.5 Ų33.59%0.09120%0.2CC..Hα-helixtrans-59.4-44.7175.700000111.8I145 M406 G408 I409 L410 I414 S415 I416I145-A412 HydrophobicContact CD1-CB 4.38Å; M406-A412 HydrophobicContact CE-CB 4.07Å; G408-A412 PolarHBondContact O-N 3Å; G408-A412 VanDerWaalsContact O-N 3.08Å; I409-A412 PolarHBondContact O-N 3.22Å; L410-A412 VanDerWaalsContact C-N 3.32Å; L410-A412 PolarHBondContact O-N 2.85Å; A412-I414 PolarHBondContact O-N 3.38Å; A412-S415 PolarHBondContact O-N 3.38Å; A412-I416 WeakPolarHBondContact O-CG1 3.44Å; A412-I416 PolarHBondContact O-N 3.24Å; A412-I416 VanDerWaalsContact O-N 3.1Å
413A75.1Confident80.1Confident0 Ų028.7 Ų28.70%018%0.175CC..Hα-helixtrans-58.7-49.217900000113I69 Y142 I145 I409 L410 Q411 I416I69-A413 HydrophobicContact CD1-CB 3.65Å; Y142-A413 HydrophobicContact CD2-CB 4.15Å; Y142-A413 HydrophobicContact CE2-CB 4.12Å; I145-A413 HydrophobicContact CG2-CB 3.99Å; I409-A413 PolarHBondContact O-N 3.07Å; L410-A413 PolarHBondContact O-N 2.78Å; Q411-A413 PolarHBondContact O-N 3.01Å; A413-I416 PolarHBondContact O-N 2.88Å
414I76.9Confident80.7Confident36 Ų3628.7 Ų28.719%0.18517%0.174CC..Hα-helixtrans-70.6-36.4-178.5-58.3172.5000110.6I253 L410 Q411 A412 I416 F417 G418 Y522 L523I253-I414 HydrophobicContact CD1-CG2 3.88Å; L410-I414 PolarHBondContact O-N 3.25Å; Q411-I414 PolarHBondContact O-N 3.42Å; A412-I414 PolarHBondContact O-N 3.38Å; I414-I416 VanDerWaalsContact C-N 3.27Å; I414-I416 PolarHBondContact O-N 3.16Å; I414-F417 PolarHBondContact O-N 2.97Å; I414-G418 PolarHBondContact O-N 3.39Å; I414-Y522 HydrophobicContact CB-CD2 4.15Å; I414-Y522 HydrophobicContact CB-CE2 4.02Å; I414-Y522 HydrophobicContact CD1-CE2 4.05Å; I414-Y522 HydrophobicContact CG2-CD2 3.8Å; I414-Y522 HydrophobicContact CG2-CE2 3.69Å; I414-L523 HydrophobicContact CG2-CD2 4.27Å
415S84Confident81.5Confident4 Ų427.1 Ų27.13%0.02816%0.164CC..Hα-helixtrans-62.2-34.4177.6-58.80000112.1Q411 A412 F417 G418 I419Q411-S415 VanDerWaalsContact O-CB 3.27Å; Q411-S415 WeakPolarHBondContact O-CB 3.19Å; Q411-S415 PolarHBondContact O-N 2.96Å; Q411-S415 PolarHBondContact O-OG 3.42Å; A412-S415 PolarHBondContact O-N 3.38Å; S415-F417 PolarHBondContact O-N 3.45Å; S415-G418 CarbonylContact O-C 3.49Å; S415-G418 WeakPolarHBondContact O-CA 3.42Å; S415-G418 PolarHBondContact O-N 2.71Å; S415-G418 VanDerWaalsContact O-N 3.14Å; S415-I419 WeakPolarHBondContact O-CB 3.23Å; S415-I419 WeakPolarHBondContact O-CD1 3.39Å; S415-I419 WeakPolarHBondContact O-CG1 3.25Å; S415-I419 PolarHBondContact O-N 3.08Å
416I88.8Confident82.3Confident21 Ų2118.7 Ų18.711%0.10813%0.127CC..Hα-helixtrans-61.1-44.7176.1-71.8159.6000111.6Q138 L141 I145 A412 A413 I414 G418 I419 I420Q138-I416 HydrophobicContact CG-CG2 3.78Å; L141-I416 HydrophobicContact CB-CD1 4.1Å; I145-I416 HydrophobicContact CD1-CD1 3.4Å; A412-I416 WeakPolarHBondContact O-CG1 3.44Å; A412-I416 PolarHBondContact O-N 3.24Å; A412-I416 VanDerWaalsContact O-N 3.1Å; A413-I416 PolarHBondContact O-N 2.88Å; I414-I416 VanDerWaalsContact C-N 3.27Å; I414-I416 PolarHBondContact O-N 3.16Å; I416-G418 VanDerWaalsContact C-N 3.31Å; I416-G418 PolarHBondContact O-N 3.32Å; I416-I419 PolarHBondContact O-N 2.92Å; I416-I420 HydrophobicContact CG2-CD1 4.42Å; I416-I420 PolarHBondContact O-N 3.49Å
417F86.7Confident83.7Confident8 Ų815 Ų154%0.03511%0.108CC..Iπ-helixtrans-64.2-38173.3-82.9-76000112.1F65 Y142 I253 I257 I414 S415 G421 G422F65-F417 HydrophobicContact CD1-CE2 4.5Å; F65-F417 HydrophobicContact CD1-CZ 4.19Å; F65-F417 HydrophobicContact CE1-CE1 4.28Å; F65-F417 HydrophobicContact CE1-CE2 4.13Å; F65-F417 AromaticContact CE1-CZ 3.48Å; F65-F417 HydrophobicContact CE1-CZ 3.48Å; F65-F417 VanDerWaalsContact CE1-CZ 3.48Å; F65-F417 HydrophobicContact CZ-CZ 4.14Å; Y142-F417 AromaticContact CD1-CE2 3.75Å; Y142-F417 HydrophobicContact CD1-CE2 3.75Å; Y142-F417 AromaticContact CD1-CZ 3.93Å; Y142-F417 HydrophobicContact CD1-CZ 3.93Å; Y142-F417 HydrophobicContact CD2-CD2 4.2Å; Y142-F417 AromaticContact CD2-CE2 3.52Å; Y142-F417 HydrophobicContact CD2-CE2 3.52Å; Y142-F417 HydrophobicContact CD2-CZ 4.47Å; Y142-F417 AromaticContact CE1-CE2 3.88Å; Y142-F417 HydrophobicContact CE1-CE2 3.88Å; Y142-F417 HydrophobicContact CE1-CZ 4.16Å; Y142-F417 HydrophobicContact CE2-CD2 4.37Å; Y142-F417 AromaticContact CE2-CE2 3.67Å; Y142-F417 HydrophobicContact CE2-CE2 3.67Å; Y142-F417 AromaticContact CG-CE2 3.55Å; Y142-F417 HydrophobicContact CG-CE2 3.55Å; Y142-F417 HydrophobicContact CG-CZ 4.08Å; Y142-F417 AromaticContact CZ-CE2 3.84Å; I253-F417 HydrophobicContact CG2-CB 4.29Å; I257-F417 HydrophobicContact CD1-CD1 4.07Å; I257-F417 HydrophobicContact CD1-CD2 4.48Å; I257-F417 HydrophobicContact CD1-CE1 4.33Å; I257-F417 HydrophobicContact CD1-CG 4.2Å; I257-F417 HydrophobicContact CG1-CD1 3.6Å; I257-F417 HydrophobicContact CG1-CE1 3.74Å; I257-F417 HydrophobicContact CG1-CG 4.22Å; I257-F417 HydrophobicContact CG1-CZ 4.42Å; I414-F417 PolarHBondContact O-N 2.97Å; S415-F417 PolarHBondContact O-N 3.45Å; F417-G421 CarbonylContact O-C 3.57Å; F417-G421 WeakPolarHBondContact O-CA 3.15Å; F417-G421 PolarHBondContact O-N 3.35Å; F417-G422 PolarHBondContact O-N 3.07Å
418G88.1Confident85.5Confident0 Ų011.8 Ų11.80%08%0.076CC..Iπ-helixtrans-55.3-56.5171.600000112.5I414 S415 I416 G422 F525 S526I414-G418 PolarHBondContact O-N 3.39Å; S415-G418 CarbonylContact O-C 3.49Å; S415-G418 WeakPolarHBondContact O-CA 3.42Å; S415-G418 PolarHBondContact O-N 2.71Å; S415-G418 VanDerWaalsContact O-N 3.14Å; I416-G418 VanDerWaalsContact C-N 3.31Å; I416-G418 PolarHBondContact O-N 3.32Å; G418-G422 PolarHBondContact O-N 2.9Å; G418-F525 CarbonylContact O-C 3.43Å; G418-S526 VanDerWaalsContact O-CA 3.28Å; G418-S526 WeakPolarHBondContact O-CA 3.35Å; G418-S526 PolarHBondContact O-N 3.26Å
419I93.6Very high87.1Confident20 Ų2010.2 Ų10.210%0.1036%0.055CC..Iπ-helixtrans-72.5-44.6-168-67.9163.3000112.1S415 I416 P423 S453 L454 F525S415-I419 WeakPolarHBondContact O-CB 3.23Å; S415-I419 WeakPolarHBondContact O-CD1 3.39Å; S415-I419 WeakPolarHBondContact O-CG1 3.25Å; S415-I419 PolarHBondContact O-N 3.08Å; I416-I419 PolarHBondContact O-N 2.92Å; I419-P423 WeakPolarHBondContact O-CD 3.46Å; I419-P423 WeakPolarHBondContact O-CG 3.37Å; I419-S453 WeakPolarHBondContact O-CB 3.39Å; I419-L454 HydrophobicContact CG2-CB 4.46Å; I419-L454 HydrophobicContact CG2-CD2 3.56Å; I419-L454 HydrophobicContact CG2-CG 3.8Å; I419-F525 HydrophobicContact CD1-CD2 4.33Å; I419-F525 HydrophobicContact CG1-CB 4.4Å; I419-F525 HydrophobicContact CG1-CD2 3.95Å; I419-F525 HydrophobicContact CG1-CG 4.46Å
420I95.1Very high88.5Confident13 Ų139.7 Ų9.77%0.0675%0.052CC..Iπ-helixtrans-97.8-40.6-175.5-47.6-175000111.3L134 Q138 I416 G422 P423 L424 M450L134-I420 HydrophobicContact CB-CG2 4.08Å; L134-I420 HydrophobicContact CD2-CG2 4.38Å; Q138-I420 HydrophobicContact CB-CB 4.19Å; Q138-I420 HydrophobicContact CB-CD1 3.93Å; Q138-I420 HydrophobicContact CB-CG2 3.99Å; Q138-I420 HydrophobicContact CG-CB 4.07Å; Q138-I420 HydrophobicContact CG-CD1 4.3Å; Q138-I420 HydrophobicContact CG-CG2 4.34Å; I416-I420 HydrophobicContact CG2-CD1 4.42Å; I416-I420 PolarHBondContact O-N 3.49Å; I420-G422 PolarHBondContact O-N 3.03Å; I420-P423 WeakPolarHBondContact O-CD 3.39Å; I420-L424 HydrophobicContact CG2-CD1 4.2Å; I420-L424 WeakPolarHBondContact O-CG 3.37Å; I420-L424 PolarHBondContact O-N 2.96Å; I420-M450 HydrophobicContact CB-CE 4.31Å; I420-M450 HydrophobicContact CB-SD 4.45Å; I420-M450 HydrophobicContact CD1-CE 4.17Å; I420-M450 HydrophobicContact CG1-CE 3.71Å; I420-M450 HydrophobicContact CG1-SD 4.36Å; I420-M450 HydrophobicContact CG2-CE 4.12Å; I420-M450 HydrophobicContact CG2-SD 4.27Å
421G94.1Very high90.2Very high2 Ų29.1 Ų9.12%0.0215%0.049CC..Iπ-helixtrans-68.7-32.3-179.100000113.3F417 L425F417-G421 CarbonylContact O-C 3.57Å; F417-G421 WeakPolarHBondContact O-CA 3.15Å; F417-G421 PolarHBondContact O-N 3.35Å; G421-L425 VanDerWaalsContact O-CB 3.27Å; G421-L425 WeakPolarHBondContact O-CB 3.14Å; G421-L425 PolarHBondContact O-N 3.37Å
422G96Very high91.4Very high0 Ų06.9 Ų6.90%04%0.039CC..Hα-helixtrans-59.8-57.317600000113.9F417 G418 I420 L424 L425 G426 S526 T530F417-G422 PolarHBondContact O-N 3.07Å; G418-G422 PolarHBondContact O-N 2.9Å; I420-G422 PolarHBondContact O-N 3.03Å; G422-L424 VanDerWaalsContact C-N 3.33Å; G422-L424 PolarHBondContact O-N 2.81Å; G422-L425 WeakPolarHBondContact O-CB 3.22Å; G422-L425 PolarHBondContact O-N 3.28Å; G422-G426 PolarHBondContact O-N 3.48Å; G422-S526 WeakPolarHBondContact CA-O 3.36Å; G422-S526 WeakPolarHBondContact CA-OG 3.31Å; G422-T530 WeakPolarHBondContact CA-OG1 3.5Å; G422-T530 VanDerWaalsContact O-CA 3.32Å; G422-T530 WeakPolarHBondContact O-CA 3.39Å; G422-T530 PolarHBondContact O-N 3.44Å; G422-T530 PolarHBondContact O-OG1 3.31Å
423P97.6Very high92.4Very high0 Ų010.3 Ų10.30%06%0.055CC..Hα-helixtrans-59.3-39.5176.2-26.134.6000113.4I419 I420 G426 L427 L446 G449 M450I419-P423 WeakPolarHBondContact O-CD 3.46Å; I419-P423 WeakPolarHBondContact O-CG 3.37Å; I420-P423 WeakPolarHBondContact O-CD 3.39Å; P423-G426 PolarHBondContact O-N 3.29Å; P423-L427 PolarHBondContact O-N 3.33Å; P423-L446 HydrophobicContact CB-CD1 4.12Å; P423-G449 VanDerWaalsContact CG-C 3.47Å; P423-M450 HydrophobicContact CB-CB 4.4Å; P423-M450 HydrophobicContact CG-CB 4.34Å; P423-M450 HydrophobicContact CG-SD 4.42Å
424L97.3Very high93.2Very high2 Ų211.5 Ų11.51%0.016%0.063CC..Hα-helixtrans-62.6-43.7173.8-75175.1000111.6L134 I260 I420 G422 G426 L427 F428 L446L134-L424 HydrophobicContact CB-CD1 4.1Å; L134-L424 HydrophobicContact CB-CD2 4.22Å; L134-L424 HydrophobicContact CB-CG 4.43Å; L134-L424 HydrophobicContact CD1-CD2 3.99Å; L134-L424 HydrophobicContact CD1-CG 4.4Å; I260-L424 VanDerWaalsContact CD1-C 3.43Å; I260-L424 HydrophobicContact CD1-CB 3.64Å; I420-L424 HydrophobicContact CG2-CD1 4.2Å; I420-L424 WeakPolarHBondContact O-CG 3.37Å; I420-L424 PolarHBondContact O-N 2.96Å; G422-L424 VanDerWaalsContact C-N 3.33Å; G422-L424 PolarHBondContact O-N 2.81Å; L424-G426 VanDerWaalsContact C-N 3.28Å; L424-G426 PolarHBondContact O-N 2.89Å; L424-L427 WeakPolarHBondContact O-CB 3.32Å; L424-L427 PolarHBondContact O-N 3.19Å; L424-L427 VanDerWaalsContact O-N 3.15Å; L424-F428 WeakPolarHBondContact O-CD2 3.31Å; L424-F428 PolarHBondContact O-N 3.28Å; L424-F428 VanDerWaalsContact O-N 3.08Å; L424-L446 HydrophobicContact CD2-CD1 4.07Å
425L97.8Very high93.7Very high1 Ų113.2 Ų13.21%0.0058%0.076CC..Hα-helixtrans-57.9-45174.6176.763.5000110.4F103 F252 L255 I260 G421 G422 L427 F428 T429 T530F103-L425 HydrophobicContact CE1-CD1 4.23Å; F103-L425 HydrophobicContact CE2-CD1 4.4Å; F103-L425 HydrophobicContact CZ-CD1 3.64Å; F252-L425 HydrophobicContact CD1-CD2 4.06Å; L255-L425 HydrophobicContact CB-CD2 4.18Å; L255-L425 HydrophobicContact CD2-CD1 4.19Å; L255-L425 HydrophobicContact CD2-CD2 4.15Å; L255-L425 HydrophobicContact CG-CD1 3.93Å; L255-L425 HydrophobicContact CG-CD2 4.18Å; I260-L425 HydrophobicContact CD1-CB 4.11Å; I260-L425 VanDerWaalsContact CD1-N 3.28Å; I260-L425 HydrophobicContact CG2-CD1 4.27Å; G421-L425 VanDerWaalsContact O-CB 3.27Å; G421-L425 WeakPolarHBondContact O-CB 3.14Å; G421-L425 PolarHBondContact O-N 3.37Å; G422-L425 WeakPolarHBondContact O-CB 3.22Å; G422-L425 PolarHBondContact O-N 3.28Å; L425-L427 VanDerWaalsContact C-N 3.33Å; L425-L427 PolarHBondContact O-N 3.33Å; L425-F428 PolarHBondContact O-N 2.74Å; L425-T429 WeakPolarHBondContact O-CB 3.2Å; L425-T429 PolarHBondContact O-N 2.88Å; L425-T429 PolarHBondContact O-OG1 3.3Å; L425-T530 HydrophobicContact CD2-CG2 4.28Å; L425-T530 HydrophobicContact CG-CG2 4.16Å
