A0A096LX41_POEFO Loading...

Trace amine associated receptor 1

AlphaFold DB , UniProt , Accession A0A096LX41, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 285 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

 

Download Structure   PDB   PAE   Table  
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
1Y65.2Low81.2Confident231 Ų23168.4 Ų68.491%0.90638%0.38SS*.  0-63.30-168.3-103.9000112.1L3 N4 V5Y1-L3 PolarHBondContact O-N 3.4Å; Y1-N4 PolarHBondContact O-N 3.46Å; Y1-V5 HydrophobicContact CD1-CG2 4.26Å; Y1-V5 HydrophobicContact CE1-CG2 3.96Å; Y1-V5 PolarHBondContact O-N 3.37Å; Y1-V5 VanDerWaalsContact O-N 3.15Å
2A74.2Confident82.1Confident73 Ų7371.3 Ų71.360%0.60339%0.393SS*.Hα-helixtrans-53.4-44.7-178.500000114.8N4 V5 V6A2-N4 VanDerWaalsContact C-N 3.29Å; A2-N4 PolarHBondContact O-N 3.01Å; A2-V5 PolarHBondContact O-N 3.44Å; A2-V6 WeakPolarHBondContact O-CG2 3.43Å; A2-V6 PolarHBondContact O-N 3.14Å
3L73.5Confident83Confident100 Ų10073.5 Ų73.552%0.52440%0.403SS..Hα-helixtrans-59.5-38177.3-173.968.5000112.9Y1 V6 A7Y1-L3 PolarHBondContact O-N 3.4Å; L3-V6 PolarHBondContact O-N 3.12Å; L3-A7 VanDerWaalsContact O-CB 3.24Å; L3-A7 WeakPolarHBondContact O-CB 3.34Å; L3-A7 PolarHBondContact O-N 3.47Å
4N75.3Confident83.9Confident30 Ų3068.3 Ų68.316%0.1638%0.375CS..Hα-helixtrans-72.1-37.7179.5-65-31.1000111.5Y1 A2 A7 V8 L62Y1-N4 PolarHBondContact O-N 3.46Å; A2-N4 VanDerWaalsContact C-N 3.29Å; A2-N4 PolarHBondContact O-N 3.01Å; N4-A7 PolarHBondContact O-N 3.33Å; N4-V8 WeakPolarHBondContact O-CB 3.39Å; N4-V8 VanDerWaalsContact O-CG2 3.3Å; N4-V8 WeakPolarHBondContact O-CG2 3.4Å; N4-V8 PolarHBondContact O-N 3.4Å; N4-L62 WeakPolarHBondContact ND2-CD2 3.44Å
5V82.6Confident84.7Confident69 Ų6966.1 Ų66.142%0.41836%0.364SS..Hα-helixtrans-60.8-50.4173.3176.30000109.7Y1 A2 A7 V8 S9Y1-V5 HydrophobicContact CD1-CG2 4.26Å; Y1-V5 HydrophobicContact CE1-CG2 3.96Å; Y1-V5 PolarHBondContact O-N 3.37Å; Y1-V5 VanDerWaalsContact O-N 3.15Å; A2-V5 PolarHBondContact O-N 3.44Å; V5-A7 VanDerWaalsContact C-N 3.28Å; V5-A7 PolarHBondContact O-N 3.4Å; V5-V8 PolarHBondContact O-N 2.99Å; V5-S9 WeakPolarHBondContact O-CB 3.41Å; V5-S9 PolarHBondContact O-N 2.8Å; V5-S9 PolarHBondContact O-OG 3.02Å
6V82.9Confident85.3Confident88 Ų8866.9 Ų66.953%0.53338%0.375SS..Hα-helixtrans-56.5-44.5177.1171.60000111.3A2 L3 S9 L10A2-V6 WeakPolarHBondContact O-CG2 3.43Å; A2-V6 PolarHBondContact O-N 3.14Å; L3-V6 PolarHBondContact O-N 3.12Å; V6-S9 PolarHBondContact O-N 3.21Å; V6-L10 VanDerWaalsContact O-CB 3.31Å; V6-L10 WeakPolarHBondContact O-CB 3.31Å; V6-L10 PolarHBondContact O-N 3.31Å
7A81.9Confident86Confident1 Ų163.9 Ų63.91%0.00836%0.363CS..Hα-helixtrans-65.4-45.3-179.300000114L3 N4 V5 L10 S11 T58 W250L3-A7 VanDerWaalsContact O-CB 3.24Å; L3-A7 WeakPolarHBondContact O-CB 3.34Å; L3-A7 PolarHBondContact O-N 3.47Å; N4-A7 PolarHBondContact O-N 3.33Å; V5-A7 VanDerWaalsContact C-N 3.28Å; V5-A7 PolarHBondContact O-N 3.4Å; A7-L10 PolarHBondContact O-N 3.46Å; A7-S11 WeakPolarHBondContact O-CB 3.41Å; A7-S11 PolarHBondContact O-N 2.89Å; A7-T58 HydrophobicContact CB-CG2 3.19Å; A7-W250 HydrophobicContact CB-CH2 3.2Å; A7-W250 HydrophobicContact CB-CZ2 4.05Å; A7-W250 HydrophobicContact CB-CZ3 3.76Å
8V86.6Confident86.6Confident72 Ų7260.4 Ų60.444%0.43634%0.343SS..Hα-helixtrans-65.8-43.5176.6171.20000110.1N4 V5 L10 S11 L12 T58N4-V8 WeakPolarHBondContact O-CB 3.39Å; N4-V8 VanDerWaalsContact O-CG2 3.3Å; N4-V8 WeakPolarHBondContact O-CG2 3.4Å; N4-V8 PolarHBondContact O-N 3.4Å; V5-V8 PolarHBondContact O-N 2.99Å; V8-L10 VanDerWaalsContact C-N 3.33Å; V8-L10 PolarHBondContact O-N 2.95Å; V8-S11 PolarHBondContact O-N 3.41Å; V8-L12 HydrophobicContact CG1-CD1 4.07Å; V8-L12 HydrophobicContact CG1-CG 4.47Å; V8-L12 WeakPolarHBondContact O-CG 3.46Å; V8-L12 PolarHBondContact O-N 3.33Å; V8-T58 HydrophobicContact CG2-CG2 4.46Å
9S89.1Confident87.1Confident57 Ų5761.4 Ų61.440%0.39935%0.346SS..Hα-helixtrans-58.5-45.2174.2-630000111.6V5 V6 L12 L13V5-S9 WeakPolarHBondContact O-CB 3.41Å; V5-S9 PolarHBondContact O-N 2.8Å; V5-S9 PolarHBondContact O-OG 3.02Å; V6-S9 PolarHBondContact O-N 3.21Å; S9-L12 PolarHBondContact O-N 3.4Å; S9-L13 WeakPolarHBondContact O-CB 3.4Å; S9-L13 VanDerWaalsContact O-CG 3.24Å; S9-L13 WeakPolarHBondContact O-CG 3.14Å; S9-L13 PolarHBondContact O-N 2.95Å
10L90Very high87.5Confident16 Ų1660.1 Ų60.18%0.08434%0.339CS..Hα-helixtrans-63.3-44.6177.4-174.364.6000111.9V6 A7 V8 L12 L13 I14 L54 W250 M257V6-L10 VanDerWaalsContact O-CB 3.31Å; V6-L10 WeakPolarHBondContact O-CB 3.31Å; V6-L10 PolarHBondContact O-N 3.31Å; A7-L10 PolarHBondContact O-N 3.46Å; V8-L10 VanDerWaalsContact C-N 3.33Å; V8-L10 PolarHBondContact O-N 2.95Å; L10-L12 PolarHBondContact O-N 2.99Å; L10-L13 PolarHBondContact O-N 3.37Å; L10-I14 HydrophobicContact CD1-CD1 4.05Å; L10-I14 HydrophobicContact CD1-CG1 4.34Å; L10-I14 HydrophobicContact CD2-CD1 4.44Å; L10-I14 HydrophobicContact CG-CD1 3.8Å; L10-I14 HydrophobicContact CG-CG1 4.45Å; L10-I14 WeakPolarHBondContact O-CB 3.34Å; L10-I14 VanDerWaalsContact O-CG1 3.25Å; L10-I14 WeakPolarHBondContact O-CG1 3.37Å; L10-I14 PolarHBondContact O-N 2.85Å; L10-L54 HydrophobicContact CB-CD1 4.44Å; L10-L54 HydrophobicContact CD2-CD1 4.11Å; L10-L54 HydrophobicContact CG-CD1 4.01Å; L10-W250 HydrophobicContact CD2-CE3 3.8Å; L10-W250 HydrophobicContact CD2-CZ3 3.86Å; L10-M257 HydrophobicContact CD1-CB 4.02Å; L10-M257 HydrophobicContact CD1-CG 4.2Å; L10-M257 HydrophobicContact CD1-SD 3.58Å; L10-M257 VanDerWaalsContact CD1-SD 3.58Å
11S92.2Very high88Confident15 Ų1557.2 Ų57.211%0.10532%0.322CS..Hα-helixtrans-58.5-46.3176.3170.10000112.1A7 V8 I14 T15 G50A7-S11 WeakPolarHBondContact O-CB 3.41Å; A7-S11 PolarHBondContact O-N 2.89Å; V8-S11 PolarHBondContact O-N 3.41Å; S11-I14 PolarHBondContact O-N 3Å; S11-T15 VanDerWaalsContact O-CB 3.31Å; S11-T15 WeakPolarHBondContact O-CB 3.46Å; S11-T15 PolarHBondContact O-N 2.92Å; S11-T15 PolarHBondContact O-OG1 3.31Å; S11-G50 PolarHBondContact OG-O 3.16Å
12L92.1Very high89.5Confident103 Ų10347.3 Ų47.354%0.53929%0.285SS..Hα-helixtrans-63.3-46176.3-70.9172.2000111.9V8 S9 L10 I14 T15 C16V8-L12 HydrophobicContact CG1-CD1 4.07Å; V8-L12 HydrophobicContact CG1-CG 4.47Å; V8-L12 WeakPolarHBondContact O-CG 3.46Å; V8-L12 PolarHBondContact O-N 3.33Å; S9-L12 PolarHBondContact O-N 3.4Å; L10-L12 PolarHBondContact O-N 2.99Å; L12-I14 PolarHBondContact O-N 3.5Å; L12-T15 PolarHBondContact O-N 3.46Å; L12-C16 VanDerWaalsContact O-CB 3.25Å; L12-C16 WeakPolarHBondContact O-CB 3.36Å; L12-C16 PolarHBondContact O-N 3.49Å; L12-C16 PolarHBondContact O-SG 3.22Å
13L94.1Very high90.5Very high101 Ų10147.2 Ų47.253%0.52927%0.273SS..Hα-helixtrans-61.7-43.5178.8-72.5171.6000112S9 L10 G17 M257S9-L13 WeakPolarHBondContact O-CB 3.4Å; S9-L13 VanDerWaalsContact O-CG 3.24Å; S9-L13 WeakPolarHBondContact O-CG 3.14Å; S9-L13 PolarHBondContact O-N 2.95Å; L10-L13 PolarHBondContact O-N 3.37Å; L13-G17 WeakPolarHBondContact O-CA 3.25Å; L13-G17 PolarHBondContact O-N 3.14Å; L13-M257 HydrophobicContact CB-CG 4.2Å; L13-M257 HydrophobicContact CB-SD 4.38Å; L13-M257 HydrophobicContact CD1-SD 4.08Å
14I95.3Very high91.5Very high0 Ų042.5 Ų42.50%025%0.249CC..Hα-helixtrans-63.6-49.3177.1-70.3170.2000110.5L10 S11 L12 N18 D46 L54 M257L10-I14 HydrophobicContact CD1-CD1 4.05Å; L10-I14 HydrophobicContact CD1-CG1 4.34Å; L10-I14 HydrophobicContact CD2-CD1 4.44Å; L10-I14 HydrophobicContact CG-CD1 3.8Å; L10-I14 HydrophobicContact CG-CG1 4.45Å; L10-I14 WeakPolarHBondContact O-CB 3.34Å; L10-I14 VanDerWaalsContact O-CG1 3.25Å; L10-I14 WeakPolarHBondContact O-CG1 3.37Å; L10-I14 PolarHBondContact O-N 2.85Å; S11-I14 PolarHBondContact O-N 3Å; L12-I14 PolarHBondContact O-N 3.5Å; I14-N18 WeakPolarHBondContact O-CB 3.3Å; I14-N18 PolarHBondContact O-N 2.92Å; I14-N18 PolarHBondContact O-ND2 3.1Å; I14-D46 WeakPolarHBondContact CG2-O 3.26Å; I14-L54 HydrophobicContact CD1-CD1 3.56Å; I14-M257 HydrophobicContact CD1-CB 4.29Å; I14-M257 HydrophobicContact CG1-CB 3.6Å; I14-M257 HydrophobicContact CG1-CG 4.34Å
15T95.5Very high92.4Very high35 Ų3541.1 Ų41.122%0.21524%0.241CC..Hα-helixtrans-63.9-51.5-176.3-55.30000110.6S11 L12 L19 L47S11-T15 VanDerWaalsContact O-CB 3.31Å; S11-T15 WeakPolarHBondContact O-CB 3.46Å; S11-T15 PolarHBondContact O-N 2.92Å; S11-T15 PolarHBondContact O-OG1 3.31Å; L12-T15 PolarHBondContact O-N 3.46Å; T15-L19 WeakPolarHBondContact O-CB 3.42Å; T15-L19 PolarHBondContact O-N 3.32Å; T15-L47 HydrophobicContact CG2-CG 4.33Å
16C95.1Very high93Very high79 Ų7943 Ų4353%0.53425%0.248SC..Hα-helixtrans-65.3-43.7-179.9-67.20000112.4L12 L19 L20L12-C16 VanDerWaalsContact O-CB 3.25Å; L12-C16 WeakPolarHBondContact O-CB 3.36Å; L12-C16 PolarHBondContact O-N 3.49Å; L12-C16 PolarHBondContact O-SG 3.22Å; C16-L19 PolarHBondContact O-N 3.44Å; C16-L20 PolarHBondContact O-N 3.05Å
17G95.8Very high93.5Very high17 Ų1745.3 Ų45.318%0.17525%0.248CC..Hα-helixtrans-62.9-45.3-179.400000112.4L13 L20 V21 P260L13-G17 WeakPolarHBondContact O-CA 3.25Å; L13-G17 PolarHBondContact O-N 3.14Å; G17-L20 WeakPolarHBondContact O-CB 3.31Å; G17-L20 PolarHBondContact O-N 3.27Å; G17-V21 WeakPolarHBondContact O-CG2 3.29Å; G17-V21 PolarHBondContact O-N 3Å; G17-P260 VanDerWaalsContact C-CG 3.43Å
18N97.3Very high94Very high0 Ų046.3 Ų46.30%025%0.252CS..Hα-helixtrans-75.4-31.3179-72.6-70.9000112.5I14 L20 V21 I22 A43 D46 L47 S256 P260I14-N18 WeakPolarHBondContact O-CB 3.3Å; I14-N18 PolarHBondContact O-N 2.92Å; I14-N18 PolarHBondContact O-ND2 3.1Å; N18-L20 VanDerWaalsContact C-N 3.28Å; N18-L20 PolarHBondContact O-N 3.43Å; N18-V21 WeakPolarHBondContact O-CB 3.45Å; N18-V21 PolarHBondContact O-N 2.93Å; N18-I22 WeakPolarHBondContact O-CD1 3.19Å; N18-I22 VanDerWaalsContact O-CG1 3.29Å; N18-I22 WeakPolarHBondContact O-CG1 3.27Å; N18-I22 PolarHBondContact O-N 2.85Å; N18-A43 HydrophobicContact CB-CB 4.36Å; N18-A43 WeakPolarHBondContact CB-O 3.44Å; N18-D46 HydrophobicContact CB-CB 4.45Å; N18-D46 WeakPolarHBondContact ND2-CB 3.46Å; N18-L47 HydrophobicContact CB-CB 4.02Å; N18-S256 PolarHBondContact ND2-O 2.94Å; N18-P260 HydrophobicContact CB-CG 4.49Å; N18-P260 WeakPolarHBondContact OD1-CG 3.2Å
19L96.7Very high94.2Very high79 Ų7951.1 Ų51.141%0.41427%0.267SS..Hα-helixtrans-59.9-40.8169.7-175.463.3000111.2T15 C16 V21 I22 I23 L47T15-L19 WeakPolarHBondContact O-CB 3.42Å; T15-L19 PolarHBondContact O-N 3.32Å; C16-L19 PolarHBondContact O-N 3.44Å; L19-V21 VanDerWaalsContact C-N 3.35Å; L19-V21 PolarHBondContact O-N 3.46Å; L19-I22 WeakPolarHBondContact O-CB 3.49Å; L19-I22 PolarHBondContact O-N 2.95Å; L19-I23 HydrophobicContact CD1-CD1 4.27Å; L19-I23 HydrophobicContact CD1-CG1 4.4Å; L19-I23 HydrophobicContact CD2-CD1 4.46Å; L19-I23 HydrophobicContact CG-CD1 3.87Å; L19-I23 HydrophobicContact CG-CG1 4.41Å; L19-I23 WeakPolarHBondContact O-CB 3.36Å; L19-I23 VanDerWaalsContact O-CG1 3.29Å; L19-I23 WeakPolarHBondContact O-CG1 3.33Å; L19-I23 PolarHBondContact O-N 3.47Å; L19-L47 HydrophobicContact CB-CD1 4Å; L19-L47 HydrophobicContact CD1-CD1 4.2Å
20L95.3Very high94.2Very high36 Ų3654.5 Ų54.519%0.18828%0.277CS..Hα-helixtrans-63.6-39175.6-173.566.4000112.4C16 G17 N18 S24 F274 I277C16-L20 PolarHBondContact O-N 3.05Å; G17-L20 WeakPolarHBondContact O-CB 3.31Å; G17-L20 PolarHBondContact O-N 3.27Å; N18-L20 VanDerWaalsContact C-N 3.28Å; N18-L20 PolarHBondContact O-N 3.43Å; L20-S24 VanDerWaalsContact O-CB 3.27Å; L20-S24 WeakPolarHBondContact O-CB 3.44Å; L20-S24 PolarHBondContact O-N 3.31Å; L20-S24 PolarHBondContact O-OG 2.87Å; L20-F274 HydrophobicContact CB-CE1 4.42Å; L20-F274 HydrophobicContact CD1-CD1 4.28Å; L20-F274 HydrophobicContact CD2-CB 4.06Å; L20-F274 HydrophobicContact CD2-CD1 3.65Å; L20-F274 HydrophobicContact CD2-CD2 3.79Å; L20-F274 HydrophobicContact CD2-CE1 3.96Å; L20-F274 HydrophobicContact CD2-CE2 4.08Å; L20-F274 HydrophobicContact CD2-CG 3.56Å; L20-F274 HydrophobicContact CD2-CZ 4.16Å; L20-F274 HydrophobicContact CG-CD1 3.56Å; L20-F274 HydrophobicContact CG-CE1 3.66Å; L20-F274 HydrophobicContact CG-CG 4.04Å; L20-F274 HydrophobicContact CG-CZ 4.2Å; L20-I277 HydrophobicContact CD1-CB 4.02Å; L20-I277 HydrophobicContact CD1-CD1 3.76Å; L20-I277 HydrophobicContact CD1-CG2 3.64Å
21V96.4Very high94.2Very high0 Ų054 Ų540%027%0.274CS..Hα-helixtrans-60.7-48.3172.3176.10000110.3G17 N18 L19 S24 V25 I39 A43 P260 Y263 F270 F274G17-V21 WeakPolarHBondContact O-CG2 3.29Å; G17-V21 PolarHBondContact O-N 3Å; N18-V21 WeakPolarHBondContact O-CB 3.45Å; N18-V21 PolarHBondContact O-N 2.93Å; L19-V21 VanDerWaalsContact C-N 3.35Å; L19-V21 PolarHBondContact O-N 3.46Å; V21-S24 WeakPolarHBondContact O-CB 3.28Å; V21-S24 PolarHBondContact O-N 3.19Å; V21-V25 PolarHBondContact O-N 2.87Å; V21-I39 HydrophobicContact CG1-CG2 4.11Å; V21-A43 HydrophobicContact CB-CB 4.02Å; V21-A43 HydrophobicContact CG1-CB 3.7Å; V21-P260 HydrophobicContact CG2-CB 4.07Å; V21-P260 HydrophobicContact CG2-CG 4.08Å; V21-Y263 HydrophobicContact CG1-CD2 4.37Å; V21-Y263 HydrophobicContact CG1-CE2 4.49Å; V21-Y263 HydrophobicContact CG2-CD2 3.85Å; V21-Y263 HydrophobicContact CG2-CE2 4.44Å; V21-F270 HydrophobicContact CG1-CE1 3.92Å; V21-F270 HydrophobicContact CG1-CZ 4.03Å; V21-F274 HydrophobicContact CG2-CE1 4.44Å; V21-F274 HydrophobicContact CG2-CZ 3.8Å
22I97.4Very high94.3Very high23 Ų2357 Ų5712%0.11829%0.286CS..Hα-helixtrans-58.6-53.9179.6-70.9160.8000110.8N18 L19 S24 V25 I26 L40 A43 V44 L47N18-I22 WeakPolarHBondContact O-CD1 3.19Å; N18-I22 VanDerWaalsContact O-CG1 3.29Å; N18-I22 WeakPolarHBondContact O-CG1 3.27Å; N18-I22 PolarHBondContact O-N 2.85Å; L19-I22 WeakPolarHBondContact O-CB 3.49Å; L19-I22 PolarHBondContact O-N 2.95Å; I22-S24 VanDerWaalsContact C-N 3.25Å; I22-S24 PolarHBondContact O-N 3.46Å; I22-V25 PolarHBondContact O-N 3.24Å; I22-I26 HydrophobicContact CG2-CD1 3.65Å; I22-I26 WeakPolarHBondContact O-CG1 3.33Å; I22-I26 PolarHBondContact O-N 3.43Å; I22-L40 HydrophobicContact CB-CD1 3.92Å; I22-L40 HydrophobicContact CG1-CD1 3.76Å; I22-L40 HydrophobicContact CG2-CD1 3.94Å; I22-A43 HydrophobicContact CD1-CB 4.49Å; I22-A43 HydrophobicContact CG1-CB 3.97Å; I22-V44 HydrophobicContact CD1-CG2 3.88Å; I22-V44 HydrophobicContact CG1-CG2 4.18Å; I22-L47 HydrophobicContact CD1-CB 4.35Å; I22-L47 HydrophobicContact CD1-CD1 3.69Å
23I95.1Very high94.3Very high71 Ų7154.3 Ų54.336%0.36427%0.274SS..Hα-helixtrans-57.3-42.5178.2-68.4168.8000110.3L19 V25 I26 Y27 I277L19-I23 HydrophobicContact CD1-CD1 4.27Å; L19-I23 HydrophobicContact CD1-CG1 4.4Å; L19-I23 HydrophobicContact CD2-CD1 4.46Å; L19-I23 HydrophobicContact CG-CD1 3.87Å; L19-I23 HydrophobicContact CG-CG1 4.41Å; L19-I23 WeakPolarHBondContact O-CB 3.36Å; L19-I23 VanDerWaalsContact O-CG1 3.29Å; L19-I23 WeakPolarHBondContact O-CG1 3.33Å; L19-I23 PolarHBondContact O-N 3.47Å; I23-V25 PolarHBondContact O-N 2.88Å; I23-I26 PolarHBondContact O-N 3.43Å; I23-Y27 WeakPolarHBondContact O-CB 3.41Å; I23-Y27 PolarHBondContact O-N 2.99Å; I23-I277 HydrophobicContact CB-CD1 4.5Å; I23-I277 HydrophobicContact CG2-CD1 3.82Å
24S94.4Very high94.3Very high0 Ų050.5 Ų50.50%026%0.255CS..Hα-helixtrans-60.5-48.3179.9-64.80000112.2L20 V21 I22 F28 L31 F274 I277L20-S24 VanDerWaalsContact O-CB 3.27Å; L20-S24 WeakPolarHBondContact O-CB 3.44Å; L20-S24 PolarHBondContact O-N 3.31Å; L20-S24 PolarHBondContact O-OG 2.87Å; V21-S24 WeakPolarHBondContact O-CB 3.28Å; V21-S24 PolarHBondContact O-N 3.19Å; I22-S24 VanDerWaalsContact C-N 3.25Å; I22-S24 PolarHBondContact O-N 3.46Å; S24-F28 WeakPolarHBondContact O-CB 3.47Å; S24-F28 VanDerWaalsContact O-CD2 3.3Å; S24-F28 WeakPolarHBondContact O-CD2 3.5Å; S24-F28 PolarHBondContact O-N 3.05Å; S24-F28 VanDerWaalsContact O-N 3.12Å; S24-L31 WeakPolarHBondContact O-CD1 3.37Å; S24-F274 VanDerWaalsContact OG-CD1 3.24Å; S24-F274 WeakPolarHBondContact OG-CD1 3.45Å; S24-F274 VanDerWaalsContact OG-CE1 3.23Å; S24-F274 WeakPolarHBondContact OG-CE1 3.47Å; S24-I277 WeakPolarHBondContact OG-CD1 3.37Å
25V95.4Very high94.2Very high1 Ų150.6 Ų50.61%0.00626%0.256CS..Hα-helixtrans-66.1-41.6-179.9179.30000111.2V21 I22 I23 H32 N36 L40 F270V21-V25 PolarHBondContact O-N 2.87Å; I22-V25 PolarHBondContact O-N 3.24Å; I23-V25 PolarHBondContact O-N 2.88Å; V25-H32 PolarHBondContact O-CD2 3.21Å; V25-H32 PolarHBondContact O-NE2 3.31Å; V25-N36 HydrophobicContact CG1-CB 4.3Å; V25-N36 HydrophobicContact CG2-CB 4.42Å; V25-L40 HydrophobicContact CB-CB 4.5Å; V25-L40 HydrophobicContact CB-CD1 4.2Å; V25-L40 HydrophobicContact CG1-CB 4.27Å; V25-L40 HydrophobicContact CG1-CD2 4.28Å; V25-F270 HydrophobicContact CG2-CE1 3.64Å; V25-F270 HydrophobicContact CG2-CZ 3.54Å
26I95.3Very high94.1Very high109 Ų10949.1 Ų49.156%0.55925%0.247SC*.Hα-helixtrans-68.8-40.7-178-67.2172.4000111.8I22 I23 H32I22-I26 HydrophobicContact CG2-CD1 3.65Å; I22-I26 WeakPolarHBondContact O-CG1 3.33Å; I22-I26 PolarHBondContact O-N 3.43Å; I23-I26 PolarHBondContact O-N 3.43Å; I26-H32 PolarHBondContact O-NE2 3.16Å
27Y93.3Very high94.2Very high136 Ų13648.1 Ų48.153%0.53323%0.232SC..Hα-helixtrans-80.2-42.7-172.9-173.1-96.2000112.7I23 K29 K280I23-Y27 WeakPolarHBondContact O-CB 3.41Å; I23-Y27 PolarHBondContact O-N 2.99Å; Y27-K29 PolarHBondContact O-N 2.9Å; Y27-K280 PolarHBondContact OH-NZ 3.44Å
28F92.6Very high94.3Very high23 Ų2347.3 Ų47.310%0.10122%0.224CC..  trans-92.9104.5-174.2-64.2-74.9000111.2S24 Q30 L31 A273 M276 I277S24-F28 WeakPolarHBondContact O-CB 3.47Å; S24-F28 VanDerWaalsContact O-CD2 3.3Å; S24-F28 WeakPolarHBondContact O-CD2 3.5Å; S24-F28 PolarHBondContact O-N 3.05Å; S24-F28 VanDerWaalsContact O-N 3.12Å; F28-Q30 PolarHBondContact O-N 3.49Å; F28-L31 HydrophobicContact CB-CD1 4.15Å; F28-L31 HydrophobicContact CB-CG 4.29Å; F28-L31 WeakPolarHBondContact O-CA 3.4Å; F28-L31 WeakPolarHBondContact O-CB 3.34Å; F28-L31 PolarHBondContact O-N 3.33Å; F28-A273 HydrophobicContact CD2-CB 3.47Å; F28-A273 VanDerWaalsContact CD2-CB 3.47Å; F28-A273 HydrophobicContact CE2-CB 3.46Å; F28-A273 VanDerWaalsContact CE2-CB 3.46Å; F28-A273 HydrophobicContact CG-CB 4.35Å; F28-A273 HydrophobicContact CZ-CB 4.32Å; F28-M276 HydrophobicContact CD1-CE 3.85Å; F28-M276 HydrophobicContact CE1-CE 3.2Å; F28-M276 HydrophobicContact CE1-SD 3.89Å; F28-M276 HydrophobicContact CE2-CE 4.33Å; F28-M276 HydrophobicContact CZ-CB 3.95Å; F28-M276 HydrophobicContact CZ-CE 3.5Å; F28-M276 VanDerWaalsContact CZ-CE 3.5Å; F28-M276 HydrophobicContact CZ-SD 4.24Å; F28-I277 HydrophobicContact CE2-CD1 3.96Å; F28-I277 HydrophobicContact CE2-CG1 3.99Å; F28-I277 HydrophobicContact CZ-CG1 4.36Å
29K90.3Very high94.2Very high172 Ų17247.3 Ų47.375%0.74822%0.224SC*.G310 helixtrans-52.9-29.3177.3-67-175.6179.6179.90113.8Y27 L31 H32Y27-K29 PolarHBondContact O-N 2.9Å; K29-L31 PolarHBondContact O-N 3.25Å; K29-H32 WeakPolarHBondContact O-CB 3.27Å; K29-H32 PolarHBondContact O-N 3.5Å
30Q88.6Confident94.3Very high129 Ų12945 Ų4560%0.60321%0.212SC*.G310 helixtrans-64-21.8176-60.183.1-3.400112.8F28F28-Q30 PolarHBondContact O-N 3.49Å
31L91Very high94.4Very high4 Ų443.6 Ų43.62%0.02121%0.205CC..G310 helixtrans-88.5-0.6174.9-69.4175.5000112.8S24 F28 K29 T33 N36 Y267 W269 F270 A273S24-L31 WeakPolarHBondContact O-CD1 3.37Å; F28-L31 HydrophobicContact CB-CD1 4.15Å; F28-L31 HydrophobicContact CB-CG 4.29Å; F28-L31 WeakPolarHBondContact O-CA 3.4Å; F28-L31 WeakPolarHBondContact O-CB 3.34Å; F28-L31 PolarHBondContact O-N 3.33Å; K29-L31 PolarHBondContact O-N 3.25Å; L31-T33 VanDerWaalsContact C-N 3.26Å; L31-T33 PolarHBondContact O-N 2.82Å; L31-N36 WeakPolarHBondContact CA-ND2 3.41Å; L31-N36 WeakPolarHBondContact CD2-ND2 3.45Å; L31-N36 WeakPolarHBondContact O-CB 3.44Å; L31-N36 PolarHBondContact O-ND2 2.86Å; L31-Y267 HydrophobicContact CD2-CE1 4.39Å; L31-W269 HydrophobicContact CD2-CB 3.54Å; L31-W269 HydrophobicContact CD2-CG 4.44Å; L31-F270 HydrophobicContact CD1-CD1 4.17Å; L31-F270 HydrophobicContact CD1-CE1 4.07Å; L31-A273 HydrophobicContact CD1-CB 4.2Å
32H93.9Very high94.4Very high78 Ų7843.6 Ų43.636%0.36121%0.205SC..  trans-7774.8178.7-64.4179.1000111.9V25 I26 K29V25-H32 PolarHBondContact O-CD2 3.21Å; V25-H32 PolarHBondContact O-NE2 3.31Å; I26-H32 PolarHBondContact O-NE2 3.16Å; K29-H32 WeakPolarHBondContact O-CB 3.27Å; K29-H32 PolarHBondContact O-N 3.5Å
33T92.4Very high94.5Very high47 Ų4742.6 Ų42.629%0.28820%0.2SC..SBendtrans-121153.517768.60000110.5L31 T35 N36 Y37L31-T33 VanDerWaalsContact C-N 3.26Å; L31-T33 PolarHBondContact O-N 2.82Å; T33-T35 PolarHBondContact O-N 3.39Å; T33-T35 VanDerWaalsContact O-N 3.14Å; T33-N36 PolarHBondContact O-N 3.08Å; T33-N36 WeakPolarHBondContact OG1-CB 3.43Å; T33-N36 PolarHBondContact OG1-N 2.74Å; T33-N36 PolarHBondContact OG1-ND2 3.29Å; T33-Y37 VanDerWaalsContact O-CD2 3.28Å; T33-Y37 WeakPolarHBondContact O-CD2 3.19Å; T33-Y37 PolarHBondContact O-N 3.24Å; T33-Y37 VanDerWaalsContact O-N 3.09Å
34P93Very high94.6Very high21 Ų2141.6 Ų41.614%0.13620%0.197CC..Hα-helixtrans-46.9-43.5177-32.638.2000113.9Y37 L38 S117P34-Y37 PolarHBondContact O-N 3.44Å; P34-L38 PolarHBondContact O-N 3.48Å; P34-S117 VanDerWaalsContact CA-OG 3.27Å; P34-S117 WeakPolarHBondContact CA-OG 3.38Å; P34-S117 VanDerWaalsContact CB-OG 3.24Å; P34-S117 WeakPolarHBondContact CB-OG 3.1Å; P34-S117 PolarHBondContact O-OG 3.16Å; P34-S117 VanDerWaalsContact O-OG 3.12Å
35T93Very high94.7Very high3 Ų341.6 Ų41.62%0.01820%0.197CC..Hα-helixtrans-65.6-43.9178-40.60000112.7T33 Y37 L38 I39 D97 R98 L212T33-T35 PolarHBondContact O-N 3.39Å; T33-T35 VanDerWaalsContact O-N 3.14Å; T35-Y37 VanDerWaalsContact C-N 3.28Å; T35-Y37 PolarHBondContact O-N 3.19Å; T35-L38 WeakPolarHBondContact O-CB 3.38Å; T35-L38 PolarHBondContact O-N 2.93Å; T35-L38 VanDerWaalsContact O-N 3.1Å; T35-I39 HydrophobicContact CG2-CD1 4.23Å; T35-I39 WeakPolarHBondContact O-CG1 3.36Å; T35-I39 PolarHBondContact O-N 3.22Å; T35-D97 WeakPolarHBondContact CB-OD2 3.4Å; T35-D97 WeakPolarHBondContact CG2-OD2 3.34Å; T35-D97 PolarHBondContact OG1-OD2 3.02Å; T35-R98 PolarHBondContact OG1-NH2 2.96Å; T35-L212 HydrophobicContact CG2-CD1 3.88Å
36N94.8Very high94.8Very high3 Ų341.6 Ų41.62%0.01620%0.197CC..Hα-helixtrans-71.8-25.4-176.6-67.5-17.6000111.6V25 L31 T33 I39 L40 Y267V25-N36 HydrophobicContact CG1-CB 4.3Å; V25-N36 HydrophobicContact CG2-CB 4.42Å; L31-N36 WeakPolarHBondContact CA-ND2 3.41Å; L31-N36 WeakPolarHBondContact CD2-ND2 3.45Å; L31-N36 WeakPolarHBondContact O-CB 3.44Å; L31-N36 PolarHBondContact O-ND2 2.86Å; T33-N36 PolarHBondContact O-N 3.08Å; T33-N36 WeakPolarHBondContact OG1-CB 3.43Å; T33-N36 PolarHBondContact OG1-N 2.74Å; T33-N36 PolarHBondContact OG1-ND2 3.29Å; N36-I39 PolarHBondContact O-N 3.22Å; N36-L40 VanDerWaalsContact O-CB 3.26Å; N36-L40 WeakPolarHBondContact O-CB 3Å; N36-L40 PolarHBondContact O-N 3.06Å; N36-Y267 PolarHBondContact OD1-OH 2.87Å; N36-Y267 VanDerWaalsContact OD1-OH 3.04Å
