A0A060XEQ0_ONCMY Loading...

TLC domain containing 2

AlphaFold DB , UniProt , Accession A0A060XEQ0, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 251 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
1M60.7Low83.5Confident90 Ų9075.8 Ų75.844%0.44342%0.421SS..  0138.80-138.6-167.4-12400107.4S5 V77 H80 A81M1-S5 VanDerWaalsContact SD-CB 3.57Å; M1-V77 HydrophobicContact CE-CG1 3.63Å; M1-H80 WeakPolarHBondContact CB-ND1 3.33Å; M1-A81 HydrophobicContact CE-CB 4.26Å
2E75.8Confident84.3Confident140 Ų14073.3 Ų73.365%0.65443%0.426SS*.  trans-71.7151.3176.6-66-172.8171.600110.8N4 S5 V6E2-N4 PolarHBondContact O-N 3.18Å; E2-N4 VanDerWaalsContact O-N 3.11Å; E2-S5 WeakPolarHBondContact O-CA 3.48Å; E2-S5 WeakPolarHBondContact O-CB 3.33Å; E2-S5 PolarHBondContact O-N 2.91Å; E2-V6 PolarHBondContact O-N 3.05Å
3L78.3Confident85.1Confident98 Ų9868.2 Ų68.251%0.51340%0.396SS..Hα-helixtrans-51.1-36.6178.2179.662.5000112.3S5 V6 L7 L125L3-S5 VanDerWaalsContact C-N 3.31Å; L3-S5 PolarHBondContact O-N 3Å; L3-V6 WeakPolarHBondContact O-CB 3.35Å; L3-V6 PolarHBondContact O-N 3.48Å; L3-L7 HydrophobicContact CG-CD1 4.29Å; L3-L7 WeakPolarHBondContact O-CG 3.22Å; L3-L7 PolarHBondContact O-N 3.43Å; L3-L125 HydrophobicContact CD1-CD2 3.27Å
4N83.3Confident85.6Confident114 Ų11467.1 Ų67.161%0.6139%0.387SS*.Hα-helixtrans-60.8-39.6176.7-64.9-33.1000112.3E2 V6 L7 L8E2-N4 PolarHBondContact O-N 3.18Å; E2-N4 VanDerWaalsContact O-N 3.11Å; N4-V6 VanDerWaalsContact C-N 3.34Å; N4-L7 PolarHBondContact O-N 3.38Å; N4-L8 VanDerWaalsContact O-CB 3.24Å; N4-L8 WeakPolarHBondContact O-CB 3.33Å; N4-L8 PolarHBondContact O-N 3.49Å
5S84.4Confident86.1Confident44 Ų4464.8 Ų64.831%0.30838%0.384SS..Hα-helixtrans-67.9-35.8176.9-49.50000111.8M1 E2 L3 T9M1-S5 VanDerWaalsContact SD-CB 3.57Å; E2-S5 WeakPolarHBondContact O-CA 3.48Å; E2-S5 WeakPolarHBondContact O-CB 3.33Å; E2-S5 PolarHBondContact O-N 2.91Å; L3-S5 VanDerWaalsContact C-N 3.31Å; L3-S5 PolarHBondContact O-N 3Å; S5-T9 WeakPolarHBondContact O-CB 3.24Å; S5-T9 VanDerWaalsContact O-CG2 3.25Å; S5-T9 WeakPolarHBondContact O-CG2 3.33Å; S5-T9 PolarHBondContact O-N 3.04Å; S5-T9 PolarHBondContact O-OG1 3.13Å
6V84.8Confident86.6Confident13 Ų1366.7 Ų66.78%0.07939%0.386CS..Hα-helixtrans-64.8-49.1174.8173.20000110.9E2 L3 N4 L8 T9 A10 H80 V124E2-V6 PolarHBondContact O-N 3.05Å; L3-V6 WeakPolarHBondContact O-CB 3.35Å; L3-V6 PolarHBondContact O-N 3.48Å; N4-V6 VanDerWaalsContact C-N 3.34Å; V6-L8 VanDerWaalsContact C-N 3.3Å; V6-L8 PolarHBondContact O-N 3.18Å; V6-T9 WeakPolarHBondContact CA-OG1 3.48Å; V6-T9 PolarHBondContact O-N 2.91Å; V6-T9 PolarHBondContact O-OG1 3.15Å; V6-A10 VanDerWaalsContact O-CB 3.28Å; V6-A10 WeakPolarHBondContact O-CB 3.39Å; V6-A10 PolarHBondContact O-N 3.02Å; V6-H80 VanDerWaalsContact CG2-CE1 3.41Å; V6-H80 WeakPolarHBondContact CG2-CE1 3.36Å; V6-V124 HydrophobicContact CB-CG1 4.05Å; V6-V124 HydrophobicContact CG1-CG1 3.36Å; V6-V124 HydrophobicContact CG2-CG1 3.46Å; V6-V124 VanDerWaalsContact CG2-CG1 3.46Å
7L88.1Confident87Confident109 Ų10962.8 Ų62.857%0.57136%0.364SS*.Hα-helixtrans-62.8-40.7178.8-67.4174.9000111.3L3 N4 G11L3-L7 HydrophobicContact CG-CD1 4.29Å; L3-L7 WeakPolarHBondContact O-CG 3.22Å; L3-L7 PolarHBondContact O-N 3.43Å; N4-L7 PolarHBondContact O-N 3.38Å; L7-G11 PolarHBondContact O-N 3.4Å
8L90.9Very high87.3Confident135 Ų13567.2 Ų67.271%0.70738%0.378SS*.Hα-helixtrans-64.4-45176.6-174.268.5000111.9N4 V6 G12N4-L8 VanDerWaalsContact O-CB 3.24Å; N4-L8 WeakPolarHBondContact O-CB 3.33Å; N4-L8 PolarHBondContact O-N 3.49Å; V6-L8 VanDerWaalsContact C-N 3.3Å; V6-L8 PolarHBondContact O-N 3.18Å; L8-G12 PolarHBondContact O-N 2.78Å
9T90.9Very high87.5Confident39 Ų3970.3 Ų70.324%0.23939%0.393CS..Hα-helixtrans-69.3-42.5179.4490000112.1S5 V6 G12 S13 S84S5-T9 WeakPolarHBondContact O-CB 3.24Å; S5-T9 VanDerWaalsContact O-CG2 3.25Å; S5-T9 WeakPolarHBondContact O-CG2 3.33Å; S5-T9 PolarHBondContact O-N 3.04Å; S5-T9 PolarHBondContact O-OG1 3.13Å; V6-T9 WeakPolarHBondContact CA-OG1 3.48Å; V6-T9 PolarHBondContact O-N 2.91Å; V6-T9 PolarHBondContact O-OG1 3.15Å; T9-G12 PolarHBondContact O-N 2.93Å; T9-S13 WeakPolarHBondContact O-CB 3.45Å; T9-S13 PolarHBondContact O-N 3.1Å; T9-S84 WeakPolarHBondContact OG1-CB 3.22Å