426G97.6Very high94Very high0 Ų015.8 Ų15.80%09%0.09CC..Hα-helixtrans-58.3-41.7175.600000113.3G422 P423 L424 L430G422-G426 PolarHBondContact O-N 3.48Å; P423-G426 PolarHBondContact O-N 3.29Å; L424-G426 VanDerWaalsContact C-N 3.28Å; L424-G426 PolarHBondContact O-N 2.89Å; G426-L430 WeakPolarHBondContact O-CB 3.35Å; G426-L430 PolarHBondContact O-N 2.89Å
427L97.9Very high94.3Very high2 Ų214.8 Ų14.81%0.018%0.084CC..Hα-helixtrans-61.1-48.5176.6176.265.1000112.6L119 F123 T127 P423 L424 L425 G431 A442 L446L119-L427 HydrophobicContact CD1-CD2 3.71Å; L119-L427 HydrophobicContact CD1-CG 4.47Å; L119-L427 HydrophobicContact CD2-CD2 4.09Å; L119-L427 HydrophobicContact CD2-CG 3.94Å; F123-L427 HydrophobicContact CE2-CD1 4.27Å; T127-L427 HydrophobicContact CG2-CD1 3.88Å; T127-L427 HydrophobicContact CG2-CD2 3.97Å; T127-L427 HydrophobicContact CG2-CG 4.4Å; P423-L427 PolarHBondContact O-N 3.33Å; L424-L427 WeakPolarHBondContact O-CB 3.32Å; L424-L427 PolarHBondContact O-N 3.19Å; L424-L427 VanDerWaalsContact O-N 3.15Å; L425-L427 VanDerWaalsContact C-N 3.33Å; L425-L427 PolarHBondContact O-N 3.33Å; L427-G431 PolarHBondContact O-N 2.97Å; L427-A442 HydrophobicContact CD1-CB 3.67Å; L427-L446 HydrophobicContact CB-CD1 4.45Å; L427-L446 HydrophobicContact CD2-CD1 4.26Å; L427-L446 HydrophobicContact CD2-CD2 4.08Å
428F97.4Very high94.7Very high0 Ų015.1 Ų15.10%09%0.087CC..Hα-helixtrans-68.1-44.1178.4-83.4-84.6000111.9F103 F107 T115 Y116 Y118 L119 I260 L424 L425 L430 G431 I432F103-F428 HydrophobicContact CE1-CB 4.13Å; F107-F428 HydrophobicContact CE1-CD1 4.2Å; F107-F428 HydrophobicContact CE1-CE1 4.15Å; F107-F428 AromaticContact CZ-CD1 3.81Å; F107-F428 HydrophobicContact CZ-CD1 3.81Å; F107-F428 AromaticContact CZ-CE1 3.95Å; F107-F428 HydrophobicContact CZ-CE1 3.95Å; T115-F428 HydrophobicContact CG2-CE1 3.81Å; T115-F428 HydrophobicContact CG2-CZ 3.91Å; T115-F428 VanDerWaalsContact O-CE1 3.32Å; T115-F428 WeakPolarHBondContact O-CE1 3.41Å; Y116-F428 HydrophobicContact CD1-CE2 4.1Å; Y116-F428 AromaticContact CD1-CZ 3.87Å; Y116-F428 HydrophobicContact CD1-CZ 3.87Å; Y116-F428 AromaticContact CE1-CE2 3.85Å; Y116-F428 HydrophobicContact CE1-CE2 3.85Å; Y116-F428 AromaticContact CE1-CZ 4Å; Y116-F428 HydrophobicContact CE1-CZ 4Å; Y118-F428 AromaticContact CD1-CD1 3.61Å; Y118-F428 HydrophobicContact CD1-CD1 3.61Å; Y118-F428 AromaticContact CD1-CE1 3.69Å; Y118-F428 HydrophobicContact CD1-CE1 3.69Å; Y118-F428 HydrophobicContact CE1-CD1 4.06Å; Y118-F428 HydrophobicContact CG-CE1 4.45Å; L119-F428 HydrophobicContact CD1-CE1 4.44Å; L119-F428 HydrophobicContact CD1-CE2 3.98Å; L119-F428 HydrophobicContact CD1-CZ 3.82Å; L119-F428 HydrophobicContact CD2-CD1 3.99Å; L119-F428 HydrophobicContact CD2-CD2 4.43Å; L119-F428 HydrophobicContact CD2-CE1 3.88Å; L119-F428 HydrophobicContact CD2-CE2 4.32Å; L119-F428 HydrophobicContact CD2-CG 4.28Å; L119-F428 HydrophobicContact CD2-CZ 4.05Å; L119-F428 HydrophobicContact CG-CE1 3.9Å; L119-F428 HydrophobicContact CG-CE2 4.3Å; L119-F428 HydrophobicContact CG-CZ 3.77Å; I260-F428 HydrophobicContact CB-CD2 3.89Å; I260-F428 HydrophobicContact CB-CE2 4.23Å; I260-F428 HydrophobicContact CB-CG 4.19Å; I260-F428 HydrophobicContact CD1-CD2 3.84Å; I260-F428 HydrophobicContact CD1-CE2 4.32Å; I260-F428 HydrophobicContact CG1-CD2 4.49Å; I260-F428 HydrophobicContact CG2-CB 3.58Å; I260-F428 HydrophobicContact CG2-CD1 4.26Å; I260-F428 HydrophobicContact CG2-CD2 3.8Å; I260-F428 HydrophobicContact CG2-CG 3.63Å; L424-F428 WeakPolarHBondContact O-CD2 3.31Å; L424-F428 PolarHBondContact O-N 3.28Å; L424-F428 VanDerWaalsContact O-N 3.08Å; L425-F428 PolarHBondContact O-N 2.74Å; F428-L430 VanDerWaalsContact C-N 3.31Å; F428-L430 PolarHBondContact O-N 3.33Å; F428-G431 PolarHBondContact O-N 3.3Å; F428-G431 VanDerWaalsContact O-N 3.17Å; F428-I432 WeakPolarHBondContact O-CB 3.25Å; F428-I432 WeakPolarHBondContact O-CG1 3.49Å; F428-I432 PolarHBondContact O-N 2.85Å
429T97.3Very high95Very high23 Ų2316.5 Ų16.514%0.14110%0.096CC..Hα-helixtrans-59.4-43.1176.3-61.20000111.3L425 G431 I432 L433 I534L425-T429 WeakPolarHBondContact O-CB 3.2Å; L425-T429 PolarHBondContact O-N 2.88Å; L425-T429 PolarHBondContact O-OG1 3.3Å; T429-G431 PolarHBondContact O-N 2.98Å; T429-I432 PolarHBondContact O-N 3.03Å; T429-L433 HydrophobicContact CG2-CD1 3.64Å; T429-L433 HydrophobicContact CG2-CG 4.28Å; T429-L433 WeakPolarHBondContact O-CB 3.48Å; T429-L433 PolarHBondContact O-N 2.85Å; T429-I534 HydrophobicContact CG2-CD1 3.81Å
430L96.1Very high95.1Very high1 Ų122 Ų221%0.00512%0.119CC..Hα-helixtrans-60.5-44.1175-178.668.8000111.5G426 F428 C434 A437 L538G426-L430 WeakPolarHBondContact O-CB 3.35Å; G426-L430 PolarHBondContact O-N 2.89Å; F428-L430 VanDerWaalsContact C-N 3.31Å; F428-L430 PolarHBondContact O-N 3.33Å; L430-C434 HydrophobicContact CD1-CB 3.95Å; L430-C434 WeakPolarHBondContact O-CB 3.18Å; L430-C434 PolarHBondContact O-N 2.78Å; L430-C434 VanDerWaalsContact O-N 3.1Å; L430-A437 HydrophobicContact CD1-CB 3.84Å; L430-A437 HydrophobicContact CD2-CB 4.14Å; L430-A437 HydrophobicContact CG-CB 3.6Å; L430-L538 HydrophobicContact CD1-CD2 3.64Å; L430-L538 HydrophobicContact CD1-CG 3.58Å
431G94.6Very high95.1Very high0 Ų021.4 Ų21.40%012%0.116CC..Hα-helixtrans-62.7-4617700000113.5Y118 R122 L427 F428 T429Y118-G431 PolarHBondContact OH-O 3.41Å; Y118-G431 VanDerWaalsContact OH-O 3.13Å; R122-G431 PolarHBondContact NE-O 3.34Å; L427-G431 PolarHBondContact O-N 2.97Å; F428-G431 PolarHBondContact O-N 3.3Å; F428-G431 VanDerWaalsContact O-N 3.17Å; T429-G431 PolarHBondContact O-N 2.98Å
432I94.7Very high95.3Very high0 Ų021.3 Ų21.30%012%0.116CC..Hα-helixtrans-77.2-38.5-171.6-68.8171.3000112V102 F103 V106 F107 Y118 F428 T429 I556 L557V102-I432 HydrophobicContact CG1-CG2 3.97Å; F103-I432 HydrophobicContact CD1-CD1 3.55Å; F103-I432 HydrophobicContact CE1-CD1 3.87Å; F103-I432 HydrophobicContact CG-CD1 4.42Å; V106-I432 HydrophobicContact CG2-CG2 4.07Å; F107-I432 HydrophobicContact CE1-CD1 4.47Å; F107-I432 HydrophobicContact CZ-CD1 4.24Å; Y118-I432 HydrophobicContact CE1-CD1 4.44Å; Y118-I432 HydrophobicContact CE1-CG1 3.8Å; Y118-I432 HydrophobicContact CE2-CG1 4.3Å; Y118-I432 VanDerWaalsContact OH-CA 3.28Å; Y118-I432 WeakPolarHBondContact OH-CA 3.48Å; Y118-I432 VanDerWaalsContact OH-CG1 3.24Å; Y118-I432 WeakPolarHBondContact OH-CG1 3.24Å; Y118-I432 PolarHBondContact OH-N 3.39Å; Y118-I432 VanDerWaalsContact OH-N 3.09Å; F428-I432 WeakPolarHBondContact O-CB 3.25Å; F428-I432 WeakPolarHBondContact O-CG1 3.49Å; F428-I432 PolarHBondContact O-N 2.85Å; T429-I432 PolarHBondContact O-N 3.03Å; I432-I556 WeakPolarHBondContact O-CG2 3.37Å; I432-L557 HydrophobicContact CG2-CB 3.87Å; I432-L557 PolarHBondContact O-N 3.14Å; I432-L557 VanDerWaalsContact O-N 3.09Å
433L93.6Very high95.3Very high83 Ų8323 Ų2344%0.43512%0.124SC..Hα-helixtrans-100.7-22.9-172-60.5-176.7000113.7V102 T429 P435 L557V102-L433 HydrophobicContact CG1-CD2 3.92Å; V102-L433 HydrophobicContact CG1-CG 4.41Å; T429-L433 HydrophobicContact CG2-CD1 3.64Å; T429-L433 HydrophobicContact CG2-CG 4.28Å; T429-L433 WeakPolarHBondContact O-CB 3.48Å; T429-L433 PolarHBondContact O-N 2.85Å; L433-P435 WeakPolarHBondContact O-CD 3.28Å; L433-L557 HydrophobicContact CD2-CB 4.23Å; L433-L557 HydrophobicContact CD2-CD2 3.89Å
434C92.3Very high95.3Very high26 Ų2625.1 Ų25.118%0.17614%0.139CC..  trans-112105-172.9-55.10000111.7R122 L430 L436 A437 L538R122-C434 PolarHBondContact NH2-O 3.45Å; L430-C434 HydrophobicContact CD1-CB 3.95Å; L430-C434 WeakPolarHBondContact O-CB 3.18Å; L430-C434 PolarHBondContact O-N 2.78Å; L430-C434 VanDerWaalsContact O-N 3.1Å; C434-L436 PolarHBondContact O-N 3.48Å; C434-A437 HydrophobicContact CB-CB 4.2Å; C434-A437 WeakPolarHBondContact O-CB 3.16Å; C434-A437 PolarHBondContact O-N 3.34Å; C434-L538 HydrophobicContact CB-CD2 3.81Å
435P88.4Confident95.4Very high71 Ų7125 Ų2546%0.46114%0.139SC..THydrogen-bonded Turntrans-64.4-28.7177.323.9-32.3000112.6R122 L433 A437 I556R122-P435 PolarHBondContact NH2-O 3.4Å; L433-P435 WeakPolarHBondContact O-CD 3.28Å; P435-A437 PolarHBondContact O-N 3.28Å; P435-I556 HydrophobicContact CB-CD1 3.8Å
436L89.6Confident95.4Very high58 Ų5825 Ų2530%0.30414%0.139SC..THydrogen-bonded Turntrans-73-13.6-179-63.5164.8000113.4C434 N438 S541 G546 Y547C434-L436 PolarHBondContact O-N 3.48Å; L436-N438 PolarHBondContact O-N 3.29Å; L436-S541 WeakPolarHBondContact O-CB 3.41Å; L436-G546 VanDerWaalsContact O-CA 3.3Å; L436-G546 WeakPolarHBondContact O-CA 3.39Å; L436-Y547 HydrophobicContact CD1-CE1 4.4Å; L436-Y547 HydrophobicContact CD2-CD1 3.6Å; L436-Y547 HydrophobicContact CD2-CE1 3.92Å; L436-Y547 HydrophobicContact CD2-CG 4.16Å
437A94.1Very high95.4Very high0 Ų030.8 Ų30.80%016%0.164CC..  trans-70.7129-175.400000111.3R122 F123 L430 C434 P435 S541 L549R122-A437 VanDerWaalsContact CZ-O 3.28Å; R122-A437 PolarHBondContact NH1-O 3.13Å; R122-A437 PolarHBondContact NH2-O 3.19Å; F123-A437 HydrophobicContact CE1-CB 3.98Å; F123-A437 HydrophobicContact CZ-CB 4.17Å; L430-A437 HydrophobicContact CD1-CB 3.84Å; L430-A437 HydrophobicContact CD2-CB 4.14Å; L430-A437 HydrophobicContact CG-CB 3.6Å; C434-A437 HydrophobicContact CB-CB 4.2Å; C434-A437 WeakPolarHBondContact O-CB 3.16Å; C434-A437 PolarHBondContact O-N 3.34Å; P435-A437 PolarHBondContact O-N 3.28Å; A437-S541 WeakPolarHBondContact CA-OG 3.45Å; A437-L549 WeakPolarHBondContact O-CD2 3.36Å
438N94.8Very high95.4Very high16 Ų1632.9 Ų32.99%0.08618%0.179CC..  trans-114.5171.5174.871.828.6000111.1L436 K440 G441 A442 S541 T544 L549L436-N438 PolarHBondContact O-N 3.29Å; N438-K440 VanDerWaalsContact C-N 3.29Å; N438-K440 PolarHBondContact O-N 2.96Å; N438-K440 PolarHBondContact OD1-N 3.45Å; N438-K440 VanDerWaalsContact OD1-N 3.16Å; N438-G441 PolarHBondContact O-N 2.81Å; N438-G441 PolarHBondContact OD1-N 3.33Å; N438-A442 WeakPolarHBondContact O-CB 3.32Å; N438-A442 PolarHBondContact O-N 3.44Å; N438-S541 PolarHBondContact N-OG 2.91Å; N438-S541 PolarHBondContact ND2-O 3.24Å; N438-T544 PolarHBondContact ND2-O 3.28Å; N438-T544 PolarHBondContact ND2-OG1 3.43Å; N438-T544 PolarHBondContact OD1-OG1 3.49Å; N438-L549 HydrophobicContact CB-CD2 4.35Å
439S94.8Very high95.3Very high28 Ų2832.9 Ų32.920%0.19618%0.179CC..Hα-helixtrans-65.1-30.3-173.5-36.80000113.3F123 N124 L443F123-S439 VanDerWaalsContact C-OG 3.24Å; F123-S439 WeakPolarHBondContact CA-OG 3.43Å; F123-S439 PolarHBondContact O-OG 3.34Å; N124-S439 WeakPolarHBondContact ND2-CB 3.38Å; S439-L443 WeakPolarHBondContact O-CG 3.43Å; S439-L443 PolarHBondContact O-N 3.23Å; S439-L443 VanDerWaalsContact O-N 3.11Å
440K95.5Very high95.3Very high136 Ų13633 Ų3359%0.59118%0.178SC*.Hα-helixtrans-68.7-45.2176.3-67.9-178.4-179.8178.70111N438 S444 T544N438-K440 VanDerWaalsContact C-N 3.29Å; N438-K440 PolarHBondContact O-N 2.96Å; N438-K440 PolarHBondContact OD1-N 3.45Å; N438-K440 VanDerWaalsContact OD1-N 3.16Å; K440-S444 WeakPolarHBondContact O-CB 3.49Å; K440-S444 PolarHBondContact O-N 3.48Å; K440-S444 PolarHBondContact O-OG 3.02Å; K440-T544 HydrophobicContact CB-CG2 4.5Å; K440-T544 HydrophobicContact CD-CG2 4.07Å
441G96.5Very high95.3Very high0 Ų035.8 Ų35.80%020%0.201CC..Hα-helixtrans-66.3-43175.100000112.2N438 L443 S444 G445 G537 S541N438-G441 PolarHBondContact O-N 2.81Å; N438-G441 PolarHBondContact OD1-N 3.33Å; G441-L443 PolarHBondContact O-N 3Å; G441-S444 PolarHBondContact O-N 3.15Å; G441-G445 PolarHBondContact O-N 3.28Å; G441-G537 WeakPolarHBondContact CA-O 3.45Å; G441-G537 WeakPolarHBondContact O-CA 3.47Å; G441-S541 WeakPolarHBondContact CA-OG 3.21Å