37Y96.8Very high94.9Very high59 Ų5938 Ų3823%0.23118%0.179CC..Hα-helixtrans-65.8-38.5167.6-74.5-63.2000112.2T33 P34 T35 L40 S41 V114 I121T33-Y37 VanDerWaalsContact O-CD2 3.28Å; T33-Y37 WeakPolarHBondContact O-CD2 3.19Å; T33-Y37 PolarHBondContact O-N 3.24Å; T33-Y37 VanDerWaalsContact O-N 3.09Å; P34-Y37 PolarHBondContact O-N 3.44Å; T35-Y37 VanDerWaalsContact C-N 3.28Å; T35-Y37 PolarHBondContact O-N 3.19Å; Y37-L40 HydrophobicContact CD1-CD2 4.37Å; Y37-L40 WeakPolarHBondContact O-CB 3.41Å; Y37-L40 PolarHBondContact O-N 3.32Å; Y37-S41 PolarHBondContact O-N 3.26Å; Y37-V114 HydrophobicContact CD2-CG1 4.38Å; Y37-V114 HydrophobicContact CE2-CG1 4.02Å; Y37-V114 HydrophobicContact CE2-CG2 4.05Å; Y37-I121 WeakPolarHBondContact O-CD1 3.33Å
38L97.2Very high95Very high0 Ų033.9 Ų33.90%017%0.166CC..Hα-helixtrans-68.3-40.2173.7-62.5171000111.7P34 T35 L40 S41 L42 F93 I94 D97 M120 I121P34-L38 PolarHBondContact O-N 3.48Å; T35-L38 WeakPolarHBondContact O-CB 3.38Å; T35-L38 PolarHBondContact O-N 2.93Å; T35-L38 VanDerWaalsContact O-N 3.1Å; L38-L40 VanDerWaalsContact C-N 3.3Å; L38-L40 PolarHBondContact O-N 3.3Å; L38-S41 PolarHBondContact O-N 3.01Å; L38-L42 PolarHBondContact O-N 3.36Å; L38-F93 HydrophobicContact CD1-CB 4.35Å; L38-F93 HydrophobicContact CD2-CB 4.18Å; L38-I94 HydrophobicContact CB-CD1 4.31Å; L38-I94 HydrophobicContact CB-CG1 3.57Å; L38-I94 HydrophobicContact CD1-CG1 4.25Å; L38-D97 HydrophobicContact CD1-CB 3.96Å; L38-M120 HydrophobicContact CD1-SD 4.47Å; L38-M120 HydrophobicContact CD2-CB 3.93Å; L38-I121 HydrophobicContact CD2-CD1 4.5Å; L38-I121 HydrophobicContact CD2-CG1 3.87Å
39I96.1Very high95Very high0 Ų033.3 Ų33.30%016%0.164CC..Hα-helixtrans-61.8-39.2172.3-65.8169.3000110.8V21 T35 N36 L42 A43 I94 L212 Y263 F270V21-I39 HydrophobicContact CG1-CG2 4.11Å; T35-I39 HydrophobicContact CG2-CD1 4.23Å; T35-I39 WeakPolarHBondContact O-CG1 3.36Å; T35-I39 PolarHBondContact O-N 3.22Å; N36-I39 PolarHBondContact O-N 3.22Å; I39-L42 PolarHBondContact O-N 3.02Å; I39-A43 WeakPolarHBondContact O-CB 2.95Å; I39-A43 PolarHBondContact O-N 3.44Å; I39-I94 HydrophobicContact CG1-CD1 4.35Å; I39-L212 HydrophobicContact CD1-CD2 3.93Å; I39-L212 HydrophobicContact CG1-CD2 4.26Å; I39-Y263 HydrophobicContact CD1-CE1 4.5Å; I39-Y263 HydrophobicContact CG2-CD2 4.48Å; I39-Y263 HydrophobicContact CG2-CE1 4.32Å; I39-Y263 HydrophobicContact CG2-CE2 3.77Å; I39-F270 HydrophobicContact CD1-CE2 4.32Å; I39-F270 HydrophobicContact CG2-CE2 4.2Å; I39-F270 HydrophobicContact CG2-CZ 4.11Å
40L97.4Very high95.1Very high30 Ų3025.1 Ų25.116%0.15713%0.129CC..Hα-helixtrans-60.5-46.8175.2177.668.6000111.1I22 V25 N36 Y37 L38 L42 A43 V44I22-L40 HydrophobicContact CB-CD1 3.92Å; I22-L40 HydrophobicContact CG1-CD1 3.76Å; I22-L40 HydrophobicContact CG2-CD1 3.94Å; V25-L40 HydrophobicContact CB-CB 4.5Å; V25-L40 HydrophobicContact CB-CD1 4.2Å; V25-L40 HydrophobicContact CG1-CB 4.27Å; V25-L40 HydrophobicContact CG1-CD2 4.28Å; N36-L40 VanDerWaalsContact O-CB 3.26Å; N36-L40 WeakPolarHBondContact O-CB 3Å; N36-L40 PolarHBondContact O-N 3.06Å; Y37-L40 HydrophobicContact CD1-CD2 4.37Å; Y37-L40 WeakPolarHBondContact O-CB 3.41Å; Y37-L40 PolarHBondContact O-N 3.32Å; L38-L40 VanDerWaalsContact C-N 3.3Å; L38-L40 PolarHBondContact O-N 3.3Å; L40-L42 VanDerWaalsContact C-N 3.33Å; L40-L42 PolarHBondContact O-N 2.85Å; L40-A43 PolarHBondContact O-N 3.36Å; L40-V44 WeakPolarHBondContact O-CG2 3.36Å; L40-V44 PolarHBondContact O-N 3.47Å
41S98.2Very high95.2Very high7 Ų721 Ų215%0.04912%0.116CC..Hα-helixtrans-60.5-41.5175.3178.90000112.5Y37 L38 V44 T45 N90 W125Y37-S41 PolarHBondContact O-N 3.26Å; L38-S41 PolarHBondContact O-N 3.01Å; S41-V44 PolarHBondContact O-N 3.27Å; S41-T45 PolarHBondContact O-N 3.43Å; S41-T45 PolarHBondContact O-OG1 3.1Å; S41-N90 WeakPolarHBondContact CB-OD1 3.17Å; S41-N90 PolarHBondContact OG-OD1 3.26Å; S41-W125 PolarHBondContact OG-NE1 3.24Å; S41-W125 VanDerWaalsContact OG-NE1 3.15Å
42L97.3Very high95Very high0 Ų023.1 Ų23.10%013%0.128CC..Hα-helixtrans-62.1-44.2173.5-177.662.1000111.6L38 I39 L40 V44 T45 D46 S87 N90 L91 I94L38-L42 PolarHBondContact O-N 3.36Å; I39-L42 PolarHBondContact O-N 3.02Å; L40-L42 VanDerWaalsContact C-N 3.33Å; L40-L42 PolarHBondContact O-N 2.85Å; L42-V44 VanDerWaalsContact C-N 3.33Å; L42-V44 PolarHBondContact O-N 3.5Å; L42-T45 WeakPolarHBondContact O-CA 3.18Å; L42-T45 VanDerWaalsContact O-CB 3.31Å; L42-T45 WeakPolarHBondContact O-CB 3.21Å; L42-T45 PolarHBondContact O-N 2.85Å; L42-T45 VanDerWaalsContact O-N 3.09Å; L42-D46 PolarHBondContact O-N 3.38Å; L42-S87 VanDerWaalsContact CD1-OG 3.3Å; L42-S87 WeakPolarHBondContact CD1-OG 3.36Å; L42-N90 HydrophobicContact CB-CB 4.23Å; L42-N90 HydrophobicContact CD1-CB 4.2Å; L42-L91 HydrophobicContact CD1-CG 4.5Å; L42-L91 HydrophobicContact CD2-CD2 3.77Å; L42-L91 HydrophobicContact CD2-CG 4.39Å; L42-I94 HydrophobicContact CD2-CD1 4.06Å
43A97.8Very high94.5Very high1 Ų119.4 Ų19.41%0.00811%0.111CC..Hα-helixtrans-63.9-35.4177.300000112.5N18 V21 I22 I39 L40 T45 D46 L47N18-A43 HydrophobicContact CB-CB 4.36Å; N18-A43 WeakPolarHBondContact CB-O 3.44Å; V21-A43 HydrophobicContact CB-CB 4.02Å; V21-A43 HydrophobicContact CG1-CB 3.7Å; I22-A43 HydrophobicContact CD1-CB 4.49Å; I22-A43 HydrophobicContact CG1-CB 3.97Å; I39-A43 WeakPolarHBondContact O-CB 2.95Å; I39-A43 PolarHBondContact O-N 3.44Å; L40-A43 PolarHBondContact O-N 3.36Å; A43-T45 VanDerWaalsContact C-N 3.35Å; A43-D46 PolarHBondContact O-N 2.98Å; A43-L47 VanDerWaalsContact O-CB 3.25Å; A43-L47 WeakPolarHBondContact O-CB 3.43Å; A43-L47 PolarHBondContact O-N 3.4Å
44V98.1Very high93.9Very high51 Ų5117.2 Ų17.231%0.30910%0.097SC..Hα-helixtrans-63.5-42.9171.4172.20000110.7I22 L40 S41 L42 L47 L48 W125I22-V44 HydrophobicContact CD1-CG2 3.88Å; I22-V44 HydrophobicContact CG1-CG2 4.18Å; L40-V44 WeakPolarHBondContact O-CG2 3.36Å; L40-V44 PolarHBondContact O-N 3.47Å; S41-V44 PolarHBondContact O-N 3.27Å; L42-V44 VanDerWaalsContact C-N 3.33Å; L42-V44 PolarHBondContact O-N 3.5Å; V44-L47 PolarHBondContact O-N 2.91Å; V44-L48 HydrophobicContact CG1-CD1 4.31Å; V44-L48 WeakPolarHBondContact O-CG 3.4Å; V44-L48 PolarHBondContact O-N 3.49Å; V44-W125 HydrophobicContact CB-CZ2 4.33Å; V44-W125 HydrophobicContact CG1-CH2 4.11Å; V44-W125 HydrophobicContact CG1-CZ2 3.87Å
45T97.1Very high93.1Very high0 Ų018 Ų180%010%0.102CC..Hα-helixtrans-60.2-48.2176.2-52.70000111S41 L42 A43 L48 V49 L83 S86 W125S41-T45 PolarHBondContact O-N 3.43Å; S41-T45 PolarHBondContact O-OG1 3.1Å; L42-T45 WeakPolarHBondContact O-CA 3.18Å; L42-T45 VanDerWaalsContact O-CB 3.31Å; L42-T45 WeakPolarHBondContact O-CB 3.21Å; L42-T45 PolarHBondContact O-N 2.85Å; L42-T45 VanDerWaalsContact O-N 3.09Å; A43-T45 VanDerWaalsContact C-N 3.35Å; T45-L48 PolarHBondContact O-N 3.46Å; T45-V49 WeakPolarHBondContact O-CG2 3.46Å; T45-V49 PolarHBondContact O-N 3.4Å; T45-V49 VanDerWaalsContact O-N 3.08Å; T45-L83 HydrophobicContact CG2-CB 4.04Å; T45-L83 HydrophobicContact CG2-CD2 3.97Å; T45-L83 WeakPolarHBondContact CG2-O 3.48Å; T45-S86 PolarHBondContact OG1-OG 3.35Å; T45-W125 WeakPolarHBondContact OG1-CZ2 3.48Å
46D97Very high92Very high1 Ų120.4 Ų20.41%0.00511%0.112CC..Hα-helixtrans-65.6-38.6179.2-73.5-28.5000112.5I14 N18 L42 A43 L48 V49 G50 S256 N259I14-D46 WeakPolarHBondContact CG2-O 3.26Å; N18-D46 HydrophobicContact CB-CB 4.45Å; N18-D46 WeakPolarHBondContact ND2-CB 3.46Å; L42-D46 PolarHBondContact O-N 3.38Å; A43-D46 PolarHBondContact O-N 2.98Å; D46-L48 VanDerWaalsContact C-N 3.32Å; D46-L48 PolarHBondContact O-N 2.89Å; D46-V49 WeakPolarHBondContact O-CB 3.45Å; D46-V49 PolarHBondContact O-N 2.97Å; D46-G50 PolarHBondContact O-N 3.41Å; D46-S256 VanDerWaalsContact OD1-CB 3.25Å; D46-S256 WeakPolarHBondContact OD1-CB 3.47Å; D46-S256 PolarHBondContact OD1-OG 3.08Å; D46-N259 PolarHBondContact OD2-ND2 2.92Å
47L97Very high90.6Very high34 Ų3420.4 Ų20.418%0.17811%0.112CC..Hα-helixtrans-60.1-43.6173.6-177.4151.1000111T15 N18 L19 I22 A43 V44 V49 G50 A51T15-L47 HydrophobicContact CG2-CG 4.33Å; N18-L47 HydrophobicContact CB-CB 4.02Å; L19-L47 HydrophobicContact CB-CD1 4Å; L19-L47 HydrophobicContact CD1-CD1 4.2Å; I22-L47 HydrophobicContact CD1-CB 4.35Å; I22-L47 HydrophobicContact CD1-CD1 3.69Å; A43-L47 VanDerWaalsContact O-CB 3.25Å; A43-L47 WeakPolarHBondContact O-CB 3.43Å; A43-L47 PolarHBondContact O-N 3.4Å; V44-L47 PolarHBondContact O-N 2.91Å; L47-V49 VanDerWaalsContact C-N 3.31Å; L47-V49 PolarHBondContact O-N 2.96Å; L47-G50 PolarHBondContact O-N 3.43Å; L47-G50 VanDerWaalsContact O-N 3.17Å; L47-A51 HydrophobicContact CD2-CB 4.4Å; L47-A51 VanDerWaalsContact O-CB 3.3Å; L47-A51 WeakPolarHBondContact O-CB 3.44Å; L47-A51 PolarHBondContact O-N 2.92Å
48L95.1Very high89Confident49 Ų4918.3 Ų18.326%0.25711%0.106SC..Hα-helixtrans-67-31.3177.5-68.2173.1000112.4V44 T45 D46 A51 L52 L83 W125V44-L48 HydrophobicContact CG1-CD1 4.31Å; V44-L48 WeakPolarHBondContact O-CG 3.4Å; V44-L48 PolarHBondContact O-N 3.49Å; T45-L48 PolarHBondContact O-N 3.46Å; D46-L48 VanDerWaalsContact C-N 3.32Å; D46-L48 PolarHBondContact O-N 2.89Å; L48-A51 PolarHBondContact O-N 3.21Å; L48-L52 HydrophobicContact CB-CD1 4.41Å; L48-L52 HydrophobicContact CD2-CD1 3.9Å; L48-L52 HydrophobicContact CD2-CG 4.38Å; L48-L52 WeakPolarHBondContact O-CA 3.46Å; L48-L52 VanDerWaalsContact O-CB 3.26Å; L48-L52 WeakPolarHBondContact O-CB 3.44Å; L48-L52 PolarHBondContact O-N 2.74Å; L48-L83 HydrophobicContact CB-CD1 3.88Å; L48-L83 HydrophobicContact CB-CD2 3.93Å; L48-L83 HydrophobicContact CD1-CD2 4.08Å; L48-W125 HydrophobicContact CD1-CH2 3.81Å; L48-W125 HydrophobicContact CD1-CZ3 4.15Å
49V93.3Very high87.3Confident10 Ų1022.2 Ų22.26%0.06113%0.126CC..Iπ-helixtrans-61.4-47.5169.9173.80000110.2T45 D46 L47 V53 L54 L83 W253T45-V49 WeakPolarHBondContact O-CG2 3.46Å; T45-V49 PolarHBondContact O-N 3.4Å; T45-V49 VanDerWaalsContact O-N 3.08Å; D46-V49 WeakPolarHBondContact O-CB 3.45Å; D46-V49 PolarHBondContact O-N 2.97Å; L47-V49 VanDerWaalsContact C-N 3.31Å; L47-V49 PolarHBondContact O-N 2.96Å; V49-V53 HydrophobicContact CG1-CB 4.34Å; V49-V53 WeakPolarHBondContact O-CB 3.44Å; V49-V53 PolarHBondContact O-N 2.94Å; V49-V53 VanDerWaalsContact O-N 3.13Å; V49-L54 PolarHBondContact O-N 2.69Å; V49-L54 VanDerWaalsContact O-N 3.12Å; V49-L83 HydrophobicContact CG2-CB 3.91Å; V49-L83 HydrophobicContact CG2-CD1 3.87Å; V49-W253 HydrophobicContact CG1-CB 4.33Å; V49-W253 HydrophobicContact CG1-CG 4.27Å
50G91.9Very high85.4Confident0 Ų023.8 Ų23.80%013%0.134CC..Iπ-helixtrans-63.6-40.4177.700000113.5S11 D46 L47 P55S11-G50 PolarHBondContact OG-O 3.16Å; D46-G50 PolarHBondContact O-N 3.41Å; L47-G50 PolarHBondContact O-N 3.43Å; L47-G50 VanDerWaalsContact O-N 3.17Å; G50-P55 WeakPolarHBondContact O-CD 3.28Å
51A91.1Very high83.4Confident42 Ų4225.4 Ų25.435%0.34715%0.148SC..Iπ-helixtrans-87.9-29.4-172.500000114.3L47 L48 P55L47-A51 HydrophobicContact CD2-CB 4.4Å; L47-A51 VanDerWaalsContact O-CB 3.3Å; L47-A51 WeakPolarHBondContact O-CB 3.44Å; L47-A51 PolarHBondContact O-N 2.92Å; L48-A51 PolarHBondContact O-N 3.21Å; A51-P55 WeakPolarHBondContact O-CG 3.48Å
52L86Confident81.2Confident50 Ų5030.8 Ų30.826%0.26218%0.175SC..Iπ-helixtrans-111.4-56.8-176.2-55.2179.2000111L48 F56 F79L48-L52 HydrophobicContact CB-CD1 4.41Å; L48-L52 HydrophobicContact CD2-CD1 3.9Å; L48-L52 HydrophobicContact CD2-CG 4.38Å; L48-L52 WeakPolarHBondContact O-CA 3.46Å; L48-L52 VanDerWaalsContact O-CB 3.26Å; L48-L52 WeakPolarHBondContact O-CB 3.44Å; L48-L52 PolarHBondContact O-N 2.74Å; L52-F56 HydrophobicContact CB-CD2 4.49Å; L52-F56 HydrophobicContact CB-CE2 4.19Å; L52-F56 HydrophobicContact CD2-CE2 4.47Å; L52-F56 WeakPolarHBondContact O-CD2 3.49Å; L52-F56 WeakPolarHBondContact O-CG 3.22Å; L52-F56 PolarHBondContact O-N 3.27Å; L52-F79 HydrophobicContact CD1-CD1 4.17Å; L52-F79 HydrophobicContact CD1-CE1 3.88Å; L52-F79 HydrophobicContact CD1-CZ 4.17Å
53V83.3Confident78.9Confident0 Ų033.1 Ų33.10%019%0.192CC..Iπ-helixtrans-67.3-47.6-169.9-179.10000111.9V49 S57 R76 F79 D80 L83 W253V49-V53 HydrophobicContact CG1-CB 4.34Å; V49-V53 WeakPolarHBondContact O-CB 3.44Å; V49-V53 PolarHBondContact O-N 2.94Å; V49-V53 VanDerWaalsContact O-N 3.13Å; V53-S57 WeakPolarHBondContact O-CB 3.17Å; V53-S57 PolarHBondContact O-N 3.11Å; V53-R76 HydrophobicContact CG1-CG 4.32Å; V53-F79 HydrophobicContact CG2-CB 3.97Å; V53-D80 HydrophobicContact CG1-CB 4.41Å; V53-L83 HydrophobicContact CG2-CD1 3.8Å; V53-W253 HydrophobicContact CG1-CZ2 3.9Å
54L80.8Confident76.1Confident0 Ų038.6 Ų38.60%023%0.23CC..Hα-helixtrans-70-44.3-176.7-67.7-178.9000114L10 I14 V49 F56 S57 T58 W250 W253L10-L54 HydrophobicContact CB-CD1 4.44Å; L10-L54 HydrophobicContact CD2-CD1 4.11Å; L10-L54 HydrophobicContact CG-CD1 4.01Å; I14-L54 HydrophobicContact CD1-CD1 3.56Å; V49-L54 PolarHBondContact O-N 2.69Å; V49-L54 VanDerWaalsContact O-N 3.12Å; L54-F56 VanDerWaalsContact C-N 3.34Å; L54-F56 PolarHBondContact O-N 3.38Å; L54-S57 WeakPolarHBondContact O-CA 3.48Å; L54-S57 VanDerWaalsContact O-CB 3.31Å; L54-S57 WeakPolarHBondContact O-CB 3.49Å; L54-S57 PolarHBondContact O-N 3.42Å; L54-T58 PolarHBondContact O-N 3.28Å; L54-W250 HydrophobicContact CD2-CE3 4.37Å; L54-W250 HydrophobicContact CD2-CH2 3.99Å; L54-W250 HydrophobicContact CD2-CZ3 3.75Å; L54-W253 HydrophobicContact CD2-CB 4.19Å; L54-W253 HydrophobicContact CD2-CD2 3.79Å; L54-W253 HydrophobicContact CD2-CE3 3.35Å; L54-W253 HydrophobicContact CD2-CG 4.17Å; L54-W253 HydrophobicContact CD2-CZ3 3.98Å
55P76.4Confident73.6Confident37 Ų3740.9 Ų40.924%0.2425%0.247CC..Hα-helixtrans-64-37176.5-2839.6000112.8G50 A51 S57 T58 I59G50-P55 WeakPolarHBondContact O-CD 3.28Å; A51-P55 WeakPolarHBondContact O-CG 3.48Å; P55-S57 VanDerWaalsContact C-N 3.29Å; P55-S57 PolarHBondContact O-N 3.19Å; P55-T58 PolarHBondContact O-N 2.99Å; P55-T58 PolarHBondContact O-OG1 3.48Å; P55-I59 WeakPolarHBondContact O-CD1 3.43Å; P55-I59 VanDerWaalsContact O-CG1 3.28Å; P55-I59 WeakPolarHBondContact O-CG1 3.24Å; P55-I59 PolarHBondContact O-N 2.9Å; P55-I59 VanDerWaalsContact O-N 3.12Å
56F69.6Low70.9Confident55 Ų5550.3 Ų50.324%0.24128%0.284CS..Hα-helixtrans-64.6-37.6171.6-67.1-48.2000111.2L52 L54 T58 I59 L60 L72 V75 R76L52-F56 HydrophobicContact CB-CD2 4.49Å; L52-F56 HydrophobicContact CB-CE2 4.19Å; L52-F56 HydrophobicContact CD2-CE2 4.47Å; L52-F56 WeakPolarHBondContact O-CD2 3.49Å; L52-F56 WeakPolarHBondContact O-CG 3.22Å; L52-F56 PolarHBondContact O-N 3.27Å; L54-F56 VanDerWaalsContact C-N 3.34Å; L54-F56 PolarHBondContact O-N 3.38Å; F56-T58 PolarHBondContact O-N 2.92Å; F56-I59 PolarHBondContact O-N 3.26Å; F56-L60 WeakPolarHBondContact O-CB 3.3Å; F56-L60 VanDerWaalsContact O-CD1 3.29Å; F56-L60 WeakPolarHBondContact O-CD1 3.47Å; F56-L60 WeakPolarHBondContact O-CG 3.27Å; F56-L60 PolarHBondContact O-N 3.2Å; F56-L72 HydrophobicContact CD1-CD2 4.02Å; F56-L72 HydrophobicContact CE1-CD2 4.19Å; F56-V75 HydrophobicContact CE2-CG1 4.49Å; F56-R76 HydrophobicContact CB-CB 4.32Å
57S66.1Low68.2Low2 Ų260.7 Ų60.71%0.01433%0.325CS..Hα-helixtrans-64.7-33.5176.4-156.40000113.9V53 L54 P55 S61 R76V53-S57 WeakPolarHBondContact O-CB 3.17Å; V53-S57 PolarHBondContact O-N 3.11Å; L54-S57 WeakPolarHBondContact O-CA 3.48Å; L54-S57 VanDerWaalsContact O-CB 3.31Å; L54-S57 WeakPolarHBondContact O-CB 3.49Å; L54-S57 PolarHBondContact O-N 3.42Å; P55-S57 VanDerWaalsContact C-N 3.29Å; P55-S57 PolarHBondContact O-N 3.19Å; S57-S61 PolarHBondContact O-N 3.22Å; S57-S61 VanDerWaalsContact O-N 3.15Å; S57-S61 PolarHBondContact O-OG 3.36Å; S57-R76 PolarHBondContact OG-NH1 3.45Å
58T62.8Low65.7Low16 Ų1663.7 Ų63.710%0.09835%0.349CS..Hα-helixtrans-76-40.4177540000112.5A7 V8 L54 P55 F56 L60 S61 L62A7-T58 HydrophobicContact CB-CG2 3.19Å; V8-T58 HydrophobicContact CG2-CG2 4.46Å; L54-T58 PolarHBondContact O-N 3.28Å; P55-T58 PolarHBondContact O-N 2.99Å; P55-T58 PolarHBondContact O-OG1 3.48Å; F56-T58 PolarHBondContact O-N 2.92Å; T58-L60 VanDerWaalsContact C-N 3.27Å; T58-L60 PolarHBondContact O-N 2.76Å; T58-S61 PolarHBondContact O-N 3.47Å; T58-S61 VanDerWaalsContact O-N 3.09Å; T58-L62 PolarHBondContact O-N 3.31Å; T58-L62 VanDerWaalsContact O-N 3.12Å
59I61.6Low63.9Low82 Ų8262.5 Ų62.542%0.42135%0.345SS..Hα-helixtrans-60.4-40.7174.2-66.8166.3000110.4P55 F56 S61 L62 S63 L72P55-I59 WeakPolarHBondContact O-CD1 3.43Å; P55-I59 VanDerWaalsContact O-CG1 3.28Å; P55-I59 WeakPolarHBondContact O-CG1 3.24Å; P55-I59 PolarHBondContact O-N 2.9Å; P55-I59 VanDerWaalsContact O-N 3.12Å; F56-I59 PolarHBondContact O-N 3.26Å; I59-S61 VanDerWaalsContact C-N 3.34Å; I59-S61 PolarHBondContact O-N 2.93Å; I59-L62 PolarHBondContact O-N 3.27Å; I59-S63 PolarHBondContact O-N 2.85Å; I59-S63 PolarHBondContact O-OG 3.49Å; I59-L72 HydrophobicContact CG2-CD1 4.03Å
60L56Low62.5Low33 Ų3364.7 Ų64.717%0.17336%0.356CS..Hα-helixtrans-67.1-29.2174.3-85.5153.3000113.7F56 T58 S69 L72 C73 R76F56-L60 WeakPolarHBondContact O-CB 3.3Å; F56-L60 VanDerWaalsContact O-CD1 3.29Å; F56-L60 WeakPolarHBondContact O-CD1 3.47Å; F56-L60 WeakPolarHBondContact O-CG 3.27Å; F56-L60 PolarHBondContact O-N 3.2Å; T58-L60 VanDerWaalsContact C-N 3.27Å; T58-L60 PolarHBondContact O-N 2.76Å; L60-S69 WeakPolarHBondContact CD2-O 3.48Å; L60-L72 HydrophobicContact CD1-CB 4.19Å; L60-L72 HydrophobicContact CD2-CB 4.47Å; L60-L72 HydrophobicContact CG-CB 4.26Å; L60-C73 HydrophobicContact CD1-CB 4.49Å; L60-C73 HydrophobicContact CD2-CB 4.08Å; L60-R76 HydrophobicContact CD1-CB 4.34Å
61S55.4Low61.4Low64 Ų6471.6 Ų71.645%0.44839%0.386SS..Hα-helixtrans-79.8-21.6177.7-59.70000113S57 T58 I59S57-S61 PolarHBondContact O-N 3.22Å; S57-S61 VanDerWaalsContact O-N 3.15Å; S57-S61 PolarHBondContact O-OG 3.36Å; T58-S61 PolarHBondContact O-N 3.47Å; T58-S61 VanDerWaalsContact O-N 3.09Å; I59-S61 VanDerWaalsContact C-N 3.34Å; I59-S61 PolarHBondContact O-N 2.93Å
62L51Low60.4Low119 Ų11971.4 Ų71.462%0.62338%0.379SS*.Hα-helixtrans-88.4-25.5177.3-76.7166000113.1N4 T58 I59N4-L62 WeakPolarHBondContact ND2-CD2 3.44Å; T58-L62 PolarHBondContact O-N 3.31Å; T58-L62 VanDerWaalsContact O-N 3.12Å; I59-L62 PolarHBondContact O-N 3.27Å
63S48.9Very low59.7Low50 Ų5069.2 Ų69.235%0.3537%0.368SS..SBendtrans-96.196.7-179.444.70000110.3I59 C65I59-S63 PolarHBondContact O-N 2.85Å; I59-S63 PolarHBondContact O-OG 3.49Å; S63-C65 PolarHBondContact O-N 2.94Å
64S39.6Very low59.2Low115 Ų11572.2 Ų72.280%0.80438%0.381SS*.  trans-46.8115.8163.9-64.90000109.4Y66S64-Y66 PolarHBondContact O-N 2.65Å
65C46.2Very low58.9Low100 Ų10073.5 Ų73.568%0.67639%0.389SS*.SBendtrans-4.388.8171.6-92.40000115.9S63S63-C65 PolarHBondContact O-N 2.94Å
66Y39.8Very low59Low198 Ų19872.9 Ų72.978%0.77638%0.382SS*.  trans-137.7160.6162.4-138.6-96.6000110.7S64 S68 S69S64-Y66 PolarHBondContact O-N 2.65Å; Y66-S68 PolarHBondContact O-N 2.67Å; Y66-S69 VanDerWaalsContact O-CB 3.3Å; Y66-S69 WeakPolarHBondContact O-CB 3.29Å; Y66-S69 PolarHBondContact O-N 2.99Å; Y66-S69 PolarHBondContact O-OG 3.28Å
67Y41Very low59.2Low218 Ų21871 Ų7186%0.85538%0.378SS*.THydrogen-bonded Turntrans-42.5-27.8-164.8-148.6-101.9000117.1S69Y67-S69 VanDerWaalsContact C-N 3.32Å; Y67-S69 PolarHBondContact O-N 3.03Å
68S43.5Very low59.9Low98 Ų9873.6 Ų73.669%0.68539%0.392SS*.THydrogen-bonded Turntrans-72-18.4175.2-157.10000114.4Y66Y66-S68 PolarHBondContact O-N 2.67Å
69S56.4Low61Low24 Ų2476 Ų7617%0.16840%0.401CS..Hα-helixtrans-73.9-20.3179.361.90000114.4L60 Y66 Y67 C73L60-S69 WeakPolarHBondContact CD2-O 3.48Å; Y66-S69 VanDerWaalsContact O-CB 3.3Å; Y66-S69 WeakPolarHBondContact O-CB 3.29Å; Y66-S69 PolarHBondContact O-N 2.99Å; Y66-S69 PolarHBondContact O-OG 3.28Å; Y67-S69 VanDerWaalsContact C-N 3.32Å; Y67-S69 PolarHBondContact O-N 3.03Å; S69-C73 WeakPolarHBondContact O-CB 3.5Å; S69-C73 PolarHBondContact O-N 3.44Å
70D64.3Low62Low56 Ų5672.9 Ų72.930%0.29939%0.385SS..Hα-helixtrans-73.6-43.6-177.7-16658.5000111.8C73 K74D70-C73 PolarHBondContact O-N 3.47Å; D70-K74 WeakPolarHBondContact O-CB 3.29Å; D70-K74 VanDerWaalsContact O-CG 3.3Å; D70-K74 WeakPolarHBondContact O-CG 3.41Å; D70-K74 PolarHBondContact O-N 2.87Å; D70-K74 WeakPolarHBondContact OD2-CE 3.35Å; D70-K74 IonicContact OD2-NZ 3.98Å; D70-K74 PolarHBondContact OD2-NZ 3.46Å
71F69.6Low63.2Low144 Ų14475.3 Ų75.363%0.63240%0.397SS*.Hα-helixtrans-63.9-47.3176.6178.2-103.2000111.9C73 K74 V75F71-C73 VanDerWaalsContact C-N 3.35Å; F71-C73 PolarHBondContact O-N 2.88Å; F71-K74 WeakPolarHBondContact O-CA 3.33Å; F71-K74 WeakPolarHBondContact O-CB 2.98Å; F71-K74 PolarHBondContact O-N 3.21Å; F71-K74 VanDerWaalsContact O-N 3.14Å; F71-V75 HydrophobicContact CD1-CG2 4.19Å; F71-V75 HydrophobicContact CD2-CG2 4.29Å; F71-V75 HydrophobicContact CE1-CG2 3.75Å; F71-V75 HydrophobicContact CE2-CG2 3.86Å; F71-V75 HydrophobicContact CG-CG2 4.45Å; F71-V75 HydrophobicContact CZ-CG2 3.58Å; F71-V75 WeakPolarHBondContact O-CG2 3.28Å; F71-V75 PolarHBondContact O-N 2.74Å
72L70.4Confident64.8Low38 Ų3873.3 Ų73.320%0.19938%0.382CS..Hα-helixtrans-65.7-37178.1-67.5175.6000112F56 I59 L60 K74 R76F56-L72 HydrophobicContact CD1-CD2 4.02Å; F56-L72 HydrophobicContact CE1-CD2 4.19Å; I59-L72 HydrophobicContact CG2-CD1 4.03Å; L60-L72 HydrophobicContact CD1-CB 4.19Å; L60-L72 HydrophobicContact CD2-CB 4.47Å; L60-L72 HydrophobicContact CG-CB 4.26Å; L72-K74 VanDerWaalsContact C-N 3.31Å; L72-R76 VanDerWaalsContact O-CB 3.24Å; L72-R76 WeakPolarHBondContact O-CB 3.3Å; L72-R76 PolarHBondContact O-N 3.33Å
73C70.4Confident66.8Low4 Ų467.8 Ų67.83%0.02735%0.353CS..Hα-helixtrans-62.1-41.3172.1168.90000110.9L60 S69 D70 F71 G77 C149L60-C73 HydrophobicContact CD1-CB 4.49Å; L60-C73 HydrophobicContact CD2-CB 4.08Å; S69-C73 WeakPolarHBondContact O-CB 3.5Å; S69-C73 PolarHBondContact O-N 3.44Å; D70-C73 PolarHBondContact O-N 3.47Å; F71-C73 VanDerWaalsContact C-N 3.35Å; F71-C73 PolarHBondContact O-N 2.88Å; C73-G77 PolarHBondContact O-N 3.08Å; C73-C149 HydrophobicContact CB-CB 4.1Å; C73-C149 WeakPolarHBondContact CB-SG 3.39Å; C73-C149 WeakPolarHBondContact SG-CB 3.19Å; C73-C149 CovalentContact SG-SG 2.05Å; C73-C149 PolarHBondContact SG-SG 3.36Å
74K72.6Confident68.7Low64 Ų6466.2 Ų66.228%0.27834%0.341SS..Hα-helixtrans-60-56174.6-73.5173.8-175.61790112.9D70 F71 L72 R76 G77 L78 E143 I151D70-K74 WeakPolarHBondContact O-CB 3.29Å; D70-K74 VanDerWaalsContact O-CG 3.3Å; D70-K74 WeakPolarHBondContact O-CG 3.41Å; D70-K74 PolarHBondContact O-N 2.87Å; D70-K74 WeakPolarHBondContact OD2-CE 3.35Å; D70-K74 IonicContact OD2-NZ 3.98Å; D70-K74 PolarHBondContact OD2-NZ 3.46Å; F71-K74 WeakPolarHBondContact O-CA 3.33Å; F71-K74 WeakPolarHBondContact O-CB 2.98Å; F71-K74 PolarHBondContact O-N 3.21Å; F71-K74 VanDerWaalsContact O-N 3.14Å; L72-K74 VanDerWaalsContact C-N 3.31Å; K74-R76 VanDerWaalsContact C-N 3.34Å; K74-R76 PolarHBondContact O-N 3.22Å; K74-G77 PolarHBondContact O-N 3.14Å; K74-L78 VanDerWaalsContact O-CG 3.3Å; K74-L78 WeakPolarHBondContact O-CG 3.19Å; K74-L78 PolarHBondContact O-N 3.45Å; K74-E143 IonicContact NZ-OE1 2.99Å; K74-E143 PolarHBondContact NZ-OE1 3.44Å; K74-I151 HydrophobicContact CB-CD1 3.89Å; K74-I151 HydrophobicContact CG-CD1 3.51Å; K74-I151 HydrophobicContact CG-CG1 4.49Å