10A90.4Very high87.7Confident12 Ų1268.2 Ų68.210%0.09938%0.381CS..Hα-helixtrans-64.8-44.717500000111.6V6 S13 I14V6-A10 VanDerWaalsContact O-CB 3.28Å; V6-A10 WeakPolarHBondContact O-CB 3.39Å; V6-A10 PolarHBondContact O-N 3.02Å; A10-S13 WeakPolarHBondContact O-CB 3.42Å; A10-S13 PolarHBondContact O-N 3.44Å; A10-I14 WeakPolarHBondContact O-CG1 3.42Å; A10-I14 PolarHBondContact O-N 3.43Å
11G91.4Very high87.9Confident40 Ų4065 Ų6541%0.41236%0.364SS..Hα-helixtrans-63.3-42.6175.300000112.8L7 S13 I14 G15L7-G11 PolarHBondContact O-N 3.4Å; G11-S13 VanDerWaalsContact C-N 3.32Å; G11-S13 PolarHBondContact O-N 3.43Å; G11-I14 PolarHBondContact O-N 2.84Å; G11-G15 PolarHBondContact O-N 3.39Å; G11-G15 VanDerWaalsContact O-N 3.09Å
12G93.3Very high89.2Confident46 Ų4663.6 Ų63.647%0.47436%0.362SS..Hα-helixtrans-60.8-40.5172.900000112.4L8 T9 G15 F16L8-G12 PolarHBondContact O-N 2.78Å; T9-G12 PolarHBondContact O-N 2.93Å; G12-G15 PolarHBondContact O-N 2.9Å; G12-F16 WeakPolarHBondContact O-CB 3.24Å; G12-F16 PolarHBondContact O-N 3.45Å
13S93.6Very high89.8Confident6 Ų658.6 Ų58.64%0.04235%0.348CS..Hα-helixtrans-62.2-44.6174.8179.10000112.2T9 A10 G11 G15 F16 F17 V85 Y89T9-S13 WeakPolarHBondContact O-CB 3.45Å; T9-S13 PolarHBondContact O-N 3.1Å; A10-S13 WeakPolarHBondContact O-CB 3.42Å; A10-S13 PolarHBondContact O-N 3.44Å; G11-S13 VanDerWaalsContact C-N 3.32Å; G11-S13 PolarHBondContact O-N 3.43Å; S13-G15 VanDerWaalsContact C-N 3.29Å; S13-G15 PolarHBondContact O-N 3.2Å; S13-F16 WeakPolarHBondContact O-CB 3.31Å; S13-F16 PolarHBondContact O-N 2.84Å; S13-F16 VanDerWaalsContact O-N 3.17Å; S13-F17 VanDerWaalsContact O-CD2 3.29Å; S13-F17 WeakPolarHBondContact O-CD2 3.47Å; S13-F17 PolarHBondContact O-N 3.32Å; S13-F17 WeakPolarHBondContact OG-CD2 3.38Å; S13-F17 WeakPolarHBondContact OG-CE2 3.44Å; S13-V85 WeakPolarHBondContact CB-O 3.49Å; S13-V85 PolarHBondContact OG-O 2.96Å; S13-Y89 PolarHBondContact OG-N 2.99Å
14I93.2Very high90.3Very high53 Ų5354.6 Ų54.627%0.27233%0.328SS..Hα-helixtrans-56.3-46.3174-66.9165.6000110.5A10 G11 K18 G88 I91 Y92A10-I14 WeakPolarHBondContact O-CG1 3.42Å; A10-I14 PolarHBondContact O-N 3.43Å; G11-I14 PolarHBondContact O-N 2.84Å; I14-K18 WeakPolarHBondContact O-CB 3.27Å; I14-K18 PolarHBondContact O-N 3.35Å; I14-G88 WeakPolarHBondContact CG1-O 3.39Å; I14-I91 HydrophobicContact CD1-CB 4.36Å; I14-I91 HydrophobicContact CD1-CG2 3.94Å; I14-Y92 HydrophobicContact CG2-CD2 4.3Å
15G91.9Very high90.3Very high33 Ų3351.5 Ų51.534%0.3432%0.315SS..Hα-helixtrans-60.7-45.9176.200000112.7G11 G12 S13 K18 L19G11-G15 PolarHBondContact O-N 3.39Å; G11-G15 VanDerWaalsContact O-N 3.09Å; G12-G15 PolarHBondContact O-N 2.9Å; S13-G15 VanDerWaalsContact C-N 3.29Å; S13-G15 PolarHBondContact O-N 3.2Å; G15-K18 WeakPolarHBondContact O-CB 3.44Å; G15-K18 PolarHBondContact O-N 3.03Å; G15-L19 WeakPolarHBondContact O-CG 3.46Å; G15-L19 PolarHBondContact O-N 3.46Å
16F94.8Very high90.4Very high95 Ų9557.5 Ų57.542%0.41734%0.336SS..Hα-helixtrans-59.1-51177.7173.1-99.4000112G12 S13 K18 L19 V20 I52G12-F16 WeakPolarHBondContact O-CB 3.24Å; G12-F16 PolarHBondContact O-N 3.45Å; S13-F16 WeakPolarHBondContact O-CB 3.31Å; S13-F16 PolarHBondContact O-N 2.84Å; S13-F16 VanDerWaalsContact O-N 3.17Å; F16-K18 VanDerWaalsContact C-N 3.3Å; F16-K18 PolarHBondContact O-N 3.41Å; F16-L19 CarbonylContact O-C 3.18Å; F16-L19 WeakPolarHBondContact O-CA 3.43Å; F16-L19 WeakPolarHBondContact O-CB 3.25Å; F16-L19 PolarHBondContact O-N 3.25Å; F16-V20 HydrophobicContact CD1-CG2 4.18Å; F16-V20 HydrophobicContact CE1-CG2 3.72Å; F16-V20 HydrophobicContact CE2-CG2 4.18Å; F16-V20 HydrophobicContact CZ-CG2 3.73Å; F16-V20 WeakPolarHBondContact O-CG2 3.13Å; F16-V20 PolarHBondContact O-N 2.82Å; F16-I52 HydrophobicContact CE1-CD1 3.84Å; F16-I52 HydrophobicContact CZ-CD1 4.04Å