442A96.8Very high95.3Very high1 Ų138.8 Ų38.81%0.00822%0.217CC..Hα-helixtrans-54.7-49.8176.300000112.6F123 L427 N438 L446F123-A442 HydrophobicContact CD1-CB 3.84Å; F123-A442 HydrophobicContact CD2-CB 3.98Å; F123-A442 HydrophobicContact CE1-CB 3.71Å; F123-A442 HydrophobicContact CE2-CB 3.84Å; F123-A442 HydrophobicContact CG-CB 3.96Å; F123-A442 HydrophobicContact CZ-CB 3.69Å; L427-A442 HydrophobicContact CD1-CB 3.67Å; N438-A442 WeakPolarHBondContact O-CB 3.32Å; N438-A442 PolarHBondContact O-N 3.44Å; A442-L446 WeakPolarHBondContact O-CB 3.24Å; A442-L446 PolarHBondContact O-N 2.83Å
443L97.5Very high95.3Very high35 Ų3538.8 Ų38.818%0.18322%0.217CC..Hα-helixtrans-66.8-44.5177.2-70.8172.5000112.4A126 M130 S439 G441 G445 L446 F447A126-L443 HydrophobicContact CB-CD1 4.41Å; M130-L443 HydrophobicContact CG-CD2 4.23Å; S439-L443 WeakPolarHBondContact O-CG 3.43Å; S439-L443 PolarHBondContact O-N 3.23Å; S439-L443 VanDerWaalsContact O-N 3.11Å; G441-L443 PolarHBondContact O-N 3Å; L443-G445 VanDerWaalsContact C-N 3.31Å; L443-G445 PolarHBondContact O-N 3.48Å; L443-L446 PolarHBondContact O-N 3.26Å; L443-F447 HydrophobicContact CB-CE2 4.42Å; L443-F447 HydrophobicContact CD2-CE2 4.47Å; L443-F447 WeakPolarHBondContact O-CD2 3.24Å; L443-F447 PolarHBondContact O-N 3.31Å
444S97.6Very high95.3Very high44 Ų4438 Ų3831%0.30821%0.213SC..Hα-helixtrans-62.2-40.9179.6-55.40000111.5K440 G441 S448K440-S444 WeakPolarHBondContact O-CB 3.49Å; K440-S444 PolarHBondContact O-N 3.48Å; K440-S444 PolarHBondContact O-OG 3.02Å; G441-S444 PolarHBondContact O-N 3.15Å; S444-S448 VanDerWaalsContact O-CB 3.29Å; S444-S448 WeakPolarHBondContact O-CB 3.38Å; S444-S448 PolarHBondContact O-N 3.34Å; S444-S448 PolarHBondContact O-OG 3.45Å
445G97.7Very high95.3Very high0 Ų043.9 Ų43.90%023%0.231CC..Hα-helixtrans-62.4-49.1173.900000111.9G441 L443 F447 S448 G449 A533G441-G445 PolarHBondContact O-N 3.28Å; L443-G445 VanDerWaalsContact C-N 3.31Å; L443-G445 PolarHBondContact O-N 3.48Å; G445-F447 PolarHBondContact O-N 2.91Å; G445-S448 PolarHBondContact O-N 3.49Å; G445-G449 PolarHBondContact O-N 3.08Å; G445-A533 WeakPolarHBondContact CA-O 3.45Å; G445-A533 VanDerWaalsContact O-CA 3.27Å; G445-A533 WeakPolarHBondContact O-CA 3.25Å; G445-A533 WeakPolarHBondContact O-CB 3.34Å
446L97.7Very high95.5Very high2 Ų240.8 Ų40.81%0.0121%0.211CC..Hα-helixtrans-55.3-51.1177.117965.5000111.7M130 L134 P423 L424 L427 A442 L443 M450M130-L446 HydrophobicContact CB-CD2 4.14Å; L134-L446 HydrophobicContact CD1-CD1 3.8Å; L134-L446 HydrophobicContact CD1-CD2 3.92Å; L134-L446 HydrophobicContact CD1-CG 4.09Å; P423-L446 HydrophobicContact CB-CD1 4.12Å; L424-L446 HydrophobicContact CD2-CD1 4.07Å; L427-L446 HydrophobicContact CB-CD1 4.45Å; L427-L446 HydrophobicContact CD2-CD1 4.26Å; L427-L446 HydrophobicContact CD2-CD2 4.08Å; A442-L446 WeakPolarHBondContact O-CB 3.24Å; A442-L446 PolarHBondContact O-N 2.83Å; L443-L446 PolarHBondContact O-N 3.26Å; L446-M450 VanDerWaalsContact O-CB 3.23Å; L446-M450 WeakPolarHBondContact O-CB 3.34Å; L446-M450 PolarHBondContact O-N 2.9Å
447F97.6Very high95.4Very high120 Ų12038.1 Ų38.153%0.52620%0.198SC..Hα-helixtrans-66.2-40.9-179.2-74.7-62.7000112.8M130 L443 G445 M450 A451M130-F447 HydrophobicContact SD-CZ 4.27Å; L443-F447 HydrophobicContact CB-CE2 4.42Å; L443-F447 HydrophobicContact CD2-CE2 4.47Å; L443-F447 WeakPolarHBondContact O-CD2 3.24Å; L443-F447 PolarHBondContact O-N 3.31Å; G445-F447 PolarHBondContact O-N 2.91Å; F447-M450 PolarHBondContact O-N 3.32Å; F447-A451 VanDerWaalsContact O-CB 3.26Å; F447-A451 WeakPolarHBondContact O-CB 3.39Å; F447-A451 PolarHBondContact O-N 3.4Å
448S97.9Very high95.1Very high46 Ų4642.8 Ų42.832%0.32222%0.221SC..Hα-helixtrans-68.4-42.3179.9-55.50000111.5S444 G445 A451 L452S444-S448 VanDerWaalsContact O-CB 3.29Å; S444-S448 WeakPolarHBondContact O-CB 3.38Å; S444-S448 PolarHBondContact O-N 3.34Å; S444-S448 PolarHBondContact O-OG 3.45Å; G445-S448 PolarHBondContact O-N 3.49Å; S448-A451 PolarHBondContact O-N 3.39Å; S448-L452 WeakPolarHBondContact O-CB 3.46Å; S448-L452 PolarHBondContact O-N 3.3Å
449G97.3Very high94.7Very high0 Ų042.2 Ų42.20%022%0.22CC..Hα-helixtrans-62.1-45.3173.700000111.7P423 G445 L452 S453P423-G449 VanDerWaalsContact CG-C 3.47Å; G445-G449 PolarHBondContact O-N 3.08Å; G449-L452 PolarHBondContact O-N 3.08Å; G449-S453 WeakPolarHBondContact O-CB 3.4Å; G449-S453 PolarHBondContact O-N 3.31Å; G449-S453 PolarHBondContact O-OG 2.83Å
450M96Very high94.2Very high26 Ų2641.1 Ų41.113%0.12821%0.212CC..Hα-helixtrans-62.7-45.5177.4-170.670.9177.500112L134 I420 P423 L446 F447 L452 S453 L454L134-M450 HydrophobicContact CD2-CE 3.84Å; L134-M450 HydrophobicContact CD2-SD 4.32Å; I420-M450 HydrophobicContact CB-CE 4.31Å; I420-M450 HydrophobicContact CB-SD 4.45Å; I420-M450 HydrophobicContact CD1-CE 4.17Å; I420-M450 HydrophobicContact CG1-CE 3.71Å; I420-M450 HydrophobicContact CG1-SD 4.36Å; I420-M450 HydrophobicContact CG2-CE 4.12Å; I420-M450 HydrophobicContact CG2-SD 4.27Å; P423-M450 HydrophobicContact CB-CB 4.4Å; P423-M450 HydrophobicContact CG-CB 4.34Å; P423-M450 HydrophobicContact CG-SD 4.42Å; L446-M450 VanDerWaalsContact O-CB 3.23Å; L446-M450 WeakPolarHBondContact O-CB 3.34Å; L446-M450 PolarHBondContact O-N 2.9Å; F447-M450 PolarHBondContact O-N 3.32Å; M450-L452 PolarHBondContact O-N 2.91Å; M450-S453 PolarHBondContact O-N 2.98Å; M450-L454 HydrophobicContact CE-CD1 3.77Å; M450-L454 HydrophobicContact CE-CD2 4.34Å; M450-L454 HydrophobicContact CE-CG 4.09Å; M450-L454 HydrophobicContact CG-CD1 3.82Å; M450-L454 HydrophobicContact CG-CG 4.41Å; M450-L454 VanDerWaalsContact O-CB 3.24Å; M450-L454 WeakPolarHBondContact O-CB 3.44Å; M450-L454 VanDerWaalsContact O-CG 3.29Å; M450-L454 WeakPolarHBondContact O-CG 3.39Å; M450-L454 PolarHBondContact O-N 3.06Å; M450-L454 HydrophobicContact SD-CD1 4.36Å
451A96.5Very high93.4Very high60 Ų6039.4 Ų39.450%0.49621%0.207SC..Hα-helixtrans-60.8-45.4178.900000111.6F447 S448 W455F447-A451 VanDerWaalsContact O-CB 3.26Å; F447-A451 WeakPolarHBondContact O-CB 3.39Å; F447-A451 PolarHBondContact O-N 3.4Å; S448-A451 PolarHBondContact O-N 3.39Å; A451-W455 VanDerWaalsContact O-CB 3.27Å; A451-W455 WeakPolarHBondContact O-CB 3.3Å; A451-W455 PolarHBondContact O-N 2.83Å
452L95.6Very high92.7Very high63 Ų6344.5 Ų44.533%0.3323%0.233SC..Hα-helixtrans-68.5-45.9179.6-175.463.9000112.1S448 G449 M450 L454 W455 V456 L528 T532S448-L452 WeakPolarHBondContact O-CB 3.46Å; S448-L452 PolarHBondContact O-N 3.3Å; G449-L452 PolarHBondContact O-N 3.08Å; M450-L452 PolarHBondContact O-N 2.91Å; L452-L454 VanDerWaalsContact C-N 3.34Å; L452-L454 PolarHBondContact O-N 3.07Å; L452-W455 PolarHBondContact O-N 3.18Å; L452-V456 HydrophobicContact CD1-CG2 4.35Å; L452-V456 WeakPolarHBondContact O-CG2 3.38Å; L452-V456 PolarHBondContact O-N 2.94Å; L452-L528 HydrophobicContact CD2-CD1 3.8Å; L452-L528 HydrophobicContact CD2-CD2 4.29Å; L452-L528 HydrophobicContact CD2-CG 3.91Å; L452-L528 HydrophobicContact CG-CD1 4.49Å; L452-L528 HydrophobicContact CG-CD2 4.1Å; L452-L528 HydrophobicContact CG-CG 4.22Å; L452-T532 HydrophobicContact CD2-CG2 4.03Å; L452-T532 VanDerWaalsContact CD2-OG1 3.29Å; L452-T532 WeakPolarHBondContact CD2-OG1 3.45Å
453S94.5Very high92Very high0 Ų050.8 Ų50.80%026%0.257CS..Hα-helixtrans-64.2-38.3178.1-72.80000112.2I419 G449 M450 G457 F525 G529I419-S453 WeakPolarHBondContact O-CB 3.39Å; G449-S453 WeakPolarHBondContact O-CB 3.4Å; G449-S453 PolarHBondContact O-N 3.31Å; G449-S453 PolarHBondContact O-OG 2.83Å; M450-S453 PolarHBondContact O-N 2.98Å; S453-G457 WeakPolarHBondContact O-CA 3.42Å; S453-G457 PolarHBondContact O-N 2.85Å; S453-F525 PolarHBondContact OG-O 3.33Å; S453-G529 WeakPolarHBondContact OG-CA 3.48Å; S453-G529 PolarHBondContact OG-N 3.48Å
454L93.1Very high90.9Very high65 Ų6553.8 Ų53.834%0.3428%0.279SS..Hα-helixtrans-65.9-45173.3-79.4168.2000111.6I419 M450 L452 V456 G457 I458I419-L454 HydrophobicContact CG2-CB 4.46Å; I419-L454 HydrophobicContact CG2-CD2 3.56Å; I419-L454 HydrophobicContact CG2-CG 3.8Å; M450-L454 HydrophobicContact CE-CD1 3.77Å; M450-L454 HydrophobicContact CE-CD2 4.34Å; M450-L454 HydrophobicContact CE-CG 4.09Å; M450-L454 HydrophobicContact CG-CD1 3.82Å; M450-L454 HydrophobicContact CG-CG 4.41Å; M450-L454 VanDerWaalsContact O-CB 3.24Å; M450-L454 WeakPolarHBondContact O-CB 3.44Å; M450-L454 VanDerWaalsContact O-CG 3.29Å; M450-L454 WeakPolarHBondContact O-CG 3.39Å; M450-L454 PolarHBondContact O-N 3.06Å; M450-L454 HydrophobicContact SD-CD1 4.36Å; L452-L454 VanDerWaalsContact C-N 3.34Å; L452-L454 PolarHBondContact O-N 3.07Å; L454-V456 PolarHBondContact O-N 3.37Å; L454-G457 PolarHBondContact O-N 2.66Å; L454-I458 HydrophobicContact CD2-CD1 4.47Å; L454-I458 VanDerWaalsContact O-CB 3.31Å; L454-I458 WeakPolarHBondContact O-CB 3.41Å; L454-I458 VanDerWaalsContact O-CG1 3.26Å; L454-I458 WeakPolarHBondContact O-CG1 3.19Å; L454-I458 PolarHBondContact O-N 3.32Å
455W93Very high89.9Confident151 Ų15153.4 Ų53.457%0.57228%0.275SS*.Hα-helixtrans-56.1-51.6177.8175.8-74.7000111.3A451 L452 G459 Y518A451-W455 VanDerWaalsContact O-CB 3.27Å; A451-W455 WeakPolarHBondContact O-CB 3.3Å; A451-W455 PolarHBondContact O-N 2.83Å; L452-W455 PolarHBondContact O-N 3.18Å; W455-G459 PolarHBondContact O-N 3.22Å; W455-Y518 AromaticContact CD1-CE1 3.84Å; W455-Y518 AromaticContact NE1-CE1 3.59Å; W455-Y518 AromaticContact NE1-CZ 3.81Å; W455-Y518 PolarHBondContact NE1-OH 3.33Å
456V91.3Very high88.9Confident6 Ų656.5 Ų56.54%0.03630%0.297CS..Hα-helixtrans-70.3-42.3-178.9175.90000111L452 L454 G459 A460 L520 F525 L528L452-V456 HydrophobicContact CD1-CG2 4.35Å; L452-V456 WeakPolarHBondContact O-CG2 3.38Å; L452-V456 PolarHBondContact O-N 2.94Å; L454-V456 PolarHBondContact O-N 3.37Å; V456-G459 PolarHBondContact O-N 3.47Å; V456-A460 WeakPolarHBondContact O-CB 3.45Å; V456-A460 PolarHBondContact O-N 3.39Å; V456-L520 HydrophobicContact CG1-CB 4.33Å; V456-L520 HydrophobicContact CG1-CD2 4.09Å; V456-F525 HydrophobicContact CG1-CD1 4.17Å; V456-F525 HydrophobicContact CG1-CE1 3.83Å; V456-L528 HydrophobicContact CB-CD2 4.06Å; V456-L528 HydrophobicContact CG1-CD2 4.27Å; V456-L528 HydrophobicContact CG2-CD2 3.8Å
457G88.8Confident87.9Confident2 Ų262.5 Ų62.52%0.02133%0.329CS..Hα-helixtrans-63.9-43.9-179.500000113.6S453 L454 Q461S453-G457 WeakPolarHBondContact O-CA 3.42Å; S453-G457 PolarHBondContact O-N 2.85Å; L454-G457 PolarHBondContact O-N 2.66Å; G457-Q461 WeakPolarHBondContact O-CG 3.37Å; G457-Q461 PolarHBondContact O-N 3.37Å
458I87Confident86.8Confident97 Ų9760.2 Ų60.250%0.49733%0.332SS..Hα-helixtrans-68.9-43.5175.1-65.7168.9000110L454 A460 Q461 I462L454-I458 HydrophobicContact CD2-CD1 4.47Å; L454-I458 VanDerWaalsContact O-CB 3.31Å; L454-I458 WeakPolarHBondContact O-CB 3.41Å; L454-I458 VanDerWaalsContact O-CG1 3.26Å; L454-I458 WeakPolarHBondContact O-CG1 3.19Å; L454-I458 PolarHBondContact O-N 3.32Å; I458-A460 VanDerWaalsContact C-N 3.29Å; I458-A460 PolarHBondContact O-N 2.92Å; I458-Q461 PolarHBondContact O-N 3.35Å; I458-I462 HydrophobicContact CG2-CD1 3.83Å; I458-I462 HydrophobicContact CG2-CG1 4.46Å; I458-I462 WeakPolarHBondContact O-CG1 3.44Å; I458-I462 PolarHBondContact O-N 3.31Å; I458-I462 VanDerWaalsContact O-N 3.13Å
459G85.8Confident85.8Confident5 Ų559.5 Ų59.55%0.05233%0.325CS..Hα-helixtrans-57.5-40.4176.600000113W455 V456 Q461 I462 Y463W455-G459 PolarHBondContact O-N 3.22Å; V456-G459 PolarHBondContact O-N 3.47Å; G459-Q461 VanDerWaalsContact C-N 3.28Å; G459-Q461 PolarHBondContact O-N 3.41Å; G459-I462 PolarHBondContact O-N 2.04Å; G459-Y463 PolarHBondContact O-N 2.91Å