75V74.8Confident71.1Confident27 Ų2761.7 Ų61.716%0.16431%0.311CS..Hα-helixtrans-58.2-45.9178.6173.50000111.3F56 F71 G77 L78 F79F56-V75 HydrophobicContact CE2-CG1 4.49Å; F71-V75 HydrophobicContact CD1-CG2 4.19Å; F71-V75 HydrophobicContact CD2-CG2 4.29Å; F71-V75 HydrophobicContact CE1-CG2 3.75Å; F71-V75 HydrophobicContact CE2-CG2 3.86Å; F71-V75 HydrophobicContact CG-CG2 4.45Å; F71-V75 HydrophobicContact CZ-CG2 3.58Å; F71-V75 WeakPolarHBondContact O-CG2 3.28Å; F71-V75 PolarHBondContact O-N 2.74Å; V75-G77 PolarHBondContact O-N 2.58Å; V75-L78 PolarHBondContact O-N 3.46Å; V75-F79 HydrophobicContact CG1-CD2 3.59Å; V75-F79 HydrophobicContact CG1-CE2 3.49Å; V75-F79 VanDerWaalsContact CG1-CE2 3.49Å; V75-F79 VanDerWaalsContact O-CD2 3.27Å; V75-F79 WeakPolarHBondContact O-CD2 3.44Å; V75-F79 PolarHBondContact O-N 3.46Å
76R78.2Confident73.4Confident24 Ų2457 Ų579%0.09128%0.279CS..Hα-helixtrans-56.2-50.2176.1-176.3-17372.3133.70.3111.8V53 F56 S57 L60 L72 K74 L78 F79 D80 E246V53-R76 HydrophobicContact CG1-CG 4.32Å; F56-R76 HydrophobicContact CB-CB 4.32Å; S57-R76 PolarHBondContact OG-NH1 3.45Å; L60-R76 HydrophobicContact CD1-CB 4.34Å; L72-R76 VanDerWaalsContact O-CB 3.24Å; L72-R76 WeakPolarHBondContact O-CB 3.3Å; L72-R76 PolarHBondContact O-N 3.33Å; K74-R76 VanDerWaalsContact C-N 3.34Å; K74-R76 PolarHBondContact O-N 3.22Å; R76-L78 VanDerWaalsContact C-N 3.32Å; R76-L78 PolarHBondContact O-N 2.94Å; R76-F79 PolarHBondContact O-N 3.25Å; R76-D80 WeakPolarHBondContact O-CB 3.18Å; R76-D80 PolarHBondContact O-N 2.86Å; R76-E246 IonicContact NH1-OE2 2.79Å; R76-E246 PolarHBondContact NH1-OE2 2.91Å; R76-E246 IonicContact NH2-OE1 3.89Å; R76-E246 IonicContact NH2-OE2 2.76Å
77G75.3Confident76Confident16 Ų1647.8 Ų47.817%0.16524%0.244CC..Hα-helixtrans-63.3-36.6-178.600000113.3C73 K74 V75 L81C73-G77 PolarHBondContact O-N 3.08Å; K74-G77 PolarHBondContact O-N 3.14Å; V75-G77 PolarHBondContact O-N 2.58Å; G77-L81 PolarHBondContact O-N 2.89Å; G77-L81 VanDerWaalsContact O-N 3.08Å
78L80.3Confident78.4Confident56 Ų5637.7 Ų37.729%0.29321%0.205SC..Hα-helixtrans-66.5-46176.1-65.8172.8000111.7K74 V75 R76 L81 L82 L132 I136K74-L78 VanDerWaalsContact O-CG 3.3Å; K74-L78 WeakPolarHBondContact O-CG 3.19Å; K74-L78 PolarHBondContact O-N 3.45Å; V75-L78 PolarHBondContact O-N 3.46Å; R76-L78 VanDerWaalsContact C-N 3.32Å; R76-L78 PolarHBondContact O-N 2.94Å; L78-L81 PolarHBondContact O-N 3.14Å; L78-L82 VanDerWaalsContact O-CB 3.32Å; L78-L82 WeakPolarHBondContact O-CB 3.29Å; L78-L82 PolarHBondContact O-N 2.88Å; L78-L132 HydrophobicContact CB-CD1 4.1Å; L78-L132 HydrophobicContact CB-CD2 4.43Å; L78-L132 HydrophobicContact CD2-CD1 3.52Å; L78-L132 HydrophobicContact CD2-CG 4.32Å; L78-L132 HydrophobicContact CG-CD1 4.4Å; L78-I136 HydrophobicContact CD1-CD1 4.31Å; L78-I136 HydrophobicContact CD2-CD1 3.97Å; L78-I136 HydrophobicContact CD2-CG1 3.83Å
79F85.1Confident80.8Confident67 Ų6734.9 Ų34.929%0.29418%0.182SC..Hα-helixtrans-64.8-39.7176.1-81.8-66.2000112.3L52 V53 V75 R76 L82 L83L52-F79 HydrophobicContact CD1-CD1 4.17Å; L52-F79 HydrophobicContact CD1-CE1 3.88Å; L52-F79 HydrophobicContact CD1-CZ 4.17Å; V53-F79 HydrophobicContact CG2-CB 3.97Å; V75-F79 HydrophobicContact CG1-CD2 3.59Å; V75-F79 HydrophobicContact CG1-CE2 3.49Å; V75-F79 VanDerWaalsContact CG1-CE2 3.49Å; V75-F79 VanDerWaalsContact O-CD2 3.27Å; V75-F79 WeakPolarHBondContact O-CD2 3.44Å; V75-F79 PolarHBondContact O-N 3.46Å; R76-F79 PolarHBondContact O-N 3.25Å; F79-L82 PolarHBondContact O-N 3.14Å; F79-L83 HydrophobicContact CB-CD1 4.48Å; F79-L83 VanDerWaalsContact O-CB 3.29Å; F79-L83 WeakPolarHBondContact O-CB 3.31Å; F79-L83 VanDerWaalsContact O-CG 3.23Å; F79-L83 WeakPolarHBondContact O-CG 3.49Å; F79-L83 PolarHBondContact O-N 3.41Å
80D82.3Confident82.7Confident16 Ų1633.7 Ų33.79%0.08617%0.174CC..Hα-helixtrans-61-47.2177.4-167.439.2000111.2V53 R76 L82 C84 W253V53-D80 HydrophobicContact CG1-CB 4.41Å; R76-D80 WeakPolarHBondContact O-CB 3.18Å; R76-D80 PolarHBondContact O-N 2.86Å; D80-L82 PolarHBondContact O-N 3.36Å; D80-C84 WeakPolarHBondContact O-CB 3.43Å; D80-C84 PolarHBondContact O-N 3.46Å; D80-W253 PolarHBondContact OD1-NE1 3.32Å
81L81.5Confident84.1Confident83 Ų8331.1 Ų31.144%0.43516%0.16SC..Hα-helixtrans-61.5-46.6176.2-178.463.3000112.1G77 L78 A85 L132 V135G77-L81 PolarHBondContact O-N 2.89Å; G77-L81 VanDerWaalsContact O-N 3.08Å; L78-L81 PolarHBondContact O-N 3.14Å; L81-A85 WeakPolarHBondContact O-CB 3.33Å; L81-A85 PolarHBondContact O-N 3.29Å; L81-A85 VanDerWaalsContact O-N 3.09Å; L81-L132 HydrophobicContact CD2-CD1 4.02Å; L81-V135 HydrophobicContact CD2-CG2 4.49Å
82L89.8Confident85.3Confident22 Ų2225.3 Ų25.312%0.11514%0.137CC..Hα-helixtrans-62.1-51.5-178.7178.768000112L78 F79 D80 A85 S86 P128 I129 L132L78-L82 VanDerWaalsContact O-CB 3.32Å; L78-L82 WeakPolarHBondContact O-CB 3.29Å; L78-L82 PolarHBondContact O-N 2.88Å; F79-L82 PolarHBondContact O-N 3.14Å; D80-L82 PolarHBondContact O-N 3.36Å; L82-A85 PolarHBondContact O-N 3.42Å; L82-S86 WeakPolarHBondContact O-CB 3.46Å; L82-S86 PolarHBondContact O-N 2.92Å; L82-P128 HydrophobicContact CD1-CB 3.61Å; L82-I129 HydrophobicContact CD1-CB 4.36Å; L82-I129 HydrophobicContact CD1-CG1 3.64Å; L82-L132 HydrophobicContact CB-CD2 4.28Å; L82-L132 HydrophobicContact CD1-CD2 4.45Å; L82-L132 HydrophobicContact CD2-CD2 4.49Å
83L92.5Very high86.5Confident4 Ų425.3 Ų25.32%0.02114%0.136CC..Hα-helixtrans-73.3-34.4-174.5-64.5172.8000111.5T45 L48 V49 V53 F79 S86 S87 W125T45-L83 HydrophobicContact CG2-CB 4.04Å; T45-L83 HydrophobicContact CG2-CD2 3.97Å; T45-L83 WeakPolarHBondContact CG2-O 3.48Å; L48-L83 HydrophobicContact CB-CD1 3.88Å; L48-L83 HydrophobicContact CB-CD2 3.93Å; L48-L83 HydrophobicContact CD1-CD2 4.08Å; V49-L83 HydrophobicContact CG2-CB 3.91Å; V49-L83 HydrophobicContact CG2-CD1 3.87Å; V53-L83 HydrophobicContact CG2-CD1 3.8Å; F79-L83 HydrophobicContact CB-CD1 4.48Å; F79-L83 VanDerWaalsContact O-CB 3.29Å; F79-L83 WeakPolarHBondContact O-CB 3.31Å; F79-L83 VanDerWaalsContact O-CG 3.23Å; F79-L83 WeakPolarHBondContact O-CG 3.49Å; F79-L83 PolarHBondContact O-N 3.41Å; L83-S86 PolarHBondContact O-N 3.48Å; L83-S87 VanDerWaalsContact O-CB 3.29Å; L83-S87 WeakPolarHBondContact O-CB 3.41Å; L83-S87 PolarHBondContact O-N 2.71Å; L83-W125 HydrophobicContact CD2-CH2 4.32Å; L83-W125 HydrophobicContact CD2-CZ3 4.17Å
84C88.9Confident87.6Confident16 Ų1625.2 Ų25.211%0.10814%0.135CC..Hα-helixtrans-62.3-48.9172.1-171.70000111D80 S86 S87 I88 W223D80-C84 WeakPolarHBondContact O-CB 3.43Å; D80-C84 PolarHBondContact O-N 3.46Å; C84-S86 PolarHBondContact O-N 3.16Å; C84-S87 WeakPolarHBondContact O-CB 3.34Å; C84-S87 PolarHBondContact O-N 3.21Å; C84-I88 WeakPolarHBondContact O-CG1 3.47Å; C84-I88 PolarHBondContact O-N 3.39Å; C84-W223 HydrophobicContact CB-CH2 4.32Å
85A89.8Confident88.6Confident21 Ų2122.1 Ų22.117%0.17412%0.121CC..Hα-helixtrans-62.8-40.9177.800000112.5L81 L82 I88 L89 P128L81-A85 WeakPolarHBondContact O-CB 3.33Å; L81-A85 PolarHBondContact O-N 3.29Å; L81-A85 VanDerWaalsContact O-N 3.09Å; L82-A85 PolarHBondContact O-N 3.42Å; A85-I88 PolarHBondContact O-N 2.97Å; A85-L89 WeakPolarHBondContact O-CG 3.08Å; A85-L89 PolarHBondContact O-N 3.19Å; A85-L89 VanDerWaalsContact O-N 3.09Å; A85-P128 HydrophobicContact CB-CB 3.89Å; A85-P128 HydrophobicContact CB-CG 3.93Å
86S94.8Very high89.4Confident0 Ų023 Ų230%013%0.126CC..Hα-helixtrans-61.2-45.5173.31780000111.8T45 L82 L83 C84 I88 L89 N90 S124T45-S86 PolarHBondContact OG1-OG 3.35Å; L82-S86 WeakPolarHBondContact O-CB 3.46Å; L82-S86 PolarHBondContact O-N 2.92Å; L83-S86 PolarHBondContact O-N 3.48Å; C84-S86 PolarHBondContact O-N 3.16Å; S86-I88 VanDerWaalsContact C-N 3.34Å; S86-I88 PolarHBondContact O-N 2.91Å; S86-L89 PolarHBondContact O-N 3.08Å; S86-N90 WeakPolarHBondContact O-CB 3.46Å; S86-N90 PolarHBondContact O-N 3.49Å; S86-N90 PolarHBondContact O-ND2 3Å; S86-N90 PolarHBondContact OG-ND2 3.05Å; S86-S124 WeakPolarHBondContact CA-O 3.27Å; S86-S124 WeakPolarHBondContact CB-O 3.41Å; S86-S124 PolarHBondContact OG-O 3.35Å
87S94.4Very high90.2Very high6 Ų621.9 Ų21.94%0.04212%0.122CC..Hα-helixtrans-58.7-45.3178.3-171.50000111.6L42 L83 C84 L89 N90 L91L42-S87 VanDerWaalsContact CD1-OG 3.3Å; L42-S87 WeakPolarHBondContact CD1-OG 3.36Å; L83-S87 VanDerWaalsContact O-CB 3.29Å; L83-S87 WeakPolarHBondContact O-CB 3.41Å; L83-S87 PolarHBondContact O-N 2.71Å; C84-S87 WeakPolarHBondContact O-CB 3.34Å; C84-S87 PolarHBondContact O-N 3.21Å; S87-L89 PolarHBondContact O-N 3.46Å; S87-N90 PolarHBondContact O-N 3.32Å; S87-L91 WeakPolarHBondContact O-CG 3.35Å; S87-L91 PolarHBondContact O-N 3.46Å
88I91.9Very high90.9Very high6 Ų622 Ų223%0.03112%0.118CC..Hα-helixtrans-62.3-45.2178.2-67.7172.6000111.7C84 A85 S86 L91 C92 A165 P169 F219C84-I88 WeakPolarHBondContact O-CG1 3.47Å; C84-I88 PolarHBondContact O-N 3.39Å; A85-I88 PolarHBondContact O-N 2.97Å; S86-I88 VanDerWaalsContact C-N 3.34Å; S86-I88 PolarHBondContact O-N 2.91Å; I88-L91 PolarHBondContact O-N 3.04Å; I88-C92 PolarHBondContact O-N 3.25Å; I88-C92 PolarHBondContact O-SG 2.79Å; I88-A165 WeakPolarHBondContact CD1-O 3.36Å; I88-P169 HydrophobicContact CG2-CB 3.43Å; I88-P169 VanDerWaalsContact CG2-CB 3.43Å; I88-P169 HydrophobicContact CG2-CG 3.72Å; I88-F219 HydrophobicContact CD1-CE1 4.2Å; I88-F219 HydrophobicContact CD1-CZ 3.78Å; I88-F219 HydrophobicContact CG1-CE1 3.7Å; I88-F219 HydrophobicContact CG1-CE2 4.14Å; I88-F219 HydrophobicContact CG1-CZ 3.24Å
89L94Very high91.4Very high38 Ų3821.8 Ų21.820%0.19911%0.113CC..Hα-helixtrans-65.4-41.2177.6-71.6171.7000111.8A85 S86 S87 L91 C92 F93 L127 P128A85-L89 WeakPolarHBondContact O-CG 3.08Å; A85-L89 PolarHBondContact O-N 3.19Å; A85-L89 VanDerWaalsContact O-N 3.09Å; S86-L89 PolarHBondContact O-N 3.08Å; S87-L89 PolarHBondContact O-N 3.46Å; L89-L91 VanDerWaalsContact C-N 3.34Å; L89-L91 PolarHBondContact O-N 3.27Å; L89-C92 WeakPolarHBondContact O-CB 3.24Å; L89-C92 PolarHBondContact O-N 2.9Å; L89-F93 HydrophobicContact CB-CE2 4.4Å; L89-F93 WeakPolarHBondContact O-CD2 3.46Å; L89-F93 WeakPolarHBondContact O-CG 3.48Å; L89-F93 PolarHBondContact O-N 2.89Å; L89-L127 HydrophobicContact CD1-CB 4.14Å; L89-L127 HydrophobicContact CD1-CD2 3.95Å; L89-L127 HydrophobicContact CD1-CG 4.28Å; L89-L127 HydrophobicContact CD2-CD2 4.33Å; L89-P128 HydrophobicContact CD1-CG 3.61Å
90N96Very high91.7Very high0 Ų022.5 Ų22.50%012%0.115CC..Hα-helixtrans-58.9-45.4173.3-76.6-64.5000110.9S41 L42 S86 S87 C92 F93 I94 S124S41-N90 WeakPolarHBondContact CB-OD1 3.17Å; S41-N90 PolarHBondContact OG-OD1 3.26Å; L42-N90 HydrophobicContact CB-CB 4.23Å; L42-N90 HydrophobicContact CD1-CB 4.2Å; S86-N90 WeakPolarHBondContact O-CB 3.46Å; S86-N90 PolarHBondContact O-N 3.49Å; S86-N90 PolarHBondContact O-ND2 3Å; S86-N90 PolarHBondContact OG-ND2 3.05Å; S87-N90 PolarHBondContact O-N 3.32Å; N90-C92 PolarHBondContact O-N 2.99Å; N90-F93 PolarHBondContact O-N 3.14Å; N90-I94 VanDerWaalsContact O-CG1 3.23Å; N90-I94 WeakPolarHBondContact O-CG1 3.34Å; N90-I94 PolarHBondContact O-N 3.08Å; N90-S124 PolarHBondContact ND2-OG 3.01Å; N90-S124 PolarHBondContact OD1-OG 3.1Å
91L93.4Very high92Very high2 Ų222.8 Ų22.81%0.0112%0.119CC..Hα-helixtrans-63.6-38.4176.1-69.8170.8000112.8L42 S87 I88 L89 I94 S95 I173 V215 M216 F219L42-L91 HydrophobicContact CD1-CG 4.5Å; L42-L91 HydrophobicContact CD2-CD2 3.77Å; L42-L91 HydrophobicContact CD2-CG 4.39Å; S87-L91 WeakPolarHBondContact O-CG 3.35Å; S87-L91 PolarHBondContact O-N 3.46Å; I88-L91 PolarHBondContact O-N 3.04Å; L89-L91 VanDerWaalsContact C-N 3.34Å; L89-L91 PolarHBondContact O-N 3.27Å; L91-I94 PolarHBondContact O-N 3.17Å; L91-S95 WeakPolarHBondContact O-CB 3.34Å; L91-S95 PolarHBondContact O-N 2.92Å; L91-S95 PolarHBondContact O-OG 2.84Å; L91-I173 HydrophobicContact CB-CD1 4.08Å; L91-V215 HydrophobicContact CD2-CG1 3.9Å; L91-M216 HydrophobicContact CD2-CG 3.95Å; L91-M216 WeakPolarHBondContact O-CE 3.46Å; L91-F219 HydrophobicContact CD1-CB 3.72Å; L91-F219 HydrophobicContact CD1-CD1 3.78Å; L91-F219 HydrophobicContact CD1-CD2 3.43Å; L91-F219 VanDerWaalsContact CD1-CD2 3.43Å; L91-F219 HydrophobicContact CD1-CE1 4.33Å; L91-F219 HydrophobicContact CD1-CE2 4.02Å; L91-F219 HydrophobicContact CD1-CG 3.32Å; L91-F219 HydrophobicContact CD1-CZ 4.46Å
92C94.1Very high92.2Very high22 Ų2219.2 Ų19.215%0.14910%0.101CC..Hα-helixtrans-61.2-47.1173.2-70.10000111.2I88 L89 N90 S95 V96I88-C92 PolarHBondContact O-N 3.25Å; I88-C92 PolarHBondContact O-SG 2.79Å; L89-C92 WeakPolarHBondContact O-CB 3.24Å; L89-C92 PolarHBondContact O-N 2.9Å; N90-C92 PolarHBondContact O-N 2.99Å; C92-S95 WeakPolarHBondContact O-CA 3.27Å; C92-S95 VanDerWaalsContact O-CB 3.26Å; C92-S95 WeakPolarHBondContact O-CB 2.96Å; C92-S95 PolarHBondContact O-N 3.26Å; C92-S95 VanDerWaalsContact O-N 3.11Å; C92-V96 WeakPolarHBondContact O-CG2 3.44Å; C92-V96 PolarHBondContact O-N 3.48Å
93F95.6Very high92Very high38 Ų3824 Ų2417%0.16712%0.117CC..Hα-helixtrans-68.1-36.5179-68-45.9000113L38 L89 N90 S95 V96 D97 M120 V123L38-F93 HydrophobicContact CD1-CB 4.35Å; L38-F93 HydrophobicContact CD2-CB 4.18Å; L89-F93 HydrophobicContact CB-CE2 4.4Å; L89-F93 WeakPolarHBondContact O-CD2 3.46Å; L89-F93 WeakPolarHBondContact O-CG 3.48Å; L89-F93 PolarHBondContact O-N 2.89Å; N90-F93 PolarHBondContact O-N 3.14Å; F93-S95 VanDerWaalsContact C-N 3.26Å; F93-S95 PolarHBondContact O-N 3.47Å; F93-V96 PolarHBondContact O-N 3.12Å; F93-D97 WeakPolarHBondContact O-CB 3.36Å; F93-D97 PolarHBondContact O-N 3.38Å; F93-M120 HydrophobicContact CB-CB 4.07Å; F93-M120 HydrophobicContact CB-CG 4.27Å; F93-M120 HydrophobicContact CB-SD 3.98Å; F93-M120 HydrophobicContact CD1-CB 4.11Å; F93-M120 HydrophobicContact CD1-CE 4.33Å; F93-M120 HydrophobicContact CD1-CG 3.74Å; F93-M120 HydrophobicContact CD1-SD 4.04Å; F93-M120 HydrophobicContact CD2-CB 3.78Å; F93-M120 HydrophobicContact CD2-CG 4.34Å; F93-M120 WeakPolarHBondContact CD2-O 3.33Å; F93-M120 HydrophobicContact CE1-CG 4.13Å; F93-M120 HydrophobicContact CE2-CB 4.22Å; F93-M120 WeakPolarHBondContact CE2-O 3.39Å; F93-M120 HydrophobicContact CG-CB 3.73Å; F93-M120 HydrophobicContact CG-CG 3.87Å; F93-M120 HydrophobicContact CG-SD 4.16Å; F93-V123 HydrophobicContact CE2-CB 4.13Å; F93-V123 HydrophobicContact CE2-CG1 4.03Å; F93-V123 HydrophobicContact CZ-CB 4.13Å; F93-V123 HydrophobicContact CZ-CG1 3.77Å
94I95.1Very high91.6Very high1 Ų127.9 Ų27.91%0.00514%0.136CC..Hα-helixtrans-59-42.2169.6-67.5165.6000109.8L38 I39 L42 N90 L91 V96 D97 R98 L212 M216L38-I94 HydrophobicContact CB-CD1 4.31Å; L38-I94 HydrophobicContact CB-CG1 3.57Å; L38-I94 HydrophobicContact CD1-CG1 4.25Å; I39-I94 HydrophobicContact CG1-CD1 4.35Å; L42-I94 HydrophobicContact CD2-CD1 4.06Å; N90-I94 VanDerWaalsContact O-CG1 3.23Å; N90-I94 WeakPolarHBondContact O-CG1 3.34Å; N90-I94 PolarHBondContact O-N 3.08Å; L91-I94 PolarHBondContact O-N 3.17Å; I94-V96 PolarHBondContact O-N 3.31Å; I94-D97 PolarHBondContact O-N 3.49Å; I94-R98 HydrophobicContact CG2-CG 4.41Å; I94-R98 WeakPolarHBondContact O-CB 3.48Å; I94-R98 VanDerWaalsContact O-CG 3.3Å; I94-R98 WeakPolarHBondContact O-CG 3.02Å; I94-R98 PolarHBondContact O-N 3.12Å; I94-L212 HydrophobicContact CG2-CD1 4.17Å; I94-L212 HydrophobicContact CG2-CD2 4.01Å; I94-L212 HydrophobicContact CG2-CG 4.48Å; I94-M216 HydrophobicContact CB-CE 3.86Å; I94-M216 HydrophobicContact CG2-CE 3.45Å; I94-M216 VanDerWaalsContact CG2-CE 3.45Å
95S92.3Very high91.5Very high0 Ų031 Ų310%016%0.155CC..Hα-helixtrans-62.1-43.6177.2-55.70000112.1L91 C92 F93 R98 Y99 Y177 M216L91-S95 WeakPolarHBondContact O-CB 3.34Å; L91-S95 PolarHBondContact O-N 2.92Å; L91-S95 PolarHBondContact O-OG 2.84Å; C92-S95 WeakPolarHBondContact O-CA 3.27Å; C92-S95 VanDerWaalsContact O-CB 3.26Å; C92-S95 WeakPolarHBondContact O-CB 2.96Å; C92-S95 PolarHBondContact O-N 3.26Å; C92-S95 VanDerWaalsContact O-N 3.11Å; F93-S95 VanDerWaalsContact C-N 3.26Å; F93-S95 PolarHBondContact O-N 3.47Å; S95-R98 PolarHBondContact O-N 3.46Å; S95-Y99 WeakPolarHBondContact O-CB 3.2Å; S95-Y99 PolarHBondContact O-N 3.35Å; S95-Y177 WeakPolarHBondContact OG-CE2 3.23Å; S95-M216 WeakPolarHBondContact OG-CE 3.44Å; S95-M216 PolarHBondContact OG-SD 3.46Å
96V92.9Very high91.3Very high45 Ų4537.9 Ų37.927%0.27319%0.188SC..Hα-helixtrans-62.9-46.7176.31720000111.3C92 F93 I94 R98 Y99 Y100 M120C92-V96 WeakPolarHBondContact O-CG2 3.44Å; C92-V96 PolarHBondContact O-N 3.48Å; F93-V96 PolarHBondContact O-N 3.12Å; I94-V96 PolarHBondContact O-N 3.31Å; V96-R98 VanDerWaalsContact C-N 3.34Å; V96-R98 PolarHBondContact O-N 3.25Å; V96-Y99 WeakPolarHBondContact O-CB 3.4Å; V96-Y99 PolarHBondContact O-N 3.46Å; V96-Y100 HydrophobicContact CG1-CD2 3.9Å; V96-Y100 HydrophobicContact CG1-CE2 3.83Å; V96-Y100 WeakPolarHBondContact O-CD2 3.48Å; V96-Y100 PolarHBondContact O-N 3.12Å; V96-M120 HydrophobicContact CG1-CE 4.14Å
97D93.5Very high91Very high0 Ų042.5 Ų42.50%021%0.211CC..Hα-helixtrans-56-48.7175.6170.575.7000111.4T35 L38 F93 I94 Y99 Y100 A101 Y108 M112T35-D97 WeakPolarHBondContact CB-OD2 3.4Å; T35-D97 WeakPolarHBondContact CG2-OD2 3.34Å; T35-D97 PolarHBondContact OG1-OD2 3.02Å; L38-D97 HydrophobicContact CD1-CB 3.96Å; F93-D97 WeakPolarHBondContact O-CB 3.36Å; F93-D97 PolarHBondContact O-N 3.38Å; I94-D97 PolarHBondContact O-N 3.49Å; D97-Y99 VanDerWaalsContact C-N 3.34Å; D97-Y99 PolarHBondContact O-N 2.73Å; D97-Y100 PolarHBondContact O-N 3.29Å; D97-A101 WeakPolarHBondContact O-CB 3.12Å; D97-A101 PolarHBondContact O-N 3.02Å; D97-Y108 WeakPolarHBondContact OD1-CE2 3.12Å; D97-Y108 PolarHBondContact OD1-OH 2.71Å; D97-M112 HydrophobicContact CB-CE 3.68Å; D97-M112 WeakPolarHBondContact OD1-CE 3.27Å
98R91.4Very high90.8Very high19 Ų1944.3 Ų44.37%0.07222%0.217CC..Hα-helixtrans-65-37.3177.9-70.6-55.293-173.6-16.1112.9T35 I94 S95 V96 A101 V102 Y108 I180 N209 L212T35-R98 PolarHBondContact OG1-NH2 2.96Å; I94-R98 HydrophobicContact CG2-CG 4.41Å; I94-R98 WeakPolarHBondContact O-CB 3.48Å; I94-R98 VanDerWaalsContact O-CG 3.3Å; I94-R98 WeakPolarHBondContact O-CG 3.02Å; I94-R98 PolarHBondContact O-N 3.12Å; S95-R98 PolarHBondContact O-N 3.46Å; V96-R98 VanDerWaalsContact C-N 3.34Å; V96-R98 PolarHBondContact O-N 3.25Å; R98-A101 PolarHBondContact O-N 3.4Å; R98-V102 WeakPolarHBondContact O-CG2 3.45Å; R98-V102 PolarHBondContact O-N 2.88Å; R98-V102 VanDerWaalsContact O-N 3.1Å; R98-Y108 PolarHBondContact NH2-OH 3Å; R98-I180 HydrophobicContact CB-CD1 3.93Å; R98-N209 VanDerWaalsContact CD-OD1 3.27Å; R98-N209 WeakPolarHBondContact CD-OD1 3.37Å; R98-L212 VanDerWaalsContact CD-CD1 3.49Å; R98-L212 HydrophobicContact CG-CD1 3.69Å
99Y89.8Confident90.6Very high51 Ų5154.6 Ų54.620%0.226%0.256CS..Hα-helixtrans-58.1-53175179.4-100.3000110.5S95 V96 D97 A101 V102 R103 I176 K179S95-Y99 WeakPolarHBondContact O-CB 3.2Å; S95-Y99 PolarHBondContact O-N 3.35Å; V96-Y99 WeakPolarHBondContact O-CB 3.4Å; V96-Y99 PolarHBondContact O-N 3.46Å; D97-Y99 VanDerWaalsContact C-N 3.34Å; D97-Y99 PolarHBondContact O-N 2.73Å; Y99-A101 VanDerWaalsContact C-N 3.35Å; Y99-A101 PolarHBondContact O-N 2.89Å; Y99-V102 PolarHBondContact O-N 2.94Å; Y99-R103 HydrophobicContact CD2-CG 4.18Å; Y99-R103 HydrophobicContact CE1-CB 4.43Å; Y99-R103 HydrophobicContact CE1-CG 4.5Å; Y99-R103 HydrophobicContact CE2-CB 4.41Å; Y99-R103 HydrophobicContact CE2-CG 3.69Å; Y99-R103 VanDerWaalsContact O-CB 3.3Å; Y99-R103 WeakPolarHBondContact O-CB 3.36Å; Y99-R103 PolarHBondContact O-N 3.46Å; Y99-I176 HydrophobicContact CD2-CG2 4.2Å; Y99-I176 HydrophobicContact CG-CG2 4.41Å; Y99-K179 HydrophobicContact CE2-CB 4.49Å; Y99-K179 HydrophobicContact CE2-CD 4.39Å
100Y91.1Very high90.4Very high82 Ų8258.5 Ų58.532%0.32228%0.277SS..Hα-helixtrans-62.2-41.2178.5-81.5-71.7000112.6V96 D97 V102 H104 M112V96-Y100 HydrophobicContact CG1-CD2 3.9Å; V96-Y100 HydrophobicContact CG1-CE2 3.83Å; V96-Y100 WeakPolarHBondContact O-CD2 3.48Å; V96-Y100 PolarHBondContact O-N 3.12Å; D97-Y100 PolarHBondContact O-N 3.29Å; Y100-V102 VanDerWaalsContact C-N 3.28Å; Y100-V102 PolarHBondContact O-N 3.48Å; Y100-H104 CarbonylContact O-C 3.58Å; Y100-H104 PolarHBondContact O-N 3.29Å; Y100-M112 HydrophobicContact CD2-CG 4.39Å; Y100-M112 HydrophobicContact CD2-SD 4.21Å; Y100-M112 HydrophobicContact CG-CG 4.37Å
101A89Confident90.1Very high22 Ų2264 Ų6418%0.18230%0.301CS..Hα-helixtrans-59-38.1179.300000112.8D97 R98 Y99 Y108D97-A101 WeakPolarHBondContact O-CB 3.12Å; D97-A101 PolarHBondContact O-N 3.02Å; R98-A101 PolarHBondContact O-N 3.4Å; Y99-A101 VanDerWaalsContact C-N 3.35Å; Y99-A101 PolarHBondContact O-N 2.89Å; A101-Y108 VanDerWaalsContact CA-CD2 3.4Å; A101-Y108 HydrophobicContact CB-CD2 3.71Å; A101-Y108 HydrophobicContact CB-CE2 3.65Å; A101-Y108 HydrophobicContact CB-CG 4.31Å
102V85.9Confident90.1Very high9 Ų964.2 Ų64.26%0.05530%0.302CS..Hα-helixtrans-90.1-42.5-176.9177.70000112.5R98 Y99 Y100 I180 V183 Q187 N209R98-V102 WeakPolarHBondContact O-CG2 3.45Å; R98-V102 PolarHBondContact O-N 2.88Å; R98-V102 VanDerWaalsContact O-N 3.1Å; Y99-V102 PolarHBondContact O-N 2.94Å; Y100-V102 VanDerWaalsContact C-N 3.28Å; Y100-V102 PolarHBondContact O-N 3.48Å; V102-I180 HydrophobicContact CB-CG2 4.4Å; V102-I180 HydrophobicContact CG1-CG2 4.28Å; V102-I180 HydrophobicContact CG2-CG2 4.04Å; V102-V183 HydrophobicContact CG1-CB 4.23Å; V102-V183 HydrophobicContact CG1-CG1 3.87Å; V102-Q187 PolarHBondContact O-NE2 3.4Å; V102-N209 WeakPolarHBondContact CG2-ND2 3.34Å
103R84.8Confident90.1Very high121 Ų12165.9 Ų65.946%0.45731%0.309SS..Hα-helixtrans-77.9-38.3-175.2-92.2-70.9-118.9-164.69113.5Y99 P105 V183Y99-R103 HydrophobicContact CD2-CG 4.18Å; Y99-R103 HydrophobicContact CE1-CB 4.43Å; Y99-R103 HydrophobicContact CE1-CG 4.5Å; Y99-R103 HydrophobicContact CE2-CB 4.41Å; Y99-R103 HydrophobicContact CE2-CG 3.69Å; Y99-R103 VanDerWaalsContact O-CB 3.3Å; Y99-R103 WeakPolarHBondContact O-CB 3.36Å; Y99-R103 PolarHBondContact O-N 3.46Å; R103-P105 VanDerWaalsContact C-CD 3.49Å; R103-V183 HydrophobicContact CG-CG2 4.22Å
104H85.4Confident89.9Confident87 Ų8767.4 Ų67.440%0.40332%0.322SS..  trans-131.662.4-172.5-59.5-68.4000110.8Y100 L106 M107 Y108Y100-H104 CarbonylContact O-C 3.58Å; Y100-H104 PolarHBondContact O-N 3.29Å; H104-L106 VanDerWaalsContact C-N 3.27Å; H104-L106 PolarHBondContact O-N 3.31Å; H104-M107 HydrophobicContact CB-CB 4.24Å; H104-M107 PolarHBondContact O-N 2.91Å; H104-Y108 PolarHBondContact O-N 2.92Å
105P85.3Confident89.8Confident80 Ų8077.6 Ų77.652%0.51936%0.36SS..Hα-helixtrans-58.8-34.9-172.323-34.1000113.6R103R103-P105 VanDerWaalsContact C-CD 3.49Å
106L86.6Confident90Very high167 Ų16779.8 Ų79.887%0.87437%0.373SS*.Hα-helixtrans-70.9-33.2178.7-59.8178.9000112.8H104H104-L106 VanDerWaalsContact C-N 3.27Å; H104-L106 PolarHBondContact O-N 3.31Å
107M88.7Confident90.2Very high97 Ų9777.6 Ų77.648%0.47836%0.36SS..Hα-helixtrans-91.5-15-179.9-62.1-63.7-72.200112.4H104 R109 N110 K111H104-M107 HydrophobicContact CB-CB 4.24Å; H104-M107 PolarHBondContact O-N 2.91Å; M107-R109 VanDerWaalsContact C-N 3.33Å; M107-R109 PolarHBondContact O-N 2.88Å; M107-N110 PolarHBondContact O-N 2.9Å; M107-N110 VanDerWaalsContact O-N 3.08Å; M107-K111 HydrophobicContact CB-CG 4.47Å; M107-K111 PolarHBondContact O-N 3.42Å