17F92.9Very high90.3Very high1 Ų161.9 Ų61.90%0.00436%0.358CS..Hα-helixtrans-68.8-29.3-179.3-77-72.4000112.9S13 V20 N21 T45 H49 V85 Y89 Y92S13-F17 VanDerWaalsContact O-CD2 3.29Å; S13-F17 WeakPolarHBondContact O-CD2 3.47Å; S13-F17 PolarHBondContact O-N 3.32Å; S13-F17 WeakPolarHBondContact OG-CD2 3.38Å; S13-F17 WeakPolarHBondContact OG-CE2 3.44Å; F17-V20 PolarHBondContact O-N 3.41Å; F17-N21 WeakPolarHBondContact O-CB 3.39Å; F17-N21 PolarHBondContact O-N 3.09Å; F17-T45 HydrophobicContact CB-CG2 4.32Å; F17-T45 HydrophobicContact CD1-CG2 3.87Å; F17-H49 HydrophobicContact CE1-CB 3.58Å; F17-H49 HydrophobicContact CZ-CB 3.76Å; F17-H49 AromaticContact CZ-ND1 3.6Å; F17-V85 HydrophobicContact CE2-CG1 4.47Å; F17-Y89 HydrophobicContact CB-CD2 4.39Å; F17-Y89 AromaticContact CD1-CD2 3.65Å; F17-Y89 HydrophobicContact CD1-CD2 3.65Å; F17-Y89 HydrophobicContact CD1-CE2 4.22Å; F17-Y89 AromaticContact CD2-CD2 3.85Å; F17-Y89 HydrophobicContact CD2-CD2 3.85Å; F17-Y89 HydrophobicContact CD2-CG 4.26Å; F17-Y89 AromaticContact CE1-CD2 3.81Å; F17-Y89 HydrophobicContact CE1-CD2 3.81Å; F17-Y89 HydrophobicContact CE1-CE2 4.4Å; F17-Y89 HydrophobicContact CE2-CD2 4.02Å; F17-Y89 HydrophobicContact CE2-CG 4.18Å; F17-Y89 AromaticContact CG-CD2 3.68Å; F17-Y89 HydrophobicContact CG-CD2 3.68Å; F17-Y89 AromaticContact CZ-CD2 3.99Å; F17-Y89 HydrophobicContact CZ-CD2 3.99Å; F17-Y89 HydrophobicContact CZ-CG 4.34Å; F17-Y92 HydrophobicContact CB-CD1 3.71Å; F17-Y92 HydrophobicContact CB-CE1 4.02Å; F17-Y92 HydrophobicContact CB-CG 4.12Å
18K91.9Very high89.8Confident141 Ų14162.3 Ų62.361%0.61337%0.367SS*.Hα-helixtrans-62.7-41.4168.2-173.1176.4-177.5177.80111.9I14 G15 F16 N21 C22 Y92I14-K18 WeakPolarHBondContact O-CB 3.27Å; I14-K18 PolarHBondContact O-N 3.35Å; G15-K18 WeakPolarHBondContact O-CB 3.44Å; G15-K18 PolarHBondContact O-N 3.03Å; F16-K18 VanDerWaalsContact C-N 3.3Å; F16-K18 PolarHBondContact O-N 3.41Å; K18-N21 PolarHBondContact O-N 3.44Å; K18-C22 WeakPolarHBondContact O-CB 3.22Å; K18-C22 PolarHBondContact O-N 3.36Å; K18-Y92 HydrophobicContact CB-CD2 4.4Å; K18-Y92 HydrophobicContact CB-CE2 3.85Å; K18-Y92 HydrophobicContact CG-CE2 4.36Å
19L92.6Very high89.5Confident127 Ų12758.3 Ų58.367%0.66535%0.346SS*.Hα-helixtrans-66.4-41.4174.6-69.5174.1000111.8G15 F16 C22 G23G15-L19 WeakPolarHBondContact O-CG 3.46Å; G15-L19 PolarHBondContact O-N 3.46Å; F16-L19 CarbonylContact O-C 3.18Å; F16-L19 WeakPolarHBondContact O-CA 3.43Å; F16-L19 WeakPolarHBondContact O-CB 3.25Å; F16-L19 PolarHBondContact O-N 3.25Å; L19-C22 WeakPolarHBondContact O-CB 3.27Å; L19-C22 PolarHBondContact O-N 2.96Å; L19-G23 PolarHBondContact O-N 3.48Å
20V91.8Very high89Confident27 Ų2758.3 Ų58.316%0.16435%0.347CS..Hα-helixtrans-58.1-50173.6171.50000110.3F16 F17 C22 G23 V24 T45 T48F16-V20 HydrophobicContact CD1-CG2 4.18Å; F16-V20 HydrophobicContact CE1-CG2 3.72Å; F16-V20 HydrophobicContact CE2-CG2 4.18Å; F16-V20 HydrophobicContact CZ-CG2 3.73Å; F16-V20 WeakPolarHBondContact O-CG2 3.13Å; F16-V20 PolarHBondContact O-N 2.82Å; F17-V20 PolarHBondContact O-N 3.41Å; V20-C22 VanDerWaalsContact C-N 3.28Å; V20-C22 PolarHBondContact O-N 3.31Å; V20-G23 WeakPolarHBondContact O-CA 3.27Å; V20-G23 PolarHBondContact O-N 3.46Å; V20-V24 HydrophobicContact CG1-CG2 4.34Å; V20-V24 WeakPolarHBondContact O-CG2 3.37Å; V20-V24 PolarHBondContact O-N 3.24Å; V20-T45 HydrophobicContact CG1-CG2 4.16Å; V20-T48 HydrophobicContact CG1-CG2 4.07Å; V20-T48 HydrophobicContact CG2-CG2 4.37Å
21N91.1Very high88.4Confident3 Ų366.6 Ų66.62%0.01638%0.383CS..Hα-helixtrans-61.3-38.5178.4-169.6-20.1000111.5F17 K18 V24 S25 R41 T45 Y92F17-N21 WeakPolarHBondContact O-CB 3.39Å; F17-N21 PolarHBondContact O-N 3.09Å; K18-N21 PolarHBondContact O-N 3.44Å; N21-V24 PolarHBondContact O-N 3.39Å; N21-S25 PolarHBondContact O-N 2.98Å; N21-R41 PolarHBondContact OD1-NE 3.33Å; N21-R41 PolarHBondContact OD1-NH2 3.27Å; N21-T45 HydrophobicContact CB-CG2 4.35Å; N21-Y92 WeakPolarHBondContact CB-OH 3.49Å; N21-Y92 PolarHBondContact ND2-OH 2.95Å