460A83.9Confident84.8Confident5 Ų560.2 Ų60.24%0.04133%0.33CS..Hα-helixtrans-67.5-23.3176.800000114.2V456 I458 Y518 F525V456-A460 WeakPolarHBondContact O-CB 3.45Å; V456-A460 PolarHBondContact O-N 3.39Å; I458-A460 VanDerWaalsContact C-N 3.29Å; I458-A460 PolarHBondContact O-N 2.92Å; A460-Y518 WeakPolarHBondContact CA-O 3.4Å; A460-Y518 VanDerWaalsContact CB-O 3.24Å; A460-Y518 WeakPolarHBondContact CB-O 3.26Å; A460-F525 HydrophobicContact CB-CE1 4.44Å; A460-F525 HydrophobicContact CB-CZ 3.7Å
461Q79.9Confident84.2Confident100 Ų10064.1 Ų64.147%0.46735%0.348SS..Hα-helixtrans-81.7-34.3174.1-65.7-64.8-24.800111.8G457 I458 G459G457-Q461 WeakPolarHBondContact O-CG 3.37Å; G457-Q461 PolarHBondContact O-N 3.37Å; I458-Q461 PolarHBondContact O-N 3.35Å; G459-Q461 VanDerWaalsContact C-N 3.28Å; G459-Q461 PolarHBondContact O-N 3.41Å
462I82.1Confident83.7Confident107 Ų10763.8 Ų63.855%0.54934%0.341SS..Hα-helixtrans-77.5-39.5177.9-61.3171.5000110.7I458 G459 P464I458-I462 HydrophobicContact CG2-CD1 3.83Å; I458-I462 HydrophobicContact CG2-CG1 4.46Å; I458-I462 WeakPolarHBondContact O-CG1 3.44Å; I458-I462 PolarHBondContact O-N 3.31Å; I458-I462 VanDerWaalsContact O-N 3.13Å; G459-I462 PolarHBondContact O-N 2.04Å; I462-P464 WeakPolarHBondContact O-CD 3.08Å
463Y82.2Confident83.3Confident132 Ų13262.8 Ų62.852%0.51834%0.335SS..SBendtrans-118.479.4-178.8-57.4-76.8000109.7G459 Y518G459-Y463 PolarHBondContact O-N 2.91Å; Y463-Y518 AromaticContact CD2-CD2 3.71Å; Y463-Y518 HydrophobicContact CD2-CD2 3.71Å; Y463-Y518 AromaticContact CD2-CE2 4Å; Y463-Y518 HydrophobicContact CD2-CE2 4Å; Y463-Y518 HydrophobicContact CD2-CG 4.47Å; Y463-Y518 HydrophobicContact CE2-CD2 4.44Å; Y463-Y518 HydrophobicContact CE2-CE2 4.3Å; Y463-Y518 HydrophobicContact CG-CD2 4.26Å
464P74.6Confident82.9Confident98 Ų9867.7 Ų67.764%0.63637%0.367SS*.PPolyproline II helixtrans-63.6147.8-177.426-34.2000111.6I462I462-P464 WeakPolarHBondContact O-CD 3.08Å
465P76.7Confident82.7Confident37 Ų3766.9 Ų66.924%0.2436%0.363CS..PPolyproline II helixtrans-63.3143.4-179.425.1-33.4000111.5L469P465-L469 HydrophobicContact CB-CB 4.43Å
466S76.3Confident82.4Confident64 Ų6461.2 Ų61.245%0.44835%0.346SS..PPolyproline II helixtrans-61.2156.1178.670.40000112.9A468 L469 S470S466-A468 PolarHBondContact O-N 3.31Å; S466-A468 VanDerWaalsContact O-N 3.1Å; S466-L469 PolarHBondContact O-N 2.99Å; S466-S470 PolarHBondContact O-N 3.12Å; S466-S470 VanDerWaalsContact O-N 3.11Å; S466-S470 PolarHBondContact O-OG 3.31Å
467N76.8Confident82.1Confident128 Ų12864.2 Ų64.268%0.68437%0.365SS*.Hα-helixtrans-56.6-27.1175.9-72.7-14.1000113.3L469 S470 Q471N467-L469 VanDerWaalsContact C-N 3.31Å; N467-L469 PolarHBondContact O-N 3.33Å; N467-S470 WeakPolarHBondContact CA-OG 3.36Å; N467-Q471 WeakPolarHBondContact O-CA 3.31Å; N467-Q471 PolarHBondContact O-N 3.48Å
468A73.3Confident81.8Confident73 Ų7372.8 Ų72.860%0.60340%0.404SS*.Hα-helixtrans-67.1-30.8175.500000112.9S466 Q471S466-A468 PolarHBondContact O-N 3.31Å; S466-A468 VanDerWaalsContact O-N 3.1Å; A468-Q471 WeakPolarHBondContact O-CG 3.38Å
469L78.2Confident81.4Confident31 Ų3170.3 Ų70.316%0.16240%0.403CS..Hα-helixtrans-89.7-31.5179.3-66.3175.6000112.4L238 R239 R240 P465 S466 N467L238-L469 HydrophobicContact CB-CD1 4.26Å; L238-L469 HydrophobicContact CB-CD2 4.23Å; R239-L469 PolarHBondContact NH1-O 2.89Å; R239-L469 VanDerWaalsContact NH1-O 3.11Å; R240-L469 PolarHBondContact N-O 3.49Å; P465-L469 HydrophobicContact CB-CB 4.43Å; S466-L469 PolarHBondContact O-N 2.99Å; N467-L469 VanDerWaalsContact C-N 3.31Å; N467-L469 PolarHBondContact O-N 3.33Å
470S75.4Confident81.3Confident15 Ų1571.1 Ų71.111%0.10541%0.407CS..Hα-helixtrans-85.2-22.9178.463.60000114.3Y81 S466 N467Y81-S470 WeakPolarHBondContact CD1-O 3.36Å; Y81-S470 VanDerWaalsContact CE1-O 3.32Å; Y81-S470 WeakPolarHBondContact CE1-O 3.35Å; S466-S470 PolarHBondContact O-N 3.12Å; S466-S470 VanDerWaalsContact O-N 3.11Å; S466-S470 PolarHBondContact O-OG 3.31Å; N467-S470 WeakPolarHBondContact CA-OG 3.36Å
471Q82.9Confident80.6Confident107 Ų10778.5 Ų78.550%0.545%0.446SS..  trans37.964.7178.8-76.7-176.14.900114.5R239 N467 A468R239-Q471 VanDerWaalsContact CZ-CD 3.41Å; R239-Q471 VanDerWaalsContact CZ-OE1 3.31Å; R239-Q471 VanDerWaalsContact NH2-CD 3.28Å; N467-Q471 WeakPolarHBondContact O-CA 3.31Å; N467-Q471 PolarHBondContact O-N 3.48Å; A468-Q471 WeakPolarHBondContact O-CG 3.38Å
472P85.6Confident79.9Confident54 Ų5479.3 Ų79.335%0.35145%0.448SS..PPolyproline II helixtrans-62.7139.116829.3-33.9000110.1Y81Y81-P472 HydrophobicContact CE1-CB 4.04Å
473L88.3Confident78.1Confident41 Ų4179.8 Ų79.822%0.21546%0.456CS..PPolyproline II helixtrans-76.1150.2176-69.3168000110.8R80 R227R80-L473 WeakPolarHBondContact O-CB 3.24Å; R80-L473 PolarHBondContact O-N 3.1Å; R227-L473 HydrophobicContact CB-CD1 4.45Å; R227-L473 HydrophobicContact CG-CD1 3.81Å
474P86.3Confident76.1Confident103 Ų10380.5 Ų80.567%0.66948%0.475SS*.PPolyproline II helixtrans-65.2142.1-176.126.2-34.4000111.8R227R227-P474 PolarHBondContact NH1-O 3.29Å; R227-P474 PolarHBondContact NH2-O 3.46Å
475L89.3Confident74.4Confident48 Ų4879.6 Ų79.625%0.25148%0.475SS..  trans-117.8148.2174.7-59.6175.2000108.4Y79 D310 W312 T313Y79-L475 HydrophobicContact CD1-CD2 3.98Å; Y79-L475 HydrophobicContact CE1-CD1 4.08Å; Y79-L475 HydrophobicContact CE1-CD2 3.31Å; Y79-L475 HydrophobicContact CE1-CG 4.34Å; D310-L475 HydrophobicContact CB-CB 4.18Å; D310-L475 WeakPolarHBondContact OD2-CD1 3.47Å; W312-L475 HydrophobicContact CE3-CD1 3.86Å; W312-L475 HydrophobicContact CZ3-CD1 4.07Å; T313-L475 HydrophobicContact CG2-CD1 4.18Å
476S86.1Confident72.5Confident33 Ų3387 Ų8723%0.23151%0.506CS..  trans-122.5140.8-178.2-178.80000111.5D310 E478D310-S476 PolarHBondContact N-O 3.3Å; S476-E478 PolarHBondContact OG-N 2.84Å
477T85.4Confident70.7Confident68 Ų6887.8 Ų87.842%0.41753%0.525SS..  trans-115.27.3173.462.10000112.2T313 T314 G479 C480T313-T477 VanDerWaalsContact OG1-CG2 3.23Å; T313-T477 WeakPolarHBondContact OG1-CG2 3.46Å; T314-T477 HydrophobicContact CG2-CG2 3.67Å; T477-G479 PolarHBondContact O-N 3.25Å; T477-C480 WeakPolarHBondContact O-CB 3.45Å; T477-C480 PolarHBondContact O-N 2.81Å; T477-C480 VanDerWaalsContact O-N 3.12Å
478E82.3Confident68.7Low182 Ų18286.2 Ų86.285%0.8552%0.524SS*.THydrogen-bonded Turntrans-63.4-29.2-172.8-68.2179.116900113.1S476S476-E478 PolarHBondContact OG-N 2.84Å
479G78.5Confident66.7Low45 Ų4591 Ų9146%0.46454%0.539SS..THydrogen-bonded Turntrans-89.74.9178.300000114.7S308 T477 N481S308-G479 VanDerWaalsContact O-CA 3.24Å; S308-G479 WeakPolarHBondContact O-CA 3.45Å; S308-G479 PolarHBondContact O-N 3.12Å; T477-G479 PolarHBondContact O-N 3.25Å; G479-N481 PolarHBondContact O-N 2.95Å
480C83.2Confident64.7Low23 Ų2399.3 Ų99.316%0.15557%0.569CS.*  trans-83.997.8-178.1-59.80000111.8C309 T314 T477 F482C309-C480 WeakPolarHBondContact CA-SG 3.27Å; C309-C480 HydrophobicContact CB-CB 4.15Å; C309-C480 WeakPolarHBondContact CB-SG 3.31Å; C309-C480 WeakPolarHBondContact SG-CA 3.23Å; C309-C480 WeakPolarHBondContact SG-CB 3.28Å; C309-C480 CovalentContact SG-SG 2.04Å; C309-C480 PolarHBondContact SG-SG 2.6Å; T314-C480 HydrophobicContact CG2-CB 4.16Å; T314-C480 WeakPolarHBondContact CG2-SG 3.16Å; T477-C480 WeakPolarHBondContact O-CB 3.45Å; T477-C480 PolarHBondContact O-N 2.81Å; T477-C480 VanDerWaalsContact O-N 3.12Å; C480-F482 HydrophobicContact CB-CD2 4.09Å; C480-F482 HydrophobicContact CB-CE2 3.61Å; C480-F482 HydrophobicContact CB-CZ 4.29Å; C480-F482 PolarHBondContact O-N 3.27Å
481N68.6Low62.7Low160 Ų160104.5 Ų104.586%0.85660%0.6SS**  trans-86.889.7172-83.7-10.4000110.9G479 T483G479-N481 PolarHBondContact O-N 2.95Å; N481-T483 PolarHBondContact O-N 3.31Å
482F66Low60.5Low117 Ų117105.2 Ų105.251%0.51362%0.616SS.*  trans-87.4105.3167.8-63.2-69.7000109.9T314 L316 C480 T484T314-F482 HydrophobicContact CG2-CE2 3.76Å; T314-F482 HydrophobicContact CG2-CZ 4.12Å; L316-F482 HydrophobicContact CD1-CE1 3.85Å; L316-F482 HydrophobicContact CD1-CZ 3.72Å; L316-F482 HydrophobicContact CD2-CE1 3.84Å; L316-F482 HydrophobicContact CD2-CZ 4.19Å; L316-F482 HydrophobicContact CG-CE1 4.07Å; L316-F482 HydrophobicContact CG-CZ 3.93Å; C480-F482 HydrophobicContact CB-CD2 4.09Å; C480-F482 HydrophobicContact CB-CE2 3.61Å; C480-F482 HydrophobicContact CB-CZ 4.29Å; C480-F482 PolarHBondContact O-N 3.27Å; F482-T484 PolarHBondContact O-N 3.18Å; F482-T484 VanDerWaalsContact O-N 3.15Å
483T43.9Very low57.9Low116 Ų116106.6 Ų106.671%0.71263%0.628SS**  trans-68.9105.9160.541.80000107.9N481 A485N481-T483 PolarHBondContact O-N 3.31Å; T483-A485 VanDerWaalsContact C-N 3.32Å; T483-A485 PolarHBondContact O-N 3.15Å
484T41.2Very low55.3Low148 Ų148110.9 Ų110.991%0.90866%0.656SS**  trans-55.692166.7310000110.1F482F482-T484 PolarHBondContact O-N 3.18Å; F482-T484 VanDerWaalsContact O-N 3.15Å
485A38.6Very low52.5Low78 Ų78113.4 Ų113.465%0.64566%0.663SS**  trans-113.679171.500000108.9T483T483-A485 VanDerWaalsContact C-N 3.32Å; T483-A485 PolarHBondContact O-N 3.15Å
486H36.9Very low49.6Very low192 Ų192115.9 Ų115.989%0.88968%0.681SS**SBend171.9127.7127.2-92.7-68.7000109.2
487G38.8Very low47Very low81 Ų81121 Ų12184%0.83571%0.705SS**  trans-67.7139.2-16300000115.5
488S33.2Very low44.4Very low96 Ų96126 Ų12667%0.67172%0.724SS**  -146.3124.1127.346.70000107.8W490S488-W490 PolarHBondContact O-N 3.45Å
489N32.7Very low41.8Very low174 Ų174122.3 Ų122.393%0.9371%0.71SS**  trans-54.3100.7166.5-89.8-18.3000108.3
490W35.7Very low39.4Very low205 Ų205129.5 Ų129.578%0.77773%0.728SS**  trans-114107.5151.4-78.375.8000105.9S488 S492S488-W490 PolarHBondContact O-N 3.45Å; W490-S492 PolarHBondContact O-N 2.9Å
491T32.8Very low36.8Very low123 Ų123132.9 Ų132.976%0.75575%0.749SS**  trans-34.2127.8157.6370000109.2S493T491-S493 PolarHBondContact O-N 3.27Å
492S37.6Very low34.9Very low122 Ų122130.1 Ų130.185%0.85374%0.742SS**  trans-6077.7178.9-43.90000111W490 T494W490-S492 PolarHBondContact O-N 2.9Å; S492-T494 VanDerWaalsContact C-N 3.34Å; S492-T494 PolarHBondContact O-N 2.84Å
493S31Very low33.4Very low84 Ų84128.9 Ų128.959%0.58774%0.744SS**  trans-74102.1144.1530000104.6T491 L495T491-S493 PolarHBondContact O-N 3.27Å; S493-L495 VanDerWaalsContact C-N 3.3Å; S493-L495 PolarHBondContact O-N 3.34Å
494T33.2Very low32.7Very low130 Ų130127 Ų12780%0.79874%0.74SS**  trans-39.198162.447.20000108.9S492S492-T494 VanDerWaalsContact C-N 3.34Å; S492-T494 PolarHBondContact O-N 2.84Å
495L28.1Very low32.4Very low157 Ų157124.3 Ų124.382%0.82273%0.725SS**  trans-64.6122.1162-80.1164.7000104.2S493 I497S493-L495 VanDerWaalsContact C-N 3.3Å; S493-L495 PolarHBondContact O-N 3.34Å; L495-I497 PolarHBondContact O-N 3.27Å
496P28.8Very low32.4Very low99 Ų99125.1 Ų125.164%0.64372%0.721SS**  trans-58.6144.8-174.425.5-31.5000107.4Q498P496-Q498 VanDerWaalsContact C-N 3.27Å; P496-Q498 PolarHBondContact O-N 3Å
497I31.1Very low32.3Very low141 Ų141123.5 Ų123.572%0.72371%0.714SS**  trans-34.2101.8154.1-58.8169.6000106.1L495 N499L495-I497 PolarHBondContact O-N 3.27Å; I497-N499 VanDerWaalsContact CG2-OD1 3.24Å; I497-N499 WeakPolarHBondContact CG2-OD1 2.99Å; I497-N499 PolarHBondContact O-N 3.38Å
498Q30.1Very low32.3Very low173 Ų173128.4 Ų128.481%0.80872%0.715SS**  trans-72.377.7162.1-86.3-169.3-32.800104P496 F500P496-Q498 VanDerWaalsContact C-N 3.27Å; P496-Q498 PolarHBondContact O-N 3Å; Q498-F500 PolarHBondContact O-N 3.02Å; Q498-F500 VanDerWaalsContact O-N 3.09Å