108Y89.9Confident90.3Very high44 Ų4480.8 Ų80.817%0.17338%0.379CS..Hα-helixtrans-53-48.4-175.8170.3-101.1000111.7D97 R98 A101 H104 N110 K111 M112D97-Y108 WeakPolarHBondContact OD1-CE2 3.12Å; D97-Y108 PolarHBondContact OD1-OH 2.71Å; R98-Y108 PolarHBondContact NH2-OH 3Å; A101-Y108 VanDerWaalsContact CA-CD2 3.4Å; A101-Y108 HydrophobicContact CB-CD2 3.71Å; A101-Y108 HydrophobicContact CB-CE2 3.65Å; A101-Y108 HydrophobicContact CB-CG 4.31Å; H104-Y108 PolarHBondContact O-N 2.92Å; Y108-N110 PolarHBondContact O-N 3.1Å; Y108-K111 PolarHBondContact O-N 3.14Å; Y108-M112 HydrophobicContact CD2-CB 3.71Å; Y108-M112 HydrophobicContact CD2-CG 3.8Å; Y108-M112 HydrophobicContact CE2-CB 3.45Å; Y108-M112 VanDerWaalsContact CE2-CB 3.45Å; Y108-M112 HydrophobicContact CE2-CG 3.74Å; Y108-M112 HydrophobicContact CG-CB 4.47Å; Y108-M112 WeakPolarHBondContact O-CA 3.37Å; Y108-M112 WeakPolarHBondContact O-CB 3.47Å; Y108-M112 PolarHBondContact O-N 3.36Å
109R87.4Confident90.6Very high222 Ų22283.9 Ų83.984%0.83840%0.401SS*.Hα-helixtrans-65-26.4-177.2-167.8167.3179.7160.7-2.3113.6M107M107-R109 VanDerWaalsContact C-N 3.33Å; M107-R109 PolarHBondContact O-N 2.88Å
110N89.8Confident90.9Very high119 Ų11982.7 Ų82.764%0.63640%0.397SS*.Hα-helixtrans-84-37.2176.3-167.226.5000111.8M107 Y108M107-N110 PolarHBondContact O-N 2.9Å; M107-N110 VanDerWaalsContact O-N 3.08Å; Y108-N110 PolarHBondContact O-N 3.1Å
111K91.1Very high91.3Very high116 Ų11680.2 Ų80.250%0.50439%0.389SS..Hα-helixtrans-85.1-35.1-177.1-70.1-67.2-172.9179.30114M107 Y108M107-K111 HydrophobicContact CB-CG 4.47Å; M107-K111 PolarHBondContact O-N 3.42Å; Y108-K111 PolarHBondContact O-N 3.14Å
112M93.3Very high91.7Very high6 Ų684 Ų843%0.0341%0.406CS..SBendtrans-118.3102.2-177.9-63.9-57.9-57.900109.1D97 Y100 Y108 V116 M120D97-M112 HydrophobicContact CB-CE 3.68Å; D97-M112 WeakPolarHBondContact OD1-CE 3.27Å; Y100-M112 HydrophobicContact CD2-CG 4.39Å; Y100-M112 HydrophobicContact CD2-SD 4.21Å; Y100-M112 HydrophobicContact CG-CG 4.37Å; Y108-M112 HydrophobicContact CD2-CB 3.71Å; Y108-M112 HydrophobicContact CD2-CG 3.8Å; Y108-M112 HydrophobicContact CE2-CB 3.45Å; Y108-M112 VanDerWaalsContact CE2-CB 3.45Å; Y108-M112 HydrophobicContact CE2-CG 3.74Å; Y108-M112 HydrophobicContact CG-CB 4.47Å; Y108-M112 WeakPolarHBondContact O-CA 3.37Å; Y108-M112 WeakPolarHBondContact O-CB 3.47Å; Y108-M112 PolarHBondContact O-N 3.36Å; M112-V116 HydrophobicContact CE-CG1 4.27Å; M112-V116 HydrophobicContact SD-CG1 4.17Å; M112-M120 HydrophobicContact CE-CE 3.84Å; M112-M120 HydrophobicContact CE-SD 3.87Å; M112-M120 HydrophobicContact SD-CE 4.06Å
113N93.2Very high92.2Very high57 Ų5786.5 Ų86.531%0.30542%0.421SS..  trans-130.3175.3176.365.145.9000109.9R115 V116 S117N113-R115 VanDerWaalsContact C-N 3.26Å; N113-R115 PolarHBondContact O-N 3.09Å; N113-R115 WeakPolarHBondContact OD1-CA 3.45Å; N113-R115 WeakPolarHBondContact OD1-CB 3.38Å; N113-R115 PolarHBondContact OD1-N 2.82Å; N113-V116 PolarHBondContact O-N 3.19Å; N113-V116 VanDerWaalsContact O-N 3.17Å; N113-V116 PolarHBondContact OD1-N 2.95Å; N113-S117 PolarHBondContact O-N 3.2Å; N113-S117 PolarHBondContact O-OG 3.07Å
114V91.1Very high92.8Very high71 Ų7180.7 Ų80.743%0.4340%0.399SS..Hα-helixtrans-58.2-37.8-177.1179.40000112.1Y37 S117 V118Y37-V114 HydrophobicContact CD2-CG1 4.38Å; Y37-V114 HydrophobicContact CE2-CG1 4.02Å; Y37-V114 HydrophobicContact CE2-CG2 4.05Å; V114-S117 PolarHBondContact O-N 3.15Å; V114-V118 HydrophobicContact CG1-CG2 4.32Å; V114-V118 WeakPolarHBondContact O-CG2 3.2Å; V114-V118 PolarHBondContact O-N 3.34Å
115R94.3Very high93.4Very high214 Ų21479.3 Ų79.381%0.80839%0.39SS*.Hα-helixtrans-62.8-46.4178.7-60.5-178.8-179.5177-0.4110.9N113 S117 V118 T119N113-R115 VanDerWaalsContact C-N 3.26Å; N113-R115 PolarHBondContact O-N 3.09Å; N113-R115 WeakPolarHBondContact OD1-CA 3.45Å; N113-R115 WeakPolarHBondContact OD1-CB 3.38Å; N113-R115 PolarHBondContact OD1-N 2.82Å; R115-S117 PolarHBondContact O-N 3.42Å; R115-V118 PolarHBondContact O-N 3.12Å; R115-T119 PolarHBondContact O-N 3.35Å; R115-T119 PolarHBondContact O-OG1 3.16Å; R115-T119 VanDerWaalsContact O-OG1 3.08Å
116V96.2Very high94Very high46 Ų4679.1 Ų79.128%0.27939%0.387SS..Hα-helixtrans-61.7-43.9176.7176.40000111.1M112 N113 V118 T119 M120M112-V116 HydrophobicContact CE-CG1 4.27Å; M112-V116 HydrophobicContact SD-CG1 4.17Å; N113-V116 PolarHBondContact O-N 3.19Å; N113-V116 VanDerWaalsContact O-N 3.17Å; N113-V116 PolarHBondContact OD1-N 2.95Å; V116-V118 PolarHBondContact O-N 3.44Å; V116-T119 PolarHBondContact O-N 3.49Å; V116-M120 HydrophobicContact CG1-CE 3.75Å; V116-M120 HydrophobicContact CG1-SD 4.22Å; V116-M120 WeakPolarHBondContact O-CG 3.39Å; V116-M120 PolarHBondContact O-N 3.04Å
117S95.6Very high94.3Very high0 Ų074.6 Ų74.60%036%0.363CS..Hα-helixtrans-59.7-44.2175-68.10000112.3P34 N113 V114 R115 M120 I121P34-S117 VanDerWaalsContact CA-OG 3.27Å; P34-S117 WeakPolarHBondContact CA-OG 3.38Å; P34-S117 VanDerWaalsContact CB-OG 3.24Å; P34-S117 WeakPolarHBondContact CB-OG 3.1Å; P34-S117 PolarHBondContact O-OG 3.16Å; P34-S117 VanDerWaalsContact O-OG 3.12Å; N113-S117 PolarHBondContact O-N 3.2Å; N113-S117 PolarHBondContact O-OG 3.07Å; V114-S117 PolarHBondContact O-N 3.15Å; R115-S117 PolarHBondContact O-N 3.42Å; S117-M120 WeakPolarHBondContact O-CB 3.41Å; S117-M120 PolarHBondContact O-N 3.19Å; S117-I121 VanDerWaalsContact O-CG1 3.25Å; S117-I121 WeakPolarHBondContact O-CG1 3.45Å; S117-I121 PolarHBondContact O-N 2.7Å
118V96.1Very high94.5Very high67 Ų6770 Ų7041%0.40634%0.341SS..Hα-helixtrans-63.3-42.3176.71710000110.9V114 R115 V116 M120 I121 L122V114-V118 HydrophobicContact CG1-CG2 4.32Å; V114-V118 WeakPolarHBondContact O-CG2 3.2Å; V114-V118 PolarHBondContact O-N 3.34Å; R115-V118 PolarHBondContact O-N 3.12Å; V116-V118 PolarHBondContact O-N 3.44Å; V118-M120 PolarHBondContact O-N 3.11Å; V118-I121 WeakPolarHBondContact O-CB 3.46Å; V118-I121 PolarHBondContact O-N 3.11Å; V118-L122 HydrophobicContact CG1-CD1 4.26Å; V118-L122 HydrophobicContact CG1-CG 4.45Å; V118-L122 WeakPolarHBondContact O-CG 3.32Å; V118-L122 PolarHBondContact O-N 3.22Å
119T97.3Very high94.6Very high84 Ų8471.4 Ų71.452%0.51535%0.351SS..Hα-helixtrans-60-44.4174-56.20000111.8R115 V116 I121 L122 V123R115-T119 PolarHBondContact O-N 3.35Å; R115-T119 PolarHBondContact O-OG1 3.16Å; R115-T119 VanDerWaalsContact O-OG1 3.08Å; V116-T119 PolarHBondContact O-N 3.49Å; T119-I121 VanDerWaalsContact C-N 3.31Å; T119-I121 PolarHBondContact O-N 3.06Å; T119-L122 PolarHBondContact O-N 3.2Å; T119-V123 WeakPolarHBondContact O-CG2 3.37Å; T119-V123 PolarHBondContact O-N 2.89Å
120M97.6Very high94.8Very high25 Ų2565.6 Ų65.612%0.12334%0.336CS..Hα-helixtrans-60.1-40.8175.5-73.5174.5173.600112L38 F93 V96 M112 V116 S117 V118 V123 S124L38-M120 HydrophobicContact CD1-SD 4.47Å; L38-M120 HydrophobicContact CD2-CB 3.93Å; F93-M120 HydrophobicContact CB-CB 4.07Å; F93-M120 HydrophobicContact CB-CG 4.27Å; F93-M120 HydrophobicContact CB-SD 3.98Å; F93-M120 HydrophobicContact CD1-CB 4.11Å; F93-M120 HydrophobicContact CD1-CE 4.33Å; F93-M120 HydrophobicContact CD1-CG 3.74Å; F93-M120 HydrophobicContact CD1-SD 4.04Å; F93-M120 HydrophobicContact CD2-CB 3.78Å; F93-M120 HydrophobicContact CD2-CG 4.34Å; F93-M120 WeakPolarHBondContact CD2-O 3.33Å; F93-M120 HydrophobicContact CE1-CG 4.13Å; F93-M120 HydrophobicContact CE2-CB 4.22Å; F93-M120 WeakPolarHBondContact CE2-O 3.39Å; F93-M120 HydrophobicContact CG-CB 3.73Å; F93-M120 HydrophobicContact CG-CG 3.87Å; F93-M120 HydrophobicContact CG-SD 4.16Å; V96-M120 HydrophobicContact CG1-CE 4.14Å; M112-M120 HydrophobicContact CE-CE 3.84Å; M112-M120 HydrophobicContact CE-SD 3.87Å; M112-M120 HydrophobicContact SD-CE 4.06Å; V116-M120 HydrophobicContact CG1-CE 3.75Å; V116-M120 HydrophobicContact CG1-SD 4.22Å; V116-M120 WeakPolarHBondContact O-CG 3.39Å; V116-M120 PolarHBondContact O-N 3.04Å; S117-M120 WeakPolarHBondContact O-CB 3.41Å; S117-M120 PolarHBondContact O-N 3.19Å; V118-M120 PolarHBondContact O-N 3.11Å; M120-V123 PolarHBondContact O-N 3.39Å; M120-S124 PolarHBondContact O-N 3.37Å
121I98.3Very high94.5Very high31 Ų3164.5 Ų64.516%0.15933%0.329CS..Hα-helixtrans-62.8-49.4174.5-67.2166.1000110.1Y37 L38 S117 V118 T119 V123 S124 W125Y37-I121 WeakPolarHBondContact O-CD1 3.33Å; L38-I121 HydrophobicContact CD2-CD1 4.5Å; L38-I121 HydrophobicContact CD2-CG1 3.87Å; S117-I121 VanDerWaalsContact O-CG1 3.25Å; S117-I121 WeakPolarHBondContact O-CG1 3.45Å; S117-I121 PolarHBondContact O-N 2.7Å; V118-I121 WeakPolarHBondContact O-CB 3.46Å; V118-I121 PolarHBondContact O-N 3.11Å; T119-I121 VanDerWaalsContact C-N 3.31Å; T119-I121 PolarHBondContact O-N 3.06Å; I121-V123 VanDerWaalsContact C-N 3.26Å; I121-V123 PolarHBondContact O-N 3.21Å; I121-S124 WeakPolarHBondContact CA-OG 3.14Å; I121-S124 PolarHBondContact O-N 3.35Å; I121-S124 PolarHBondContact O-OG 3.36Å; I121-W125 PolarHBondContact O-N 2.89Å; I121-W125 VanDerWaalsContact O-N 3.14Å
122L97.9Very high94.3Very high102 Ų10260.1 Ų60.153%0.53431%0.311SS..Hα-helixtrans-57.2-42.3178.5-69173.2000111.5V118 T119 W125 V126V118-L122 HydrophobicContact CG1-CD1 4.26Å; V118-L122 HydrophobicContact CG1-CG 4.45Å; V118-L122 WeakPolarHBondContact O-CG 3.32Å; V118-L122 PolarHBondContact O-N 3.22Å; T119-L122 PolarHBondContact O-N 3.2Å; L122-W125 PolarHBondContact O-N 3.06Å; L122-V126 VanDerWaalsContact O-CB 3.32Å; L122-V126 WeakPolarHBondContact O-CB 3.28Å; L122-V126 VanDerWaalsContact O-CG2 3.25Å; L122-V126 WeakPolarHBondContact O-CG2 3.25Å; L122-V126 PolarHBondContact O-N 3.36Å
123V97.4Very high93.9Very high60 Ų6064 Ų6436%0.36433%0.331SS..Hα-helixtrans-63.7-40.3175.2174.40000111.7F93 T119 M120 I121 W125 L127F93-V123 HydrophobicContact CE2-CB 4.13Å; F93-V123 HydrophobicContact CE2-CG1 4.03Å; F93-V123 HydrophobicContact CZ-CB 4.13Å; F93-V123 HydrophobicContact CZ-CG1 3.77Å; T119-V123 WeakPolarHBondContact O-CG2 3.37Å; T119-V123 PolarHBondContact O-N 2.89Å; M120-V123 PolarHBondContact O-N 3.39Å; I121-V123 VanDerWaalsContact C-N 3.26Å; I121-V123 PolarHBondContact O-N 3.21Å; V123-W125 PolarHBondContact O-N 3.03Å; V123-L127 VanDerWaalsContact O-CB 3.28Å; V123-L127 WeakPolarHBondContact O-CB 3.32Å; V123-L127 PolarHBondContact O-N 3.09Å
124S96.8Very high93.4Very high0 Ų063.3 Ų63.30%033%0.334CS..Hα-helixtrans-67.6-19.5179.769.50000113.8S86 N90 M120 I121 P128S86-S124 WeakPolarHBondContact CA-O 3.27Å; S86-S124 WeakPolarHBondContact CB-O 3.41Å; S86-S124 PolarHBondContact OG-O 3.35Å; N90-S124 PolarHBondContact ND2-OG 3.01Å; N90-S124 PolarHBondContact OD1-OG 3.1Å; M120-S124 PolarHBondContact O-N 3.37Å; I121-S124 WeakPolarHBondContact CA-OG 3.14Å; I121-S124 PolarHBondContact O-N 3.35Å; I121-S124 PolarHBondContact O-OG 3.36Å; S124-P128 WeakPolarHBondContact O-CD 3.17Å; S124-P128 WeakPolarHBondContact O-CG 3.18Å
125W97.5Very high92.8Very high58 Ų5863.3 Ų63.322%0.2233%0.334CS..Hα-helixtrans-95-46.6172.3-71.697.3000112.9S41 V44 T45 L48 L83 I121 L122 V123 P128 I129S41-W125 PolarHBondContact OG-NE1 3.24Å; S41-W125 VanDerWaalsContact OG-NE1 3.15Å; V44-W125 HydrophobicContact CB-CZ2 4.33Å; V44-W125 HydrophobicContact CG1-CH2 4.11Å; V44-W125 HydrophobicContact CG1-CZ2 3.87Å; T45-W125 WeakPolarHBondContact OG1-CZ2 3.48Å; L48-W125 HydrophobicContact CD1-CH2 3.81Å; L48-W125 HydrophobicContact CD1-CZ3 4.15Å; L83-W125 HydrophobicContact CD2-CH2 4.32Å; L83-W125 HydrophobicContact CD2-CZ3 4.17Å; I121-W125 PolarHBondContact O-N 2.89Å; I121-W125 VanDerWaalsContact O-N 3.14Å; L122-W125 PolarHBondContact O-N 3.06Å; V123-W125 PolarHBondContact O-N 3.03Å; W125-P128 WeakPolarHBondContact O-CD 3.34Å; W125-I129 WeakPolarHBondContact O-CD1 3.48Å; W125-I129 VanDerWaalsContact O-CG1 3.22Å; W125-I129 WeakPolarHBondContact O-CG1 3.44Å; W125-I129 PolarHBondContact O-N 2.94Å
126V97.1Very high92Very high75 Ų7556.6 Ų56.646%0.45531%0.313SS..Hα-helixtrans-68.8-43.7-174.1172.70000111.5L122 I129 L130L122-V126 VanDerWaalsContact O-CB 3.32Å; L122-V126 WeakPolarHBondContact O-CB 3.28Å; L122-V126 VanDerWaalsContact O-CG2 3.25Å; L122-V126 WeakPolarHBondContact O-CG2 3.25Å; L122-V126 PolarHBondContact O-N 3.36Å; V126-I129 PolarHBondContact O-N 3.45Å; V126-L130 HydrophobicContact CG1-CD1 3.88Å; V126-L130 HydrophobicContact CG1-CG 4.18Å; V126-L130 WeakPolarHBondContact O-CG 3.25Å; V126-L130 PolarHBondContact O-N 3Å
127L93.5Very high91.2Very high72 Ų7258.8 Ų58.838%0.37733%0.327SS..Hα-helixtrans-62.7-46.7-177.2178.463.5000112.2L89 V123 I129 L130 L131L89-L127 HydrophobicContact CD1-CB 4.14Å; L89-L127 HydrophobicContact CD1-CD2 3.95Å; L89-L127 HydrophobicContact CD1-CG 4.28Å; L89-L127 HydrophobicContact CD2-CD2 4.33Å; V123-L127 VanDerWaalsContact O-CB 3.28Å; V123-L127 WeakPolarHBondContact O-CB 3.32Å; V123-L127 PolarHBondContact O-N 3.09Å; L127-I129 VanDerWaalsContact C-N 3.33Å; L127-I129 PolarHBondContact O-N 2.91Å; L127-L130 PolarHBondContact O-N 3.03Å; L127-L131 HydrophobicContact CD1-CG 4.44Å; L127-L131 HydrophobicContact CG-CD1 4.37Å; L127-L131 WeakPolarHBondContact O-CG 3.4Å; L127-L131 PolarHBondContact O-N 3.14Å
128P92.7Very high90.2Very high2 Ų267 Ų671%0.01336%0.357CS..Hα-helixtrans-59.4-37.6172.3-31.641.6000114.5L82 A85 L89 S124 W125 L131 L132L82-P128 HydrophobicContact CD1-CB 3.61Å; A85-P128 HydrophobicContact CB-CB 3.89Å; A85-P128 HydrophobicContact CB-CG 3.93Å; L89-P128 HydrophobicContact CD1-CG 3.61Å; S124-P128 WeakPolarHBondContact O-CD 3.17Å; S124-P128 WeakPolarHBondContact O-CG 3.18Å; W125-P128 WeakPolarHBondContact O-CD 3.34Å; P128-L131 PolarHBondContact O-N 3.39Å; P128-L132 WeakPolarHBondContact O-CB 3.34Å; P128-L132 PolarHBondContact O-N 3.39Å
129I93.1Very high88.7Confident73 Ų7365.6 Ų65.637%0.37436%0.357SS..Hα-helixtrans-62.8-45.9175.8-69168000110.3L82 W125 V126 L127 L131 L132 I133L82-I129 HydrophobicContact CD1-CB 4.36Å; L82-I129 HydrophobicContact CD1-CG1 3.64Å; W125-I129 WeakPolarHBondContact O-CD1 3.48Å; W125-I129 VanDerWaalsContact O-CG1 3.22Å; W125-I129 WeakPolarHBondContact O-CG1 3.44Å; W125-I129 PolarHBondContact O-N 2.94Å; V126-I129 PolarHBondContact O-N 3.45Å; L127-I129 VanDerWaalsContact C-N 3.33Å; L127-I129 PolarHBondContact O-N 2.91Å; I129-L131 VanDerWaalsContact C-N 3.34Å; I129-L131 PolarHBondContact O-N 3.46Å; I129-L132 WeakPolarHBondContact O-CB 3.42Å; I129-L132 PolarHBondContact O-N 2.97Å; I129-I133 HydrophobicContact CG2-CD1 3.81Å; I129-I133 HydrophobicContact CG2-CG1 4.45Å; I129-I133 VanDerWaalsContact O-CG1 3.31Å; I129-I133 WeakPolarHBondContact O-CG1 3.47Å; I129-I133 PolarHBondContact O-N 3.26Å
130L91Very high86.7Confident99 Ų9967.9 Ų67.952%0.51836%0.364SS..Hα-helixtrans-62.2-41.9177.6-68.6174.3000111.9V126 L127 L132 I133 A134V126-L130 HydrophobicContact CG1-CD1 3.88Å; V126-L130 HydrophobicContact CG1-CG 4.18Å; V126-L130 WeakPolarHBondContact O-CG 3.25Å; V126-L130 PolarHBondContact O-N 3Å; L127-L130 PolarHBondContact O-N 3.03Å; L130-L132 VanDerWaalsContact C-N 3.34Å; L130-I133 PolarHBondContact O-N 3.41Å; L130-A134 WeakPolarHBondContact O-CB 3.33Å; L130-A134 PolarHBondContact O-N 3.02Å
131L84.6Confident84.4Confident96 Ų9670.4 Ų70.450%0.50340%0.397SS..Hα-helixtrans-62.2-42174.6-69.3173.8000111.5L127 P128 I129 A134 V135L127-L131 HydrophobicContact CD1-CG 4.44Å; L127-L131 HydrophobicContact CG-CD1 4.37Å; L127-L131 WeakPolarHBondContact O-CG 3.4Å; L127-L131 PolarHBondContact O-N 3.14Å; P128-L131 PolarHBondContact O-N 3.39Å; I129-L131 VanDerWaalsContact C-N 3.34Å; I129-L131 PolarHBondContact O-N 3.46Å; L131-A134 PolarHBondContact O-N 2.93Å; L131-V135 WeakPolarHBondContact O-CG2 3.37Å; L131-V135 PolarHBondContact O-N 3.27Å
132L85.2Confident82.4Confident24 Ų2477.7 Ų77.713%0.12643%0.428CS..Hα-helixtrans-62-47176.8-174.468.6000111.5L78 L81 L82 P128 I129 L130 A134 V135 I136L78-L132 HydrophobicContact CB-CD1 4.1Å; L78-L132 HydrophobicContact CB-CD2 4.43Å; L78-L132 HydrophobicContact CD2-CD1 3.52Å; L78-L132 HydrophobicContact CD2-CG 4.32Å; L78-L132 HydrophobicContact CG-CD1 4.4Å; L81-L132 HydrophobicContact CD2-CD1 4.02Å; L82-L132 HydrophobicContact CB-CD2 4.28Å; L82-L132 HydrophobicContact CD1-CD2 4.45Å; L82-L132 HydrophobicContact CD2-CD2 4.49Å; P128-L132 WeakPolarHBondContact O-CB 3.34Å; P128-L132 PolarHBondContact O-N 3.39Å; I129-L132 WeakPolarHBondContact O-CB 3.42Å; I129-L132 PolarHBondContact O-N 2.97Å; L130-L132 VanDerWaalsContact C-N 3.34Å; L132-A134 VanDerWaalsContact C-N 3.31Å; L132-A134 PolarHBondContact O-N 3.28Å; L132-V135 PolarHBondContact O-N 3.41Å; L132-I136 HydrophobicContact CG-CD1 4.03Å; L132-I136 WeakPolarHBondContact O-CG1 3.28Å; L132-I136 PolarHBondContact O-N 2.87Å
133I86.2Confident80.2Confident87 Ų8779.7 Ų79.745%0.44643%0.434SS..Hα-helixtrans-59.3-45176.9-67.9165.9000110.1I129 L130 V135 I136 V137I129-I133 HydrophobicContact CG2-CD1 3.81Å; I129-I133 HydrophobicContact CG2-CG1 4.45Å; I129-I133 VanDerWaalsContact O-CG1 3.31Å; I129-I133 WeakPolarHBondContact O-CG1 3.47Å; I129-I133 PolarHBondContact O-N 3.26Å; L130-I133 PolarHBondContact O-N 3.41Å; I133-V135 VanDerWaalsContact C-N 3.32Å; I133-V135 PolarHBondContact O-N 2.96Å; I133-I136 PolarHBondContact O-N 3.32Å; I133-V137 HydrophobicContact CG2-CG2 4.21Å; I133-V137 WeakPolarHBondContact O-CB 3.33Å; I133-V137 VanDerWaalsContact O-CG2 3.29Å; I133-V137 WeakPolarHBondContact O-CG2 3.11Å; I133-V137 PolarHBondContact O-N 3.04Å
134A83Confident77.8Confident44 Ų4479.9 Ų79.936%0.36444%0.438SS..Hα-helixtrans-60.5-40177.400000112.6L130 L131 L132 R138L130-A134 WeakPolarHBondContact O-CB 3.33Å; L130-A134 PolarHBondContact O-N 3.02Å; L131-A134 PolarHBondContact O-N 2.93Å; L132-A134 VanDerWaalsContact C-N 3.31Å; L132-A134 PolarHBondContact O-N 3.28Å; A134-R138 WeakPolarHBondContact O-CB 3.48Å; A134-R138 VanDerWaalsContact O-CG 3.31Å; A134-R138 WeakPolarHBondContact O-CG 3.29Å; A134-R138 PolarHBondContact O-N 3.14Å; A134-R138 VanDerWaalsContact O-N 3.1Å
135V76.8Confident75.5Confident71 Ų7186.9 Ų86.943%0.4348%0.484SS..Hα-helixtrans-64.9-45.8175.3169.80000111.2L81 L131 L132 I133 R138 G139L81-V135 HydrophobicContact CD2-CG2 4.49Å; L131-V135 WeakPolarHBondContact O-CG2 3.37Å; L131-V135 PolarHBondContact O-N 3.27Å; L132-V135 PolarHBondContact O-N 3.41Å; I133-V135 VanDerWaalsContact C-N 3.32Å; I133-V135 PolarHBondContact O-N 2.96Å; V135-R138 PolarHBondContact O-N 2.85Å; V135-G139 PolarHBondContact O-N 3.21Å; V135-G139 VanDerWaalsContact O-N 3.11Å
136I77.6Confident73Confident73 Ų7395.4 Ų95.437%0.37452%0.516SS..Hα-helixtrans-60.4-50.5178.2-67.7166.4000109.9L78 L132 I133 R138 G139 I140L78-I136 HydrophobicContact CD1-CD1 4.31Å; L78-I136 HydrophobicContact CD2-CD1 3.97Å; L78-I136 HydrophobicContact CD2-CG1 3.83Å; L132-I136 HydrophobicContact CG-CD1 4.03Å; L132-I136 WeakPolarHBondContact O-CG1 3.28Å; L132-I136 PolarHBondContact O-N 2.87Å; I133-I136 PolarHBondContact O-N 3.32Å; I136-R138 VanDerWaalsContact C-N 3.33Å; I136-R138 PolarHBondContact O-N 3.43Å; I136-G139 WeakPolarHBondContact O-CA 3.21Å; I136-G139 PolarHBondContact O-N 2.93Å; I136-I140 WeakPolarHBondContact O-CG1 3.49Å; I136-I140 PolarHBondContact O-N 2.9Å
137V80.7Confident70.7Confident92 Ų9294.5 Ų94.556%0.55851%0.513SS*.Hα-helixtrans-59.5-41.4-178.5171.30000111.9I133 G139 I140I133-V137 HydrophobicContact CG2-CG2 4.21Å; I133-V137 WeakPolarHBondContact O-CB 3.33Å; I133-V137 VanDerWaalsContact O-CG2 3.29Å; I133-V137 WeakPolarHBondContact O-CG2 3.11Å; I133-V137 PolarHBondContact O-N 3.04Å; V137-G139 VanDerWaalsContact C-N 3.25Å; V137-G139 PolarHBondContact O-N 3.25Å; V137-I140 PolarHBondContact O-N 2.88Å
138R74.3Confident68.5Low172 Ų17299.1 Ų99.165%0.64953%0.53SS*.Hα-helixtrans-68-23.3175.3-73.1178.4-176.9-174.92.5113.7A134 V135 I136 E157A134-R138 WeakPolarHBondContact O-CB 3.48Å; A134-R138 VanDerWaalsContact O-CG 3.31Å; A134-R138 WeakPolarHBondContact O-CG 3.29Å; A134-R138 PolarHBondContact O-N 3.14Å; A134-R138 VanDerWaalsContact O-N 3.1Å; V135-R138 PolarHBondContact O-N 2.85Å; I136-R138 VanDerWaalsContact C-N 3.33Å; I136-R138 PolarHBondContact O-N 3.43Å; R138-E157 IonicContact NH1-OE2 3.26Å; R138-E157 PolarHBondContact NH1-OE2 2.99Å
139G64.7Low66.6Low38 Ų38102.2 Ų102.239%0.39255%0.551SS.*Hα-helixtrans-83.8-22.2179.800000114.2V135 I136 V137 G141 K142V135-G139 PolarHBondContact O-N 3.21Å; V135-G139 VanDerWaalsContact O-N 3.11Å; I136-G139 WeakPolarHBondContact O-CA 3.21Å; I136-G139 PolarHBondContact O-N 2.93Å; V137-G139 VanDerWaalsContact C-N 3.25Å; V137-G139 PolarHBondContact O-N 3.25Å; G139-G141 PolarHBondContact O-N 3.06Å; G139-K142 PolarHBondContact O-N 3.09Å
140I54.9Low64.6Low131 Ų131104.2 Ų104.267%0.67256%0.557SS**THydrogen-bonded Turntrans-62.5118178-64.2170.3000108.9I136 V137I136-I140 WeakPolarHBondContact O-CG1 3.49Å; I136-I140 PolarHBondContact O-N 2.9Å; V137-I140 PolarHBondContact O-N 2.88Å
141G49.7Very low62.6Low79 Ų79102.7 Ų102.781%0.81455%0.548SS*.THydrogen-bonded Turntrans102.6-1.8176.900000116.7G139G139-G141 PolarHBondContact O-N 3.06Å
142K55Low60.7Low183 Ų183101.9 Ų101.980%0.79654%0.541SS*.  trans-104.611.3175.7-68.7-172.9179.3-1790114.5G139 S144G139-K142 PolarHBondContact O-N 3.09Å; K142-S144 PolarHBondContact O-N 3.37Å
143E51.8Low58.7Low145 Ų145104.7 Ų104.768%0.67856%0.555SS**  trans-75112.4-175.6-69.3-161.7145.700111.9K74K74-E143 IonicContact NZ-OE1 2.99Å; K74-E143 PolarHBondContact NZ-OE1 3.44Å
144S48.4Very low56.7Low64 Ų64104.4 Ų104.445%0.44857%0.566SS.*  trans-84.9143.5166.290.60000110.2K142 R146 S147K142-S144 PolarHBondContact O-N 3.37Å; S144-R146 PolarHBondContact O-N 2.9Å; S144-S147 PolarHBondContact O-N 3.28Å; S144-S147 PolarHBondContact O-OG 3.35Å; S144-S147 PolarHBondContact OG-OG 3.22Å
145P48.2Very low54.9Low147 Ų147105.1 Ų105.196%0.95557%0.566SS**THydrogen-bonded Turntrans-66.1-4.2-179.21.70.2000115.5
146R45.3Very low53.4Low236 Ų236110.5 Ų110.589%0.89159%0.587SS**THydrogen-bonded Turntrans-109.1-1.8-175-100.1175.1-174.2176.22.2115.5S144 K148S144-R146 PolarHBondContact O-N 2.9Å; R146-K148 PolarHBondContact O-N 2.81Å; R146-K148 VanDerWaalsContact O-N 3.09Å
147S48.2Very low52.1Low56 Ų56112.7 Ų112.739%0.39260%0.595SS.*  trans-87.274.1-175.135.20000112.9S144 C149S144-S147 PolarHBondContact O-N 3.28Å; S144-S147 PolarHBondContact O-OG 3.35Å; S144-S147 PolarHBondContact OG-OG 3.22Å; S147-C149 PolarHBondContact O-N 3.15Å; S147-C149 VanDerWaalsContact O-N 3.16Å
148K47.8Very low50.9Low170 Ų170109 Ų10974%0.73957%0.573SS**THydrogen-bonded Turntrans-61.5114.2170.9-64.8-176.2178.5-177.40109.9R146 K150R146-K148 PolarHBondContact O-N 2.81Å; R146-K148 VanDerWaalsContact O-N 3.09Å; K148-K150 PolarHBondContact O-N 3.23Å
149C52.5Low50.1Low66 Ų66102.3 Ų102.345%0.44655%0.552SS.*THydrogen-bonded Turntrans44.461.8169.6-168.10000115.4C73 S147C73-C149 HydrophobicContact CB-CB 4.1Å; C73-C149 WeakPolarHBondContact CB-SG 3.39Å; C73-C149 WeakPolarHBondContact SG-CB 3.19Å; C73-C149 CovalentContact SG-SG 2.05Å; C73-C149 PolarHBondContact SG-SG 3.36Å; S147-C149 PolarHBondContact O-N 3.15Å; S147-C149 VanDerWaalsContact O-N 3.16Å