22C88.8Confident87.7Confident59 Ų5967.1 Ų67.140%0.39938%0.381SS..Hα-helixtrans-62.3-43.7172.2-170.90000112.1K18 L19 V20 S25K18-C22 WeakPolarHBondContact O-CB 3.22Å; K18-C22 PolarHBondContact O-N 3.36Å; L19-C22 WeakPolarHBondContact O-CB 3.27Å; L19-C22 PolarHBondContact O-N 2.96Å; V20-C22 VanDerWaalsContact C-N 3.28Å; V20-C22 PolarHBondContact O-N 3.31Å; C22-S25 WeakPolarHBondContact O-CB 3.36Å; C22-S25 PolarHBondContact O-N 3.31Å; C22-S25 PolarHBondContact O-OG 3.01Å
23G88.4Confident86.9Confident36 Ų3665 Ų6537%0.37136%0.359SS..Hα-helixtrans-60.3-46.4174.400000112.6L19 V20 S25 K26L19-G23 PolarHBondContact O-N 3.48Å; V20-G23 WeakPolarHBondContact O-CA 3.27Å; V20-G23 PolarHBondContact O-N 3.46Å; G23-S25 PolarHBondContact O-N 3.39Å; G23-K26 WeakPolarHBondContact O-CB 3.47Å; G23-K26 PolarHBondContact O-N 3.14Å
24V87.5Confident86.1Confident13 Ų1368 Ų688%0.07938%0.379CS..Hα-helixtrans-61.3-34176.5174.30000111.4V20 N21 K26 L27 R41 C44V20-V24 HydrophobicContact CG1-CG2 4.34Å; V20-V24 WeakPolarHBondContact O-CG2 3.37Å; V20-V24 PolarHBondContact O-N 3.24Å; N21-V24 PolarHBondContact O-N 3.39Å; V24-K26 PolarHBondContact O-N 3.21Å; V24-L27 WeakPolarHBondContact O-CB 3.29Å; V24-L27 PolarHBondContact O-N 3.36Å; V24-L27 VanDerWaalsContact O-N 3.09Å; V24-R41 HydrophobicContact CG1-CB 4.37Å; V24-R41 HydrophobicContact CG1-CG 4.16Å; V24-C44 HydrophobicContact CB-CB 4.47Å; V24-C44 HydrophobicContact CG1-CB 3.61Å; V24-C44 HydrophobicContact CG2-CB 3.98Å
25S84.4Confident85.3Confident49 Ų4976.2 Ų76.234%0.34341%0.407SS..Hα-helixtrans-64.2-19.717780.20000114.1N21 C22 G23N21-S25 PolarHBondContact O-N 2.98Å; C22-S25 WeakPolarHBondContact O-CB 3.36Å; C22-S25 PolarHBondContact O-N 3.31Å; C22-S25 PolarHBondContact O-OG 3.01Å; G23-S25 PolarHBondContact O-N 3.39Å
26K85.5Confident84.9Confident171 Ų17178.8 Ų78.874%0.74341%0.413SS*.THydrogen-bonded Turntrans-89.7-10.6176.3-61-179.4-179.4-178.50113.3G23 V24G23-K26 WeakPolarHBondContact O-CB 3.47Å; G23-K26 PolarHBondContact O-N 3.14Å; V24-K26 PolarHBondContact O-N 3.21Å
27L83.3Confident84.4Confident104 Ų10475.9 Ų75.955%0.54541%0.406SS..SBendtrans-77.4149.1178.3-66.5175.8000110.7V24 I29V24-L27 WeakPolarHBondContact O-CB 3.29Å; V24-L27 PolarHBondContact O-N 3.36Å; V24-L27 VanDerWaalsContact O-N 3.09Å; L27-I29 PolarHBondContact O-N 3.29Å
28P77.9Confident84.2Confident119 Ų11978 Ų7877%0.77341%0.414SS*.PPolyproline II helixtrans-61.1124.5175.425-32.7000110.1
29I82.9Confident84Confident50 Ų5075.5 Ų75.526%0.25640%0.403SS..PPolyproline II helixtrans-93.4129177.3-55177000107.6L27 E31 A33 A37 W40L27-I29 PolarHBondContact O-N 3.29Å; I29-E31 PolarHBondContact O-N 3.37Å; I29-A33 HydrophobicContact CG2-CB 3.87Å; I29-A37 HydrophobicContact CD1-CB 4.11Å; I29-W40 HydrophobicContact CG2-CG 4.3Å
30P80.6Confident83.8Confident40 Ų4070.6 Ų70.626%0.2638%0.376SS..PPolyproline II helixtrans-56.5139.6172.4-23.432.4000111S32 A33 C34 W40 A155P30-S32 PolarHBondContact O-N 2.84Å; P30-S32 VanDerWaalsContact O-N 3.1Å; P30-A33 HydrophobicContact CB-CB 4.27Å; P30-A33 HydrophobicContact CG-CB 4.47Å; P30-A33 WeakPolarHBondContact O-CA 3.26Å; P30-A33 WeakPolarHBondContact O-CB 3.24Å; P30-A33 PolarHBondContact O-N 2.91Å; P30-C34 PolarHBondContact O-N 3.45Å; P30-C34 VanDerWaalsContact O-N 3.08Å; P30-C34 PolarHBondContact O-SG 3.36Å; P30-W40 HydrophobicContact CG-CH2 3.8Å; P30-W40 HydrophobicContact CG-CZ2 4.17Å; P30-W40 HydrophobicContact CG-CZ3 4.27Å; P30-A155 HydrophobicContact CB-CB 4.38Å; P30-A155 HydrophobicContact CG-CB 4.06Å
31E78.8Confident83.6Confident185 Ų18573.1 Ų73.186%0.86438%0.383SS*.Hα-helixtrans-54.1-36-178.7-69.2-173.8168.800112.6I29 A33 C34I29-E31 PolarHBondContact O-N 3.37Å; E31-A33 VanDerWaalsContact C-N 3.28Å; E31-A33 PolarHBondContact O-N 3.47Å; E31-C34 WeakPolarHBondContact O-CB 3.26Å; E31-C34 PolarHBondContact O-N 3.32Å