499N27.2Very low32.4Very low104 Ų104125.8 Ų125.856%0.55670%0.703SS**  trans-42.7120.9142.3-73.6-22.8000103.6I497 T501I497-N499 VanDerWaalsContact CG2-OD1 3.24Å; I497-N499 WeakPolarHBondContact CG2-OD1 2.99Å; I497-N499 PolarHBondContact O-N 3.38Å; N499-T501 HydrophobicContact CB-CG2 4Å; N499-T501 PolarHBondContact O-N 2.9Å; N499-T501 PolarHBondContact O-OG1 3.23Å
500F28.4Very low32.7Very low196 Ų196123.9 Ų123.986%0.8669%0.693SS**  trans-64.662.6152.2-91.1-92.4000107.6Q498 S502Q498-F500 PolarHBondContact O-N 3.02Å; Q498-F500 VanDerWaalsContact O-N 3.09Å; F500-S502 PolarHBondContact O-N 3.2Å
501T29.8Very low33.3Very low95 Ų95123 Ų12358%0.58369%0.694SS**  trans-77.870143.145.50000105.5N499 V503N499-T501 HydrophobicContact CB-CG2 4Å; N499-T501 PolarHBondContact O-N 2.9Å; N499-T501 PolarHBondContact O-OG1 3.23Å; T501-V503 HydrophobicContact CG2-CG2 3.76Å; T501-V503 PolarHBondContact O-N 3.45Å
502S28.8Very low34.2Very low101 Ų101125.5 Ų125.571%0.70669%0.69SS**  trans-65.274.8131.159.90000105.4F500 A504F500-S502 PolarHBondContact O-N 3.2Å; S502-A504 PolarHBondContact O-N 2.98Å
503V33Very low35.2Very low92 Ų92125.3 Ų125.356%0.55868%0.683SS**  trans-69.878.7155.9174.30000102.9T501T501-V503 HydrophobicContact CG2-CG2 3.76Å; T501-V503 PolarHBondContact O-N 3.45Å
504A30.8Very low36.6Very low76 Ų76125.1 Ų125.163%0.62868%0.676SS**  trans-48129.3131.800000104.3S502 V506S502-A504 PolarHBondContact O-N 2.98Å; A504-V506 PolarHBondContact O-N 2.92Å
505P32.9Very low38Very low91 Ų91122 Ų12259%0.59166%0.656SS**  trans-46.3120.8-170.818.7-30.4000108H507P505-H507 PolarHBondContact O-N 3.19Å
506V40.3Very low40.1Very low95 Ų95118 Ų11858%0.57664%0.636SS**  trans-6489.3164.1177.20000103.6A504 H508A504-V506 PolarHBondContact O-N 2.92Å; V506-H508 VanDerWaalsContact CG1-CD2 3.46Å; V506-H508 WeakPolarHBondContact CG1-CD2 3.25Å; V506-H508 PolarHBondContact O-N 3.43Å
507H34.4Very low42.5Very low158 Ų158117.4 Ų117.473%0.73163%0.627SS**  trans-63.392.2159.4-81.6-53.7000105.3P505 G509P505-H507 PolarHBondContact O-N 3.19Å; H507-G509 PolarHBondContact O-N 2.87Å
508H39.3Very low45Very low185 Ų185112.3 Ų112.386%0.85660%0.599SS**  trans-69.528.1154.1-87.7-58.4000111.1V506V506-H508 VanDerWaalsContact CG1-CD2 3.46Å; V506-H508 WeakPolarHBondContact CG1-CD2 3.25Å; V506-H508 PolarHBondContact O-N 3.43Å
509G34.9Very low47.6Very low41 Ų41104.7 Ų104.742%0.42357%0.565SS.*SBendtrans-113.5114.2172.100000107.4H507H507-G509 PolarHBondContact O-N 2.87Å
510D39Very low50.4Low133 Ų133101.1 Ų101.171%0.71155%0.545SS*.  trans48.993.9167.6-54.9-24.1000115.5W512D510-W512 VanDerWaalsContact C-N 3.27Å; D510-W512 VanDerWaalsContact O-CD1 3.3Å; D510-W512 PolarHBondContact O-N 2.91Å
511K47Very low53.3Low186 Ų18692 Ų9281%0.80951%0.506SS*.  trans-57.194.4162.8-75.8-174.8177.1-174.40108.7V513K511-V513 PolarHBondContact O-N 3.42Å
512W52.8Low56.1Low176 Ų17687.9 Ų87.967%0.66748%0.48SS*.  trans-64133.9170.7-60.1-25.1000107.8D510 L514 T515D510-W512 VanDerWaalsContact C-N 3.27Å; D510-W512 VanDerWaalsContact O-CD1 3.3Å; D510-W512 PolarHBondContact O-N 2.91Å; W512-L514 PolarHBondContact O-N 2.86Å; W512-T515 PolarHBondContact O-N 3.01Å; W512-T515 PolarHBondContact O-OG1 3.46Å
513V58.4Low59Low118 Ų11883.1 Ų83.172%0.71545%0.446SS*.Hα-helixtrans-49.1-25176.1176.90000112.2K511 L517K511-V513 PolarHBondContact O-N 3.42Å; V513-L517 PolarHBondContact O-N 3.39Å
514L60.2Low61.9Low81 Ų8180.2 Ų80.242%0.42443%0.425SS..Hα-helixtrans-66.2-34.3176.6-71.1158.7000113.9W512 D516 L517 Y518W512-L514 PolarHBondContact O-N 2.86Å; L514-D516 VanDerWaalsContact C-N 3.34Å; L514-L517 HydrophobicContact CD2-CD1 4.46Å; L514-L517 WeakPolarHBondContact O-CB 3.43Å; L514-L517 PolarHBondContact O-N 2.71Å; L514-Y518 HydrophobicContact CB-CE2 4.49Å; L514-Y518 WeakPolarHBondContact O-CD2 3.24Å; L514-Y518 WeakPolarHBondContact O-CE2 3.35Å; L514-Y518 PolarHBondContact O-N 3.32Å
515T63Low64.9Low63 Ų6376.6 Ų76.639%0.38740%0.396SS..Hα-helixtrans-71.2-33-178.9-38.80000111.6W512 Y518 S519W512-T515 PolarHBondContact O-N 3.01Å; W512-T515 PolarHBondContact O-OG1 3.46Å; T515-Y518 PolarHBondContact O-N 3.5Å; T515-S519 PolarHBondContact O-OG 2.86Å
516D72.9Confident67.8Low74 Ų7472.3 Ų72.340%0.39637%0.368SS..Hα-helixtrans-70.4-34.6174.2-69.9-20.6000111.3L238 L514 Y518 S519L238-D516 HydrophobicContact CD1-CB 4.34Å; L238-D516 WeakPolarHBondContact CD2-O 3.46Å; L514-D516 VanDerWaalsContact C-N 3.34Å; D516-Y518 VanDerWaalsContact C-N 3.31Å; D516-Y518 PolarHBondContact O-N 3.03Å; D516-S519 WeakPolarHBondContact O-CB 3.33Å; D516-S519 PolarHBondContact O-N 2.97Å; D516-S519 VanDerWaalsContact O-N 3.1Å
517L78Confident70.5Confident87 Ų8768 Ų6846%0.45534%0.342SS..Hα-helixtrans-64.1-32.9175.5-75.4168.4000113.1V513 L514 S519 L520V513-L517 PolarHBondContact O-N 3.39Å; L514-L517 HydrophobicContact CD2-CD1 4.46Å; L514-L517 WeakPolarHBondContact O-CB 3.43Å; L514-L517 PolarHBondContact O-N 2.71Å; L517-S519 PolarHBondContact O-N 2.87Å; L517-L520 VanDerWaalsContact O-CB 3.3Å; L517-L520 WeakPolarHBondContact O-CB 3.43Å; L517-L520 PolarHBondContact O-N 2.99Å
518Y83.4Confident73.4Confident33 Ų3362.8 Ų62.813%0.12932%0.319CS..Hα-helixtrans-74.7-15.6175.4-57.9-39.6000113.3W455 A460 Y463 L514 T515 D516 L520W455-Y518 AromaticContact CD1-CE1 3.84Å; W455-Y518 AromaticContact NE1-CE1 3.59Å; W455-Y518 AromaticContact NE1-CZ 3.81Å; W455-Y518 PolarHBondContact NE1-OH 3.33Å; A460-Y518 WeakPolarHBondContact CA-O 3.4Å; A460-Y518 VanDerWaalsContact CB-O 3.24Å; A460-Y518 WeakPolarHBondContact CB-O 3.26Å; Y463-Y518 AromaticContact CD2-CD2 3.71Å; Y463-Y518 HydrophobicContact CD2-CD2 3.71Å; Y463-Y518 AromaticContact CD2-CE2 4Å; Y463-Y518 HydrophobicContact CD2-CE2 4Å; Y463-Y518 HydrophobicContact CD2-CG 4.47Å; Y463-Y518 HydrophobicContact CE2-CD2 4.44Å; Y463-Y518 HydrophobicContact CE2-CE2 4.3Å; Y463-Y518 HydrophobicContact CG-CD2 4.26Å; L514-Y518 HydrophobicContact CB-CE2 4.49Å; L514-Y518 WeakPolarHBondContact O-CD2 3.24Å; L514-Y518 WeakPolarHBondContact O-CE2 3.35Å; L514-Y518 PolarHBondContact O-N 3.32Å; T515-Y518 PolarHBondContact O-N 3.5Å; D516-Y518 VanDerWaalsContact C-N 3.31Å; D516-Y518 PolarHBondContact O-N 3.03Å; Y518-L520 PolarHBondContact O-N 3.43Å
519S84.3Confident76.2Confident14 Ų1454 Ų5410%0.09828%0.278CS..THydrogen-bonded Turntrans-83.13173.3-60.40000113.4L238 T515 D516 L517 S521L238-S519 WeakPolarHBondContact CA-O 3.39Å; L238-S519 VanDerWaalsContact O-O 3.05Å; T515-S519 PolarHBondContact O-OG 2.86Å; D516-S519 WeakPolarHBondContact O-CB 3.33Å; D516-S519 PolarHBondContact O-N 2.97Å; D516-S519 VanDerWaalsContact O-N 3.1Å; L517-S519 PolarHBondContact O-N 2.87Å; S519-S521 PolarHBondContact O-N 2.78Å
520L87.4Confident79.1Confident28 Ų2852.1 Ų52.115%0.14726%0.259CS..SBendtrans-56.9135.2176.8-173.870.7000110.7P237 L238 V456 L517 Y518 Y522 Y524 F525 L528P237-L520 HydrophobicContact CB-CD1 3.93Å; P237-L520 HydrophobicContact CG-CD1 4.49Å; L238-L520 HydrophobicContact CD2-CB 4.4Å; L238-L520 HydrophobicContact CD2-CD1 4.4Å; V456-L520 HydrophobicContact CG1-CB 4.33Å; V456-L520 HydrophobicContact CG1-CD2 4.09Å; L517-L520 VanDerWaalsContact O-CB 3.3Å; L517-L520 WeakPolarHBondContact O-CB 3.43Å; L517-L520 PolarHBondContact O-N 2.99Å; Y518-L520 PolarHBondContact O-N 3.43Å; L520-Y522 PolarHBondContact O-N 3.29Å; L520-Y524 HydrophobicContact CD1-CD2 4.35Å; L520-Y524 HydrophobicContact CD1-CG 4.43Å; L520-F525 HydrophobicContact CB-CE1 4.4Å; L520-F525 HydrophobicContact CD2-CD1 4.16Å; L520-F525 HydrophobicContact CD2-CE1 4.4Å; L520-L528 HydrophobicContact CD2-CD2 4.1Å
521S88.6Confident81.9Confident5 Ų550.2 Ų50.24%0.03525%0.248CC..  trans-55135.9175.1-177.30000110.8P237 R239 R240 S519 L523 Y524P237-S521 PolarHBondContact O-N 3.38Å; P237-S521 VanDerWaalsContact O-N 3.07Å; R239-S521 WeakPolarHBondContact O-CB 3.4Å; R240-S521 PolarHBondContact O-OG 2.98Å; S519-S521 PolarHBondContact O-N 2.78Å; S521-L523 PolarHBondContact O-N 3.45Å; S521-L523 PolarHBondContact OG-N 3.45Å; S521-Y524 PolarHBondContact O-N 3.28Å
522Y87.8Confident84.3Confident9 Ų942.5 Ų42.54%0.03522%0.216CC..G310 helixtrans-57.3-21177.568.2-85.4000112.9R240 H241 Q411 I414 L520 Y524 F525R240-Y522 HydrophobicContact CG-CE1 4.15Å; H241-Y522 AromaticContact NE2-CE1 3.94Å; H241-Y522 AromaticContact NE2-CZ 3.9Å; H241-Y522 PolarHBondContact NE2-OH 2.94Å; Q411-Y522 HydrophobicContact CG-CD1 4.44Å; Q411-Y522 HydrophobicContact CG-CG 4.34Å; I414-Y522 HydrophobicContact CB-CD2 4.15Å; I414-Y522 HydrophobicContact CB-CE2 4.02Å; I414-Y522 HydrophobicContact CD1-CE2 4.05Å; I414-Y522 HydrophobicContact CG2-CD2 3.8Å; I414-Y522 HydrophobicContact CG2-CE2 3.69Å; L520-Y522 PolarHBondContact O-N 3.29Å; Y522-Y524 VanDerWaalsContact C-N 3.32Å; Y522-F525 WeakPolarHBondContact O-CG 3.5Å
523L90.8Very high86.5Confident0 Ų034.1 Ų34.10%019%0.185CC..G310 helixtrans-71.4-25.4174.6-58.9178.4000113.4Y88 L246 G249 I253 I414 S521 P527Y88-L523 HydrophobicContact CE1-CD2 4.47Å; Y88-L523 WeakPolarHBondContact OH-CD2 3.42Å; L246-L523 HydrophobicContact CD2-CD1 3.65Å; L246-L523 HydrophobicContact CG-CD1 4.18Å; G249-L523 CarbonylContact C-O 3.58Å; G249-L523 VanDerWaalsContact CA-O 3.26Å; G249-L523 WeakPolarHBondContact CA-O 3.45Å; I253-L523 HydrophobicContact CD1-CB 4.37Å; I253-L523 HydrophobicContact CD1-CD2 3.67Å; I414-L523 HydrophobicContact CG2-CD2 4.27Å; S521-L523 PolarHBondContact O-N 3.45Å; S521-L523 PolarHBondContact OG-N 3.45Å; L523-P527 VanDerWaalsContact O-CD 3.3Å; L523-P527 WeakPolarHBondContact O-CD 3.24Å
524Y93.7Very high88.4Confident31 Ų3130.3 Ų30.312%0.12216%0.16CC..G310 helixtrans-86.8-4.2178.6-80.8-57.8000114P237 W244 T245 I248 L520 S521 Y522 S526 P527 L528P237-Y524 HydrophobicContact CB-CD2 3.76Å; P237-Y524 HydrophobicContact CB-CE2 3.69Å; W244-Y524 PolarHBondContact O-OH 2.91Å; T245-Y524 HydrophobicContact CG2-CD2 4.08Å; T245-Y524 HydrophobicContact CG2-CE2 3.41Å; T245-Y524 VanDerWaalsContact CG2-CE2 3.41Å; I248-Y524 HydrophobicContact CB-CE1 4.38Å; I248-Y524 HydrophobicContact CG2-CE1 4.19Å; L520-Y524 HydrophobicContact CD1-CD2 4.35Å; L520-Y524 HydrophobicContact CD1-CG 4.43Å; S521-Y524 PolarHBondContact O-N 3.28Å; Y522-Y524 VanDerWaalsContact C-N 3.32Å; Y524-S526 VanDerWaalsContact C-N 3.28Å; Y524-S526 PolarHBondContact O-N 3.21Å; Y524-P527 HydrophobicContact CD1-CB 4.09Å; Y524-P527 HydrophobicContact CD1-CG 3.8Å; Y524-P527 HydrophobicContact CE1-CG 4.44Å; Y524-P527 WeakPolarHBondContact O-CD 3.35Å; Y524-L528 VanDerWaalsContact O-CB 3.24Å; Y524-L528 WeakPolarHBondContact O-CB 3.24Å; Y524-L528 PolarHBondContact O-N 3.29Å
525F93.7Very high90.1Very high1 Ų129.8 Ų29.80%0.00416%0.16CC..Hα-helixtrans-61.3-37.4174.5-62.4-12.8000112.5G418 I419 S453 V456 A460 L520 Y522 G529G418-F525 CarbonylContact O-C 3.43Å; I419-F525 HydrophobicContact CD1-CD2 4.33Å; I419-F525 HydrophobicContact CG1-CB 4.4Å; I419-F525 HydrophobicContact CG1-CD2 3.95Å; I419-F525 HydrophobicContact CG1-CG 4.46Å; S453-F525 PolarHBondContact OG-O 3.33Å; V456-F525 HydrophobicContact CG1-CD1 4.17Å; V456-F525 HydrophobicContact CG1-CE1 3.83Å; A460-F525 HydrophobicContact CB-CE1 4.44Å; A460-F525 HydrophobicContact CB-CZ 3.7Å; L520-F525 HydrophobicContact CB-CE1 4.4Å; L520-F525 HydrophobicContact CD2-CD1 4.16Å; L520-F525 HydrophobicContact CD2-CE1 4.4Å; Y522-F525 WeakPolarHBondContact O-CG 3.5Å; F525-G529 PolarHBondContact O-N 3.25Å; F525-G529 VanDerWaalsContact O-N 3.1Å