150K50.5Low50.2Low116 Ų116104.3 Ų104.350%0.50456%0.556SS.*  trans-112.535177.3-81.7-162.7178.9-177.10113.7K148 F152 L153 A154K148-K150 PolarHBondContact O-N 3.23Å; K150-F152 PolarHBondContact O-N 2.88Å; K150-L153 HydrophobicContact CB-CB 3.95Å; K150-L153 HydrophobicContact CB-CD1 4.43Å; K150-L153 HydrophobicContact CD-CB 4Å; K150-L153 HydrophobicContact CD-CD1 3.7Å; K150-L153 HydrophobicContact CD-CG 4.48Å; K150-L153 HydrophobicContact CG-CB 4.14Å; K150-L153 HydrophobicContact CG-CD1 3.75Å; K150-L153 PolarHBondContact O-N 3.45Å; K150-A154 PolarHBondContact O-N 3.48Å
151I50Low51Low66 Ų66100 Ų10034%0.33854%0.544SS..THydrogen-bonded Turntrans-62.3-21.4179.4-73.1170.3000112.8K74K74-I151 HydrophobicContact CB-CD1 3.89Å; K74-I151 HydrophobicContact CG-CD1 3.51Å; K74-I151 HydrophobicContact CG-CG1 4.49Å
152F43.7Very low52.2Low80 Ų8096.5 Ų96.535%0.35151%0.508SS..THydrogen-bonded Turntrans-89.1-10.9174.5-133.1-108.7000115K150 F226 I230K150-F152 PolarHBondContact O-N 2.88Å; F152-F226 HydrophobicContact CD1-CE2 4.18Å; F152-F226 HydrophobicContact CD1-CZ 4.08Å; F152-F226 HydrophobicContact CD2-CZ 4.27Å; F152-F226 HydrophobicContact CE1-CD2 4.47Å; F152-F226 AromaticContact CE1-CE1 3.84Å; F152-F226 HydrophobicContact CE1-CE1 3.84Å; F152-F226 AromaticContact CE1-CE2 3.43Å; F152-F226 HydrophobicContact CE1-CE2 3.43Å; F152-F226 VanDerWaalsContact CE1-CE2 3.43Å; F152-F226 AromaticContact CE1-CZ 3.13Å; F152-F226 HydrophobicContact CE1-CZ 3.13Å; F152-F226 AromaticContact CE2-CE1 3.99Å; F152-F226 HydrophobicContact CE2-CE1 3.99Å; F152-F226 HydrophobicContact CE2-CE2 4.44Å; F152-F226 AromaticContact CE2-CZ 3.46Å; F152-F226 HydrophobicContact CE2-CZ 3.46Å; F152-F226 VanDerWaalsContact CE2-CZ 3.46Å; F152-F226 HydrophobicContact CZ-CD1 4.41Å; F152-F226 AromaticContact CZ-CE1 3.26Å; F152-F226 HydrophobicContact CZ-CE1 3.26Å; F152-F226 AromaticContact CZ-CE2 3.71Å; F152-F226 HydrophobicContact CZ-CE2 3.71Å; F152-F226 AromaticContact CZ-CZ 2.85Å; F152-F226 HydrophobicContact CZ-CZ 2.85Å; F152-I230 HydrophobicContact CD1-CD1 4.39Å; F152-I230 HydrophobicContact CD1-CG1 4.28Å; F152-I230 HydrophobicContact CE1-CD1 3.16Å; F152-I230 HydrophobicContact CE1-CG1 3.37Å; F152-I230 HydrophobicContact CZ-CD1 3.3Å; F152-I230 HydrophobicContact CZ-CG1 4.07Å
153L44Very low53.4Low82 Ų8290.5 Ų90.543%0.42949%0.486SS..THydrogen-bonded Turntrans-106.4-10.2178.9-82.3154.7000112.3K150 T155 Y233K150-L153 HydrophobicContact CB-CB 3.95Å; K150-L153 HydrophobicContact CB-CD1 4.43Å; K150-L153 HydrophobicContact CD-CB 4Å; K150-L153 HydrophobicContact CD-CD1 3.7Å; K150-L153 HydrophobicContact CD-CG 4.48Å; K150-L153 HydrophobicContact CG-CB 4.14Å; K150-L153 HydrophobicContact CG-CD1 3.75Å; K150-L153 PolarHBondContact O-N 3.45Å; L153-T155 VanDerWaalsContact C-N 3.29Å; L153-T155 PolarHBondContact O-N 2.93Å; L153-Y233 HydrophobicContact CD2-CE1 3.63Å
154A43.5Very low54.6Low81 Ų8190.2 Ų90.267%0.66948%0.483SS*.  trans-8614.6-177.100000114.8K150K150-A154 PolarHBondContact O-N 3.48Å
155T44.6Very low55.9Low60 Ų6089 Ų8937%0.36848%0.477SS..  trans-106.595.7159.824.10000108.5L153 E157 S158 R234L153-T155 VanDerWaalsContact C-N 3.29Å; L153-T155 PolarHBondContact O-N 2.93Å; T155-E157 HydrophobicContact CG2-CB 4.46Å; T155-E157 PolarHBondContact O-N 3.09Å; T155-S158 WeakPolarHBondContact O-CB 3.26Å; T155-S158 PolarHBondContact O-N 3.47Å; T155-S158 VanDerWaalsContact O-N 3.08Å; T155-S158 WeakPolarHBondContact OG1-CB 3.03Å; T155-R234 PolarHBondContact O-NH2 3.47Å
156E45.2Very low57.7Low184 Ų18482.2 Ų82.286%0.8643%0.433SS*.THydrogen-bonded Turntrans-56.1-6.7152.6-73.9-97.3139.600110.8R234E156-R234 PolarHBondContact O-NH1 3.46Å; E156-R234 PolarHBondContact O-NH2 3.45Å
157E51.6Low59.7Low118 Ų11874.4 Ų74.455%0.55140%0.403SS*.THydrogen-bonded Turntrans-108.38.8171.6-60.7-169.216600116.6R138 T155 T159 T160 G161 R234R138-E157 IonicContact NH1-OE2 3.26Å; R138-E157 PolarHBondContact NH1-OE2 2.99Å; T155-E157 HydrophobicContact CG2-CB 4.46Å; T155-E157 PolarHBondContact O-N 3.09Å; E157-T159 VanDerWaalsContact C-N 3.31Å; E157-T159 PolarHBondContact O-N 2.81Å; E157-T159 VanDerWaalsContact O-N 3.12Å; E157-T160 PolarHBondContact O-N 3.36Å; E157-T160 VanDerWaalsContact O-N 3.12Å; E157-G161 PolarHBondContact O-N 2.75Å; E157-G161 VanDerWaalsContact O-N 3.14Å; E157-R234 VanDerWaalsContact C-NH1 3.33Å
158S54.8Low61.6Low14 Ų1475 Ų7510%0.09840%0.402CS..Hα-helixtrans-58.6-26.6-168.174.10000116.5T155 S162 R234T155-S158 WeakPolarHBondContact O-CB 3.26Å; T155-S158 PolarHBondContact O-N 3.47Å; T155-S158 VanDerWaalsContact O-N 3.08Å; T155-S158 WeakPolarHBondContact OG1-CB 3.03Å; S158-S162 WeakPolarHBondContact O-CB 3.36Å; S158-S162 PolarHBondContact O-N 3.31Å; S158-S162 PolarHBondContact O-OG 3.29Å; S158-R234 PolarHBondContact OG-NE 2.84Å; S158-R234 PolarHBondContact OG-NH2 2.86Å
159T58.4Low63.6Low32 Ų3267.7 Ų67.720%0.19637%0.371CS..Hα-helixtrans-74-42.5176.9-65.70000111.1E157 G161 S162 V163 R234E157-T159 VanDerWaalsContact C-N 3.31Å; E157-T159 PolarHBondContact O-N 2.81Å; E157-T159 VanDerWaalsContact O-N 3.12Å; T159-G161 VanDerWaalsContact C-N 3.31Å; T159-G161 PolarHBondContact O-N 3.1Å; T159-S162 PolarHBondContact O-N 3.03Å; T159-V163 VanDerWaalsContact O-CG2 3.28Å; T159-V163 WeakPolarHBondContact O-CG2 3.28Å; T159-V163 PolarHBondContact O-N 3.47Å; T159-R234 WeakPolarHBondContact OG1-CB 3.3Å; T159-R234 WeakPolarHBondContact OG1-CD 3.36Å; T159-R234 PolarHBondContact OG1-NE 3.17Å
160T66.1Low65.3Low80 Ų8065.3 Ų65.349%0.49136%0.357SS..Hα-helixtrans-61.9-43.9173.4-51.30000110E157 S162 V163 F164E157-T160 PolarHBondContact O-N 3.36Å; E157-T160 VanDerWaalsContact O-N 3.12Å; T160-S162 PolarHBondContact O-N 2.82Å; T160-V163 PolarHBondContact O-N 3.46Å; T160-F164 HydrophobicContact CG2-CD2 3.85Å; T160-F164 HydrophobicContact CG2-CE2 3.57Å; T160-F164 WeakPolarHBondContact O-CD2 3.42Å; T160-F164 PolarHBondContact O-N 2.84Å; T160-F164 VanDerWaalsContact O-N 3.16Å
161G70.9Confident67.3Low40 Ų4064 Ų6441%0.41236%0.358SS..Hα-helixtrans-58.1-45.9174.200000113.3E157 T159 V163 F164 A165E157-G161 PolarHBondContact O-N 2.75Å; E157-G161 VanDerWaalsContact O-N 3.14Å; T159-G161 VanDerWaalsContact C-N 3.31Å; T159-G161 PolarHBondContact O-N 3.1Å; G161-V163 PolarHBondContact O-N 3.05Å; G161-F164 PolarHBondContact O-N 2.81Å; G161-A165 WeakPolarHBondContact O-CB 3.43Å; G161-A165 PolarHBondContact O-N 3.25Å
162S75.6Confident69.2Low7 Ų764.6 Ų64.65%0.04936%0.361CS..Hα-helixtrans-67.1-33.9179.4-57.20000112.9S158 T159 T160 F166 Y167S158-S162 WeakPolarHBondContact O-CB 3.36Å; S158-S162 PolarHBondContact O-N 3.31Å; S158-S162 PolarHBondContact O-OG 3.29Å; T159-S162 PolarHBondContact O-N 3.03Å; T160-S162 PolarHBondContact O-N 2.82Å; S162-F166 WeakPolarHBondContact O-CB 3.3Å; S162-F166 PolarHBondContact O-N 3.22Å; S162-Y167 WeakPolarHBondContact O-CD2 3.11Å; S162-Y167 PolarHBondContact O-N 3.49Å
163V80.2Confident71.4Confident56 Ų5661 Ų6134%0.33935%0.346SS..Iπ-helixtrans-62.9-51174.8171.50000111.4T159 T160 G161 Y167 I168T159-V163 VanDerWaalsContact O-CG2 3.28Å; T159-V163 WeakPolarHBondContact O-CG2 3.28Å; T159-V163 PolarHBondContact O-N 3.47Å; T160-V163 PolarHBondContact O-N 3.46Å; G161-V163 PolarHBondContact O-N 3.05Å; V163-Y167 HydrophobicContact CG2-CD2 4.15Å; V163-Y167 PolarHBondContact O-N 2.74Å; V163-I168 HydrophobicContact CG1-CD1 3.89Å; V163-I168 HydrophobicContact CG1-CG1 4.03Å; V163-I168 WeakPolarHBondContact O-CG1 3.45Å; V163-I168 PolarHBondContact O-N 2.63Å
164F77.3Confident73.6Confident139 Ų13962.1 Ų62.161%0.6135%0.352SS*.Iπ-helixtrans-71.9-38179.4-71.6-67.5000112.9T160 G161 I168 P169T160-F164 HydrophobicContact CG2-CD2 3.85Å; T160-F164 HydrophobicContact CG2-CE2 3.57Å; T160-F164 WeakPolarHBondContact O-CD2 3.42Å; T160-F164 PolarHBondContact O-N 2.84Å; T160-F164 VanDerWaalsContact O-N 3.16Å; G161-F164 PolarHBondContact O-N 2.81Å; F164-I168 HydrophobicContact CD1-CD1 3.61Å; F164-I168 HydrophobicContact CE1-CD1 3.79Å; F164-I168 HydrophobicContact CG-CD1 4.45Å; F164-P169 WeakPolarHBondContact O-CD 3.42Å; F164-P169 WeakPolarHBondContact O-CG 3.25Å
165A75.5Confident75.8Confident40 Ų4061.1 Ų61.133%0.33134%0.337SS..Iπ-helixtrans-77.1-33.5-175.700000113I88 G161I88-A165 WeakPolarHBondContact CD1-O 3.36Å; G161-A165 WeakPolarHBondContact O-CB 3.43Å; G161-A165 PolarHBondContact O-N 3.25Å
166F85.1Confident78Confident4 Ų459.4 Ų59.42%0.01833%0.325CS..Iπ-helixtrans-125.9-56.8-172.4-176.6-104.9000113.7S162 I168 P169 A170 F219 W223 T224 F227S162-F166 WeakPolarHBondContact O-CB 3.3Å; S162-F166 PolarHBondContact O-N 3.22Å; F166-I168 PolarHBondContact O-N 3.03Å; F166-P169 WeakPolarHBondContact O-CD 3.32Å; F166-A170 WeakPolarHBondContact O-CB 3.47Å; F166-A170 PolarHBondContact O-N 3.02Å; F166-F219 HydrophobicContact CD2-CE1 4.25Å; F166-F219 AromaticContact CE2-CE1 3.97Å; F166-F219 HydrophobicContact CE2-CE1 3.97Å; F166-W223 HydrophobicContact CD2-CB 4.4Å; F166-W223 HydrophobicContact CE2-CB 3.68Å; F166-W223 HydrophobicContact CZ-CB 4.24Å; F166-T224 WeakPolarHBondContact CZ-OG1 3.38Å; F166-F227 HydrophobicContact CB-CB 4.47Å; F166-F227 HydrophobicContact CB-CD1 3.73Å; F166-F227 HydrophobicContact CB-CD2 3.72Å; F166-F227 HydrophobicContact CB-CE1 3.77Å; F166-F227 HydrophobicContact CB-CE2 3.77Å; F166-F227 HydrophobicContact CB-CG 3.7Å; F166-F227 HydrophobicContact CB-CZ 3.79Å; F166-F227 HydrophobicContact CD1-CB 3.7Å; F166-F227 AromaticContact CD1-CD2 3.67Å; F166-F227 HydrophobicContact CD1-CD2 3.67Å; F166-F227 HydrophobicContact CD1-CE2 4.45Å; F166-F227 AromaticContact CD1-CG 3.71Å; F166-F227 HydrophobicContact CD1-CG 3.71Å; F166-F227 AromaticContact CD2-CD2 3.32Å; F166-F227 HydrophobicContact CD2-CD2 3.32Å; F166-F227 AromaticContact CD2-CE2 3.36Å; F166-F227 HydrophobicContact CD2-CE2 3.36Å; F166-F227 HydrophobicContact CD2-CG 4.13Å; F166-F227 HydrophobicContact CD2-CZ 4.17Å; F166-F227 HydrophobicContact CE1-CB 4.12Å; F166-F227 HydrophobicContact CE1-CD2 4.07Å; F166-F227 HydrophobicContact CE1-CG 4.36Å; F166-F227 AromaticContact CE2-CD2 3.76Å; F166-F227 HydrophobicContact CE2-CD2 3.76Å; F166-F227 HydrophobicContact CE2-CE2 4.02Å; F166-F227 HydrophobicContact CG-CB 4.11Å; F166-F227 HydrophobicContact CG-CD1 4.14Å; F166-F227 AromaticContact CG-CD2 3.27Å; F166-F227 HydrophobicContact CG-CD2 3.27Å; F166-F227 HydrophobicContact CG-CE1 4.41Å; F166-F227 AromaticContact CG-CE2 3.61Å; F166-F227 HydrophobicContact CG-CE2 3.61Å; F166-F227 AromaticContact CG-CG 3.57Å; F166-F227 HydrophobicContact CG-CG 3.57Å; F166-F227 HydrophobicContact CG-CZ 4.17Å; F166-F227 HydrophobicContact CZ-CD2 4.11Å
167Y88.7Confident80Confident71 Ų7151.4 Ų51.428%0.27829%0.287SS..Iπ-helixtrans-67-42.7-169.4-64.9-67.2000113.4S162 V163 A170 V171 F227 L228 S231S162-Y167 WeakPolarHBondContact O-CD2 3.11Å; S162-Y167 PolarHBondContact O-N 3.49Å; V163-Y167 HydrophobicContact CG2-CD2 4.15Å; V163-Y167 PolarHBondContact O-N 2.74Å; Y167-A170 PolarHBondContact O-N 3.08Å; Y167-V171 WeakPolarHBondContact O-CG2 3.45Å; Y167-V171 PolarHBondContact O-N 3.07Å; Y167-F227 PolarHBondContact OH-O 3.29Å; Y167-L228 PolarHBondContact OH-N 2.94Å; Y167-S231 PolarHBondContact OH-OG 3.03Å
168I88.8Confident81.7Confident69 Ų6950.3 Ų50.335%0.35429%0.285SS..Hα-helixtrans-63.9-53.5176.2-71172.4000110.9V163 F164 F166 A170 V171 I172V163-I168 HydrophobicContact CG1-CD1 3.89Å; V163-I168 HydrophobicContact CG1-CG1 4.03Å; V163-I168 WeakPolarHBondContact O-CG1 3.45Å; V163-I168 PolarHBondContact O-N 2.63Å; F164-I168 HydrophobicContact CD1-CD1 3.61Å; F164-I168 HydrophobicContact CE1-CD1 3.79Å; F164-I168 HydrophobicContact CG-CD1 4.45Å; F166-I168 PolarHBondContact O-N 3.03Å; I168-A170 PolarHBondContact O-N 3.43Å; I168-V171 PolarHBondContact O-N 3.13Å; I168-I172 HydrophobicContact CG2-CD1 3.73Å; I168-I172 HydrophobicContact CG2-CG1 4.47Å; I168-I172 WeakPolarHBondContact O-CG1 3.45Å; I168-I172 PolarHBondContact O-N 3.15Å
169P88Confident83.4Confident16 Ų1655.3 Ų55.310%0.10431%0.305CS..Hα-helixtrans-52.6-40.7172.8-31.237.7000113.4I88 F164 F166 I172 I173I88-P169 HydrophobicContact CG2-CB 3.43Å; I88-P169 VanDerWaalsContact CG2-CB 3.43Å; I88-P169 HydrophobicContact CG2-CG 3.72Å; F164-P169 WeakPolarHBondContact O-CD 3.42Å; F164-P169 WeakPolarHBondContact O-CG 3.25Å; F166-P169 WeakPolarHBondContact O-CD 3.32Å; P169-I172 PolarHBondContact O-N 3.04Å; P169-I173 WeakPolarHBondContact O-CB 3.48Å; P169-I173 VanDerWaalsContact O-CG1 3.24Å; P169-I173 WeakPolarHBondContact O-CG1 3.15Å; P169-I173 PolarHBondContact O-N 3.25Å
170A90.1Very high84.8Confident17 Ų1754 Ų5414%0.1430%0.296CS..Hα-helixtrans-62.6-46.2179.400000113.1F166 Y167 I168 I172 I173 L174 H220F166-A170 WeakPolarHBondContact O-CB 3.47Å; F166-A170 PolarHBondContact O-N 3.02Å; Y167-A170 PolarHBondContact O-N 3.08Å; I168-A170 PolarHBondContact O-N 3.43Å; A170-I172 VanDerWaalsContact C-N 3.34Å; A170-I173 PolarHBondContact O-N 3.17Å; A170-L174 WeakPolarHBondContact O-CB 3.4Å; A170-L174 PolarHBondContact O-N 3.25Å; A170-H220 WeakPolarHBondContact CA-NE2 3.25Å; A170-H220 WeakPolarHBondContact CB-CD2 3.25Å; A170-H220 VanDerWaalsContact CB-NE2 3.29Å; A170-H220 WeakPolarHBondContact CB-NE2 3.43Å
171V90.9Very high85.6Confident89 Ų8954 Ų5454%0.53929%0.293SS..Hα-helixtrans-63.8-41.7175.9172.90000110.7Y167 I168 L174 T175Y167-V171 WeakPolarHBondContact O-CG2 3.45Å; Y167-V171 PolarHBondContact O-N 3.07Å; I168-V171 PolarHBondContact O-N 3.13Å; V171-L174 PolarHBondContact O-N 3.36Å; V171-T175 HydrophobicContact CG1-CG2 4.2Å; V171-T175 WeakPolarHBondContact O-CB 3.42Å; V171-T175 WeakPolarHBondContact O-CG2 3.47Å; V171-T175 PolarHBondContact O-N 3.31Å; V171-T175 PolarHBondContact O-OG1 3.11Å
172I90.1Very high86.4Confident77 Ų7756.8 Ų56.840%0.39530%0.302SS..Hα-helixtrans-61.5-51.1177.8-68.2168.7000110.7I168 P169 A170 L174 T175 I176I168-I172 HydrophobicContact CG2-CD1 3.73Å; I168-I172 HydrophobicContact CG2-CG1 4.47Å; I168-I172 WeakPolarHBondContact O-CG1 3.45Å; I168-I172 PolarHBondContact O-N 3.15Å; P169-I172 PolarHBondContact O-N 3.04Å; A170-I172 VanDerWaalsContact C-N 3.34Å; I172-L174 PolarHBondContact O-N 3.19Å; I172-T175 PolarHBondContact O-N 3.03Å; I172-T175 PolarHBondContact O-OG1 2.96Å; I172-I176 HydrophobicContact CG2-CD1 3.74Å; I172-I176 WeakPolarHBondContact O-CB 3.39Å; I172-I176 VanDerWaalsContact O-CG1 3.27Å; I172-I176 WeakPolarHBondContact O-CG1 3.49Å; I172-I176 PolarHBondContact O-N 3.34Å
173I89.9Confident86.9Confident5 Ų557.2 Ų57.23%0.02630%0.304CS..Hα-helixtrans-60.9-48.7179.8-68.3169000110L91 P169 A170 T175 I176 Y177 M216L91-I173 HydrophobicContact CB-CD1 4.08Å; P169-I173 WeakPolarHBondContact O-CB 3.48Å; P169-I173 VanDerWaalsContact O-CG1 3.24Å; P169-I173 WeakPolarHBondContact O-CG1 3.15Å; P169-I173 PolarHBondContact O-N 3.25Å; A170-I173 PolarHBondContact O-N 3.17Å; I173-T175 PolarHBondContact O-N 2.79Å; I173-I176 PolarHBondContact O-N 3.25Å; I173-Y177 HydrophobicContact CG2-CD2 4.16Å; I173-Y177 WeakPolarHBondContact O-CD2 3.47Å; I173-Y177 PolarHBondContact O-N 3Å; I173-M216 HydrophobicContact CG2-CB 3.96Å; I173-M216 HydrophobicContact CG2-CG 4.08Å; I173-M216 HydrophobicContact CG2-SD 3.54Å; I173-M216 VanDerWaalsContact CG2-SD 3.54Å
174L90.8Very high86.9Confident106 Ų10656.3 Ų56.356%0.55530%0.303SS*.Hα-helixtrans-58.7-48.7-179.9-179.562.8000111.6A170 V171 I172 I176 Y177 L178A170-L174 WeakPolarHBondContact O-CB 3.4Å; A170-L174 PolarHBondContact O-N 3.25Å; V171-L174 PolarHBondContact O-N 3.36Å; I172-L174 PolarHBondContact O-N 3.19Å; L174-I176 PolarHBondContact O-N 3.22Å; L174-Y177 PolarHBondContact O-N 3.41Å; L174-L178 HydrophobicContact CD1-CD1 4.28Å; L174-L178 HydrophobicContact CD1-CG 4.3Å; L174-L178 HydrophobicContact CG-CD1 4.07Å; L174-L178 HydrophobicContact CG-CG 4.48Å; L174-L178 VanDerWaalsContact O-CG 3.28Å; L174-L178 WeakPolarHBondContact O-CG 3.39Å; L174-L178 PolarHBondContact O-N 3.36Å
175T90Very high87.2Confident60 Ų6056.3 Ų56.337%0.36830%0.303SS..Hα-helixtrans-65.1-39.1-179.455.60000112.4V171 I172 I173 K179V171-T175 HydrophobicContact CG1-CG2 4.2Å; V171-T175 WeakPolarHBondContact O-CB 3.42Å; V171-T175 WeakPolarHBondContact O-CG2 3.47Å; V171-T175 PolarHBondContact O-N 3.31Å; V171-T175 PolarHBondContact O-OG1 3.11Å; I172-T175 PolarHBondContact O-N 3.03Å; I172-T175 PolarHBondContact O-OG1 2.96Å; I173-T175 PolarHBondContact O-N 2.79Å; T175-K179 WeakPolarHBondContact O-CG 3.2Å; T175-K179 PolarHBondContact O-N 3.26Å
176I90.1Very high87.6Confident23 Ų2360.3 Ų60.312%0.11831%0.312CS..Hα-helixtrans-60.1-46.8173.8-74.1170.6000110.5Y99 I172 I173 L174 K179 I180Y99-I176 HydrophobicContact CD2-CG2 4.2Å; Y99-I176 HydrophobicContact CG-CG2 4.41Å; I172-I176 HydrophobicContact CG2-CD1 3.74Å; I172-I176 WeakPolarHBondContact O-CB 3.39Å; I172-I176 VanDerWaalsContact O-CG1 3.27Å; I172-I176 WeakPolarHBondContact O-CG1 3.49Å; I172-I176 PolarHBondContact O-N 3.34Å; I173-I176 PolarHBondContact O-N 3.25Å; L174-I176 PolarHBondContact O-N 3.22Å; I176-K179 WeakPolarHBondContact O-CB 3.07Å; I176-K179 PolarHBondContact O-N 2.92Å; I176-I180 HydrophobicContact CG2-CD1 3.68Å; I176-I180 HydrophobicContact CG2-CG1 4.35Å; I176-I180 VanDerWaalsContact O-CG1 3.31Å; I176-I180 WeakPolarHBondContact O-CG1 3.34Å; I176-I180 PolarHBondContact O-N 3.15Å
177Y87.1Confident87.4Confident16 Ų1663.6 Ų63.66%0.06333%0.328CS..Hα-helixtrans-70.6-37.7-177.4-90.8-96.2000113.4S95 I173 L174 K179 I180 L181 L212 A213 M216S95-Y177 WeakPolarHBondContact OG-CE2 3.23Å; I173-Y177 HydrophobicContact CG2-CD2 4.16Å; I173-Y177 WeakPolarHBondContact O-CD2 3.47Å; I173-Y177 PolarHBondContact O-N 3Å; L174-Y177 PolarHBondContact O-N 3.41Å; Y177-K179 VanDerWaalsContact C-N 3.3Å; Y177-K179 PolarHBondContact O-N 3.31Å; Y177-I180 HydrophobicContact CD2-CD1 4.4Å; Y177-I180 HydrophobicContact CE2-CD1 4.31Å; Y177-I180 PolarHBondContact O-N 3.02Å; Y177-L181 WeakPolarHBondContact O-CB 3.43Å; Y177-L181 VanDerWaalsContact O-CG 3.29Å; Y177-L181 WeakPolarHBondContact O-CG 3.32Å; Y177-L181 PolarHBondContact O-N 3.18Å; Y177-L212 WeakPolarHBondContact OH-CB 3.25Å; Y177-A213 HydrophobicContact CD1-CB 3.46Å; Y177-A213 VanDerWaalsContact CD1-CB 3.46Å; Y177-A213 VanDerWaalsContact CE1-CA 3.4Å; Y177-A213 HydrophobicContact CE1-CB 3.53Å; Y177-M216 HydrophobicContact CD2-SD 3.65Å; Y177-M216 HydrophobicContact CE1-SD 4.16Å; Y177-M216 HydrophobicContact CE2-CE 3.57Å; Y177-M216 HydrophobicContact CE2-SD 2.95Å; Y177-M216 WeakPolarHBondContact CE2-SD 3.49Å; Y177-M216 HydrophobicContact CG-SD 4.49Å; Y177-M216 WeakPolarHBondContact OH-CE 3.13Å; Y177-M216 PolarHBondContact OH-SD 2.84Å; Y177-M216 VanDerWaalsContact OH-SD 3.33Å
178L88.4Confident86.8Confident95 Ų9561.1 Ų61.150%0.49732%0.322SS..Hα-helixtrans-58.6-44.5170.5-69.9173.6000110.8L174 I180 L181 V182L174-L178 HydrophobicContact CD1-CD1 4.28Å; L174-L178 HydrophobicContact CD1-CG 4.3Å; L174-L178 HydrophobicContact CG-CD1 4.07Å; L174-L178 HydrophobicContact CG-CG 4.48Å; L174-L178 VanDerWaalsContact O-CG 3.28Å; L174-L178 WeakPolarHBondContact O-CG 3.39Å; L174-L178 PolarHBondContact O-N 3.36Å; L178-I180 PolarHBondContact O-N 3.32Å; L178-L181 PolarHBondContact O-N 2.9Å; L178-V182 VanDerWaalsContact O-CG2 3.31Å; L178-V182 WeakPolarHBondContact O-CG2 3.31Å; L178-V182 PolarHBondContact O-N 2.86Å
179K89Confident86.4Confident119 Ų11965.9 Ų65.952%0.51734%0.336SS..Hα-helixtrans-62.1-43.1174.6-72.7179.4-175.7-1790112.1Y99 T175 I176 Y177 L181 V182 V183Y99-K179 HydrophobicContact CE2-CB 4.49Å; Y99-K179 HydrophobicContact CE2-CD 4.39Å; T175-K179 WeakPolarHBondContact O-CG 3.2Å; T175-K179 PolarHBondContact O-N 3.26Å; I176-K179 WeakPolarHBondContact O-CB 3.07Å; I176-K179 PolarHBondContact O-N 2.92Å; Y177-K179 VanDerWaalsContact C-N 3.3Å; Y177-K179 PolarHBondContact O-N 3.31Å; K179-L181 VanDerWaalsContact C-N 3.35Å; K179-L181 PolarHBondContact O-N 3.21Å; K179-V182 PolarHBondContact O-N 3.21Å; K179-V183 WeakPolarHBondContact O-CB 3.49Å; K179-V183 WeakPolarHBondContact O-CG2 3.48Å; K179-V183 PolarHBondContact O-N 3.38Å
180I87.6Confident86Confident4 Ų472.8 Ų72.82%0.02136%0.359CS..Hα-helixtrans-58.9-47176.2-72.7166.7000110.5R98 V102 I176 Y177 L178 V183 A184R98-I180 HydrophobicContact CB-CD1 3.93Å; V102-I180 HydrophobicContact CB-CG2 4.4Å; V102-I180 HydrophobicContact CG1-CG2 4.28Å; V102-I180 HydrophobicContact CG2-CG2 4.04Å; I176-I180 HydrophobicContact CG2-CD1 3.68Å; I176-I180 HydrophobicContact CG2-CG1 4.35Å; I176-I180 VanDerWaalsContact O-CG1 3.31Å; I176-I180 WeakPolarHBondContact O-CG1 3.34Å; I176-I180 PolarHBondContact O-N 3.15Å; Y177-I180 HydrophobicContact CD2-CD1 4.4Å; Y177-I180 HydrophobicContact CE2-CD1 4.31Å; Y177-I180 PolarHBondContact O-N 3.02Å; L178-I180 PolarHBondContact O-N 3.32Å; I180-V183 PolarHBondContact O-N 3.49Å; I180-A184 VanDerWaalsContact O-CB 3.27Å; I180-A184 WeakPolarHBondContact O-CB 3.47Å; I180-A184 PolarHBondContact O-N 2.96Å
181L84.6Confident85.3Confident82 Ų8274.6 Ų74.643%0.42937%0.366SS..Hα-helixtrans-63.3-43.1179.8-71.2174000112Y177 L178 K179 A184 K185Y177-L181 WeakPolarHBondContact O-CB 3.43Å; Y177-L181 VanDerWaalsContact O-CG 3.29Å; Y177-L181 WeakPolarHBondContact O-CG 3.32Å; Y177-L181 PolarHBondContact O-N 3.18Å; L178-L181 PolarHBondContact O-N 2.9Å; K179-L181 VanDerWaalsContact C-N 3.35Å; K179-L181 PolarHBondContact O-N 3.21Å; L181-A184 PolarHBondContact O-N 3.44Å; L181-K185 WeakPolarHBondContact O-CB 3.25Å; L181-K185 WeakPolarHBondContact O-CG 3.44Å; L181-K185 PolarHBondContact O-N 3.13Å
182V87Confident84.5Confident97 Ų9772.7 Ų72.759%0.58835%0.352SS*.Hα-helixtrans-61.5-45.4176.5169.80000111L178 K179 K185 K186L178-V182 VanDerWaalsContact O-CG2 3.31Å; L178-V182 WeakPolarHBondContact O-CG2 3.31Å; L178-V182 PolarHBondContact O-N 2.86Å; K179-V182 PolarHBondContact O-N 3.21Å; V182-K185 PolarHBondContact O-N 3.05Å; V182-K186 WeakPolarHBondContact O-CB 3.31Å; V182-K186 PolarHBondContact O-N 3.24Å
183V85.9Confident83.8Confident17 Ų1775.5 Ų75.510%0.10337%0.367CS..Hα-helixtrans-67.3-44.6-179.1173.90000110.9V102 R103 K179 I180 K186 Q187V102-V183 HydrophobicContact CG1-CB 4.23Å; V102-V183 HydrophobicContact CG1-CG1 3.87Å; R103-V183 HydrophobicContact CG-CG2 4.22Å; K179-V183 WeakPolarHBondContact O-CB 3.49Å; K179-V183 WeakPolarHBondContact O-CG2 3.48Å; K179-V183 PolarHBondContact O-N 3.38Å; I180-V183 PolarHBondContact O-N 3.49Å; V183-K186 PolarHBondContact O-N 2.92Å; V183-Q187 WeakPolarHBondContact O-CG 3.36Å; V183-Q187 PolarHBondContact O-N 3.11Å
184A80.6Confident83.2Confident37 Ų3782 Ų8231%0.30640%0.401SS..Hα-helixtrans-58.6-48.9175.700000110.8I180 L181 K186 Q187 A188I180-A184 VanDerWaalsContact O-CB 3.27Å; I180-A184 WeakPolarHBondContact O-CB 3.47Å; I180-A184 PolarHBondContact O-N 2.96Å; L181-A184 PolarHBondContact O-N 3.44Å; A184-K186 VanDerWaalsContact C-N 3.32Å; A184-K186 PolarHBondContact O-N 3.39Å; A184-Q187 PolarHBondContact O-N 3.43Å; A184-A188 WeakPolarHBondContact O-CB 3.33Å; A184-A188 PolarHBondContact O-N 3.35Å