32S76.1Confident83.7Confident52 Ų5273.5 Ų73.536%0.36439%0.385SS..Hα-helixtrans-64-30.8175.3610000113.6P30 M154 A155 S156P30-S32 PolarHBondContact O-N 2.84Å; P30-S32 VanDerWaalsContact O-N 3.1Å; S32-M154 CarbonylContact C-O 3.47Å; S32-M154 WeakPolarHBondContact CB-O 3.5Å; S32-M154 PolarHBondContact OG-O 2.93Å; S32-A155 WeakPolarHBondContact OG-CA 3.06Å; S32-S156 VanDerWaalsContact CB-OG 3.26Å; S32-S156 WeakPolarHBondContact CB-OG 3.45Å
33A76.6Confident83.7Confident2 Ų271 Ų712%0.01737%0.367CS..Hα-helixtrans-88.5-17.7179.600000112.7I29 P30 E31 R35 N36 A37 W40 M154I29-A33 HydrophobicContact CG2-CB 3.87Å; P30-A33 HydrophobicContact CB-CB 4.27Å; P30-A33 HydrophobicContact CG-CB 4.47Å; P30-A33 WeakPolarHBondContact O-CA 3.26Å; P30-A33 WeakPolarHBondContact O-CB 3.24Å; P30-A33 PolarHBondContact O-N 2.91Å; E31-A33 VanDerWaalsContact C-N 3.28Å; E31-A33 PolarHBondContact O-N 3.47Å; A33-R35 PolarHBondContact O-N 2.88Å; A33-N36 CarbonylContact O-C 3.59Å; A33-N36 PolarHBondContact O-N 2.94Å; A33-A37 PolarHBondContact O-N 2.99Å; A33-W40 HydrophobicContact CB-CD2 4.13Å; A33-W40 HydrophobicContact CB-CE3 3.71Å; A33-W40 HydrophobicContact CB-CG 4.49Å; A33-W40 HydrophobicContact CB-CZ3 4.21Å; A33-M154 HydrophobicContact CB-CB 4.3Å; A33-M154 HydrophobicContact CB-CE 4.48Å
34C76.4Confident83.9Confident68 Ų6870.1 Ų70.146%0.45936%0.355SS..Hα-helixtrans-56.3-33.3177.4-71.80000112.9P30 E31 N36 A37P30-C34 PolarHBondContact O-N 3.45Å; P30-C34 VanDerWaalsContact O-N 3.08Å; P30-C34 PolarHBondContact O-SG 3.36Å; E31-C34 WeakPolarHBondContact O-CB 3.26Å; E31-C34 PolarHBondContact O-N 3.32Å; C34-N36 PolarHBondContact O-N 3.46Å; C34-N36 VanDerWaalsContact O-N 3.1Å; C34-A37 PolarHBondContact O-N 3.17Å
35R77.9Confident84.1Confident225 Ų22569.5 Ų69.585%0.84935%0.352SS*.THydrogen-bonded Turntrans-56.7-27.5175.6-175.3175170.5-177.1-0.8113.1A33A33-R35 PolarHBondContact O-N 2.88Å
36N83.1Confident84.6Confident87 Ų8767.3 Ų67.347%0.46534%0.336SS..THydrogen-bonded Turntrans-133.953.6175.7-70.8-52.3000110.8A33 C34 W38 K39 W40 M154A33-N36 CarbonylContact O-C 3.59Å; A33-N36 PolarHBondContact O-N 2.94Å; C34-N36 PolarHBondContact O-N 3.46Å; C34-N36 VanDerWaalsContact O-N 3.1Å; N36-W38 PolarHBondContact O-N 3.33Å; N36-K39 HydrophobicContact CB-CB 4.06Å; N36-K39 PolarHBondContact O-N 3.16Å; N36-W40 PolarHBondContact O-N 3.3Å; N36-W40 VanDerWaalsContact O-N 3.1Å; N36-M154 HydrophobicContact CB-CE 4.42Å
37A85Confident84.9Confident34 Ų3460.7 Ų60.728%0.28131%0.309SS..Hα-helixtrans-55.1-36.5-176.600000113.6I29 A33 C34 W40 R41I29-A37 HydrophobicContact CD1-CB 4.11Å; A33-A37 PolarHBondContact O-N 2.99Å; C34-A37 PolarHBondContact O-N 3.17Å; A37-W40 WeakPolarHBondContact O-CB 3.37Å; A37-W40 PolarHBondContact O-N 2.8Å; A37-R41 WeakPolarHBondContact O-CG 3.42Å; A37-R41 PolarHBondContact O-N 3.27Å; A37-R41 VanDerWaalsContact O-N 3.12Å
38W88.3Confident85.4Confident47 Ų4757.7 Ų57.718%0.17830%0.295CS..Hα-helixtrans-62-47.4174.4173.182.1000111.9N36 W40 R41 N42 D96 M97 N100 Q101N36-W38 PolarHBondContact O-N 3.33Å; W38-W40 VanDerWaalsContact C-N 3.25Å; W38-W40 PolarHBondContact O-N 3.27Å; W38-R41 WeakPolarHBondContact O-CB 3.43Å; W38-R41 PolarHBondContact O-N 3.39Å; W38-R41 VanDerWaalsContact O-N 3.1Å; W38-N42 HydrophobicContact CH2-CB 4.06Å; W38-N42 WeakPolarHBondContact CH2-OD1 3.02Å; W38-N42 HydrophobicContact CZ2-CB 4.05Å; W38-N42 WeakPolarHBondContact CZ2-OD1 3.23Å; W38-N42 HydrophobicContact CZ3-CB 4.4Å; W38-N42 PolarHBondContact O-N 2.93Å; W38-D96 PolarHBondContact NE1-OD2 3.23Å; W38-M97 HydrophobicContact CH2-CG 3.97Å; W38-M97 HydrophobicContact CZ2-CG 4.18Å; W38-N100 HydrophobicContact CD2-CB 3.79Å; W38-N100 HydrophobicContact CG-CB 3.81Å; W38-N100 HydrophobicContact CZ2-CB 4.04Å; W38-N100 PolarHBondContact NE1-ND2 3.33Å; W38-Q101 HydrophobicContact CD2-CG 4.47Å; W38-Q101 HydrophobicContact CE3-CG 3.65Å; W38-Q101 HydrophobicContact CH2-CB 4.3Å; W38-Q101 HydrophobicContact CH2-CG 3.29Å; W38-Q101 HydrophobicContact CZ2-CG 4.13Å; W38-Q101 HydrophobicContact CZ3-CB 4.37Å; W38-Q101 HydrophobicContact CZ3-CG 3.02Å