526S94.9Very high91.8Very high0 Ų028.8 Ų28.80%015%0.154CC..Hα-helixtrans-68.3-54.9176.6177.50000112.1F252 G418 G422 Y524 L528 G529 T530F252-S526 PolarHBondContact O-OG 3.34Å; G418-S526 VanDerWaalsContact O-CA 3.28Å; G418-S526 WeakPolarHBondContact O-CA 3.35Å; G418-S526 PolarHBondContact O-N 3.26Å; G422-S526 WeakPolarHBondContact CA-O 3.36Å; G422-S526 WeakPolarHBondContact CA-OG 3.31Å; Y524-S526 VanDerWaalsContact C-N 3.28Å; Y524-S526 PolarHBondContact O-N 3.21Å; S526-L528 VanDerWaalsContact C-N 3.3Å; S526-L528 PolarHBondContact O-N 2.85Å; S526-G529 PolarHBondContact O-N 2.88Å; S526-G529 VanDerWaalsContact O-N 3.17Å; S526-T530 WeakPolarHBondContact O-CB 3.43Å; S526-T530 PolarHBondContact O-N 3.4Å; S526-T530 PolarHBondContact O-OG1 3.01Å
527P96.1Very high93Very high6 Ų625.3 Ų25.34%0.03914%0.135CC..Hα-helixtrans-50.8-45.4172.1-2933.5000114F252 L523 Y524 G529 T530 I531F252-P527 HydrophobicContact CB-CG 3.65Å; F252-P527 HydrophobicContact CD1-CB 4.29Å; F252-P527 HydrophobicContact CD1-CG 4.23Å; F252-P527 HydrophobicContact CD2-CB 4.38Å; F252-P527 HydrophobicContact CD2-CG 3.88Å; F252-P527 HydrophobicContact CG-CB 4.18Å; F252-P527 HydrophobicContact CG-CG 3.67Å; L523-P527 VanDerWaalsContact O-CD 3.3Å; L523-P527 WeakPolarHBondContact O-CD 3.24Å; Y524-P527 HydrophobicContact CD1-CB 4.09Å; Y524-P527 HydrophobicContact CD1-CG 3.8Å; Y524-P527 HydrophobicContact CE1-CG 4.44Å; Y524-P527 WeakPolarHBondContact O-CD 3.35Å; P527-G529 PolarHBondContact O-N 3.26Å; P527-T530 PolarHBondContact O-N 2.85Å; P527-I531 WeakPolarHBondContact O-CB 3.4Å; P527-I531 VanDerWaalsContact O-CG1 3.23Å; P527-I531 WeakPolarHBondContact O-CG1 3.37Å; P527-I531 PolarHBondContact O-N 3.46Å
528L95.9Very high93.8Very high47 Ų4723.4 Ų23.425%0.24613%0.125CC..Hα-helixtrans-58-48.9178.9-177.568.5000111.3L452 V456 L520 Y524 S526 T532L452-L528 HydrophobicContact CD2-CD1 3.8Å; L452-L528 HydrophobicContact CD2-CD2 4.29Å; L452-L528 HydrophobicContact CD2-CG 3.91Å; L452-L528 HydrophobicContact CG-CD1 4.49Å; L452-L528 HydrophobicContact CG-CD2 4.1Å; L452-L528 HydrophobicContact CG-CG 4.22Å; V456-L528 HydrophobicContact CB-CD2 4.06Å; V456-L528 HydrophobicContact CG1-CD2 4.27Å; V456-L528 HydrophobicContact CG2-CD2 3.8Å; L520-L528 HydrophobicContact CD2-CD2 4.1Å; Y524-L528 VanDerWaalsContact O-CB 3.24Å; Y524-L528 WeakPolarHBondContact O-CB 3.24Å; Y524-L528 PolarHBondContact O-N 3.29Å; S526-L528 VanDerWaalsContact C-N 3.3Å; S526-L528 PolarHBondContact O-N 2.85Å; L528-T532 VanDerWaalsContact O-CB 3.26Å; L528-T532 WeakPolarHBondContact O-CB 3.28Å; L528-T532 PolarHBondContact O-N 3.16Å; L528-T532 VanDerWaalsContact O-N 3.09Å; L528-T532 PolarHBondContact O-OG1 3.3Å
529G96.6Very high94.5Very high0 Ų025.9 Ų25.90%014%0.143CC..Hα-helixtrans-65.9-43.4178.200000112.9S453 F525 S526 P527 A533S453-G529 WeakPolarHBondContact OG-CA 3.48Å; S453-G529 PolarHBondContact OG-N 3.48Å; F525-G529 PolarHBondContact O-N 3.25Å; F525-G529 VanDerWaalsContact O-N 3.1Å; S526-G529 PolarHBondContact O-N 2.88Å; S526-G529 VanDerWaalsContact O-N 3.17Å; P527-G529 PolarHBondContact O-N 3.26Å; G529-A533 VanDerWaalsContact O-CB 3.26Å; G529-A533 WeakPolarHBondContact O-CB 3.35Å; G529-A533 PolarHBondContact O-N 2.84Å
530T97.6Very high95.1Very high3 Ų326.8 Ų26.82%0.01815%0.148CC..Hα-helixtrans-63.9-49.8179.5-59.10000111.8F252 G422 L425 S526 P527 T532 A533 I534F252-T530 HydrophobicContact CD1-CG2 3.95Å; F252-T530 HydrophobicContact CE1-CG2 3.67Å; G422-T530 WeakPolarHBondContact CA-OG1 3.5Å; G422-T530 VanDerWaalsContact O-CA 3.32Å; G422-T530 WeakPolarHBondContact O-CA 3.39Å; G422-T530 PolarHBondContact O-N 3.44Å; G422-T530 PolarHBondContact O-OG1 3.31Å; L425-T530 HydrophobicContact CD2-CG2 4.28Å; L425-T530 HydrophobicContact CG-CG2 4.16Å; S526-T530 WeakPolarHBondContact O-CB 3.43Å; S526-T530 PolarHBondContact O-N 3.4Å; S526-T530 PolarHBondContact O-OG1 3.01Å; P527-T530 PolarHBondContact O-N 2.85Å; T530-T532 VanDerWaalsContact C-N 3.35Å; T530-T532 PolarHBondContact O-N 3.42Å; T530-A533 PolarHBondContact O-N 3.02Å; T530-I534 HydrophobicContact CG2-CD1 3.85Å; T530-I534 VanDerWaalsContact O-CG1 3.32Å; T530-I534 WeakPolarHBondContact O-CG1 3.3Å; T530-I534 PolarHBondContact O-N 2.82Å
531I97.4Very high95.5Very high93 Ų9325.5 Ų25.548%0.47714%0.141SC..Hα-helixtrans-64.1-43.4-179-67.7167.6000110P527 A533 I534 T535P527-I531 WeakPolarHBondContact O-CB 3.4Å; P527-I531 VanDerWaalsContact O-CG1 3.23Å; P527-I531 WeakPolarHBondContact O-CG1 3.37Å; P527-I531 PolarHBondContact O-N 3.46Å; I531-A533 PolarHBondContact O-N 2.92Å; I531-I534 PolarHBondContact O-N 3.47Å; I531-T535 HydrophobicContact CG2-CG2 4.11Å; I531-T535 WeakPolarHBondContact O-CB 3.48Å; I531-T535 VanDerWaalsContact O-CG2 3.24Å; I531-T535 WeakPolarHBondContact O-CG2 3.45Å; I531-T535 PolarHBondContact O-N 2.86Å; I531-T535 PolarHBondContact O-OG1 3.46Å
532T97.8Very high95.7Very high23 Ų2328.4 Ų28.414%0.14116%0.156CC..Hα-helixtrans-62.7-44.3177.8-56.80000111.3L452 L528 T530 I534 T535 V536L452-T532 HydrophobicContact CD2-CG2 4.03Å; L452-T532 VanDerWaalsContact CD2-OG1 3.29Å; L452-T532 WeakPolarHBondContact CD2-OG1 3.45Å; L528-T532 VanDerWaalsContact O-CB 3.26Å; L528-T532 WeakPolarHBondContact O-CB 3.28Å; L528-T532 PolarHBondContact O-N 3.16Å; L528-T532 VanDerWaalsContact O-N 3.09Å; L528-T532 PolarHBondContact O-OG1 3.3Å; T530-T532 VanDerWaalsContact C-N 3.35Å; T530-T532 PolarHBondContact O-N 3.42Å; T532-I534 PolarHBondContact O-N 3.45Å; T532-T535 WeakPolarHBondContact CA-OG1 3.47Å; T532-T535 PolarHBondContact O-N 3.49Å; T532-T535 PolarHBondContact O-OG1 3.09Å; T532-T535 VanDerWaalsContact O-OG1 3.09Å; T532-V536 HydrophobicContact CG2-CG2 4.21Å; T532-V536 WeakPolarHBondContact O-CB 2.85Å; T532-V536 WeakPolarHBondContact O-CG2 3.34Å; T532-V536 PolarHBondContact O-N 3.15Å
533A97.8Very high96.1Very high1 Ų134.5 Ų34.51%0.00819%0.188CC..Hα-helixtrans-63.8-41.6178.500000112.6G445 G529 T530 I531 G537G445-A533 WeakPolarHBondContact CA-O 3.45Å; G445-A533 VanDerWaalsContact O-CA 3.27Å; G445-A533 WeakPolarHBondContact O-CA 3.25Å; G445-A533 WeakPolarHBondContact O-CB 3.34Å; G529-A533 VanDerWaalsContact O-CB 3.26Å; G529-A533 WeakPolarHBondContact O-CB 3.35Å; G529-A533 PolarHBondContact O-N 2.84Å; T530-A533 PolarHBondContact O-N 3.02Å; I531-A533 PolarHBondContact O-N 2.92Å; A533-G537 WeakPolarHBondContact O-CA 3.49Å; A533-G537 PolarHBondContact O-N 3.39Å
534I97.8Very high96.2Very high38 Ų3837.2 Ų37.220%0.19521%0.205CC..Hα-helixtrans-67.5-48.2177.4-68168.8000110.8T429 T530 I531 T532 G537 L538T429-I534 HydrophobicContact CG2-CD1 3.81Å; T530-I534 HydrophobicContact CG2-CD1 3.85Å; T530-I534 VanDerWaalsContact O-CG1 3.32Å; T530-I534 WeakPolarHBondContact O-CG1 3.3Å; T530-I534 PolarHBondContact O-N 2.82Å; I531-I534 PolarHBondContact O-N 3.47Å; T532-I534 PolarHBondContact O-N 3.45Å; I534-G537 PolarHBondContact O-N 3.49Å; I534-L538 HydrophobicContact CG2-CD1 3.82Å; I534-L538 HydrophobicContact CG2-CG 4.4Å; I534-L538 WeakPolarHBondContact O-CB 3.35Å; I534-L538 VanDerWaalsContact O-CG 3.27Å; I534-L538 WeakPolarHBondContact O-CG 3.3Å; I534-L538 PolarHBondContact O-N 2.94Å
535T97.6Very high95.9Very high69 Ų6937.5 Ų37.542%0.42322%0.218SC..Hα-helixtrans-65.4-54.1-175.650.20000111.8I531 T532 G537 L538 V539I531-T535 HydrophobicContact CG2-CG2 4.11Å; I531-T535 WeakPolarHBondContact O-CB 3.48Å; I531-T535 VanDerWaalsContact O-CG2 3.24Å; I531-T535 WeakPolarHBondContact O-CG2 3.45Å; I531-T535 PolarHBondContact O-N 2.86Å; I531-T535 PolarHBondContact O-OG1 3.46Å; T532-T535 WeakPolarHBondContact CA-OG1 3.47Å; T532-T535 PolarHBondContact O-N 3.49Å; T532-T535 PolarHBondContact O-OG1 3.09Å; T532-T535 VanDerWaalsContact O-OG1 3.09Å; T535-G537 VanDerWaalsContact C-N 3.29Å; T535-G537 PolarHBondContact O-N 3.47Å; T535-L538 PolarHBondContact O-N 2.92Å; T535-V539 WeakPolarHBondContact O-CG2 3.28Å; T535-V539 PolarHBondContact O-N 3.1Å
536V98Very high95.5Very high43 Ų4337.6 Ų37.626%0.26122%0.219SC..Hα-helixtrans-61.9-41.7176.6176.30000110.3T532 L538 V539 V540T532-V536 HydrophobicContact CG2-CG2 4.21Å; T532-V536 WeakPolarHBondContact O-CB 2.85Å; T532-V536 WeakPolarHBondContact O-CG2 3.34Å; T532-V536 PolarHBondContact O-N 3.15Å; V536-L538 PolarHBondContact O-N 3.15Å; V536-V539 PolarHBondContact O-N 3.04Å; V536-V540 HydrophobicContact CG1-CG2 4.13Å; V536-V540 WeakPolarHBondContact O-CB 3.37Å; V536-V540 WeakPolarHBondContact O-CG2 3.42Å; V536-V540 PolarHBondContact O-N 2.87Å
537G97.3Very high94.9Very high0 Ų045 Ų450%025%0.248CC..Hα-helixtrans-63.4-39.4-179.900000113.5G441 A533 I534 T535 S541G441-G537 WeakPolarHBondContact CA-O 3.45Å; G441-G537 WeakPolarHBondContact O-CA 3.47Å; A533-G537 WeakPolarHBondContact O-CA 3.49Å; A533-G537 PolarHBondContact O-N 3.39Å; I534-G537 PolarHBondContact O-N 3.49Å; T535-G537 VanDerWaalsContact C-N 3.29Å; T535-G537 PolarHBondContact O-N 3.47Å; G537-S541 WeakPolarHBondContact O-CB 3.43Å; G537-S541 PolarHBondContact O-N 3.38Å; G537-S541 PolarHBondContact O-OG 3.1Å
538L95.8Very high94.1Very high48 Ų4851.7 Ų51.725%0.25128%0.283SS..Hα-helixtrans-67.1-48.2174.1-78.4172.7000112L430 C434 I534 T535 V536 V540 S541 I542L430-L538 HydrophobicContact CD1-CD2 3.64Å; L430-L538 HydrophobicContact CD1-CG 3.58Å; C434-L538 HydrophobicContact CB-CD2 3.81Å; I534-L538 HydrophobicContact CG2-CD1 3.82Å; I534-L538 HydrophobicContact CG2-CG 4.4Å; I534-L538 WeakPolarHBondContact O-CB 3.35Å; I534-L538 VanDerWaalsContact O-CG 3.27Å; I534-L538 WeakPolarHBondContact O-CG 3.3Å; I534-L538 PolarHBondContact O-N 2.94Å; T535-L538 PolarHBondContact O-N 2.92Å; V536-L538 PolarHBondContact O-N 3.15Å; L538-V540 PolarHBondContact O-N 3.19Å; L538-S541 PolarHBondContact O-N 3.19Å; L538-I542 WeakPolarHBondContact O-CB 3.38Å; L538-I542 WeakPolarHBondContact O-CG1 3.21Å; L538-I542 PolarHBondContact O-N 3.39Å
539V96.9Very high93.5Very high84 Ų8453.1 Ų53.151%0.50929%0.29SS..Hα-helixtrans-58.6-50.8179.8170.60000110.4T535 V536 S541 I542 L543T535-V539 WeakPolarHBondContact O-CG2 3.28Å; T535-V539 PolarHBondContact O-N 3.1Å; V536-V539 PolarHBondContact O-N 3.04Å; V539-S541 VanDerWaalsContact C-N 3.33Å; V539-S541 PolarHBondContact O-N 3.21Å; V539-I542 PolarHBondContact O-N 3.3Å; V539-L543 HydrophobicContact CG1-CD1 3.91Å; V539-L543 HydrophobicContact CG1-CG 4.49Å; V539-L543 VanDerWaalsContact O-CG 3.29Å; V539-L543 WeakPolarHBondContact O-CG 3.36Å; V539-L543 PolarHBondContact O-N 3.38Å
540V96.9Very high92.8Very high34 Ų3463 Ų6321%0.20633%0.334CS..Hα-helixtrans-65-38.4178.9174.60000111.2V536 L538 I542 L543 T544V536-V540 HydrophobicContact CG1-CG2 4.13Å; V536-V540 WeakPolarHBondContact O-CB 3.37Å; V536-V540 WeakPolarHBondContact O-CG2 3.42Å; V536-V540 PolarHBondContact O-N 2.87Å; L538-V540 PolarHBondContact O-N 3.19Å; V540-I542 VanDerWaalsContact C-N 3.34Å; V540-I542 PolarHBondContact O-N 3.15Å; V540-L543 PolarHBondContact O-N 3.28Å; V540-T544 HydrophobicContact CG1-CG2 4.13Å; V540-T544 WeakPolarHBondContact O-CB 3.24Å; V540-T544 WeakPolarHBondContact O-CG2 3.41Å; V540-T544 PolarHBondContact O-N 2.66Å; V540-T544 PolarHBondContact O-OG1 3.4Å
541S95.8Very high92.1Very high0 Ų064.5 Ų64.50%034%0.343CS..Hα-helixtrans-61.8-43.2176.6-64.10000111.9L436 A437 N438 G441 G537 L538 V539 T544 G545 G546L436-S541 WeakPolarHBondContact O-CB 3.41Å; A437-S541 WeakPolarHBondContact CA-OG 3.45Å; N438-S541 PolarHBondContact N-OG 2.91Å; N438-S541 PolarHBondContact ND2-O 3.24Å; G441-S541 WeakPolarHBondContact CA-OG 3.21Å; G537-S541 WeakPolarHBondContact O-CB 3.43Å; G537-S541 PolarHBondContact O-N 3.38Å; G537-S541 PolarHBondContact O-OG 3.1Å; L538-S541 PolarHBondContact O-N 3.19Å; V539-S541 VanDerWaalsContact C-N 3.33Å; V539-S541 PolarHBondContact O-N 3.21Å; S541-T544 PolarHBondContact O-N 2.86Å; S541-G545 PolarHBondContact O-N 2.97Å; S541-G546 WeakPolarHBondContact O-CA 3.46Å; S541-G546 PolarHBondContact O-N 2.8Å