185K82.1Confident82.3Confident139 Ų13982.7 Ų82.760%0.60440%0.402SS*.Hα-helixtrans-59.1-40.7176-76.8-176177.4-175.60112.4L181 V182 A188 R189L181-K185 WeakPolarHBondContact O-CB 3.25Å; L181-K185 WeakPolarHBondContact O-CG 3.44Å; L181-K185 PolarHBondContact O-N 3.13Å; V182-K185 PolarHBondContact O-N 3.05Å; K185-A188 WeakPolarHBondContact O-CB 3.34Å; K185-A188 PolarHBondContact O-N 3.1Å; K185-R189 WeakPolarHBondContact O-CG 3.36Å; K185-R189 PolarHBondContact O-N 2.91Å
186K84.1Confident81.2Confident123 Ų12389.5 Ų89.554%0.53543%0.427SS..Hα-helixtrans-66.1-43.1177.9-171.4175.7-176.2173.30112.3V182 V183 A184 A188 R189 R190V182-K186 WeakPolarHBondContact O-CB 3.31Å; V182-K186 PolarHBondContact O-N 3.24Å; V183-K186 PolarHBondContact O-N 2.92Å; A184-K186 VanDerWaalsContact C-N 3.32Å; A184-K186 PolarHBondContact O-N 3.39Å; K186-A188 VanDerWaalsContact C-N 3.34Å; K186-R189 PolarHBondContact O-N 3.2Å; K186-R190 PolarHBondContact O-N 2.99Å; K186-R190 VanDerWaalsContact O-N 3.12Å
187Q80.9Confident79.8Confident73 Ų7390.6 Ų90.634%0.34144%0.437SS..Hα-helixtrans-61.7-44.1175.1-74.1172-1700110.9V102 V183 A184 R189 R190 I191 M204V102-Q187 PolarHBondContact O-NE2 3.4Å; V183-Q187 WeakPolarHBondContact O-CG 3.36Å; V183-Q187 PolarHBondContact O-N 3.11Å; A184-Q187 PolarHBondContact O-N 3.43Å; Q187-R189 PolarHBondContact O-N 3.33Å; Q187-R190 PolarHBondContact O-N 2.97Å; Q187-I191 WeakPolarHBondContact O-CG1 3.42Å; Q187-I191 PolarHBondContact O-N 2.89Å; Q187-I191 VanDerWaalsContact O-N 3.14Å; Q187-M204 HydrophobicContact CB-CE 4.43Å
188A77.9Confident78.5Confident19 Ų1997.6 Ų97.616%0.15747%0.47CS..Hα-helixtrans-56.1-50.4176.100000112.5A184 K185 K186 R190 I191 Q192 L201A184-A188 WeakPolarHBondContact O-CB 3.33Å; A184-A188 PolarHBondContact O-N 3.35Å; K185-A188 WeakPolarHBondContact O-CB 3.34Å; K185-A188 PolarHBondContact O-N 3.1Å; K186-A188 VanDerWaalsContact C-N 3.34Å; A188-R190 PolarHBondContact O-N 3.2Å; A188-I191 PolarHBondContact O-N 3.3Å; A188-Q192 PolarHBondContact O-N 2.89Å; A188-L201 HydrophobicContact CB-CD1 3.18Å
189R80.3Confident76.9Confident170 Ų17096.4 Ų96.464%0.64247%0.474SS*.Hα-helixtrans-61.6-41.7178-71.7179.9-172.2-169.21112.9K185 K186 Q187 I191 Q192 N193K185-R189 WeakPolarHBondContact O-CG 3.36Å; K185-R189 PolarHBondContact O-N 2.91Å; K186-R189 PolarHBondContact O-N 3.2Å; Q187-R189 PolarHBondContact O-N 3.33Å; R189-I191 VanDerWaalsContact C-N 3.32Å; R189-I191 PolarHBondContact O-N 3.21Å; R189-Q192 PolarHBondContact O-N 2.88Å; R189-N193 VanDerWaalsContact O-CG 3.28Å; R189-N193 PolarHBondContact O-N 2.94Å; R189-N193 PolarHBondContact O-OD1 3.38Å
190R79.3Confident75.3Confident160 Ų16091.9 Ų91.960%0.60446%0.459SS*.Hα-helixtrans-61.4-41.9178.1-78.2-177.2173-173-4.7112K186 Q187 A188 N193 I194K186-R190 PolarHBondContact O-N 2.99Å; K186-R190 VanDerWaalsContact O-N 3.12Å; Q187-R190 PolarHBondContact O-N 2.97Å; A188-R190 PolarHBondContact O-N 3.2Å; R190-N193 PolarHBondContact O-N 3.08Å; R190-I194 WeakPolarHBondContact O-CG1 3.32Å; R190-I194 PolarHBondContact O-N 3Å
191I74.3Confident73.6Confident55 Ų5594.6 Ų94.628%0.28247%0.473SS..Hα-helixtrans-72-38.6179.6-65.3177.7000111.1Q187 A188 R189 N193 I194 M195 M204Q187-I191 WeakPolarHBondContact O-CG1 3.42Å; Q187-I191 PolarHBondContact O-N 2.89Å; Q187-I191 VanDerWaalsContact O-N 3.14Å; A188-I191 PolarHBondContact O-N 3.3Å; R189-I191 VanDerWaalsContact C-N 3.32Å; R189-I191 PolarHBondContact O-N 3.21Å; I191-N193 VanDerWaalsContact C-N 3.29Å; I191-N193 PolarHBondContact O-N 3.5Å; I191-I194 PolarHBondContact O-N 3.47Å; I191-I194 VanDerWaalsContact O-N 3.14Å; I191-M195 HydrophobicContact CG2-CG 4.01Å; I191-M195 HydrophobicContact CG2-SD 3.51Å; I191-M195 VanDerWaalsContact CG2-SD 3.51Å; I191-M195 WeakPolarHBondContact O-CB 3.38Å; I191-M195 PolarHBondContact O-N 3.03Å; I191-M204 HydrophobicContact CD1-CE 3.44Å; I191-M204 VanDerWaalsContact CD1-CE 3.44Å; I191-M204 HydrophobicContact CD1-SD 3.4Å; I191-M204 WeakPolarHBondContact CD1-SD 3.22Å
192Q74.3Confident72Confident50 Ų5094.3 Ų94.323%0.23448%0.478CS..Hα-helixtrans-56.6-44.2171.3-92.8-175-47.500112A188 R189 I194 M195 K196 L201A188-Q192 PolarHBondContact O-N 2.89Å; R189-Q192 PolarHBondContact O-N 2.88Å; Q192-I194 PolarHBondContact O-N 2.97Å; Q192-M195 PolarHBondContact O-N 2.88Å; Q192-K196 WeakPolarHBondContact O-CA 3.46Å; Q192-K196 PolarHBondContact O-N 3.07Å; Q192-L201 HydrophobicContact CG-CB 4.34Å; Q192-L201 HydrophobicContact CG-CD1 4.19Å
193N75Confident70.3Confident135 Ų13598.7 Ų98.772%0.72249%0.489SS*.Hα-helixtrans-63.6-31.1178.4-69.7-4.4000112.6R189 R190 I191R189-N193 VanDerWaalsContact O-CG 3.28Å; R189-N193 PolarHBondContact O-N 2.94Å; R189-N193 PolarHBondContact O-OD1 3.38Å; R190-N193 PolarHBondContact O-N 3.08Å; I191-N193 VanDerWaalsContact C-N 3.29Å; I191-N193 PolarHBondContact O-N 3.5Å
194I77.8Confident68.6Low142 Ų142101.9 Ų101.973%0.72850%0.504SS*.Hα-helixtrans-83.2-41.8178.7-65.2165.9000111.6R190 I191 Q192R190-I194 WeakPolarHBondContact O-CG1 3.32Å; R190-I194 PolarHBondContact O-N 3Å; I191-I194 PolarHBondContact O-N 3.47Å; I191-I194 VanDerWaalsContact O-N 3.14Å; Q192-I194 PolarHBondContact O-N 2.97Å
195M71.8Confident67.4Low120 Ų120105.7 Ų105.759%0.59152%0.515SS*.Hα-helixtrans-101.1-5.7-168.8-62-174.674.200114.5I191 Q192 S197I191-M195 HydrophobicContact CG2-CG 4.01Å; I191-M195 HydrophobicContact CG2-SD 3.51Å; I191-M195 VanDerWaalsContact CG2-SD 3.51Å; I191-M195 WeakPolarHBondContact O-CB 3.38Å; I191-M195 PolarHBondContact O-N 3.03Å; Q192-M195 PolarHBondContact O-N 2.88Å; M195-S197 PolarHBondContact O-N 2.96Å
196K67.3Low66.5Low204 Ų204102.9 Ų102.989%0.88751%0.507SS*.  trans43.532.4-175.8-77.9-172.9177.3-179.90114.3Q192Q192-K196 WeakPolarHBondContact O-CA 3.46Å; Q192-K196 PolarHBondContact O-N 3.07Å
197S61Low65.6Low46 Ų46101 Ų10132%0.32250%0.499SS..  trans-128.6116.5-175.8-175.30000111.6M195 A199 A200M195-S197 PolarHBondContact O-N 2.96Å; S197-A199 VanDerWaalsContact C-N 3.25Å; S197-A199 PolarHBondContact O-N 3.09Å; S197-A199 PolarHBondContact OG-N 3.04Å; S197-A200 PolarHBondContact O-N 3.05Å
198E58.6Low65Low162 Ų16298.4 Ų98.476%0.75749%0.49SS*.Hα-helixtrans-64.4-28.5170.6-82.1-177.9145.600112.7A200 L201E198-A200 VanDerWaalsContact C-N 3.26Å; E198-A200 PolarHBondContact O-N 3.41Å; E198-L201 VanDerWaalsContact O-CB 3.25Å; E198-L201 WeakPolarHBondContact O-CB 3.34Å; E198-L201 PolarHBondContact O-N 3.34Å; E198-L201 VanDerWaalsContact O-N 3.1Å
199A56.5Low64.9Low71 Ų7198.1 Ų98.159%0.58749%0.486SS*.Hα-helixtrans-66.1-28.1179.400000113S197 L201 K203S197-A199 VanDerWaalsContact C-N 3.25Å; S197-A199 PolarHBondContact O-N 3.09Å; S197-A199 PolarHBondContact OG-N 3.04Å; A199-L201 VanDerWaalsContact C-N 3.31Å; A199-K203 PolarHBondContact O-N 3.42Å
200A55.2Low65Low23 Ų2393.1 Ų93.119%0.1947%0.471CS..Hα-helixtrans-68.1-31.4174.400000112.2S197 E198 K203 M204S197-A200 PolarHBondContact O-N 3.05Å; E198-A200 VanDerWaalsContact C-N 3.26Å; E198-A200 PolarHBondContact O-N 3.41Å; A200-K203 PolarHBondContact O-N 3.2Å; A200-M204 WeakPolarHBondContact O-CB 3.23Å; A200-M204 PolarHBondContact O-N 3.39Å
201L51.7Low65.3Low61 Ų6185.5 Ų85.532%0.31944%0.442SS..Hα-helixtrans-66-47.9-179.9-16874.7000111.8A188 Q192 E198 A199 K203 M204 E205A188-L201 HydrophobicContact CB-CD1 3.18Å; Q192-L201 HydrophobicContact CG-CB 4.34Å; Q192-L201 HydrophobicContact CG-CD1 4.19Å; E198-L201 VanDerWaalsContact O-CB 3.25Å; E198-L201 WeakPolarHBondContact O-CB 3.34Å; E198-L201 PolarHBondContact O-N 3.34Å; E198-L201 VanDerWaalsContact O-N 3.1Å; A199-L201 VanDerWaalsContact C-N 3.31Å; L201-K203 VanDerWaalsContact C-N 3.33Å; L201-K203 PolarHBondContact O-N 2.93Å; L201-M204 PolarHBondContact O-N 3.04Å; L201-E205 PolarHBondContact O-N 3.5Å; L201-E205 VanDerWaalsContact O-N 3.16Å
202S49.9Very low65.9Low76 Ų7682.9 Ų82.953%0.53143%0.429SS..Hα-helixtrans-66.9-30.4178.2168.10000113.3
203K51.3Low66.5Low189 Ų18981.9 Ų81.982%0.82243%0.429SS*.Hα-helixtrans-75.2-25.8177.3-120.2176-177.7176.50112.8A199 A200 L201A199-K203 PolarHBondContact O-N 3.42Å; A200-K203 PolarHBondContact O-N 3.2Å; L201-K203 VanDerWaalsContact C-N 3.33Å; L201-K203 PolarHBondContact O-N 2.93Å
204M51.6Low67.2Low85 Ų8578.2 Ų78.242%0.41941%0.409SS..Hα-helixtrans-107.6-5-171.6-145.3-175.570.500114.5Q187 I191 A200 L201 N206Q187-M204 HydrophobicContact CB-CE 4.43Å; I191-M204 HydrophobicContact CD1-CE 3.44Å; I191-M204 VanDerWaalsContact CD1-CE 3.44Å; I191-M204 HydrophobicContact CD1-SD 3.4Å; I191-M204 WeakPolarHBondContact CD1-SD 3.22Å; A200-M204 WeakPolarHBondContact O-CB 3.23Å; A200-M204 PolarHBondContact O-N 3.39Å; L201-M204 PolarHBondContact O-N 3.04Å; M204-N206 VanDerWaalsContact C-N 3.3Å; M204-N206 PolarHBondContact O-N 3.05Å
205E54.8Low67.8Low117 Ų11771.5 Ų71.555%0.54737%0.374SS..SBendtrans-53.5103.2155-82-169156.800107.4L201 K207 I210L201-E205 PolarHBondContact O-N 3.5Å; L201-E205 VanDerWaalsContact O-N 3.16Å; E205-K207 WeakPolarHBondContact O-CG 3.29Å; E205-K207 PolarHBondContact O-N 2.82Å; E205-I210 HydrophobicContact CB-CD1 4.05Å; E205-I210 HydrophobicContact CG-CD1 4.42Å
206N62.8Low68.6Low80 Ų8066 Ų6643%0.42835%0.347SS..  trans-67.688.6-176-1690000107.2M204 A208 N209 I210M204-N206 VanDerWaalsContact C-N 3.3Å; M204-N206 PolarHBondContact O-N 3.05Å; N206-A208 CarbonylContact O-C 3.36Å; N206-A208 PolarHBondContact O-N 3.45Å; N206-N209 HydrophobicContact CB-CB 4.21Å; N206-N209 PolarHBondContact ND2-ND2 3.22Å; N206-N209 PolarHBondContact ND2-OD1 3.46Å; N206-N209 WeakPolarHBondContact O-CA 3.31Å; N206-N209 WeakPolarHBondContact O-CB 3.49Å; N206-N209 PolarHBondContact O-N 2.76Å; N206-I210 PolarHBondContact O-N 3.46Å
207K66.4Low69.7Low83 Ų8358.1 Ų58.136%0.36132%0.324SS..Hα-helixtrans-53.9-27.6-173.1-60.1-167.8178.7-162.20111.4E205 T211E205-K207 WeakPolarHBondContact O-CG 3.29Å; E205-K207 PolarHBondContact O-N 2.82Å; K207-T211 WeakPolarHBondContact O-CB 3.37Å; K207-T211 PolarHBondContact O-N 2.89Å; K207-T211 PolarHBondContact O-OG1 3.25Å
208A66.9Low71.2Confident19 Ų1957.1 Ų57.116%0.15732%0.316CS..Hα-helixtrans-61.1-46170.400000113.2N206 T211 L212 Y267N206-A208 CarbonylContact O-C 3.36Å; N206-A208 PolarHBondContact O-N 3.45Å; A208-T211 WeakPolarHBondContact O-CB 3.49Å; A208-T211 PolarHBondContact O-N 3.08Å; A208-L212 WeakPolarHBondContact O-CG 3.45Å; A208-L212 PolarHBondContact O-N 3.23Å; A208-Y267 HydrophobicContact CB-CD2 4.21Å; A208-Y267 HydrophobicContact CB-CE2 3.53Å
209N75.6Confident72.7Confident13 Ų1349.5 Ų49.57%0.0728%0.28CS..Hα-helixtrans-68.2-37.8177.8-66.8-11.6000112.1R98 V102 N206 L212 A213R98-N209 VanDerWaalsContact CD-OD1 3.27Å; R98-N209 WeakPolarHBondContact CD-OD1 3.37Å; V102-N209 WeakPolarHBondContact CG2-ND2 3.34Å; N206-N209 HydrophobicContact CB-CB 4.21Å; N206-N209 PolarHBondContact ND2-ND2 3.22Å; N206-N209 PolarHBondContact ND2-OD1 3.46Å; N206-N209 WeakPolarHBondContact O-CA 3.31Å; N206-N209 WeakPolarHBondContact O-CB 3.49Å; N206-N209 PolarHBondContact O-N 2.76Å; N209-L212 PolarHBondContact O-N 2.85Å; N209-A213 WeakPolarHBondContact O-CB 3.29Å; N209-A213 PolarHBondContact O-N 3.06Å
210I82.3Confident74.3Confident64 Ų6447.7 Ų47.733%0.32826%0.259SS..Hα-helixtrans-63.7-45.9174.6-63.7174000109.9E205 N206 L212 A213 I214E205-I210 HydrophobicContact CB-CD1 4.05Å; E205-I210 HydrophobicContact CG-CD1 4.42Å; N206-I210 PolarHBondContact O-N 3.46Å; I210-L212 VanDerWaalsContact C-N 3.31Å; I210-L212 PolarHBondContact O-N 3.05Å; I210-A213 WeakPolarHBondContact O-CB 3.45Å; I210-A213 PolarHBondContact O-N 3.2Å; I210-A213 VanDerWaalsContact O-N 3.16Å; I210-I214 HydrophobicContact CG2-CD1 3.99Å; I210-I214 HydrophobicContact CG2-CG1 4.49Å; I210-I214 WeakPolarHBondContact O-CG1 3.41Å; I210-I214 PolarHBondContact O-N 3.24Å
211T86Confident76.1Confident1 Ų153.4 Ų53.41%0.00628%0.284CS..Hα-helixtrans-54.7-48.1175.9-57.30000111.1K207 A208 A213 I214 V215 V262 Y263 F266 Y267K207-T211 WeakPolarHBondContact O-CB 3.37Å; K207-T211 PolarHBondContact O-N 2.89Å; K207-T211 PolarHBondContact O-OG1 3.25Å; A208-T211 WeakPolarHBondContact O-CB 3.49Å; A208-T211 PolarHBondContact O-N 3.08Å; T211-A213 VanDerWaalsContact C-N 3.34Å; T211-A213 PolarHBondContact O-N 3.49Å; T211-I214 WeakPolarHBondContact O-CB 3.42Å; T211-I214 PolarHBondContact O-N 3.12Å; T211-V215 WeakPolarHBondContact O-CG2 3.07Å; T211-V215 PolarHBondContact O-N 3.31Å; T211-V262 HydrophobicContact CG2-CG1 3.68Å; T211-Y263 HydrophobicContact CG2-CD1 4.08Å; T211-F266 HydrophobicContact CG2-CB 4.04Å; T211-F266 VanDerWaalsContact OG1-C 3.3Å; T211-F266 VanDerWaalsContact OG1-CB 3.27Å; T211-F266 WeakPolarHBondContact OG1-CB 3.5Å; T211-F266 PolarHBondContact OG1-O 2.92Å; T211-Y267 HydrophobicContact CG2-CD2 4.17Å
212L86.4Confident78Confident0 Ų050.8 Ų50.80%027%0.271CS..Hα-helixtrans-70.3-31.3-178.8-65.8167.7000112.5T35 I39 I94 R98 Y177 A208 N209 I210 I214 V215 M216 Y263T35-L212 HydrophobicContact CG2-CD1 3.88Å; I39-L212 HydrophobicContact CD1-CD2 3.93Å; I39-L212 HydrophobicContact CG1-CD2 4.26Å; I94-L212 HydrophobicContact CG2-CD1 4.17Å; I94-L212 HydrophobicContact CG2-CD2 4.01Å; I94-L212 HydrophobicContact CG2-CG 4.48Å; R98-L212 VanDerWaalsContact CD-CD1 3.49Å; R98-L212 HydrophobicContact CG-CD1 3.69Å; Y177-L212 WeakPolarHBondContact OH-CB 3.25Å; A208-L212 WeakPolarHBondContact O-CG 3.45Å; A208-L212 PolarHBondContact O-N 3.23Å; N209-L212 PolarHBondContact O-N 2.85Å; I210-L212 VanDerWaalsContact C-N 3.31Å; I210-L212 PolarHBondContact O-N 3.05Å; L212-I214 VanDerWaalsContact C-N 3.33Å; L212-V215 PolarHBondContact O-N 3.25Å; L212-M216 WeakPolarHBondContact O-CG 3.49Å; L212-M216 PolarHBondContact O-N 3.42Å; L212-M216 VanDerWaalsContact O-N 3.08Å; L212-Y263 HydrophobicContact CD2-CE1 4.42Å
213A87.6Confident80Confident29 Ų2947.8 Ų47.824%0.2425%0.248CC..Hα-helixtrans-63.4-41.2170.500000111.4Y177 N209 I210 T211 M216 G217Y177-A213 HydrophobicContact CD1-CB 3.46Å; Y177-A213 VanDerWaalsContact CD1-CB 3.46Å; Y177-A213 VanDerWaalsContact CE1-CA 3.4Å; Y177-A213 HydrophobicContact CE1-CB 3.53Å; N209-A213 WeakPolarHBondContact O-CB 3.29Å; N209-A213 PolarHBondContact O-N 3.06Å; I210-A213 WeakPolarHBondContact O-CB 3.45Å; I210-A213 PolarHBondContact O-N 3.2Å; I210-A213 VanDerWaalsContact O-N 3.16Å; T211-A213 VanDerWaalsContact C-N 3.34Å; T211-A213 PolarHBondContact O-N 3.49Å; A213-M216 PolarHBondContact O-N 2.95Å; A213-G217 PolarHBondContact O-N 3.3Å
214I90.1Very high81.9Confident57 Ų5741.5 Ų41.529%0.29223%0.225SC..Hα-helixtrans-62.9-49175.6-66.3165.2000110I210 T211 L212 M216 G217 V218 V262 F266I210-I214 HydrophobicContact CG2-CD1 3.99Å; I210-I214 HydrophobicContact CG2-CG1 4.49Å; I210-I214 WeakPolarHBondContact O-CG1 3.41Å; I210-I214 PolarHBondContact O-N 3.24Å; T211-I214 WeakPolarHBondContact O-CB 3.42Å; T211-I214 PolarHBondContact O-N 3.12Å; L212-I214 VanDerWaalsContact C-N 3.33Å; I214-M216 VanDerWaalsContact C-N 3.27Å; I214-M216 PolarHBondContact O-N 2.88Å; I214-G217 PolarHBondContact O-N 3.02Å; I214-G217 VanDerWaalsContact O-N 3.14Å; I214-V218 HydrophobicContact CG2-CG2 4.19Å; I214-V218 WeakPolarHBondContact O-CB 3.44Å; I214-V218 VanDerWaalsContact O-CG2 3.29Å; I214-V218 WeakPolarHBondContact O-CG2 3.48Å; I214-V218 PolarHBondContact O-N 2.9Å; I214-V262 HydrophobicContact CB-CG1 4.2Å; I214-V262 HydrophobicContact CG2-CG1 3.91Å; I214-V262 HydrophobicContact CG2-CG2 3.89Å; I214-F266 HydrophobicContact CD1-CD1 4.46Å; I214-F266 HydrophobicContact CD1-CD2 4.36Å; I214-F266 HydrophobicContact CD1-CG 4.33Å
215V90.1Very high83.8Confident1 Ų139 Ų391%0.00622%0.215CC..Hα-helixtrans-52.4-47176.7166.10000111.4L91 T211 L212 V218 F219 N259 V262 Y263L91-V215 HydrophobicContact CD2-CG1 3.9Å; T211-V215 WeakPolarHBondContact O-CG2 3.07Å; T211-V215 PolarHBondContact O-N 3.31Å; L212-V215 PolarHBondContact O-N 3.25Å; V215-V218 PolarHBondContact O-N 2.86Å; V215-F219 PolarHBondContact O-N 3.19Å; V215-N259 WeakPolarHBondContact CG1-OD1 3.3Å; V215-V262 HydrophobicContact CG2-CB 4.1Å; V215-V262 HydrophobicContact CG2-CG1 3.59Å; V215-Y263 HydrophobicContact CG2-CD1 4.41Å; V215-Y263 HydrophobicContact CG2-CE1 3.66Å
216M88.8Confident85.4Confident5 Ų533.6 Ų33.63%0.02519%0.19CC..Hα-helixtrans-70.6-38.3179.7-68.7171.9-166.200112.9L91 I94 S95 I173 Y177 L212 A213 I214 V218 F219 H220L91-M216 HydrophobicContact CD2-CG 3.95Å; L91-M216 WeakPolarHBondContact O-CE 3.46Å; I94-M216 HydrophobicContact CB-CE 3.86Å; I94-M216 HydrophobicContact CG2-CE 3.45Å; I94-M216 VanDerWaalsContact CG2-CE 3.45Å; S95-M216 WeakPolarHBondContact OG-CE 3.44Å; S95-M216 PolarHBondContact OG-SD 3.46Å; I173-M216 HydrophobicContact CG2-CB 3.96Å; I173-M216 HydrophobicContact CG2-CG 4.08Å; I173-M216 HydrophobicContact CG2-SD 3.54Å; I173-M216 VanDerWaalsContact CG2-SD 3.54Å; Y177-M216 HydrophobicContact CD2-SD 3.65Å; Y177-M216 HydrophobicContact CE1-SD 4.16Å; Y177-M216 HydrophobicContact CE2-CE 3.57Å; Y177-M216 HydrophobicContact CE2-SD 2.95Å; Y177-M216 WeakPolarHBondContact CE2-SD 3.49Å; Y177-M216 HydrophobicContact CG-SD 4.49Å; Y177-M216 WeakPolarHBondContact OH-CE 3.13Å; Y177-M216 PolarHBondContact OH-SD 2.84Å; Y177-M216 VanDerWaalsContact OH-SD 3.33Å; L212-M216 WeakPolarHBondContact O-CG 3.49Å; L212-M216 PolarHBondContact O-N 3.42Å; L212-M216 VanDerWaalsContact O-N 3.08Å; A213-M216 PolarHBondContact O-N 2.95Å; I214-M216 VanDerWaalsContact C-N 3.27Å; I214-M216 PolarHBondContact O-N 2.88Å; M216-V218 VanDerWaalsContact C-N 3.34Å; M216-F219 PolarHBondContact O-N 2.93Å; M216-H220 PolarHBondContact O-N 3.35Å; M216-H220 VanDerWaalsContact O-N 3.14Å; M216-H220 PolarHBondContact O-ND1 3.35Å
217G89.6Confident86.5Confident38 Ų3830.5 Ų30.539%0.39217%0.173SC..Hα-helixtrans-61.7-43.1174.700000112.1A213 I214 H220 M221A213-G217 PolarHBondContact O-N 3.3Å; I214-G217 PolarHBondContact O-N 3.02Å; I214-G217 VanDerWaalsContact O-N 3.14Å; G217-H220 PolarHBondContact O-N 3.06Å; G217-M221 VanDerWaalsContact O-CB 3.31Å; G217-M221 WeakPolarHBondContact O-CB 3.4Å; G217-M221 PolarHBondContact O-N 2.93Å
218V92.2Very high87.4Confident26 Ų2630.5 Ų30.516%0.15818%0.176CC..Hα-helixtrans-61-46.2175.3170.70000110.8I214 V215 M216 H220 M221 C222 L258I214-V218 HydrophobicContact CG2-CG2 4.19Å; I214-V218 WeakPolarHBondContact O-CB 3.44Å; I214-V218 VanDerWaalsContact O-CG2 3.29Å; I214-V218 WeakPolarHBondContact O-CG2 3.48Å; I214-V218 PolarHBondContact O-N 2.9Å; V215-V218 PolarHBondContact O-N 2.86Å; M216-V218 VanDerWaalsContact C-N 3.34Å; V218-H220 PolarHBondContact O-N 2.71Å; V218-M221 PolarHBondContact O-N 2.94Å; V218-C222 WeakPolarHBondContact O-CB 3.42Å; V218-C222 PolarHBondContact O-N 2.92Å; V218-C222 PolarHBondContact O-SG 3.03Å; V218-C222 VanDerWaalsContact O-SG 3.37Å; V218-L258 HydrophobicContact CG1-CB 3.82Å; V218-L258 HydrophobicContact CG1-CD1 3.38Å; V218-L258 HydrophobicContact CG1-CG 4.23Å
219F90Very high88.2Confident2 Ų230.1 Ų30.11%0.00917%0.172CC..Hα-helixtrans-53.7-52.9176.3177.9-88.8000112.2I88 L91 F166 V215 M216 M221 C222 W223 N255I88-F219 HydrophobicContact CD1-CE1 4.2Å; I88-F219 HydrophobicContact CD1-CZ 3.78Å; I88-F219 HydrophobicContact CG1-CE1 3.7Å; I88-F219 HydrophobicContact CG1-CE2 4.14Å; I88-F219 HydrophobicContact CG1-CZ 3.24Å; L91-F219 HydrophobicContact CD1-CB 3.72Å; L91-F219 HydrophobicContact CD1-CD1 3.78Å; L91-F219 HydrophobicContact CD1-CD2 3.43Å; L91-F219 VanDerWaalsContact CD1-CD2 3.43Å; L91-F219 HydrophobicContact CD1-CE1 4.33Å; L91-F219 HydrophobicContact CD1-CE2 4.02Å; L91-F219 HydrophobicContact CD1-CG 3.32Å; L91-F219 HydrophobicContact CD1-CZ 4.46Å; F166-F219 HydrophobicContact CD2-CE1 4.25Å; F166-F219 AromaticContact CE2-CE1 3.97Å; F166-F219 HydrophobicContact CE2-CE1 3.97Å; V215-F219 PolarHBondContact O-N 3.19Å; M216-F219 PolarHBondContact O-N 2.93Å; F219-M221 PolarHBondContact O-N 2.76Å; F219-C222 PolarHBondContact O-N 3.31Å; F219-W223 AromaticContact CD2-CD1 3.7Å; F219-W223 AromaticContact CE2-CD1 3.41Å; F219-W223 VanDerWaalsContact CE2-CD1 3.41Å; F219-W223 HydrophobicContact CE2-CG 4.27Å; F219-W223 AromaticContact CE2-NE1 3.54Å; F219-W223 AromaticContact CZ-CD1 3.65Å; F219-W223 HydrophobicContact CZ-CG 4.1Å; F219-W223 PolarHBondContact O-N 3.41Å; F219-N255 WeakPolarHBondContact CA-OD1 3.4Å; F219-N255 PolarHBondContact N-OD1 3.36Å
220H90.3Very high88.2Confident32 Ų3230.3 Ų30.315%0.14817%0.173CC..Hα-helixtrans-65.1-41.3-178.9-69.387.5000111.6A170 M216 G217 V218 C222 W223 T224A170-H220 WeakPolarHBondContact CA-NE2 3.25Å; A170-H220 WeakPolarHBondContact CB-CD2 3.25Å; A170-H220 VanDerWaalsContact CB-NE2 3.29Å; A170-H220 WeakPolarHBondContact CB-NE2 3.43Å; M216-H220 PolarHBondContact O-N 3.35Å; M216-H220 VanDerWaalsContact O-N 3.14Å; M216-H220 PolarHBondContact O-ND1 3.35Å; G217-H220 PolarHBondContact O-N 3.06Å; V218-H220 PolarHBondContact O-N 2.71Å; H220-C222 VanDerWaalsContact C-N 3.35Å; H220-C222 PolarHBondContact O-N 2.93Å; H220-W223 PolarHBondContact O-N 3.18Å; H220-T224 WeakPolarHBondContact O-CB 3.49Å; H220-T224 PolarHBondContact O-N 3.44Å; H220-T224 PolarHBondContact O-OG1 3.47Å
221M92.8Very high88.1Confident143 Ų14327.8 Ų27.870%0.70416%0.161SC*.Hα-helixtrans-60.5-44.1177.8-174.4-175.3-60.800111.9G217 V218 F219 P225G217-M221 VanDerWaalsContact O-CB 3.31Å; G217-M221 WeakPolarHBondContact O-CB 3.4Å; G217-M221 PolarHBondContact O-N 2.93Å; V218-M221 PolarHBondContact O-N 2.94Å; F219-M221 PolarHBondContact O-N 2.76Å; M221-P225 VanDerWaalsContact O-CD 3.27Å; M221-P225 WeakPolarHBondContact O-CD 3.35Å
222C93.5Very high87.8Confident7 Ų730.9 Ų30.95%0.04718%0.178CC..Hα-helixtrans-68.6-39.5-179.2-74.80000112.9V218 F219 H220 L251 N255V218-C222 WeakPolarHBondContact O-CB 3.42Å; V218-C222 PolarHBondContact O-N 2.92Å; V218-C222 PolarHBondContact O-SG 3.03Å; V218-C222 VanDerWaalsContact O-SG 3.37Å; F219-C222 PolarHBondContact O-N 3.31Å; H220-C222 VanDerWaalsContact C-N 3.35Å; H220-C222 PolarHBondContact O-N 2.93Å; C222-L251 HydrophobicContact CB-CG 4.46Å; C222-L251 WeakPolarHBondContact CB-O 3.37Å; C222-N255 HydrophobicContact CB-CB 3.95Å
223W90.8Very high87.2Confident12 Ų1236.1 Ų36.15%0.04520%0.198CC..Hα-helixtrans-91.6-21.4-174.6-77.898.1000114.6C84 F166 F219 H220 F226 F227 G252C84-W223 HydrophobicContact CB-CH2 4.32Å; F166-W223 HydrophobicContact CD2-CB 4.4Å; F166-W223 HydrophobicContact CE2-CB 3.68Å; F166-W223 HydrophobicContact CZ-CB 4.24Å; F219-W223 AromaticContact CD2-CD1 3.7Å; F219-W223 AromaticContact CE2-CD1 3.41Å; F219-W223 VanDerWaalsContact CE2-CD1 3.41Å; F219-W223 HydrophobicContact CE2-CG 4.27Å; F219-W223 AromaticContact CE2-NE1 3.54Å; F219-W223 AromaticContact CZ-CD1 3.65Å; F219-W223 HydrophobicContact CZ-CG 4.1Å; F219-W223 PolarHBondContact O-N 3.41Å; H220-W223 PolarHBondContact O-N 3.18Å; W223-F226 AromaticContact CE3-CD1 3.82Å; W223-F226 HydrophobicContact CE3-CD1 3.82Å; W223-F226 HydrophobicContact CE3-CE1 4.36Å; W223-F226 AromaticContact CZ3-CD1 3.81Å; W223-F226 HydrophobicContact CZ3-CD1 3.81Å; W223-F226 AromaticContact CZ3-CE1 3.91Å; W223-F226 HydrophobicContact CZ3-CE1 3.91Å; W223-F226 WeakPolarHBondContact O-CB 3.5Å; W223-F226 PolarHBondContact O-N 3.38Å; W223-F227 HydrophobicContact CB-CD2 4.03Å; W223-F227 HydrophobicContact CB-CE2 4Å; W223-F227 HydrophobicContact CD2-CE2 4.25Å; W223-F227 HydrophobicContact CE3-CD2 4.39Å; W223-F227 AromaticContact CE3-CE2 3.74Å; W223-F227 HydrophobicContact CE3-CE2 3.74Å; W223-F227 HydrophobicContact CE3-CZ 4.43Å; W223-F227 HydrophobicContact CG-CE2 4.4Å; W223-F227 WeakPolarHBondContact O-CD2 3.23Å; W223-F227 PolarHBondContact O-N 3.2Å; W223-F227 VanDerWaalsContact O-N 3.16Å; W223-G252 PolarHBondContact NE1-O 2.99Å