39K87.4Confident86.3Confident87 Ų8752.1 Ų52.138%0.37826%0.259SS..Hα-helixtrans-63-36-179.3-174.7173.3-179.8168.80111.2N36 V43 M154N36-K39 HydrophobicContact CB-CB 4.06Å; N36-K39 PolarHBondContact O-N 3.16Å; K39-V43 HydrophobicContact CG-CG2 4.37Å; K39-V43 WeakPolarHBondContact O-CB 3.26Å; K39-V43 WeakPolarHBondContact O-CG2 3.31Å; K39-V43 PolarHBondContact O-N 3.43Å; K39-M154 HydrophobicContact CB-CE 4.15Å; K39-M154 HydrophobicContact CD-SD 4.44Å; K39-M154 HydrophobicContact CG-CE 4.21Å; K39-M154 HydrophobicContact CG-SD 4.21Å
40W87.3Confident86.8Confident25 Ų2549.7 Ų49.710%0.09525%0.246CC..Hα-helixtrans-59.3-51.1173.6174.2-96.6000110.9I29 P30 A33 N36 A37 W38 N42 V43 C44 I151 M154 A155I29-W40 HydrophobicContact CG2-CG 4.3Å; P30-W40 HydrophobicContact CG-CH2 3.8Å; P30-W40 HydrophobicContact CG-CZ2 4.17Å; P30-W40 HydrophobicContact CG-CZ3 4.27Å; A33-W40 HydrophobicContact CB-CD2 4.13Å; A33-W40 HydrophobicContact CB-CE3 3.71Å; A33-W40 HydrophobicContact CB-CG 4.49Å; A33-W40 HydrophobicContact CB-CZ3 4.21Å; N36-W40 PolarHBondContact O-N 3.3Å; N36-W40 VanDerWaalsContact O-N 3.1Å; A37-W40 WeakPolarHBondContact O-CB 3.37Å; A37-W40 PolarHBondContact O-N 2.8Å; W38-W40 VanDerWaalsContact C-N 3.25Å; W38-W40 PolarHBondContact O-N 3.27Å; W40-N42 PolarHBondContact O-N 2.71Å; W40-V43 PolarHBondContact O-N 3.16Å; W40-C44 PolarHBondContact O-N 3.17Å; W40-C44 PolarHBondContact O-SG 3.3Å; W40-I151 HydrophobicContact CH2-CG2 3.54Å; W40-I151 HydrophobicContact CZ2-CG2 4.43Å; W40-I151 HydrophobicContact CZ3-CB 4.28Å; W40-I151 HydrophobicContact CZ3-CG2 3.65Å; W40-M154 HydrophobicContact CB-CE 3.85Å; W40-M154 HydrophobicContact CE3-CB 4.07Å; W40-M154 HydrophobicContact CE3-CE 4.33Å; W40-M154 HydrophobicContact CZ3-CB 4.23Å; W40-A155 HydrophobicContact CZ3-CB 4.44Å
41R89.6Confident87.5Confident79 Ų7951.3 Ų51.330%0.29825%0.253SS..Hα-helixtrans-60.7-43.7178.8-69.5171.258.7-174.8-1.5112.7N21 V24 A37 W38 C44 T45N21-R41 PolarHBondContact OD1-NE 3.33Å; N21-R41 PolarHBondContact OD1-NH2 3.27Å; V24-R41 HydrophobicContact CG1-CB 4.37Å; V24-R41 HydrophobicContact CG1-CG 4.16Å; A37-R41 WeakPolarHBondContact O-CG 3.42Å; A37-R41 PolarHBondContact O-N 3.27Å; A37-R41 VanDerWaalsContact O-N 3.12Å; W38-R41 WeakPolarHBondContact O-CB 3.43Å; W38-R41 PolarHBondContact O-N 3.39Å; W38-R41 VanDerWaalsContact O-N 3.1Å; R41-C44 PolarHBondContact O-N 2.99Å; R41-T45 WeakPolarHBondContact O-CB 3.27Å; R41-T45 PolarHBondContact O-N 3.2Å; R41-T45 PolarHBondContact O-OG1 3.39Å
42N91.2Very high88.2Confident11 Ų1145.1 Ų45.16%0.05923%0.225CC..Hα-helixtrans-58.6-52.3176.5-162109000110.3W38 W40 C44 T45 S46 D93W38-N42 HydrophobicContact CH2-CB 4.06Å; W38-N42 WeakPolarHBondContact CH2-OD1 3.02Å; W38-N42 HydrophobicContact CZ2-CB 4.05Å; W38-N42 WeakPolarHBondContact CZ2-OD1 3.23Å; W38-N42 HydrophobicContact CZ3-CB 4.4Å; W38-N42 PolarHBondContact O-N 2.93Å; W40-N42 PolarHBondContact O-N 2.71Å; N42-C44 VanDerWaalsContact C-N 3.34Å; N42-C44 PolarHBondContact O-N 3Å; N42-T45 WeakPolarHBondContact O-CB 3.38Å; N42-T45 PolarHBondContact O-N 3.05Å; N42-S46 PolarHBondContact ND2-OG 3.5Å; N42-S46 PolarHBondContact O-N 2.94Å; N42-S46 PolarHBondContact O-OG 2.94Å; N42-D93 PolarHBondContact ND2-OD1 2.99Å; N42-D93 PolarHBondContact OD1-OD1 3.13Å
43V90.6Very high89.1Confident6 Ų642.7 Ų42.74%0.03621%0.208CC..Hα-helixtrans-62.3-39.4-177.5176.40000112.2K39 W40 T45 S46 L47 H147 Q150 I151K39-V43 HydrophobicContact CG-CG2 4.37Å; K39-V43 WeakPolarHBondContact O-CB 3.26Å; K39-V43 WeakPolarHBondContact O-CG2 3.31Å; K39-V43 PolarHBondContact O-N 3.43Å; W40-V43 PolarHBondContact O-N 3.16Å; V43-T45 VanDerWaalsContact C-N 3.33Å; V43-S46 PolarHBondContact O-N 3.45Å; V43-L47 WeakPolarHBondContact O-CB 3.2Å; V43-L47 PolarHBondContact O-N 2.74Å; V43-H147 HydrophobicContact CG1-CB 4.02Å; V43-Q150 HydrophobicContact CG1-CB 4.18Å; V43-Q150 HydrophobicContact CG1-CG 4.24Å; V43-Q150 HydrophobicContact CG2-CG 4.09Å; V43-I151 HydrophobicContact CG1-CD1 4.09Å; V43-I151 HydrophobicContact CG1-CG1 3.63Å