542I94.6Very high91.4Very high66 Ų6666.1 Ų66.134%0.33835%0.348SS..Hα-helixtrans-60.9-49.2175.9-74.2164.6000110.4L538 V539 V540 T544 G545 Y547L538-I542 WeakPolarHBondContact O-CB 3.38Å; L538-I542 WeakPolarHBondContact O-CG1 3.21Å; L538-I542 PolarHBondContact O-N 3.39Å; V539-I542 PolarHBondContact O-N 3.3Å; V540-I542 VanDerWaalsContact C-N 3.34Å; V540-I542 PolarHBondContact O-N 3.15Å; I542-T544 PolarHBondContact O-N 3.37Å; I542-G545 PolarHBondContact O-N 3.02Å; I542-Y547 HydrophobicContact CB-CE2 4.42Å; I542-Y547 HydrophobicContact CG1-CE2 4.22Å; I542-Y547 HydrophobicContact CG2-CE2 3.78Å
543L94.9Very high90.5Very high137 Ų13768.7 Ų68.772%0.71737%0.365SS*.Hα-helixtrans-65.7-26.2-179.1-67.2174.6000113.4V539 V540V539-L543 HydrophobicContact CG1-CD1 3.91Å; V539-L543 HydrophobicContact CG1-CG 4.49Å; V539-L543 VanDerWaalsContact O-CG 3.29Å; V539-L543 WeakPolarHBondContact O-CG 3.36Å; V539-L543 PolarHBondContact O-N 3.38Å; V540-L543 PolarHBondContact O-N 3.28Å
544T93.4Very high89.7Confident58 Ų5870.5 Ų70.536%0.35638%0.377SS..THydrogen-bonded Turntrans-102.318.4-177.757.70000113.6N438 K440 V540 S541 I542N438-T544 PolarHBondContact ND2-O 3.28Å; N438-T544 PolarHBondContact ND2-OG1 3.43Å; N438-T544 PolarHBondContact OD1-OG1 3.49Å; K440-T544 HydrophobicContact CB-CG2 4.5Å; K440-T544 HydrophobicContact CD-CG2 4.07Å; V540-T544 HydrophobicContact CG1-CG2 4.13Å; V540-T544 WeakPolarHBondContact O-CB 3.24Å; V540-T544 WeakPolarHBondContact O-CG2 3.41Å; V540-T544 PolarHBondContact O-N 2.66Å; V540-T544 PolarHBondContact O-OG1 3.4Å; S541-T544 PolarHBondContact O-N 2.86Å; I542-T544 PolarHBondContact O-N 3.37Å
545G87.8Confident88.9Confident37 Ų3769.2 Ų69.238%0.38137%0.371SS..THydrogen-bonded Turntrans93.923.4169.300000115.8S541 I542 Y547 N548S541-G545 PolarHBondContact O-N 2.97Å; I542-G545 PolarHBondContact O-N 3.02Å; G545-Y547 PolarHBondContact O-N 3.45Å; G545-Y547 VanDerWaalsContact O-N 3.14Å; G545-N548 PolarHBondContact O-N 3.45Å; G545-N548 VanDerWaalsContact O-N 3.13Å
546G85.3Confident88.4Confident2 Ų267.3 Ų67.32%0.02136%0.358CS..G310 helixtrans-56.9-24.4179.100000115.2L436 S541 N548 L549L436-G546 VanDerWaalsContact O-CA 3.3Å; L436-G546 WeakPolarHBondContact O-CA 3.39Å; S541-G546 WeakPolarHBondContact O-CA 3.46Å; S541-G546 PolarHBondContact O-N 2.8Å; G546-N548 PolarHBondContact O-N 3.26Å; G546-L549 VanDerWaalsContact O-CB 3.29Å; G546-L549 WeakPolarHBondContact O-CB 3.46Å; G546-L549 PolarHBondContact O-N 3.02Å
547Y81.7Confident87.8Confident157 Ų15767.1 Ų67.162%0.61636%0.355SS*.G310 helixtrans-62.8-25.8175.8-75.2-74000114.2L436 I542 G545 L549L436-Y547 HydrophobicContact CD1-CE1 4.4Å; L436-Y547 HydrophobicContact CD2-CD1 3.6Å; L436-Y547 HydrophobicContact CD2-CE1 3.92Å; L436-Y547 HydrophobicContact CD2-CG 4.16Å; I542-Y547 HydrophobicContact CB-CE2 4.42Å; I542-Y547 HydrophobicContact CG1-CE2 4.22Å; I542-Y547 HydrophobicContact CG2-CE2 3.78Å; G545-Y547 PolarHBondContact O-N 3.45Å; G545-Y547 VanDerWaalsContact O-N 3.14Å; Y547-L549 VanDerWaalsContact C-N 3.34Å
548N79.2Confident87Confident146 Ų14671 Ų7178%0.78137%0.372SS*.G310 helixtrans-92.93.7-179.2-66-26.6000112.7G545 G546 K550G545-N548 PolarHBondContact O-N 3.45Å; G545-N548 VanDerWaalsContact O-N 3.13Å; G546-N548 PolarHBondContact O-N 3.26Å; N548-K550 PolarHBondContact O-N 3.01Å
549L83.8Confident85.8Confident76 Ų7676.9 Ų76.940%0.39840%0.396SS..  trans-78.4122.1-174.9-161.475.3000110.9A437 N438 G546 Y547 V551A437-L549 WeakPolarHBondContact O-CD2 3.36Å; N438-L549 HydrophobicContact CB-CD2 4.35Å; G546-L549 VanDerWaalsContact O-CB 3.29Å; G546-L549 WeakPolarHBondContact O-CB 3.46Å; G546-L549 PolarHBondContact O-N 3.02Å; Y547-L549 VanDerWaalsContact C-N 3.34Å; L549-V551 HydrophobicContact CD2-CG2 3.5Å; L549-V551 HydrophobicContact CG-CG2 3.85Å
550K80.7Confident84.4Confident209 Ų20978.5 Ų78.591%0.90940%0.398SS*.  trans-94.8107.5168.6-66.3-177.3-178.1178.80108.6N548N548-K550 PolarHBondContact O-N 3.01Å
551V83Confident83.2Confident34 Ų3477.7 Ų77.721%0.20639%0.392CS..  trans-100.8138.2179.2-174.30000109.7L549 L555 I556L549-V551 HydrophobicContact CD2-CG2 3.5Å; L549-V551 HydrophobicContact CG-CG2 3.85Å; V551-L555 HydrophobicContact CG1-CB 4.34Å; V551-I556 HydrophobicContact CB-CD1 3.85Å; V551-I556 HydrophobicContact CG1-CD1 3.67Å; V551-I556 HydrophobicContact CG1-CG1 3.92Å
552E82.5Confident82.3Confident127 Ų12779 Ų7959%0.59340%0.4SS*.  trans-62.3128.3175.3-161.3-173.7146.300110.2S554 L555E552-S554 WeakPolarHBondContact CG-OG 3.32Å; E552-S554 PolarHBondContact O-N 3.49Å; E552-S554 PolarHBondContact OE1-OG 3.2Å; E552-L555 HydrophobicContact CB-CD1 3.98Å; E552-L555 HydrophobicContact CB-CG 4.25Å; E552-L555 PolarHBondContact O-N 3.35Å
553P80.1Confident81.2Confident77 Ų7778.3 Ų78.350%0.540%0.399SS..G310 helixtrans-62.1-18.4-174.8-25.734.7000114.8L555 K558P553-L555 VanDerWaalsContact C-N 3.28Å; P553-K558 WeakPolarHBondContact O-CE 3.5Å
554S80Confident80Confident38 Ų3876.8 Ų76.827%0.26639%0.391SS..G310 helixtrans-70.8-20.7176.954.80000113.4E552E552-S554 WeakPolarHBondContact CG-OG 3.32Å; E552-S554 PolarHBondContact O-N 3.49Å; E552-S554 PolarHBondContact OE1-OG 3.2Å
555L82.8Confident78.7Confident12 Ų1277.9 Ų77.96%0.06339%0.389CS..G310 helixtrans-92.3-1.5-176.7-59.1172.6000113.5L110 Y118 L121 V551 E552 P553L110-L555 HydrophobicContact CD1-CD2 3.95Å; L110-L555 HydrophobicContact CD2-CD2 3.82Å; Y118-L555 HydrophobicContact CE2-CB 4.41Å; Y118-L555 HydrophobicContact CE2-CD2 4.5Å; Y118-L555 WeakPolarHBondContact CE2-O 3.24Å; Y118-L555 PolarHBondContact OH-O 3.36Å; L121-L555 HydrophobicContact CB-CD1 4.39Å; L121-L555 HydrophobicContact CB-CD2 3.71Å; L121-L555 HydrophobicContact CD1-CD2 4.3Å; L121-L555 WeakPolarHBondContact O-CD1 3.41Å; V551-L555 HydrophobicContact CG1-CB 4.34Å; E552-L555 HydrophobicContact CB-CD1 3.98Å; E552-L555 HydrophobicContact CB-CG 4.25Å; E552-L555 PolarHBondContact O-N 3.35Å; P553-L555 VanDerWaalsContact C-N 3.28Å
556I86.4Confident77.6Confident29 Ų2980.8 Ų80.815%0.14939%0.392CS..SBendtrans-123.7147.2-177.1-60.8-179.3000108.3I432 P435 V551 K558I432-I556 WeakPolarHBondContact O-CG2 3.37Å; P435-I556 HydrophobicContact CB-CD1 3.8Å; V551-I556 HydrophobicContact CB-CD1 3.85Å; V551-I556 HydrophobicContact CG1-CD1 3.67Å; V551-I556 HydrophobicContact CG1-CG1 3.92Å; I556-K558 PolarHBondContact O-N 2.73Å
557L86.1Confident76.9Confident39 Ų3987.7 Ų87.720%0.20442%0.422CS..  trans-63.2118.9173.4-17767.8000110.9E101 V102 I432 L433 D561E101-L557 WeakPolarHBondContact O-CD1 3.3Å; V102-L557 HydrophobicContact CB-CD2 4.36Å; V102-L557 HydrophobicContact CG1-CD2 4.27Å; V102-L557 HydrophobicContact CG2-CD2 4.11Å; I432-L557 HydrophobicContact CG2-CB 3.87Å; I432-L557 PolarHBondContact O-N 3.14Å; I432-L557 VanDerWaalsContact O-N 3.09Å; L433-L557 HydrophobicContact CD2-CB 4.23Å; L433-L557 HydrophobicContact CD2-CD2 3.89Å; L557-D561 HydrophobicContact CD1-CB 4.14Å
558K78.9Confident76.3Confident81 Ų8184.7 Ų84.735%0.35242%0.416SS..  trans-92152.1171.3-60.8-176.1-175.4-177.10111.2P553 I556 E560 D561P553-K558 WeakPolarHBondContact O-CE 3.5Å; I556-K558 PolarHBondContact O-N 2.73Å; K558-E560 PolarHBondContact O-N 2.95Å; K558-D561 PolarHBondContact N-OD2 3Å; K558-D561 WeakPolarHBondContact O-CB 3.34Å; K558-D561 PolarHBondContact O-N 3.49Å
559K71.6Confident75.9Confident172 Ų17282.3 Ų82.375%0.74840%0.398SS*.G310 helixtrans-54.6-38.4171.5-68.1-176.1179.3-179.80111.6D561 T562 Y565K559-D561 PolarHBondContact O-N 2.95Å; K559-D561 VanDerWaalsContact O-N 3.15Å; K559-T562 PolarHBondContact O-N 3.42Å; K559-T562 PolarHBondContact O-OG1 2.69Å; K559-Y565 HydrophobicContact CB-CD2 4.37Å; K559-Y565 WeakPolarHBondContact O-CB 3.38Å
560E67.6Low75.2Confident117 Ų11782.1 Ų82.155%0.54740%0.401SS..G310 helixtrans-62.9-17.9179.6-61.1177.6174.600113.8K558 Y565 H566K558-E560 PolarHBondContact O-N 2.95Å; E560-Y565 HydrophobicContact CB-CD1 4.46Å; E560-Y565 HydrophobicContact CB-CE1 4.36Å; E560-Y565 HydrophobicContact CG-CD1 4.47Å; E560-Y565 HydrophobicContact CG-CE1 3.95Å; E560-H566 PolarHBondContact O-CD2 2.91Å; E560-H566 PolarHBondContact O-NE2 3.13Å
561D71.5Confident74.7Confident18 Ų1877.8 Ų77.810%0.09638%0.382CS..G310 helixtrans-88.1-15.9-173.6-59.1-11.1000112.2P105 K109 R278 L557 K558 K559P105-D561 HydrophobicContact CB-CB 3.95Å; K109-D561 IonicContact NZ-OD1 3.75Å; K109-D561 PolarHBondContact NZ-OD1 2.93Å; K109-D561 IonicContact NZ-OD2 3.95Å; K109-D561 PolarHBondContact NZ-OD2 3.37Å; R278-D561 PolarHBondContact NH2-O 3.42Å; L557-D561 HydrophobicContact CD1-CB 4.14Å; K558-D561 PolarHBondContact N-OD2 3Å; K558-D561 WeakPolarHBondContact O-CB 3.34Å; K558-D561 PolarHBondContact O-N 3.49Å; K559-D561 PolarHBondContact O-N 2.95Å; K559-D561 VanDerWaalsContact O-N 3.15Å
562T76.8Confident74Confident27 Ų2779.8 Ų79.817%0.16640%0.395CS..SBendtrans-82.4137.8-178.966.40000111.1E101 K559 I564 Y565 H566E101-T562 VanDerWaalsContact OE2-CA 3.26Å; E101-T562 WeakPolarHBondContact OE2-CA 3.41Å; E101-T562 WeakPolarHBondContact OE2-CB 3.45Å; K559-T562 PolarHBondContact O-N 3.42Å; K559-T562 PolarHBondContact O-OG1 2.69Å; T562-I564 PolarHBondContact O-N 2.71Å; T562-Y565 PolarHBondContact O-N 3.25Å; T562-Y565 VanDerWaalsContact OG1-CB 3.23Å; T562-Y565 WeakPolarHBondContact OG1-CB 3.3Å; T562-Y565 PolarHBondContact OG1-N 2.83Å; T562-H566 PolarHBondContact O-N 2.8Å
563T70.3Confident72.9Confident52 Ų5275.2 Ų75.232%0.31938%0.381SS..Hα-helixtrans-63.9-31.6174.262.20000111E101 R278 Y565 H566 F567E101-T563 WeakPolarHBondContact OE1-CB 3.32Å; E101-T563 WeakPolarHBondContact OE1-CG2 3.32Å; E101-T563 PolarHBondContact OE1-OG1 2.86Å; E101-T563 PolarHBondContact OE2-N 3.44Å; E101-T563 PolarHBondContact OE2-OG1 3.36Å; E101-T563 VanDerWaalsContact OE2-OG1 3.13Å; R278-T563 VanDerWaalsContact CZ-CG2 3.44Å; T563-Y565 VanDerWaalsContact C-N 3.33Å; T563-Y565 PolarHBondContact O-N 3.06Å; T563-H566 PolarHBondContact O-N 3.12Å; T563-F567 WeakPolarHBondContact O-CB 3.37Å; T563-F567 PolarHBondContact O-N 2.86Å
564I69.7Low72.2Confident105 Ų10579.8 Ų79.854%0.53839%0.389SS..Hα-helixtrans-57.8-46174.5-63.9173.6000110.3T562 F567 I568T562-I564 PolarHBondContact O-N 2.71Å; I564-F567 PolarHBondContact O-N 3.46Å; I564-I568 HydrophobicContact CG2-CD1 3.61Å; I564-I568 HydrophobicContact CG2-CG1 4.32Å; I564-I568 WeakPolarHBondContact O-CB 3.33Å; I564-I568 VanDerWaalsContact O-CG1 3.22Å; I564-I568 WeakPolarHBondContact O-CG1 3.36Å; I564-I568 PolarHBondContact O-N 3.36Å
565Y67.6Low71.4Confident81 Ų8182.2 Ų82.232%0.31840%0.398SS..Hα-helixtrans-64.2-43.5177.2178.3-96000112.3K559 E560 T562 T563 K569K559-Y565 HydrophobicContact CB-CD2 4.37Å; K559-Y565 WeakPolarHBondContact O-CB 3.38Å; E560-Y565 HydrophobicContact CB-CD1 4.46Å; E560-Y565 HydrophobicContact CB-CE1 4.36Å; E560-Y565 HydrophobicContact CG-CD1 4.47Å; E560-Y565 HydrophobicContact CG-CE1 3.95Å; T562-Y565 PolarHBondContact O-N 3.25Å; T562-Y565 VanDerWaalsContact OG1-CB 3.23Å; T562-Y565 WeakPolarHBondContact OG1-CB 3.3Å; T562-Y565 PolarHBondContact OG1-N 2.83Å; T563-Y565 VanDerWaalsContact C-N 3.33Å; T563-Y565 PolarHBondContact O-N 3.06Å; Y565-K569 HydrophobicContact CE1-CD 3.96Å; Y565-K569 WeakPolarHBondContact O-CB 3.44Å; Y565-K569 PolarHBondContact O-N 3.3Å
566H65.3Low70.2Confident97 Ų9787.8 Ų87.845%0.44942%0.421SS..Hα-helixtrans-63.5-40.9175.6-88.1-76.2000112.5E560 T562 T563 T570E560-H566 PolarHBondContact O-CD2 2.91Å; E560-H566 PolarHBondContact O-NE2 3.13Å; T562-H566 PolarHBondContact O-N 2.8Å; T563-H566 PolarHBondContact O-N 3.12Å; H566-T570 VanDerWaalsContact O-CB 3.28Å; H566-T570 WeakPolarHBondContact O-CB 3.31Å; H566-T570 PolarHBondContact O-N 2.87Å; H566-T570 PolarHBondContact O-OG1 3.3Å