224T91.3Very high86.4Confident57 Ų5738.7 Ų38.735%0.3520%0.202SC..Hα-helixtrans-55.5-46.5-178.7-67.70000113.5F166 H220 F226 F227 L228F166-T224 WeakPolarHBondContact CZ-OG1 3.38Å; H220-T224 WeakPolarHBondContact O-CB 3.49Å; H220-T224 PolarHBondContact O-N 3.44Å; H220-T224 PolarHBondContact O-OG1 3.47Å; T224-F226 PolarHBondContact O-N 3.35Å; T224-F227 PolarHBondContact O-N 3.19Å; T224-L228 WeakPolarHBondContact O-CB 3.24Å; T224-L228 PolarHBondContact O-N 3.27Å
225P91.8Very high85.6Confident32 Ų3241.5 Ų41.521%0.20822%0.216CC..Hα-helixtrans-57.8-37-179.1-27.537.6000112.9M221 S229 F248 L251M221-P225 VanDerWaalsContact O-CD 3.27Å; M221-P225 WeakPolarHBondContact O-CD 3.35Å; P225-S229 WeakPolarHBondContact O-CB 3.27Å; P225-S229 PolarHBondContact O-N 3.03Å; P225-S229 PolarHBondContact O-OG 3.29Å; P225-F248 HydrophobicContact CB-CB 4.29Å; P225-F248 HydrophobicContact CB-CD1 3.5Å; P225-F248 HydrophobicContact CB-CD2 4Å; P225-F248 HydrophobicContact CB-CE1 3.68Å; P225-F248 HydrophobicContact CB-CE2 4.15Å; P225-F248 HydrophobicContact CB-CG 3.68Å; P225-F248 HydrophobicContact CB-CZ 4Å; P225-F248 WeakPolarHBondContact O-CD2 3.45Å; P225-L251 HydrophobicContact CG-CD2 3.96Å
226F87.3Confident84.9Confident5 Ų550.4 Ų50.42%0.02225%0.25CC..Hα-helixtrans-69.2-53.8178.3179.5-114.8000112.5F152 W223 T224 L228 S229 I230 I245 F248 K249F152-F226 HydrophobicContact CD1-CE2 4.18Å; F152-F226 HydrophobicContact CD1-CZ 4.08Å; F152-F226 HydrophobicContact CD2-CZ 4.27Å; F152-F226 HydrophobicContact CE1-CD2 4.47Å; F152-F226 AromaticContact CE1-CE1 3.84Å; F152-F226 HydrophobicContact CE1-CE1 3.84Å; F152-F226 AromaticContact CE1-CE2 3.43Å; F152-F226 HydrophobicContact CE1-CE2 3.43Å; F152-F226 VanDerWaalsContact CE1-CE2 3.43Å; F152-F226 AromaticContact CE1-CZ 3.13Å; F152-F226 HydrophobicContact CE1-CZ 3.13Å; F152-F226 AromaticContact CE2-CE1 3.99Å; F152-F226 HydrophobicContact CE2-CE1 3.99Å; F152-F226 HydrophobicContact CE2-CE2 4.44Å; F152-F226 AromaticContact CE2-CZ 3.46Å; F152-F226 HydrophobicContact CE2-CZ 3.46Å; F152-F226 VanDerWaalsContact CE2-CZ 3.46Å; F152-F226 HydrophobicContact CZ-CD1 4.41Å; F152-F226 AromaticContact CZ-CE1 3.26Å; F152-F226 HydrophobicContact CZ-CE1 3.26Å; F152-F226 AromaticContact CZ-CE2 3.71Å; F152-F226 HydrophobicContact CZ-CE2 3.71Å; F152-F226 AromaticContact CZ-CZ 2.85Å; F152-F226 HydrophobicContact CZ-CZ 2.85Å; W223-F226 AromaticContact CE3-CD1 3.82Å; W223-F226 HydrophobicContact CE3-CD1 3.82Å; W223-F226 HydrophobicContact CE3-CE1 4.36Å; W223-F226 AromaticContact CZ3-CD1 3.81Å; W223-F226 HydrophobicContact CZ3-CD1 3.81Å; W223-F226 AromaticContact CZ3-CE1 3.91Å; W223-F226 HydrophobicContact CZ3-CE1 3.91Å; W223-F226 WeakPolarHBondContact O-CB 3.5Å; W223-F226 PolarHBondContact O-N 3.38Å; T224-F226 PolarHBondContact O-N 3.35Å; F226-L228 VanDerWaalsContact C-N 3.28Å; F226-L228 PolarHBondContact O-N 3.31Å; F226-S229 WeakPolarHBondContact O-CB 3.48Å; F226-S229 PolarHBondContact O-N 3.43Å; F226-S229 VanDerWaalsContact O-N 3.11Å; F226-I230 HydrophobicContact CD1-CD1 4.1Å; F226-I230 HydrophobicContact CE1-CD1 3.94Å; F226-I230 HydrophobicContact CZ-CD1 4.25Å; F226-I230 WeakPolarHBondContact O-CG1 3.26Å; F226-I230 PolarHBondContact O-N 3.21Å; F226-I230 VanDerWaalsContact O-N 3.16Å; F226-I245 HydrophobicContact CD2-CG2 4.46Å; F226-I245 HydrophobicContact CE2-CG2 4.05Å; F226-F248 HydrophobicContact CB-CB 3.98Å; F226-F248 HydrophobicContact CD2-CB 4.39Å; F226-K249 HydrophobicContact CD2-CG 3.78Å; F226-K249 HydrophobicContact CE2-CD 3.97Å; F226-K249 HydrophobicContact CE2-CG 3.32Å; F226-K249 HydrophobicContact CZ-CD 4.24Å; F226-K249 HydrophobicContact CZ-CG 3.74Å
227F86Confident83.9Confident15 Ų1558.5 Ų58.57%0.06629%0.285CS..Hα-helixtrans-64.4-34.1179.9-76.2-72.6000112.6F166 Y167 W223 T224 I230 S231F166-F227 HydrophobicContact CB-CB 4.47Å; F166-F227 HydrophobicContact CB-CD1 3.73Å; F166-F227 HydrophobicContact CB-CD2 3.72Å; F166-F227 HydrophobicContact CB-CE1 3.77Å; F166-F227 HydrophobicContact CB-CE2 3.77Å; F166-F227 HydrophobicContact CB-CG 3.7Å; F166-F227 HydrophobicContact CB-CZ 3.79Å; F166-F227 HydrophobicContact CD1-CB 3.7Å; F166-F227 AromaticContact CD1-CD2 3.67Å; F166-F227 HydrophobicContact CD1-CD2 3.67Å; F166-F227 HydrophobicContact CD1-CE2 4.45Å; F166-F227 AromaticContact CD1-CG 3.71Å; F166-F227 HydrophobicContact CD1-CG 3.71Å; F166-F227 AromaticContact CD2-CD2 3.32Å; F166-F227 HydrophobicContact CD2-CD2 3.32Å; F166-F227 AromaticContact CD2-CE2 3.36Å; F166-F227 HydrophobicContact CD2-CE2 3.36Å; F166-F227 HydrophobicContact CD2-CG 4.13Å; F166-F227 HydrophobicContact CD2-CZ 4.17Å; F166-F227 HydrophobicContact CE1-CB 4.12Å; F166-F227 HydrophobicContact CE1-CD2 4.07Å; F166-F227 HydrophobicContact CE1-CG 4.36Å; F166-F227 AromaticContact CE2-CD2 3.76Å; F166-F227 HydrophobicContact CE2-CD2 3.76Å; F166-F227 HydrophobicContact CE2-CE2 4.02Å; F166-F227 HydrophobicContact CG-CB 4.11Å; F166-F227 HydrophobicContact CG-CD1 4.14Å; F166-F227 AromaticContact CG-CD2 3.27Å; F166-F227 HydrophobicContact CG-CD2 3.27Å; F166-F227 HydrophobicContact CG-CE1 4.41Å; F166-F227 AromaticContact CG-CE2 3.61Å; F166-F227 HydrophobicContact CG-CE2 3.61Å; F166-F227 AromaticContact CG-CG 3.57Å; F166-F227 HydrophobicContact CG-CG 3.57Å; F166-F227 HydrophobicContact CG-CZ 4.17Å; F166-F227 HydrophobicContact CZ-CD2 4.11Å; Y167-F227 PolarHBondContact OH-O 3.29Å; W223-F227 HydrophobicContact CB-CD2 4.03Å; W223-F227 HydrophobicContact CB-CE2 4Å; W223-F227 HydrophobicContact CD2-CE2 4.25Å; W223-F227 HydrophobicContact CE3-CD2 4.39Å; W223-F227 AromaticContact CE3-CE2 3.74Å; W223-F227 HydrophobicContact CE3-CE2 3.74Å; W223-F227 HydrophobicContact CE3-CZ 4.43Å; W223-F227 HydrophobicContact CG-CE2 4.4Å; W223-F227 WeakPolarHBondContact O-CD2 3.23Å; W223-F227 PolarHBondContact O-N 3.2Å; W223-F227 VanDerWaalsContact O-N 3.16Å; T224-F227 PolarHBondContact O-N 3.19Å; F227-I230 HydrophobicContact CD1-CD1 4.24Å; F227-S231 WeakPolarHBondContact O-CB 3.44Å; F227-S231 PolarHBondContact O-N 3.43Å; F227-S231 VanDerWaalsContact O-N 3.15Å; F227-S231 PolarHBondContact O-OG 3.41Å
228L87.1Confident83.1Confident82 Ų8262.8 Ų62.843%0.42929%0.293SS..Hα-helixtrans-63.6-43.9172.6-177.261.6000111.3Y167 T224 F226 I230 S231 L232Y167-L228 PolarHBondContact OH-N 2.94Å; T224-L228 WeakPolarHBondContact O-CB 3.24Å; T224-L228 PolarHBondContact O-N 3.27Å; F226-L228 VanDerWaalsContact C-N 3.28Å; F226-L228 PolarHBondContact O-N 3.31Å; L228-I230 PolarHBondContact O-N 3Å; L228-S231 PolarHBondContact O-N 3.38Å; L228-L232 HydrophobicContact CD1-CD1 4.14Å; L228-L232 HydrophobicContact CD1-CG 4.08Å; L228-L232 HydrophobicContact CD2-CD1 4.47Å; L228-L232 HydrophobicContact CG-CD1 3.86Å; L228-L232 HydrophobicContact CG-CG 4.24Å; L228-L232 WeakPolarHBondContact O-CB 3.28Å; L228-L232 VanDerWaalsContact O-CG 3.3Å; L228-L232 WeakPolarHBondContact O-CG 3.29Å; L228-L232 PolarHBondContact O-N 2.05Å
229S82.1Confident82Confident11 Ų1167.7 Ų67.78%0.07732%0.323CS..Hα-helixtrans-59.4-43.7178.8-65.10000112.6P225 F226 S231 L232 Y233 I240 F248P225-S229 WeakPolarHBondContact O-CB 3.27Å; P225-S229 PolarHBondContact O-N 3.03Å; P225-S229 PolarHBondContact O-OG 3.29Å; F226-S229 WeakPolarHBondContact O-CB 3.48Å; F226-S229 PolarHBondContact O-N 3.43Å; F226-S229 VanDerWaalsContact O-N 3.11Å; S229-S231 VanDerWaalsContact C-N 3.34Å; S229-S231 PolarHBondContact O-N 2.91Å; S229-L232 PolarHBondContact O-N 3.06Å; S229-Y233 WeakPolarHBondContact O-CB 3.46Å; S229-Y233 PolarHBondContact O-N 3.13Å; S229-I240 VanDerWaalsContact CB-CD1 3.48Å; S229-I240 WeakPolarHBondContact O-CD1 3.19Å; S229-F248 WeakPolarHBondContact OG-CD2 3.37Å; S229-F248 WeakPolarHBondContact OG-CE2 3.33Å
230I76.9Confident81.2Confident17 Ų1769.4 Ų69.49%0.08733%0.332CS..Hα-helixtrans-61.2-45.9176.1-60164.1000111F152 F226 F227 L228 Y233 R234F152-I230 HydrophobicContact CD1-CD1 4.39Å; F152-I230 HydrophobicContact CD1-CG1 4.28Å; F152-I230 HydrophobicContact CE1-CD1 3.16Å; F152-I230 HydrophobicContact CE1-CG1 3.37Å; F152-I230 HydrophobicContact CZ-CD1 3.3Å; F152-I230 HydrophobicContact CZ-CG1 4.07Å; F226-I230 HydrophobicContact CD1-CD1 4.1Å; F226-I230 HydrophobicContact CE1-CD1 3.94Å; F226-I230 HydrophobicContact CZ-CD1 4.25Å; F226-I230 WeakPolarHBondContact O-CG1 3.26Å; F226-I230 PolarHBondContact O-N 3.21Å; F226-I230 VanDerWaalsContact O-N 3.16Å; F227-I230 HydrophobicContact CD1-CD1 4.24Å; L228-I230 PolarHBondContact O-N 3Å; I230-Y233 PolarHBondContact O-N 3.12Å; I230-R234 PolarHBondContact O-N 2.85Å
231S79.8Confident80.5Confident11 Ų1171.7 Ų71.78%0.07735%0.35CS..Hα-helixtrans-65.9-42.9-177.4-590000111.1Y167 F227 L228 S229 R234 I235Y167-S231 PolarHBondContact OH-OG 3.03Å; F227-S231 WeakPolarHBondContact O-CB 3.44Å; F227-S231 PolarHBondContact O-N 3.43Å; F227-S231 VanDerWaalsContact O-N 3.15Å; F227-S231 PolarHBondContact O-OG 3.41Å; L228-S231 PolarHBondContact O-N 3.38Å; S229-S231 VanDerWaalsContact C-N 3.34Å; S229-S231 PolarHBondContact O-N 2.91Å; S231-R234 PolarHBondContact O-N 3.36Å; S231-I235 VanDerWaalsContact O-CG1 3.29Å; S231-I235 WeakPolarHBondContact O-CG1 3.27Å; S231-I235 PolarHBondContact O-N 2.94Å
232L79.5Confident79.5Confident67 Ų6770.1 Ų70.135%0.35135%0.348SS..Hα-helixtrans-66.2-40.3176.8-70.9175.8000112.6L228 S229 R234 I235 R236L228-L232 HydrophobicContact CD1-CD1 4.14Å; L228-L232 HydrophobicContact CD1-CG 4.08Å; L228-L232 HydrophobicContact CD2-CD1 4.47Å; L228-L232 HydrophobicContact CG-CD1 3.86Å; L228-L232 HydrophobicContact CG-CG 4.24Å; L228-L232 WeakPolarHBondContact O-CB 3.28Å; L228-L232 VanDerWaalsContact O-CG 3.3Å; L228-L232 WeakPolarHBondContact O-CG 3.29Å; L228-L232 PolarHBondContact O-N 2.05Å; S229-L232 PolarHBondContact O-N 3.06Å; L232-R234 PolarHBondContact O-N 3.49Å; L232-I235 PolarHBondContact O-N 3.26Å; L232-R236 PolarHBondContact O-N 3.2Å
233Y74.1Confident78.4Confident110 Ų11075.5 Ų75.543%0.43138%0.38SS..Hα-helixtrans-56-41.9173.6178-98.8000110.9L153 S229 I230 K237 F238L153-Y233 HydrophobicContact CD2-CE1 3.63Å; S229-Y233 WeakPolarHBondContact O-CB 3.46Å; S229-Y233 PolarHBondContact O-N 3.13Å; I230-Y233 PolarHBondContact O-N 3.12Å; Y233-K237 WeakPolarHBondContact O-CA 3.19Å; Y233-K237 PolarHBondContact O-N 2.74Å; Y233-K237 VanDerWaalsContact O-N 3.12Å; Y233-F238 VanDerWaalsContact CD2-O 3.28Å; Y233-F238 WeakPolarHBondContact CD2-O 3.46Å
234R70.4Confident77.8Confident82 Ų8277.5 Ų77.531%0.30939%0.394SS..Hα-helixtrans-73.1-49.9177.7-170.4178.2-57.1-136.3-37.3113.5T155 E156 E157 S158 T159 I230 S231 L232T155-R234 PolarHBondContact O-NH2 3.47Å; E156-R234 PolarHBondContact O-NH1 3.46Å; E156-R234 PolarHBondContact O-NH2 3.45Å; E157-R234 VanDerWaalsContact C-NH1 3.33Å; S158-R234 PolarHBondContact OG-NE 2.84Å; S158-R234 PolarHBondContact OG-NH2 2.86Å; T159-R234 WeakPolarHBondContact OG1-CB 3.3Å; T159-R234 WeakPolarHBondContact OG1-CD 3.36Å; T159-R234 PolarHBondContact OG1-NE 3.17Å; I230-R234 PolarHBondContact O-N 2.85Å; S231-R234 PolarHBondContact O-N 3.36Å; L232-R234 PolarHBondContact O-N 3.49Å
235I73.4Confident77.1Confident117 Ų11776.9 Ų76.960%0.639%0.388SS*.Hα-helixtrans-70.3-41.2-169.1-64.5166.1000111.4S231 L232S231-I235 VanDerWaalsContact O-CG1 3.29Å; S231-I235 WeakPolarHBondContact O-CG1 3.27Å; S231-I235 PolarHBondContact O-N 2.94Å; L232-I235 PolarHBondContact O-N 3.26Å
236R74.3Confident76.3Confident187 Ų18777.7 Ų77.771%0.70639%0.389SS*.Hα-helixtrans-114.4-1-172.1-68.3-68.8-172.9168.3-0.4113.4L232 F238L232-R236 PolarHBondContact O-N 3.2Å; R236-F238 HydrophobicContact CB-CD2 3.33Å; R236-F238 HydrophobicContact CB-CE2 3.55Å; R236-F238 HydrophobicContact CB-CG 4.26Å; R236-F238 HydrophobicContact CG-CD2 4.1Å; R236-F238 HydrophobicContact CG-CE2 3.92Å; R236-F238 PolarHBondContact O-N 2.63Å; R236-F238 VanDerWaalsContact O-N 3.14Å
237K69.4Low76Confident176 Ų17679.9 Ų79.977%0.76541%0.408SS*.  trans53.127.9-172.7-61.2-172.8179.2-178.90113.2Y233 T239Y233-K237 WeakPolarHBondContact O-CA 3.19Å; Y233-K237 PolarHBondContact O-N 2.74Å; Y233-K237 VanDerWaalsContact O-N 3.12Å; K237-T239 PolarHBondContact O-N 3.37Å
238F71.4Confident76.1Confident128 Ų12882 Ų8256%0.56142%0.417SS*.  trans-64.3119174.9-85.2-63.9000109.7Y233 R236 I240Y233-F238 VanDerWaalsContact CD2-O 3.28Å; Y233-F238 WeakPolarHBondContact CD2-O 3.46Å; R236-F238 HydrophobicContact CB-CD2 3.33Å; R236-F238 HydrophobicContact CB-CE2 3.55Å; R236-F238 HydrophobicContact CB-CG 4.26Å; R236-F238 HydrophobicContact CG-CD2 4.1Å; R236-F238 HydrophobicContact CG-CE2 3.92Å; R236-F238 PolarHBondContact O-N 2.63Å; R236-F238 VanDerWaalsContact O-N 3.14Å; F238-I240 PolarHBondContact O-N 2.94Å; F238-I240 VanDerWaalsContact O-N 3.11Å
239T70.7Confident75.9Confident128 Ų12878.6 Ų78.679%0.78540%0.399SS*.  trans-74.7100.3173.547.10000109.6K237K237-T239 PolarHBondContact O-N 3.37Å
240I72.4Confident76.1Confident38 Ų3879.8 Ų79.820%0.19540%0.402CS..  trans-85.3128.2173.6-58.5174.2000108S229 F238 V242 V244 I245S229-I240 VanDerWaalsContact CB-CD1 3.48Å; S229-I240 WeakPolarHBondContact O-CD1 3.19Å; F238-I240 PolarHBondContact O-N 2.94Å; F238-I240 VanDerWaalsContact O-N 3.11Å; I240-V242 PolarHBondContact O-N 3.48Å; I240-V244 HydrophobicContact CG2-CB 3.85Å; I240-V244 HydrophobicContact CG2-CG1 3.8Å; I240-I245 HydrophobicContact CB-CD1 4.3Å; I240-I245 HydrophobicContact CB-CG1 4.31Å; I240-I245 HydrophobicContact CG2-CD1 4.35Å; I240-I245 HydrophobicContact CG2-CG1 3.84Å
241P76.1Confident76.7Confident81 Ų8182.5 Ų82.553%0.52642%0.416SS..  trans-57140177.5-23.732.9000111.7V243 V244 I245P241-V243 PolarHBondContact O-N 2.93Å; P241-V243 VanDerWaalsContact O-N 3.15Å; P241-V244 HydrophobicContact CB-CG2 4.11Å; P241-V244 HydrophobicContact CG-CG2 4.2Å; P241-V244 WeakPolarHBondContact O-CB 3.48Å; P241-V244 PolarHBondContact O-N 3.43Å; P241-I245 PolarHBondContact O-N 2.91Å
242V70.8Confident77.2Confident110 Ų11082 Ų8267%0.66741%0.412SS*.Hα-helixtrans-55-37.3-179.7175.90000111.8I240 V244 I245 E246I240-V242 PolarHBondContact O-N 3.48Å; V242-V244 VanDerWaalsContact C-N 3.28Å; V242-V244 PolarHBondContact O-N 2.87Å; V242-I245 PolarHBondContact O-N 3.29Å; V242-E246 HydrophobicContact CG1-CG 4.37Å; V242-E246 PolarHBondContact O-N 2.86Å
243V71.1Confident77.7Confident120 Ų12078.9 Ų78.973%0.72740%0.396SS*.Hα-helixtrans-59.2-38.5176.9-1800000111.9P241 A247P241-V243 PolarHBondContact O-N 2.93Å; P241-V243 VanDerWaalsContact O-N 3.15Å; V243-A247 WeakPolarHBondContact O-CB 3.24Å; V243-A247 PolarHBondContact O-N 2.92Å
244V77.6Confident78.5Confident54 Ų5475 Ų7533%0.32739%0.385SS..Hα-helixtrans-70.5-40.9178.5176.60000110.8I240 P241 V242 A247 F248I240-V244 HydrophobicContact CG2-CB 3.85Å; I240-V244 HydrophobicContact CG2-CG1 3.8Å; P241-V244 HydrophobicContact CB-CG2 4.11Å; P241-V244 HydrophobicContact CG-CG2 4.2Å; P241-V244 WeakPolarHBondContact O-CB 3.48Å; P241-V244 PolarHBondContact O-N 3.43Å; V242-V244 VanDerWaalsContact C-N 3.28Å; V242-V244 PolarHBondContact O-N 2.87Å; V244-A247 PolarHBondContact O-N 3Å; V244-F248 HydrophobicContact CG1-CD2 4.09Å; V244-F248 HydrophobicContact CG1-CE1 4.47Å; V244-F248 HydrophobicContact CG1-CE2 3.53Å; V244-F248 HydrophobicContact CG1-CZ 3.76Å; V244-F248 WeakPolarHBondContact O-CG 3.26Å; V244-F248 PolarHBondContact O-N 2.95Å
245I76.2Confident79.6Confident44 Ų4471.1 Ų71.123%0.22637%0.37CS..Hα-helixtrans-63-46.4176.2-66.9167.5000110.8F226 I240 P241 V242 A247 F248 K249F226-I245 HydrophobicContact CD2-CG2 4.46Å; F226-I245 HydrophobicContact CE2-CG2 4.05Å; I240-I245 HydrophobicContact CB-CD1 4.3Å; I240-I245 HydrophobicContact CB-CG1 4.31Å; I240-I245 HydrophobicContact CG2-CD1 4.35Å; I240-I245 HydrophobicContact CG2-CG1 3.84Å; P241-I245 PolarHBondContact O-N 2.91Å; V242-I245 PolarHBondContact O-N 3.29Å; I245-A247 VanDerWaalsContact C-N 3.35Å; I245-F248 PolarHBondContact O-N 3.37Å; I245-K249 PolarHBondContact O-N 2.94Å; I245-K249 VanDerWaalsContact O-N 3.08Å
246E75.6Confident80.6Confident49 Ų4965.9 Ų65.923%0.22934%0.344CS..Hα-helixtrans-64.3-40.4176.7-69.1-63.312200110.8R76 V242 F248 K249 W250R76-E246 IonicContact NH1-OE2 2.79Å; R76-E246 PolarHBondContact NH1-OE2 2.91Å; R76-E246 IonicContact NH2-OE1 3.89Å; R76-E246 IonicContact NH2-OE2 2.76Å; V242-E246 HydrophobicContact CG1-CG 4.37Å; V242-E246 PolarHBondContact O-N 2.86Å; E246-F248 VanDerWaalsContact C-N 3.31Å; E246-F248 PolarHBondContact O-N 3.48Å; E246-K249 WeakPolarHBondContact O-CB 3.49Å; E246-K249 PolarHBondContact O-N 3.3Å; E246-K249 IonicContact OE1-NZ 3.39Å; E246-K249 PolarHBondContact OE1-NZ 3.43Å; E246-W250 PolarHBondContact O-N 3.44Å
247A82Confident81.6Confident51 Ų5159 Ų5942%0.42132%0.32SS..Hα-helixtrans-58.5-40.6174.500000112.7V243 V244 I245 K249 W250 L251V243-A247 WeakPolarHBondContact O-CB 3.24Å; V243-A247 PolarHBondContact O-N 2.92Å; V244-A247 PolarHBondContact O-N 3Å; I245-A247 VanDerWaalsContact C-N 3.35Å; A247-K249 VanDerWaalsContact C-N 3.35Å; A247-W250 WeakPolarHBondContact O-CB 3.4Å; A247-W250 PolarHBondContact O-N 3.46Å; A247-L251 PolarHBondContact O-N 3.32Å
248F87.2Confident82.7Confident58 Ų5853.2 Ų53.225%0.25430%0.297SS..Hα-helixtrans-68.3-31174.6-65.7-27.8000113.3P225 F226 S229 V244 I245 E246 L251 G252P225-F248 HydrophobicContact CB-CB 4.29Å; P225-F248 HydrophobicContact CB-CD1 3.5Å; P225-F248 HydrophobicContact CB-CD2 4Å; P225-F248 HydrophobicContact CB-CE1 3.68Å; P225-F248 HydrophobicContact CB-CE2 4.15Å; P225-F248 HydrophobicContact CB-CG 3.68Å; P225-F248 HydrophobicContact CB-CZ 4Å; P225-F248 WeakPolarHBondContact O-CD2 3.45Å; F226-F248 HydrophobicContact CB-CB 3.98Å; F226-F248 HydrophobicContact CD2-CB 4.39Å; S229-F248 WeakPolarHBondContact OG-CD2 3.37Å; S229-F248 WeakPolarHBondContact OG-CE2 3.33Å; V244-F248 HydrophobicContact CG1-CD2 4.09Å; V244-F248 HydrophobicContact CG1-CE1 4.47Å; V244-F248 HydrophobicContact CG1-CE2 3.53Å; V244-F248 HydrophobicContact CG1-CZ 3.76Å; V244-F248 WeakPolarHBondContact O-CG 3.26Å; V244-F248 PolarHBondContact O-N 2.95Å; I245-F248 PolarHBondContact O-N 3.37Å; E246-F248 VanDerWaalsContact C-N 3.31Å; E246-F248 PolarHBondContact O-N 3.48Å; F248-L251 PolarHBondContact O-N 3.42Å; F248-G252 PolarHBondContact O-N 2.94Å
249K82.5Confident83.8Confident11 Ų1147.2 Ų47.25%0.04827%0.271CS..Hα-helixtrans-66.2-43.4169.9-68178.4-174.6169.80112F226 I245 E246 A247 L251 G252 W253F226-K249 HydrophobicContact CD2-CG 3.78Å; F226-K249 HydrophobicContact CE2-CD 3.97Å; F226-K249 HydrophobicContact CE2-CG 3.32Å; F226-K249 HydrophobicContact CZ-CD 4.24Å; F226-K249 HydrophobicContact CZ-CG 3.74Å; I245-K249 PolarHBondContact O-N 2.94Å; I245-K249 VanDerWaalsContact O-N 3.08Å; E246-K249 WeakPolarHBondContact O-CB 3.49Å; E246-K249 PolarHBondContact O-N 3.3Å; E246-K249 IonicContact OE1-NZ 3.39Å; E246-K249 PolarHBondContact OE1-NZ 3.43Å; A247-K249 VanDerWaalsContact C-N 3.35Å; K249-L251 VanDerWaalsContact C-N 3.25Å; K249-L251 PolarHBondContact O-N 3.22Å; K249-G252 CarbonylContact O-C 3.55Å; K249-G252 WeakPolarHBondContact O-CA 3.3Å; K249-G252 PolarHBondContact O-N 2.94Å; K249-W253 HydrophobicContact CB-CH2 3.96Å; K249-W253 HydrophobicContact CB-CZ2 3.99Å; K249-W253 HydrophobicContact CB-CZ3 4.24Å; K249-W253 HydrophobicContact CD-CH2 4.37Å; K249-W253 HydrophobicContact CD-CZ2 4.31Å; K249-W253 PolarHBondContact O-N 3.07Å
250W86.3Confident84.8Confident37 Ų3741.5 Ų41.514%0.1424%0.236CC..Hα-helixtrans-57.1-41.4174.1-79.4102.1000111.8A7 L10 L54 E246 A247 W253 S254A7-W250 HydrophobicContact CB-CH2 3.2Å; A7-W250 HydrophobicContact CB-CZ2 4.05Å; A7-W250 HydrophobicContact CB-CZ3 3.76Å; L10-W250 HydrophobicContact CD2-CE3 3.8Å; L10-W250 HydrophobicContact CD2-CZ3 3.86Å; L54-W250 HydrophobicContact CD2-CE3 4.37Å; L54-W250 HydrophobicContact CD2-CH2 3.99Å; L54-W250 HydrophobicContact CD2-CZ3 3.75Å; E246-W250 PolarHBondContact O-N 3.44Å; A247-W250 WeakPolarHBondContact O-CB 3.4Å; A247-W250 PolarHBondContact O-N 3.46Å; W250-W253 HydrophobicContact CD2-CE3 4.06Å; W250-W253 HydrophobicContact CD2-CZ3 4.03Å; W250-W253 AromaticContact CE2-CZ3 3.95Å; W250-W253 HydrophobicContact CE3-CE3 4.16Å; W250-W253 HydrophobicContact CE3-CZ3 4.48Å; W250-W253 HydrophobicContact CG-CE3 4.33Å; W250-W253 HydrophobicContact CG-CZ3 4.28Å; W250-W253 HydrophobicContact CZ2-CZ3 4.26Å; W250-S254 WeakPolarHBondContact O-CB 3.29Å; W250-S254 PolarHBondContact O-N 3.37Å; W250-S254 PolarHBondContact O-OG 3.42Å
251L90.5Very high85.7Confident73 Ų7343.4 Ų43.438%0.38225%0.247SC..Hα-helixtrans-63.5-43.1173.1-177.264.5000111.7C222 P225 A247 F248 K249 S254C222-L251 HydrophobicContact CB-CG 4.46Å; C222-L251 WeakPolarHBondContact CB-O 3.37Å; P225-L251 HydrophobicContact CG-CD2 3.96Å; A247-L251 PolarHBondContact O-N 3.32Å; F248-L251 PolarHBondContact O-N 3.42Å; K249-L251 VanDerWaalsContact C-N 3.25Å; K249-L251 PolarHBondContact O-N 3.22Å; L251-S254 WeakPolarHBondContact O-CB 3.48Å; L251-S254 PolarHBondContact O-N 3.48Å
252G90.1Very high86.4Confident0 Ų040.2 Ų40.20%023%0.225CC..Hα-helixtrans-56.8-51173.900000112.9W223 F248 K249 S254 N255W223-G252 PolarHBondContact NE1-O 2.99Å; F248-G252 PolarHBondContact O-N 2.94Å; K249-G252 CarbonylContact O-C 3.55Å; K249-G252 WeakPolarHBondContact O-CA 3.3Å; K249-G252 PolarHBondContact O-N 2.94Å; G252-S254 VanDerWaalsContact C-N 3.28Å; G252-S254 PolarHBondContact O-N 3.48Å; G252-N255 WeakPolarHBondContact O-CB 3.17Å; G252-N255 PolarHBondContact O-N 2.99Å; G252-N255 VanDerWaalsContact O-N 3.13Å
253W89.4Confident87.4Confident2 Ų235 Ų351%0.00819%0.194CC..Hα-helixtrans-66.2-29.1178.1-59.5-37.4000113.3V49 V53 L54 D80 K249 W250 N255 S256V49-W253 HydrophobicContact CG1-CB 4.33Å; V49-W253 HydrophobicContact CG1-CG 4.27Å; V53-W253 HydrophobicContact CG1-CZ2 3.9Å; L54-W253 HydrophobicContact CD2-CB 4.19Å; L54-W253 HydrophobicContact CD2-CD2 3.79Å; L54-W253 HydrophobicContact CD2-CE3 3.35Å; L54-W253 HydrophobicContact CD2-CG 4.17Å; L54-W253 HydrophobicContact CD2-CZ3 3.98Å; D80-W253 PolarHBondContact OD1-NE1 3.32Å; K249-W253 HydrophobicContact CB-CH2 3.96Å; K249-W253 HydrophobicContact CB-CZ2 3.99Å; K249-W253 HydrophobicContact CB-CZ3 4.24Å; K249-W253 HydrophobicContact CD-CH2 4.37Å; K249-W253 HydrophobicContact CD-CZ2 4.31Å; K249-W253 PolarHBondContact O-N 3.07Å; W250-W253 HydrophobicContact CD2-CE3 4.06Å; W250-W253 HydrophobicContact CD2-CZ3 4.03Å; W250-W253 AromaticContact CE2-CZ3 3.95Å; W250-W253 HydrophobicContact CE3-CE3 4.16Å; W250-W253 HydrophobicContact CE3-CZ3 4.48Å; W250-W253 HydrophobicContact CG-CE3 4.33Å; W250-W253 HydrophobicContact CG-CZ3 4.28Å; W250-W253 HydrophobicContact CZ2-CZ3 4.26Å; W253-N255 PolarHBondContact O-N 3.18Å; W253-N255 VanDerWaalsContact O-N 3.15Å; W253-S256 WeakPolarHBondContact O-CB 3.5Å; W253-S256 PolarHBondContact O-N 3.49Å