44C91.4Very high89.8Confident18 Ų1842.8 Ų42.812%0.12221%0.209CC..Hα-helixtrans-65.8-36.9174.8-69.70000112.3V24 W40 R41 N42 L47 T48V24-C44 HydrophobicContact CB-CB 4.47Å; V24-C44 HydrophobicContact CG1-CB 3.61Å; V24-C44 HydrophobicContact CG2-CB 3.98Å; W40-C44 PolarHBondContact O-N 3.17Å; W40-C44 PolarHBondContact O-SG 3.3Å; R41-C44 PolarHBondContact O-N 2.99Å; N42-C44 VanDerWaalsContact C-N 3.34Å; N42-C44 PolarHBondContact O-N 3Å; C44-L47 PolarHBondContact O-N 3.41Å; C44-T48 PolarHBondContact O-N 2.77Å; C44-T48 PolarHBondContact O-OG1 3.46Å
45T92.8Very high90.6Very high0 Ų044.6 Ų44.60%021%0.213CC..Hα-helixtrans-67.9-43.4175.5-52.50000110.5F17 V20 N21 R41 N42 V43 L47 T48 H49 Y92F17-T45 HydrophobicContact CB-CG2 4.32Å; F17-T45 HydrophobicContact CD1-CG2 3.87Å; V20-T45 HydrophobicContact CG1-CG2 4.16Å; N21-T45 HydrophobicContact CB-CG2 4.35Å; R41-T45 WeakPolarHBondContact O-CB 3.27Å; R41-T45 PolarHBondContact O-N 3.2Å; R41-T45 PolarHBondContact O-OG1 3.39Å; N42-T45 WeakPolarHBondContact O-CB 3.38Å; N42-T45 PolarHBondContact O-N 3.05Å; V43-T45 VanDerWaalsContact C-N 3.33Å; T45-L47 VanDerWaalsContact C-N 3.34Å; T45-L47 PolarHBondContact O-N 2.93Å; T45-T48 WeakPolarHBondContact O-CB 3.49Å; T45-T48 PolarHBondContact O-N 2.94Å; T45-T48 VanDerWaalsContact O-N 3.16Å; T45-H49 PolarHBondContact O-N 3.02Å; T45-Y92 HydrophobicContact CG2-CE1 4.04Å
46S93.1Very high91.4Very high3 Ų336.9 Ų36.92%0.02118%0.184CC..Hα-helixtrans-63.9-35.6173.9-46.20000113N42 V43 T48 H49 S50 Y89 H147N42-S46 PolarHBondContact ND2-OG 3.5Å; N42-S46 PolarHBondContact O-N 2.94Å; N42-S46 PolarHBondContact O-OG 2.94Å; V43-S46 PolarHBondContact O-N 3.45Å; S46-T48 VanDerWaalsContact C-N 3.34Å; S46-H49 PolarHBondContact O-N 3.02Å; S46-S50 WeakPolarHBondContact O-CB 3.4Å; S46-S50 PolarHBondContact O-N 2.72Å; S46-S50 PolarHBondContact O-OG 2.82Å; S46-Y89 WeakPolarHBondContact CA-OH 3.49Å; S46-Y89 WeakPolarHBondContact CB-OH 3.45Å; S46-Y89 PolarHBondContact OG-OH 3.17Å; S46-H147 VanDerWaalsContact CB-CE1 3.47Å; S46-H147 WeakPolarHBondContact CB-CE1 3.44Å; S46-H147 WeakPolarHBondContact CB-NE2 3.39Å
47L93.6Very high91.8Very high32 Ų3232.8 Ų32.817%0.16816%0.162CC..Hα-helixtrans-61.7-44171.8177.563.2000110.9V43 C44 T45 H49 S50 L51 V144 H147 I151V43-L47 WeakPolarHBondContact O-CB 3.2Å; V43-L47 PolarHBondContact O-N 2.74Å; C44-L47 PolarHBondContact O-N 3.41Å; T45-L47 VanDerWaalsContact C-N 3.34Å; T45-L47 PolarHBondContact O-N 2.93Å; L47-H49 VanDerWaalsContact C-N 3.32Å; L47-H49 PolarHBondContact O-N 2.94Å; L47-S50 WeakPolarHBondContact CA-OG 3.25Å; L47-S50 PolarHBondContact O-N 3.48Å; L47-S50 PolarHBondContact O-OG 2.86Å; L47-L51 HydrophobicContact CD1-CD1 4.23Å; L47-L51 HydrophobicContact CD1-CG 4.27Å; L47-L51 HydrophobicContact CG-CD1 4.07Å; L47-L51 WeakPolarHBondContact O-CB 3.37Å; L47-L51 VanDerWaalsContact O-CG 3.32Å; L47-L51 WeakPolarHBondContact O-CG 3.31Å; L47-L51 PolarHBondContact O-N 3.47Å; L47-V144 HydrophobicContact CD1-CB 4.42Å; L47-V144 HydrophobicContact CD1-CG1 3.9Å; L47-H147 HydrophobicContact CB-CB 3.99Å; L47-H147 HydrophobicContact CD1-CB 4.11Å; L47-I151 HydrophobicContact CB-CD1 4.48Å; L47-I151 HydrophobicContact CD2-CD1 3.68Å
48T93.8Very high92.1Very high42 Ų4233.5 Ų33.526%0.25816%0.163SC..Hα-helixtrans-62.1-43.2177.5-550000110.8V20 C44 T45 S46 I52V20-T48 HydrophobicContact CG1-CG2 4.07Å; V20-T48 HydrophobicContact CG2-CG2 4.37Å; C44-T48 PolarHBondContact O-N 2.77Å; C44-T48 PolarHBondContact O-OG1 3.46Å; T45-T48 WeakPolarHBondContact O-CB 3.49Å; T45-T48 PolarHBondContact O-N 2.94Å; T45-T48 VanDerWaalsContact O-N 3.16Å; S46-T48 VanDerWaalsContact C-N 3.34Å; T48-I52 HydrophobicContact CG2-CD1 3.9Å; T48-I52 VanDerWaalsContact O-CG1 3.27Å; T48-I52 WeakPolarHBondContact O-CG1 3.41Å; T48-I52 PolarHBondContact O-N 3.2Å; T48-I52 VanDerWaalsContact O-N 3.11Å