567F68.6Low68.7Low148 Ų14893.7 Ų93.765%0.64944%0.442SS*.Hα-helixtrans-65.1-49177.7-174.5-98.3000111.1T563 I564 T570 F571T563-F567 WeakPolarHBondContact O-CB 3.37Å; T563-F567 PolarHBondContact O-N 2.86Å; I564-F567 PolarHBondContact O-N 3.46Å; F567-T570 PolarHBondContact O-N 3.32Å; F567-F571 VanDerWaalsContact O-CB 3.3Å; F567-F571 WeakPolarHBondContact O-CB 3.42Å; F567-F571 PolarHBondContact O-N 2.95Å
568I70.2Confident67.3Low93 Ų93103.2 Ų103.248%0.47748%0.475SS..Hα-helixtrans-60-48.3175.8-68.3170.9000110.2I564 T570 F571 T572I564-I568 HydrophobicContact CG2-CD1 3.61Å; I564-I568 HydrophobicContact CG2-CG1 4.32Å; I564-I568 WeakPolarHBondContact O-CB 3.33Å; I564-I568 VanDerWaalsContact O-CG1 3.22Å; I564-I568 WeakPolarHBondContact O-CG1 3.36Å; I564-I568 PolarHBondContact O-N 3.36Å; I568-T570 VanDerWaalsContact C-N 3.31Å; I568-T570 PolarHBondContact O-N 3.44Å; I568-F571 PolarHBondContact O-N 3.37Å; I568-T572 WeakPolarHBondContact O-CB 3.34Å; I568-T572 PolarHBondContact O-N 2.92Å; I568-T572 PolarHBondContact O-OG1 2.81Å
569K70.7Confident66.2Low96 Ų96103.9 Ų103.942%0.41749%0.49SS..Hα-helixtrans-60.3-40178.2-175.4178.1178.6-179.30112.2Y565 G573Y565-K569 HydrophobicContact CE1-CD 3.96Å; Y565-K569 WeakPolarHBondContact O-CB 3.44Å; Y565-K569 PolarHBondContact O-N 3.3Å; K569-G573 WeakPolarHBondContact O-CA 3.16Å; K569-G573 PolarHBondContact O-N 3.15Å
570T69.6Low65.2Low73 Ų7398.5 Ų98.545%0.44848%0.484SS..Hα-helixtrans-70.3-39.6177.6-530000111.2H566 F567 I568 G573 R574H566-T570 VanDerWaalsContact O-CB 3.28Å; H566-T570 WeakPolarHBondContact O-CB 3.31Å; H566-T570 PolarHBondContact O-N 2.87Å; H566-T570 PolarHBondContact O-OG1 3.3Å; F567-T570 PolarHBondContact O-N 3.32Å; I568-T570 VanDerWaalsContact C-N 3.31Å; I568-T570 PolarHBondContact O-N 3.44Å; T570-G573 PolarHBondContact O-N 2.87Å; T570-R574 WeakPolarHBondContact O-CB 3.25Å; T570-R574 WeakPolarHBondContact O-CG 3.5Å; T570-R574 PolarHBondContact O-N 3.11Å
571F70.1Confident64.4Low117 Ų117100.3 Ų100.351%0.51349%0.492SS..Hα-helixtrans-68.8-47.9177.5-169.1-102.7000111.5F567 I568 G573 R574 I575F567-F571 VanDerWaalsContact O-CB 3.3Å; F567-F571 WeakPolarHBondContact O-CB 3.42Å; F567-F571 PolarHBondContact O-N 2.95Å; I568-F571 PolarHBondContact O-N 3.37Å; F571-G573 VanDerWaalsContact C-N 3.28Å; F571-G573 PolarHBondContact O-N 2.98Å; F571-R574 WeakPolarHBondContact O-CB 3.26Å; F571-R574 PolarHBondContact O-N 3.31Å; F571-R574 VanDerWaalsContact O-N 3.14Å; F571-I575 HydrophobicContact CD1-CD1 3.64Å; F571-I575 HydrophobicContact CD1-CG1 4.49Å; F571-I575 HydrophobicContact CE1-CD1 3.4Å; F571-I575 HydrophobicContact CE1-CG1 4.35Å; F571-I575 HydrophobicContact CZ-CD1 4.14Å; F571-I575 WeakPolarHBondContact O-CG1 3.42Å; F571-I575 PolarHBondContact O-N 3.26Å
572T67.6Low63Low77 Ų77104.7 Ų104.747%0.47251%0.514SS..Hα-helixtrans-60.6-38.4171.5-540000111.1I568 I575 K576I568-T572 WeakPolarHBondContact O-CB 3.34Å; I568-T572 PolarHBondContact O-N 2.92Å; I568-T572 PolarHBondContact O-OG1 2.81Å; T572-I575 PolarHBondContact O-N 3.34Å; T572-K576 VanDerWaalsContact O-CB 3.25Å; T572-K576 WeakPolarHBondContact O-CB 3.36Å; T572-K576 PolarHBondContact O-N 3.06Å
573G59.6Low61.6Low31 Ų31109.9 Ų109.932%0.3254%0.541SS..Hα-helixtrans-64.1-39.1173.400000113K569 T570 F571 K576 R577K569-G573 WeakPolarHBondContact O-CA 3.16Å; K569-G573 PolarHBondContact O-N 3.15Å; T570-G573 PolarHBondContact O-N 2.87Å; F571-G573 VanDerWaalsContact C-N 3.28Å; F571-G573 PolarHBondContact O-N 2.98Å; G573-K576 PolarHBondContact O-N 3Å; G573-R577 WeakPolarHBondContact O-CB 3.36Å; G573-R577 PolarHBondContact O-N 3.32Å
574R65.6Low60.4Low172 Ų172113.9 Ų113.965%0.64956%0.56SS**Hα-helixtrans-67.4-39.1172.9-78.5179.3178.1-177.3-0.1112.2T570 F571 R578T570-R574 WeakPolarHBondContact O-CB 3.25Å; T570-R574 WeakPolarHBondContact O-CG 3.5Å; T570-R574 PolarHBondContact O-N 3.11Å; F571-R574 WeakPolarHBondContact O-CB 3.26Å; F571-R574 PolarHBondContact O-N 3.31Å; F571-R574 VanDerWaalsContact O-N 3.14Å; R574-R578 PolarHBondContact O-N 3.44Å
575I63.5Low59Low90 Ų90118.7 Ų118.746%0.46258%0.577SS.*Hα-helixtrans-65.5-42.6173.1-69170.1000110.4F571 T572 R578 S579F571-I575 HydrophobicContact CD1-CD1 3.64Å; F571-I575 HydrophobicContact CD1-CG1 4.49Å; F571-I575 HydrophobicContact CE1-CD1 3.4Å; F571-I575 HydrophobicContact CE1-CG1 4.35Å; F571-I575 HydrophobicContact CZ-CD1 4.14Å; F571-I575 WeakPolarHBondContact O-CG1 3.42Å; F571-I575 PolarHBondContact O-N 3.26Å; T572-I575 PolarHBondContact O-N 3.34Å; I575-R578 CarbonylContact O-C 3.45Å; I575-R578 WeakPolarHBondContact O-CA 3.19Å; I575-R578 WeakPolarHBondContact O-CB 3.33Å; I575-R578 PolarHBondContact O-N 2.85Å; I575-R578 VanDerWaalsContact O-N 3.14Å; I575-S579 PolarHBondContact O-N 3.45Å
576K56.4Low57.8Low128 Ų128122.7 Ų122.756%0.55760%0.596SS**Hα-helixtrans-69.6-33.8178.7-156.6171.1-174.1179.40112.5T572 G573 S579 G580T572-K576 VanDerWaalsContact O-CB 3.25Å; T572-K576 WeakPolarHBondContact O-CB 3.36Å; T572-K576 PolarHBondContact O-N 3.06Å; G573-K576 PolarHBondContact O-N 3Å; K576-S579 CarbonylContact O-C 3.56Å; K576-S579 PolarHBondContact O-N 3.39Å; K576-S579 VanDerWaalsContact O-N 3.1Å; K576-G580 PolarHBondContact O-N 3.04Å
577R55.4Low56.4Low153 Ų153121.2 Ų121.258%0.57759%0.591SS**Hα-helixtrans-63.8-36.4167.7-86.5-175.4-179.1176.61.6112.4G573 S579 D587G573-R577 WeakPolarHBondContact O-CB 3.36Å; G573-R577 PolarHBondContact O-N 3.32Å; R577-S579 VanDerWaalsContact C-N 3.26Å; R577-S579 PolarHBondContact O-N 2.93Å; R577-D587 IonicContact CZ-OD2 2.84Å; R577-D587 IonicContact NH2-OD2 3.69Å; R577-D587 PolarHBondContact NH2-OD2 2.96Å
578R57.4Low54.7Low239 Ų239125.5 Ų125.590%0.90260%0.603SS**Hα-helixtrans-69.2-22.4170.2-79-176174.9-178.5-1.9113.1R574 I575R574-R578 PolarHBondContact O-N 3.44Å; I575-R578 CarbonylContact O-C 3.45Å; I575-R578 WeakPolarHBondContact O-CA 3.19Å; I575-R578 WeakPolarHBondContact O-CB 3.33Å; I575-R578 PolarHBondContact O-N 2.85Å; I575-R578 VanDerWaalsContact O-N 3.14Å
579S56.1Low53.2Low95 Ų95130.2 Ų130.266%0.66462%0.624SS**THydrogen-bonded Turntrans-96.98.9-178.7-168.70000114.8I575 K576 R577I575-S579 PolarHBondContact O-N 3.45Å; K576-S579 CarbonylContact O-C 3.56Å; K576-S579 PolarHBondContact O-N 3.39Å; K576-S579 VanDerWaalsContact O-N 3.1Å; R577-S579 VanDerWaalsContact C-N 3.26Å; R577-S579 PolarHBondContact O-N 2.93Å
580G49.7Very low51.7Low60 Ų60131 Ų13162%0.61963%0.63SS**THydrogen-bonded Turntrans7531.2166.300000117.3K576K576-G580 PolarHBondContact O-N 3.04Å
581H50.2Low50Low154 Ų154132.3 Ų132.371%0.71364%0.638SS**  trans-119.5106.5167.1-101.945.6000110.1
582L43.5Very low48.3Very low110 Ų110136 Ų13658%0.57665%0.654SS**  trans-122.3111.2-171.2-136.2142.3000108.7L584L582-L584 HydrophobicContact CD2-CB 4.47Å; L582-L584 HydrophobicContact CD2-CD1 3.38Å; L582-L584 HydrophobicContact CD2-CD2 4.44Å; L582-L584 HydrophobicContact CD2-CG 3.46Å; L582-L584 VanDerWaalsContact CD2-CG 3.46Å
583D45.8Very low46.9Very low136 Ų136135.3 Ų135.373%0.72766%0.662SS**  trans-115.297.7172.6-158-8.4000108.4K585D583-K585 VanDerWaalsContact C-N 3.25Å; D583-K585 PolarHBondContact O-N 2.79Å
584L46.4Very low46Very low137 Ų137140.5 Ų140.572%0.71768%0.683SS**THydrogen-bonded Turntrans-75.4-2.4-163.1-105.9140.2000114.8L582L582-L584 HydrophobicContact CD2-CB 4.47Å; L582-L584 HydrophobicContact CD2-CD1 3.38Å; L582-L584 HydrophobicContact CD2-CD2 4.44Å; L582-L584 HydrophobicContact CD2-CG 3.46Å; L582-L584 VanDerWaalsContact CD2-CG 3.46Å
585K39.1Very low45Very low205 Ų205135.5 Ų135.589%0.89168%0.678SS**THydrogen-bonded Turntrans-85.1-16.2-175.7-116.5177.7179179.80114.5D583D583-K585 VanDerWaalsContact C-N 3.25Å; D583-K585 PolarHBondContact O-N 2.79Å
586K42.4Very low44.1Very low166 Ų166132 Ų13272%0.72266%0.661SS**SBendtrans-98.6-11.8-172.1-145.4171.8-173.61710115
587D37.6Very low43.6Very low65 Ų65130.2 Ų130.235%0.34866%0.662SS.*SBendtrans-90.5-9-171-83.6-12.4000114.3R577 M590R577-D587 IonicContact CZ-OD2 2.84Å; R577-D587 IonicContact NH2-OD2 3.69Å; R577-D587 PolarHBondContact NH2-OD2 2.96Å; D587-M590 PolarHBondContact O-N 3.5Å
588R32.4Very low43.2Very low238 Ų238125.3 Ų125.390%0.89865%0.654SS**THydrogen-bonded Turntrans-79.3-16-176.6-140177.2-166.3-178.23.1114.3
589E37.7Very low42.6Very low193 Ų193121.4 Ų121.490%0.90264%0.644SS**THydrogen-bonded Turntrans-88.6-2.7173.9-70.2180167.400113.1
590M39.2Very low41.6Very low112 Ų112120.6 Ų120.655%0.55264%0.638SS**  trans-100.423.5-165.9-121.9-176.2-100.100114.9D587D587-M590 PolarHBondContact O-N 3.5Å
591T34.4Very low40.9Very low100 Ų100124.8 Ų124.861%0.61365%0.647SS**SBendtrans-124.2118.2-179.7-40000109.9
592F33.8Very low40Very low194 Ų194126.8 Ų126.885%0.85165%0.654SS**SBendtrans83.6112.8179.7-62.8-83.9000115.7N594F592-N594 PolarHBondContact O-N 3.46Å
593G39.4Very low39.3Very low63 Ų63130.4 Ų130.465%0.64967%0.667SS**  trans-55.2134.1176.200000110.9A595G593-A595 PolarHBondContact O-N 3.21Å
594N39.7Very low38.6Very low141 Ų141132.1 Ų132.175%0.75468%0.676SS**  trans-45.2116179.3-68.2-6.8000110F592F592-N594 PolarHBondContact O-N 3.46Å
595A45.8Very low37.8Very low67 Ų67136.7 Ų136.755%0.55470%0.701SS**  trans-54.3151.8160.200000108.2G593 P597G593-A595 PolarHBondContact O-N 3.21Å; A595-P597 VanDerWaalsContact O-CD 3.29Å; A595-P597 WeakPolarHBondContact O-CD 3.49Å
596N44.6Very low37.7Very low16 Ų16133.3 Ų133.39%0.08669%0.692CS.*  trans-46.1112-179.3177.615.3000110.9R50 A598 F599R50-N596 WeakPolarHBondContact CD-ND2 3.42Å; R50-N596 PolarHBondContact NH1-ND2 3.36Å; R50-N596 PolarHBondContact NH1-OD1 2.88Å; N596-A598 PolarHBondContact O-N 3.4Å; N596-A598 WeakPolarHBondContact OD1-CB 3.45Å; N596-A598 PolarHBondContact OD1-N 3.44Å; N596-F599 PolarHBondContact O-N 3.27Å
597P44.1Very low37.5Very low90 Ų90131.6 Ų131.658%0.58469%0.69SS**THydrogen-bonded Turntrans-67.1-10.7-174.725.6-32.8000112.7A595 F599A595-P597 VanDerWaalsContact O-CD 3.29Å; A595-P597 WeakPolarHBondContact O-CD 3.49Å; P597-F599 VanDerWaalsContact C-N 3.29Å; P597-F599 PolarHBondContact O-N 2.91Å
598A47.3Very low37.5Very low50 Ų50135.3 Ų135.341%0.41371%0.709SS.*THydrogen-bonded Turntrans-76-8.817800000114.5N596N596-A598 PolarHBondContact O-N 3.4Å; N596-A598 WeakPolarHBondContact OD1-CB 3.45Å; N596-A598 PolarHBondContact OD1-N 3.44Å
599F44.8Very low37.8Very low158 Ų158129.2 Ų129.269%0.69370%0.698SS**SBendtrans-147.620.4-175.8-74.6-78.8000114.8N596 P597 D601N596-F599 PolarHBondContact O-N 3.27Å; P597-F599 VanDerWaalsContact C-N 3.29Å; P597-F599 PolarHBondContact O-N 2.91Å; F599-D601 PolarHBondContact O-N 3.44Å
600S35.2Very low37.8Very low77 Ų77125.3 Ų125.354%0.53869%0.685SS.*  trans-86.139.3174.461.60000112.9
601D36.1Very low37.7Very low149 Ų149126.1 Ų126.180%0.79769%0.694SS**  trans-147.381.9167.7-75.4-40.2000107.6F599F599-D601 PolarHBondContact O-N 3.44Å
602F30.3Very low37.9Very low196 Ų196128 Ų12886%0.8670%0.7SS**  trans-135.5105.5151.3-113-83.9000106L604F602-L604 PolarHBondContact O-N 3.28Å
603E29.5Very low38.2Very low185 Ų185122.9 Ų122.986%0.86469%0.688SS**  trans-47128.2175.7-70.5166.2145.600110.1D605E603-D605 PolarHBondContact O-N 3.21Å
604L30Very low38.1Very low172 Ų172127.9 Ų127.990%0.90169%0.691SS**  trans-73.8106.5154.3-86.4153.9000106F602F602-L604 PolarHBondContact O-N 3.28Å
605D30.3Very low38Very low234 Ų234126.7 Ų126.7100%1.25169%0.686SS**  trans-1350145.4-90.1-20.5000108.6E603E603-D605 PolarHBondContact O-N 3.21Å

Retrieved 605 of 605 residues in 485.2 ms (Link to these results)

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