254S90.8Very high88.1Confident29 Ų2930.5 Ų30.520%0.20317%0.169CC..Hα-helixtrans-60.3-22.9174.5-60.60000112.6W250 L251 G252 S256 M257 L258W250-S254 WeakPolarHBondContact O-CB 3.29Å; W250-S254 PolarHBondContact O-N 3.37Å; W250-S254 PolarHBondContact O-OG 3.42Å; L251-S254 WeakPolarHBondContact O-CB 3.48Å; L251-S254 PolarHBondContact O-N 3.48Å; G252-S254 VanDerWaalsContact C-N 3.28Å; G252-S254 PolarHBondContact O-N 3.48Å; S254-S256 VanDerWaalsContact C-N 3.26Å; S254-S256 PolarHBondContact O-N 2.98Å; S254-M257 VanDerWaalsContact O-CB 3.32Å; S254-M257 WeakPolarHBondContact O-CB 3.31Å; S254-M257 PolarHBondContact O-N 2.79Å; S254-L258 WeakPolarHBondContact O-CG 3.45Å; S254-L258 PolarHBondContact O-N 2.99Å
255N93.5Very high88.5Confident1 Ų134.7 Ų34.71%0.00518%0.183CC..Hα-helixtrans-52.4-44.4170.3172.674.1000112.5F219 C222 G252 W253 M257 L258 N259F219-N255 WeakPolarHBondContact CA-OD1 3.4Å; F219-N255 PolarHBondContact N-OD1 3.36Å; C222-N255 HydrophobicContact CB-CB 3.95Å; G252-N255 WeakPolarHBondContact O-CB 3.17Å; G252-N255 PolarHBondContact O-N 2.99Å; G252-N255 VanDerWaalsContact O-N 3.13Å; W253-N255 PolarHBondContact O-N 3.18Å; W253-N255 VanDerWaalsContact O-N 3.15Å; N255-M257 PolarHBondContact O-N 3.39Å; N255-L258 PolarHBondContact O-N 2.98Å; N255-N259 PolarHBondContact O-N 3.11Å
256S94.7Very high88.8Confident6 Ų637.5 Ų37.54%0.04219%0.194CC..Hα-helixtrans-63.6-23.4-179-62.20000112.6N18 D46 W253 S254 P260N18-S256 PolarHBondContact ND2-O 2.94Å; D46-S256 VanDerWaalsContact OD1-CB 3.25Å; D46-S256 WeakPolarHBondContact OD1-CB 3.47Å; D46-S256 PolarHBondContact OD1-OG 3.08Å; W253-S256 WeakPolarHBondContact O-CB 3.5Å; W253-S256 PolarHBondContact O-N 3.49Å; S254-S256 VanDerWaalsContact C-N 3.26Å; S254-S256 PolarHBondContact O-N 2.98Å; S256-P260 WeakPolarHBondContact O-CD 3.24Å
257M94.5Very high89.2Confident44 Ų4436.1 Ų36.122%0.21719%0.187CC..Hα-helixtrans-79.2-39.2172.6-173.8-1646900111.6L10 L13 I14 S254 N255 N259 P260 L261L10-M257 HydrophobicContact CD1-CB 4.02Å; L10-M257 HydrophobicContact CD1-CG 4.2Å; L10-M257 HydrophobicContact CD1-SD 3.58Å; L10-M257 VanDerWaalsContact CD1-SD 3.58Å; L13-M257 HydrophobicContact CB-CG 4.2Å; L13-M257 HydrophobicContact CB-SD 4.38Å; L13-M257 HydrophobicContact CD1-SD 4.08Å; I14-M257 HydrophobicContact CD1-CB 4.29Å; I14-M257 HydrophobicContact CG1-CB 3.6Å; I14-M257 HydrophobicContact CG1-CG 4.34Å; S254-M257 VanDerWaalsContact O-CB 3.32Å; S254-M257 WeakPolarHBondContact O-CB 3.31Å; S254-M257 PolarHBondContact O-N 2.79Å; N255-M257 PolarHBondContact O-N 3.39Å; M257-N259 VanDerWaalsContact C-N 3.3Å; M257-N259 PolarHBondContact O-N 3.16Å; M257-P260 WeakPolarHBondContact O-CD 3.31Å; M257-L261 HydrophobicContact CE-CD1 4.34Å
258L93.8Very high89.3Confident54 Ų5440.4 Ų40.428%0.28319%0.192SC..Hα-helixtrans-69.8-27.7-174.5-66.3172.2000112.3V218 S254 N255 L261 V262V218-L258 HydrophobicContact CG1-CB 3.82Å; V218-L258 HydrophobicContact CG1-CD1 3.38Å; V218-L258 HydrophobicContact CG1-CG 4.23Å; S254-L258 WeakPolarHBondContact O-CG 3.45Å; S254-L258 PolarHBondContact O-N 2.99Å; N255-L258 PolarHBondContact O-N 2.98Å; L258-L261 HydrophobicContact CD2-CD1 4.29Å; L258-L261 WeakPolarHBondContact O-CB 3.44Å; L258-L261 PolarHBondContact O-N 2.85Å; L258-V262 WeakPolarHBondContact O-CG2 3.25Å; L258-V262 PolarHBondContact O-N 3.14Å
259N93.3Very high89.1Confident1 Ų144 Ų441%0.00520%0.204CC..Hα-helixtrans-56-58.8179.8-74.3-15.5000113.3D46 V215 N255 M257 L261 V262 Y263D46-N259 PolarHBondContact OD2-ND2 2.92Å; V215-N259 WeakPolarHBondContact CG1-OD1 3.3Å; N255-N259 PolarHBondContact O-N 3.11Å; M257-N259 VanDerWaalsContact C-N 3.3Å; M257-N259 PolarHBondContact O-N 3.16Å; N259-L261 VanDerWaalsContact C-N 3.26Å; N259-L261 PolarHBondContact O-N 3.4Å; N259-V262 PolarHBondContact O-N 2.9Å; N259-V262 VanDerWaalsContact O-N 3.17Å; N259-Y263 HydrophobicContact CB-CE2 4.09Å; N259-Y263 WeakPolarHBondContact O-CD2 3.31Å; N259-Y263 VanDerWaalsContact O-CG 3.32Å; N259-Y263 PolarHBondContact O-N 3.47Å
260P92.8Very high89.2Confident9 Ų943.5 Ų43.56%0.05820%0.201CC..Hα-helixtrans-53-38.5173.3-28.833.2000114.7G17 N18 V21 S256 M257 Y263 A264G17-P260 VanDerWaalsContact C-CG 3.43Å; N18-P260 HydrophobicContact CB-CG 4.49Å; N18-P260 WeakPolarHBondContact OD1-CG 3.2Å; V21-P260 HydrophobicContact CG2-CB 4.07Å; V21-P260 HydrophobicContact CG2-CG 4.08Å; S256-P260 WeakPolarHBondContact O-CD 3.24Å; M257-P260 WeakPolarHBondContact O-CD 3.31Å; P260-Y263 PolarHBondContact O-N 2.9Å; P260-A264 WeakPolarHBondContact O-CB 3.4Å; P260-A264 PolarHBondContact O-N 2.97Å
261L91.9Very high89.3Confident78 Ų7847 Ų4741%0.40822%0.215SC..Hα-helixtrans-64.9-47.2178.1-64.6175.7000110.8M257 L258 N259 Y263 A264 F265M257-L261 HydrophobicContact CE-CD1 4.34Å; L258-L261 HydrophobicContact CD2-CD1 4.29Å; L258-L261 WeakPolarHBondContact O-CB 3.44Å; L258-L261 PolarHBondContact O-N 2.85Å; N259-L261 VanDerWaalsContact C-N 3.26Å; N259-L261 PolarHBondContact O-N 3.4Å; L261-Y263 VanDerWaalsContact C-N 3.28Å; L261-Y263 PolarHBondContact O-N 3.09Å; L261-A264 WeakPolarHBondContact O-CB 3.49Å; L261-A264 PolarHBondContact O-N 3.26Å; L261-A264 VanDerWaalsContact O-N 3.13Å; L261-F265 HydrophobicContact CB-CD2 4.45Å; L261-F265 HydrophobicContact CB-CE2 4.4Å; L261-F265 HydrophobicContact CD2-CE2 4.33Å; L261-F265 WeakPolarHBondContact O-CD2 3.24Å; L261-F265 PolarHBondContact O-N 3.15Å
262V90.8Very high89.1Confident13 Ų1350.6 Ų50.68%0.07922%0.223CC..Hα-helixtrans-58.6-42.1176.3172.40000110.6T211 I214 V215 L258 N259 F266T211-V262 HydrophobicContact CG2-CG1 3.68Å; I214-V262 HydrophobicContact CB-CG1 4.2Å; I214-V262 HydrophobicContact CG2-CG1 3.91Å; I214-V262 HydrophobicContact CG2-CG2 3.89Å; V215-V262 HydrophobicContact CG2-CB 4.1Å; V215-V262 HydrophobicContact CG2-CG1 3.59Å; L258-V262 WeakPolarHBondContact O-CG2 3.25Å; L258-V262 PolarHBondContact O-N 3.14Å; N259-V262 PolarHBondContact O-N 2.9Å; N259-V262 VanDerWaalsContact O-N 3.17Å; V262-F266 HydrophobicContact CG1-CD2 4.09Å; V262-F266 WeakPolarHBondContact O-CB 3.39Å; V262-F266 WeakPolarHBondContact O-CD2 3.35Å; V262-F266 PolarHBondContact O-N 3.09Å
263Y90Very high89Confident2 Ų250.6 Ų50.61%0.00822%0.223CC..Hα-helixtrans-64.6-42.4174.9-57.1-38.6000112.9V21 I39 T211 L212 V215 N259 P260 L261 F265 Y267 F270V21-Y263 HydrophobicContact CG1-CD2 4.37Å; V21-Y263 HydrophobicContact CG1-CE2 4.49Å; V21-Y263 HydrophobicContact CG2-CD2 3.85Å; V21-Y263 HydrophobicContact CG2-CE2 4.44Å; I39-Y263 HydrophobicContact CD1-CE1 4.5Å; I39-Y263 HydrophobicContact CG2-CD2 4.48Å; I39-Y263 HydrophobicContact CG2-CE1 4.32Å; I39-Y263 HydrophobicContact CG2-CE2 3.77Å; T211-Y263 HydrophobicContact CG2-CD1 4.08Å; L212-Y263 HydrophobicContact CD2-CE1 4.42Å; V215-Y263 HydrophobicContact CG2-CD1 4.41Å; V215-Y263 HydrophobicContact CG2-CE1 3.66Å; N259-Y263 HydrophobicContact CB-CE2 4.09Å; N259-Y263 WeakPolarHBondContact O-CD2 3.31Å; N259-Y263 VanDerWaalsContact O-CG 3.32Å; N259-Y263 PolarHBondContact O-N 3.47Å; P260-Y263 PolarHBondContact O-N 2.9Å; L261-Y263 VanDerWaalsContact C-N 3.28Å; L261-Y263 PolarHBondContact O-N 3.09Å; Y263-F265 PolarHBondContact O-N 3.49Å; Y263-Y267 WeakPolarHBondContact O-CA 3.43Å; Y263-Y267 WeakPolarHBondContact O-CB 3.37Å; Y263-Y267 PolarHBondContact O-N 3.42Å; Y263-F270 HydrophobicContact CD1-CD2 4.45Å; Y263-F270 HydrophobicContact CG-CD2 4.14Å; Y263-F270 HydrophobicContact CG-CE2 4.45Å
264A87.1Confident89Confident24 Ų2451.3 Ų51.320%0.19823%0.226CC..Hα-helixtrans-61.9-41.1179.300000112.6P260 L261 R271 F274P260-A264 WeakPolarHBondContact O-CB 3.4Å; P260-A264 PolarHBondContact O-N 2.97Å; L261-A264 WeakPolarHBondContact O-CB 3.49Å; L261-A264 PolarHBondContact O-N 3.26Å; L261-A264 VanDerWaalsContact O-N 3.13Å; A264-R271 VanDerWaalsContact O-CB 3.25Å; A264-R271 WeakPolarHBondContact O-CB 3.15Å; A264-R271 WeakPolarHBondContact O-CD 2.82Å; A264-R271 WeakPolarHBondContact O-CG 3.29Å; A264-F274 HydrophobicContact CB-CD2 3.71Å; A264-F274 HydrophobicContact CB-CE2 3.74Å
265F85.8Confident89Confident143 Ų14356.8 Ų56.863%0.62725%0.247SC*.Hα-helixtrans-86-42.6-175.5-70-66.1000112.9L261 Y263L261-F265 HydrophobicContact CB-CD2 4.45Å; L261-F265 HydrophobicContact CB-CE2 4.4Å; L261-F265 HydrophobicContact CD2-CE2 4.33Å; L261-F265 WeakPolarHBondContact O-CD2 3.24Å; L261-F265 PolarHBondContact O-N 3.15Å; Y263-F265 PolarHBondContact O-N 3.49Å
266F81.6Confident88.7Confident103 Ų10361 Ų6145%0.45227%0.267SS..Hα-helixtrans-106.2-19.9-167.8-56.9-75.8000113.7T211 I214 V262T211-F266 HydrophobicContact CG2-CB 4.04Å; T211-F266 VanDerWaalsContact OG1-C 3.3Å; T211-F266 VanDerWaalsContact OG1-CB 3.27Å; T211-F266 WeakPolarHBondContact OG1-CB 3.5Å; T211-F266 PolarHBondContact OG1-O 2.92Å; I214-F266 HydrophobicContact CD1-CD1 4.46Å; I214-F266 HydrophobicContact CD1-CD2 4.36Å; I214-F266 HydrophobicContact CD1-CG 4.33Å; V262-F266 HydrophobicContact CG1-CD2 4.09Å; V262-F266 WeakPolarHBondContact O-CB 3.39Å; V262-F266 WeakPolarHBondContact O-CD2 3.35Å; V262-F266 PolarHBondContact O-N 3.09Å
267Y84.3Confident88.4Confident20 Ų2061.7 Ų61.78%0.07827%0.27CS..  trans-100.4100.5179.4-150.9-102.5000112.5L31 N36 A208 T211 Y263 W269 F270 R271L31-Y267 HydrophobicContact CD2-CE1 4.39Å; N36-Y267 PolarHBondContact OD1-OH 2.87Å; N36-Y267 VanDerWaalsContact OD1-OH 3.04Å; A208-Y267 HydrophobicContact CB-CD2 4.21Å; A208-Y267 HydrophobicContact CB-CE2 3.53Å; T211-Y267 HydrophobicContact CG2-CD2 4.17Å; Y263-Y267 WeakPolarHBondContact O-CA 3.43Å; Y263-Y267 WeakPolarHBondContact O-CB 3.37Å; Y263-Y267 PolarHBondContact O-N 3.42Å; Y267-W269 VanDerWaalsContact C-N 3.27Å; Y267-W269 HydrophobicContact CD1-CB 4.25Å; Y267-W269 HydrophobicContact CE1-CB 4.22Å; Y267-W269 PolarHBondContact O-N 3.36Å; Y267-W269 VanDerWaalsContact O-N 3.1Å; Y267-F270 HydrophobicContact CD1-CB 4.09Å; Y267-F270 AromaticContact CD1-CD2 3.13Å; Y267-F270 HydrophobicContact CD1-CD2 3.13Å; Y267-F270 AromaticContact CD1-CE2 3.84Å; Y267-F270 HydrophobicContact CD1-CE2 3.84Å; Y267-F270 AromaticContact CD1-CG 3.93Å; Y267-F270 HydrophobicContact CD1-CG 3.93Å; Y267-F270 AromaticContact CE1-CD2 3.66Å; Y267-F270 HydrophobicContact CE1-CD2 3.66Å; Y267-F270 AromaticContact CE1-CE2 3.88Å; Y267-F270 HydrophobicContact CE1-CE2 3.88Å; Y267-F270 AromaticContact CG-CD2 3.78Å; Y267-F270 HydrophobicContact CG-CD2 3.78Å; Y267-F270 PolarHBondContact O-N 3.05Å; Y267-F270 VanDerWaalsContact O-N 3.09Å; Y267-R271 PolarHBondContact O-N 2.82Å
268R83.8Confident88Confident141 Ų14163.5 Ų63.553%0.53228%0.28SS..Hα-helixtrans-52-39.5-173-72.1-178.9171179-5.2114.6R272R268-R272 WeakPolarHBondContact O-CG 3.03Å; R268-R272 PolarHBondContact O-N 3.45Å; R268-R272 VanDerWaalsContact O-N 3.14Å
269W83.7Confident87.8Confident133 Ų13365.8 Ų65.850%0.50429%0.289SS..Hα-helixtrans-73.3-40-179-67.1111.4000112.5L31 Y267 R272 A273L31-W269 HydrophobicContact CD2-CB 3.54Å; L31-W269 HydrophobicContact CD2-CG 4.44Å; Y267-W269 VanDerWaalsContact C-N 3.27Å; Y267-W269 HydrophobicContact CD1-CB 4.25Å; Y267-W269 HydrophobicContact CE1-CB 4.22Å; Y267-W269 PolarHBondContact O-N 3.36Å; Y267-W269 VanDerWaalsContact O-N 3.1Å; W269-R272 PolarHBondContact O-N 3.01Å; W269-A273 WeakPolarHBondContact O-CB 3.3Å; W269-A273 PolarHBondContact O-N 2.92Å
270F85.6Confident87.4Confident0 Ų070.6 Ų70.60%031%0.31CS..Hα-helixtrans-65.6-42.8172.7-83-62.9000111V21 V25 L31 I39 Y263 Y267 R272 A273 F274V21-F270 HydrophobicContact CG1-CE1 3.92Å; V21-F270 HydrophobicContact CG1-CZ 4.03Å; V25-F270 HydrophobicContact CG2-CE1 3.64Å; V25-F270 HydrophobicContact CG2-CZ 3.54Å; L31-F270 HydrophobicContact CD1-CD1 4.17Å; L31-F270 HydrophobicContact CD1-CE1 4.07Å; I39-F270 HydrophobicContact CD1-CE2 4.32Å; I39-F270 HydrophobicContact CG2-CE2 4.2Å; I39-F270 HydrophobicContact CG2-CZ 4.11Å; Y263-F270 HydrophobicContact CD1-CD2 4.45Å; Y263-F270 HydrophobicContact CG-CD2 4.14Å; Y263-F270 HydrophobicContact CG-CE2 4.45Å; Y267-F270 HydrophobicContact CD1-CB 4.09Å; Y267-F270 AromaticContact CD1-CD2 3.13Å; Y267-F270 HydrophobicContact CD1-CD2 3.13Å; Y267-F270 AromaticContact CD1-CE2 3.84Å; Y267-F270 HydrophobicContact CD1-CE2 3.84Å; Y267-F270 AromaticContact CD1-CG 3.93Å; Y267-F270 HydrophobicContact CD1-CG 3.93Å; Y267-F270 AromaticContact CE1-CD2 3.66Å; Y267-F270 HydrophobicContact CE1-CD2 3.66Å; Y267-F270 AromaticContact CE1-CE2 3.88Å; Y267-F270 HydrophobicContact CE1-CE2 3.88Å; Y267-F270 AromaticContact CG-CD2 3.78Å; Y267-F270 HydrophobicContact CG-CD2 3.78Å; Y267-F270 PolarHBondContact O-N 3.05Å; Y267-F270 VanDerWaalsContact O-N 3.09Å; F270-R272 VanDerWaalsContact C-N 3.27Å; F270-R272 PolarHBondContact O-N 3.46Å; F270-A273 WeakPolarHBondContact O-CB 3.43Å; F270-A273 PolarHBondContact O-N 3.06Å; F270-A273 VanDerWaalsContact O-N 3.11Å; F270-F274 HydrophobicContact CB-CE1 4.33Å; F270-F274 HydrophobicContact CB-CZ 4.3Å; F270-F274 AromaticContact CD1-CE1 3.82Å; F270-F274 HydrophobicContact CD1-CE1 3.82Å; F270-F274 HydrophobicContact CD1-CZ 4.16Å; F270-F274 HydrophobicContact CG-CE1 4.49Å; F270-F274 WeakPolarHBondContact O-CB 3.44Å; F270-F274 WeakPolarHBondContact O-CD1 3.36Å; F270-F274 VanDerWaalsContact O-CG 3.25Å; F270-F274 WeakPolarHBondContact O-CG 3.47Å; F270-F274 PolarHBondContact O-N 3.49Å
271R86.9Confident87Confident111 Ų11175 Ų7542%0.41933%0.332SS..Hα-helixtrans-55.7-41.2175-168.5175.767.4174.55.4112.9A264 Y267 K275A264-R271 VanDerWaalsContact O-CB 3.25Å; A264-R271 WeakPolarHBondContact O-CB 3.15Å; A264-R271 WeakPolarHBondContact O-CD 2.82Å; A264-R271 WeakPolarHBondContact O-CG 3.29Å; Y267-R271 PolarHBondContact O-N 2.82Å; R271-K275 WeakPolarHBondContact O-CG 3.46Å; R271-K275 PolarHBondContact O-N 3.46Å
272R87.5Confident86.5Confident148 Ų14877 Ų7756%0.55834%0.34SS*.Hα-helixtrans-68.1-46175.3-76178.5175.3178-3.7111.3R268 W269 F270 F274 K275 M276R268-R272 WeakPolarHBondContact O-CG 3.03Å; R268-R272 PolarHBondContact O-N 3.45Å; R268-R272 VanDerWaalsContact O-N 3.14Å; W269-R272 PolarHBondContact O-N 3.01Å; F270-R272 VanDerWaalsContact C-N 3.27Å; F270-R272 PolarHBondContact O-N 3.46Å; R272-F274 PolarHBondContact O-N 3.12Å; R272-K275 PolarHBondContact O-N 3.12Å; R272-M276 HydrophobicContact CB-CE 4.45Å; R272-M276 WeakPolarHBondContact O-CE 3.3Å; R272-M276 WeakPolarHBondContact O-CG 3.35Å; R272-M276 PolarHBondContact O-N 3.33Å
273A88Confident85.9Confident1 Ų182.9 Ų82.91%0.00837%0.366CS..Hα-helixtrans-56.9-48.8176.700000112F28 L31 W269 F270 K275 M276 I277F28-A273 HydrophobicContact CD2-CB 3.47Å; F28-A273 VanDerWaalsContact CD2-CB 3.47Å; F28-A273 HydrophobicContact CE2-CB 3.46Å; F28-A273 VanDerWaalsContact CE2-CB 3.46Å; F28-A273 HydrophobicContact CG-CB 4.35Å; F28-A273 HydrophobicContact CZ-CB 4.32Å; L31-A273 HydrophobicContact CD1-CB 4.2Å; W269-A273 WeakPolarHBondContact O-CB 3.3Å; W269-A273 PolarHBondContact O-N 2.92Å; F270-A273 WeakPolarHBondContact O-CB 3.43Å; F270-A273 PolarHBondContact O-N 3.06Å; F270-A273 VanDerWaalsContact O-N 3.11Å; A273-K275 PolarHBondContact O-N 3.21Å; A273-M276 PolarHBondContact O-N 3.35Å; A273-I277 WeakPolarHBondContact O-CG1 3.39Å; A273-I277 PolarHBondContact O-N 3.36Å
274F88.8Confident85.2Confident16 Ų1689.7 Ų89.77%0.0740%0.4CS..Hα-helixtrans-60.9-45.7179.9-68.22.1000111.4L20 V21 S24 A264 F270 R272 M276 I277 I278L20-F274 HydrophobicContact CB-CE1 4.42Å; L20-F274 HydrophobicContact CD1-CD1 4.28Å; L20-F274 HydrophobicContact CD2-CB 4.06Å; L20-F274 HydrophobicContact CD2-CD1 3.65Å; L20-F274 HydrophobicContact CD2-CD2 3.79Å; L20-F274 HydrophobicContact CD2-CE1 3.96Å; L20-F274 HydrophobicContact CD2-CE2 4.08Å; L20-F274 HydrophobicContact CD2-CG 3.56Å; L20-F274 HydrophobicContact CD2-CZ 4.16Å; L20-F274 HydrophobicContact CG-CD1 3.56Å; L20-F274 HydrophobicContact CG-CE1 3.66Å; L20-F274 HydrophobicContact CG-CG 4.04Å; L20-F274 HydrophobicContact CG-CZ 4.2Å; V21-F274 HydrophobicContact CG2-CE1 4.44Å; V21-F274 HydrophobicContact CG2-CZ 3.8Å; S24-F274 VanDerWaalsContact OG-CD1 3.24Å; S24-F274 WeakPolarHBondContact OG-CD1 3.45Å; S24-F274 VanDerWaalsContact OG-CE1 3.23Å; S24-F274 WeakPolarHBondContact OG-CE1 3.47Å; A264-F274 HydrophobicContact CB-CD2 3.71Å; A264-F274 HydrophobicContact CB-CE2 3.74Å; F270-F274 HydrophobicContact CB-CE1 4.33Å; F270-F274 HydrophobicContact CB-CZ 4.3Å; F270-F274 AromaticContact CD1-CE1 3.82Å; F270-F274 HydrophobicContact CD1-CE1 3.82Å; F270-F274 HydrophobicContact CD1-CZ 4.16Å; F270-F274 HydrophobicContact CG-CE1 4.49Å; F270-F274 WeakPolarHBondContact O-CB 3.44Å; F270-F274 WeakPolarHBondContact O-CD1 3.36Å; F270-F274 VanDerWaalsContact O-CG 3.25Å; F270-F274 WeakPolarHBondContact O-CG 3.47Å; F270-F274 PolarHBondContact O-N 3.49Å; R272-F274 PolarHBondContact O-N 3.12Å; F274-M276 VanDerWaalsContact C-N 3.33Å; F274-M276 PolarHBondContact O-N 3.38Å; F274-I277 PolarHBondContact O-N 3.21Å; F274-I278 WeakPolarHBondContact O-CB 3.47Å; F274-I278 VanDerWaalsContact O-CG1 3.26Å; F274-I278 WeakPolarHBondContact O-CG1 3.37Å; F274-I278 PolarHBondContact O-N 3.2Å
275K89.7Confident84Confident145 Ų14595.6 Ų95.663%0.6344%0.44SS*.Hα-helixtrans-59-43175.5-75.6-176.1177.9-160.30112.4R271 R272 A273 H279R271-K275 WeakPolarHBondContact O-CG 3.46Å; R271-K275 PolarHBondContact O-N 3.46Å; R272-K275 PolarHBondContact O-N 3.12Å; A273-K275 PolarHBondContact O-N 3.21Å; K275-H279 VanDerWaalsContact O-CB 3.28Å; K275-H279 WeakPolarHBondContact O-CB 3.28Å; K275-H279 PolarHBondContact O-N 3.48Å
276M88.6Confident83.9Confident88 Ų8893.3 Ų93.343%0.43343%0.431SS..Hα-helixtrans-66.8-41.3178.6-72.4-175.3-71.900112.3F28 R272 A273 F274 K280F28-M276 HydrophobicContact CD1-CE 3.85Å; F28-M276 HydrophobicContact CE1-CE 3.2Å; F28-M276 HydrophobicContact CE1-SD 3.89Å; F28-M276 HydrophobicContact CE2-CE 4.33Å; F28-M276 HydrophobicContact CZ-CB 3.95Å; F28-M276 HydrophobicContact CZ-CE 3.5Å; F28-M276 VanDerWaalsContact CZ-CE 3.5Å; F28-M276 HydrophobicContact CZ-SD 4.24Å; R272-M276 HydrophobicContact CB-CE 4.45Å; R272-M276 WeakPolarHBondContact O-CE 3.3Å; R272-M276 WeakPolarHBondContact O-CG 3.35Å; R272-M276 PolarHBondContact O-N 3.33Å; A273-M276 PolarHBondContact O-N 3.35Å; F274-M276 VanDerWaalsContact C-N 3.33Å; F274-M276 PolarHBondContact O-N 3.38Å; M276-K280 WeakPolarHBondContact O-CG 3.41Å; M276-K280 PolarHBondContact O-N 2.88Å
277I88.3Confident84Confident21 Ų2192.7 Ų92.711%0.10843%0.43CS..Hα-helixtrans-65.6-48.4178.1-67.3165.8000110.4L20 I23 S24 F28 A273 F274 H279 K280 L281L20-I277 HydrophobicContact CD1-CB 4.02Å; L20-I277 HydrophobicContact CD1-CD1 3.76Å; L20-I277 HydrophobicContact CD1-CG2 3.64Å; I23-I277 HydrophobicContact CB-CD1 4.5Å; I23-I277 HydrophobicContact CG2-CD1 3.82Å; S24-I277 WeakPolarHBondContact OG-CD1 3.37Å; F28-I277 HydrophobicContact CE2-CD1 3.96Å; F28-I277 HydrophobicContact CE2-CG1 3.99Å; F28-I277 HydrophobicContact CZ-CG1 4.36Å; A273-I277 WeakPolarHBondContact O-CG1 3.39Å; A273-I277 PolarHBondContact O-N 3.36Å; F274-I277 PolarHBondContact O-N 3.21Å; I277-H279 VanDerWaalsContact C-N 3.32Å; I277-H279 PolarHBondContact O-N 3.33Å; I277-K280 PolarHBondContact O-N 2.99Å; I277-L281 HydrophobicContact CG2-CD1 3.98Å; I277-L281 HydrophobicContact CG2-CG 4.42Å; I277-L281 WeakPolarHBondContact O-CG 3.46Å; I277-L281 PolarHBondContact O-N 3.24Å
278I86.6Confident84Confident82 Ų8296.8 Ų96.842%0.42145%0.449SS..Hα-helixtrans-60.7-43.9179.3-67.6167.1000110.5F274 K280 L281 Q282F274-I278 WeakPolarHBondContact O-CB 3.47Å; F274-I278 VanDerWaalsContact O-CG1 3.26Å; F274-I278 WeakPolarHBondContact O-CG1 3.37Å; F274-I278 PolarHBondContact O-N 3.2Å; I278-K280 VanDerWaalsContact C-N 3.34Å; I278-K280 PolarHBondContact O-N 3.17Å; I278-L281 PolarHBondContact O-N 2.82Å; I278-Q282 HydrophobicContact CG2-CG 4.49Å; I278-Q282 WeakPolarHBondContact O-CG 3.48Å; I278-Q282 PolarHBondContact O-N 3.15Å
279H89.4Confident84Confident103 Ų10394.2 Ų94.248%0.47744%0.444SS..Hα-helixtrans-61.5-41.3177.6-173.161.5000112.4K275 I277 Q282 Q283K275-H279 VanDerWaalsContact O-CB 3.28Å; K275-H279 WeakPolarHBondContact O-CB 3.28Å; K275-H279 PolarHBondContact O-N 3.48Å; I277-H279 VanDerWaalsContact C-N 3.32Å; I277-H279 PolarHBondContact O-N 3.33Å; H279-Q282 PolarHBondContact O-N 3.04Å; H279-Q283 PolarHBondContact NE2-NE2 2.76Å; H279-Q283 VanDerWaalsContact NE2-NE2 3.11Å; H279-Q283 WeakPolarHBondContact O-CG 3.3Å; H279-Q283 PolarHBondContact O-N 3.28Å
280K85.3Confident84Confident102 Ų10291.8 Ų91.844%0.44344%0.441SS..Hα-helixtrans-64.5-40.6174.3-78-169.7175.5-1650112.6Y27 M276 I277 I278 Q282 Q283 M284Y27-K280 PolarHBondContact OH-NZ 3.44Å; M276-K280 WeakPolarHBondContact O-CG 3.41Å; M276-K280 PolarHBondContact O-N 2.88Å; I277-K280 PolarHBondContact O-N 2.99Å; I278-K280 VanDerWaalsContact C-N 3.34Å; I278-K280 PolarHBondContact O-N 3.17Å; K280-Q282 VanDerWaalsContact C-N 3.31Å; K280-Q282 PolarHBondContact O-N 3.46Å; K280-Q283 PolarHBondContact O-N 2.68Å; K280-M284 WeakPolarHBondContact O-CG 3.15Å; K280-M284 PolarHBondContact O-N 3.21Å
281L83Confident83.9Confident100 Ų10097.9 Ų97.952%0.52447%0.47SS..Hα-helixtrans-61.6-41.4176.7-71.7168.9000111.4I277 I278 Q283 M284 S285I277-L281 HydrophobicContact CG2-CD1 3.98Å; I277-L281 HydrophobicContact CG2-CG 4.42Å; I277-L281 WeakPolarHBondContact O-CG 3.46Å; I277-L281 PolarHBondContact O-N 3.24Å; I278-L281 PolarHBondContact O-N 2.82Å; L281-Q283 VanDerWaalsContact C-N 3.27Å; L281-Q283 PolarHBondContact O-N 2.84Å; L281-M284 HydrophobicContact CD2-CE 3.79Å; L281-M284 HydrophobicContact CG-CE 4.48Å; L281-M284 PolarHBondContact O-N 3.39Å; L281-S285 PolarHBondContact O-N 2.99Å
282Q82.5Confident83.7Confident122 Ų12296.9 Ų96.957%0.5747%0.474SS*.Hα-helixtrans-66.2-25.3176.1-71.2175.6-39.900113.7I278 H279 K280 S285I278-Q282 HydrophobicContact CG2-CG 4.49Å; I278-Q282 WeakPolarHBondContact O-CG 3.48Å; I278-Q282 PolarHBondContact O-N 3.15Å; H279-Q282 PolarHBondContact O-N 3.04Å; K280-Q282 VanDerWaalsContact C-N 3.31Å; K280-Q282 PolarHBondContact O-N 3.46Å; Q282-S285 PolarHBondContact O-OG 3.03Å
283Q78.4Confident83.4Confident135 Ų13593 Ų9363%0.63147%0.467SS*.Hα-helixtrans-80.8-16.7176-73.7178.4-21.600113.3H279 K280 L281H279-Q283 PolarHBondContact NE2-NE2 2.76Å; H279-Q283 VanDerWaalsContact NE2-NE2 3.11Å; H279-Q283 WeakPolarHBondContact O-CG 3.3Å; H279-Q283 PolarHBondContact O-N 3.28Å; K280-Q283 PolarHBondContact O-N 2.68Å; L281-Q283 VanDerWaalsContact C-N 3.27Å; L281-Q283 PolarHBondContact O-N 2.84Å
284M74.4Confident83Confident145 Ų145100.7 Ų100.771%0.71451%0.505SS*.Hα-helixtrans-97-13.8179.9-66.4-176.5-63.400113.2K280 L281K280-M284 WeakPolarHBondContact O-CG 3.15Å; K280-M284 PolarHBondContact O-N 3.21Å; L281-M284 HydrophobicContact CD2-CE 3.79Å; L281-M284 HydrophobicContact CG-CE 4.48Å; L281-M284 PolarHBondContact O-N 3.39Å
285S61.2Low82.5Confident149 Ų149108.4 Ų108.4100%1.04255%0.545SS*.  trans-92.90175.461.70000111.6L281 Q282L281-S285 PolarHBondContact O-N 2.99Å; Q282-S285 PolarHBondContact O-OG 3.03Å

Retrieved 285 of 285 residues in 305.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).