49H95.1Very high92.2Very high1 Ų135 Ų351%0.00517%0.174CC..Hα-helixtrans-58.7-56.3175.1173.773.3000111.9F17 T45 S46 L47 L51 I52 T53 Y89 F90F17-H49 HydrophobicContact CE1-CB 3.58Å; F17-H49 HydrophobicContact CZ-CB 3.76Å; F17-H49 AromaticContact CZ-ND1 3.6Å; T45-H49 PolarHBondContact O-N 3.02Å; S46-H49 PolarHBondContact O-N 3.02Å; L47-H49 VanDerWaalsContact C-N 3.32Å; L47-H49 PolarHBondContact O-N 2.94Å; H49-L51 VanDerWaalsContact C-N 3.27Å; H49-L51 PolarHBondContact O-N 2.97Å; H49-I52 PolarHBondContact O-N 3.34Å; H49-I52 VanDerWaalsContact O-N 3.09Å; H49-T53 WeakPolarHBondContact CE1-CG2 3.48Å; H49-T53 PolarHBondContact O-N 3.47Å; H49-T53 PolarHBondContact O-OG1 2.91Å; H49-Y89 HydrophobicContact CB-CD1 4.03Å; H49-Y89 HydrophobicContact CB-CD2 3.59Å; H49-Y89 HydrophobicContact CB-CE1 3.99Å; H49-Y89 HydrophobicContact CB-CE2 3.51Å; H49-Y89 HydrophobicContact CB-CG 3.85Å; H49-Y89 AromaticContact CD2-CD1 3.32Å; H49-Y89 WeakPolarHBondContact CD2-CD1 3.42Å; H49-Y89 AromaticContact CD2-CE1 3.4Å; H49-Y89 WeakPolarHBondContact CD2-CE1 3.48Å; H49-Y89 AromaticContact CD2-CG 3.92Å; H49-Y89 AromaticContact CE1-CD1 3.38Å; H49-Y89 WeakPolarHBondContact CE1-CD1 3.39Å; H49-Y89 AromaticContact CE1-CG 3.59Å; H49-Y89 AromaticContact CG-CD1 3.26Å; H49-Y89 AromaticContact CG-CD2 3.66Å; H49-Y89 AromaticContact CG-CE1 3.54Å; H49-Y89 AromaticContact CG-CE2 3.88Å; H49-Y89 AromaticContact CG-CG 3.34Å; H49-Y89 AromaticContact CG-CZ 3.84Å; H49-Y89 VanDerWaalsContact ND1-CB 3.33Å; H49-Y89 WeakPolarHBondContact ND1-CB 3.1Å; H49-Y89 AromaticContact ND1-CD1 3.32Å; H49-Y89 VanDerWaalsContact ND1-CD1 3.32Å; H49-Y89 WeakPolarHBondContact ND1-CD1 3.29Å; H49-Y89 AromaticContact ND1-CD2 3.76Å; H49-Y89 AromaticContact ND1-CG 3.13Å; H49-Y89 AromaticContact NE2-CD1 3.42Å; H49-Y89 WeakPolarHBondContact NE2-CD1 3.32Å; H49-Y89 AromaticContact NE2-CE1 3.9Å; H49-F90 AromaticContact NE2-CZ 4Å
50S94.2Very high92.2Very high0 Ų030.9 Ų30.90%016%0.156CC..Hα-helixtrans-61.8-32.2-17750.70000113.4S46 L47 G54S46-S50 WeakPolarHBondContact O-CB 3.4Å; S46-S50 PolarHBondContact O-N 2.72Å; S46-S50 PolarHBondContact O-OG 2.82Å; L47-S50 WeakPolarHBondContact CA-OG 3.25Å; L47-S50 PolarHBondContact O-N 3.48Å; L47-S50 PolarHBondContact O-OG 2.86Å; S50-G54 WeakPolarHBondContact O-CA 3.45Å; S50-G54 PolarHBondContact O-N 3.48Å
51L94.7Very high92.2Very high74 Ų7431.6 Ų31.639%0.38716%0.16SC..Hα-helixtrans-65-49.8171.5-78169.5000111.7L47 H49 I55 V144L47-L51 HydrophobicContact CD1-CD1 4.23Å; L47-L51 HydrophobicContact CD1-CG 4.27Å; L47-L51 HydrophobicContact CG-CD1 4.07Å; L47-L51 WeakPolarHBondContact O-CB 3.37Å; L47-L51 VanDerWaalsContact O-CG 3.32Å; L47-L51 WeakPolarHBondContact O-CG 3.31Å; L47-L51 PolarHBondContact O-N 3.47Å; H49-L51 VanDerWaalsContact C-N 3.27Å; H49-L51 PolarHBondContact O-N 2.97Å; L51-I55 WeakPolarHBondContact O-CB 3.43Å; L51-I55 WeakPolarHBondContact O-CD1 3.26Å; L51-I55 VanDerWaalsContact O-CG1 3.27Å; L51-I55 WeakPolarHBondContact O-CG1 3.48Å; L51-I55 PolarHBondContact O-N 3.47Å; L51-V144 HydrophobicContact CD2-CB 4.49Å; L51-V144 HydrophobicContact CD2-CG1 3.63Å; L51-V144 HydrophobicContact CD2-CG2 3.94Å; L51-V144 HydrophobicContact CG-CG1 4.17Å; L51-V144 HydrophobicContact CG-CG2 4.1Å
52I94.2Very high92Very high55 Ų5535.5 Ų35.528%0.28218%0.179SC..Hα-helixtrans-62.5-52.5-179.8-68.1167.9000109.8F16 T48 H49 W56F16-I52 HydrophobicContact CE1-CD1 3.84Å; F16-I52 HydrophobicContact CZ-CD1 4.04Å; T48-I52 HydrophobicContact CG2-CD1 3.9Å; T48-I52 VanDerWaalsContact O-CG1 3.27Å; T48-I52 WeakPolarHBondContact O-CG1 3.41Å; T48-I52 PolarHBondContact O-N 3.2Å; T48-I52 VanDerWaalsContact O-N 3.11Å; H49-I52 PolarHBondContact O-N 3.34Å; H49-I52 VanDerWaalsContact O-N 3.09Å; I52-W56 HydrophobicContact CG2-CE3 3.89Å; I52-W56 HydrophobicContact CG2-CZ3 4.37Å; I52-W56 WeakPolarHBondContact O-CB 3.44Å; I52-W56 PolarHBondContact O-N 2.97Å
53T94.3Very high91.6Very high0 Ų039.1 Ų39.10%020%0.201CC..Hα-helixtrans-73.8-34.9-174.355.90000113.1H49 W56 A57 L82 S86H49-T53 WeakPolarHBondContact CE1-CG2 3.48Å; H49-T53 PolarHBondContact O-N 3.47Å; H49-T53 PolarHBondContact O-OG1 2.91Å; T53-W56 PolarHBondContact O-N 3.28Å; T53-A57 WeakPolarHBondContact O-CB 3.41Å; T53-A57 PolarHBondContact O-N 3.23Å; T53-L82 HydrophobicContact CG2-CD1 3.88Å; T53-S86 WeakPolarHBondContact CG2-OG 3.25Å
54G91.6Very high91.2Very high5 Ų542.1 Ų42.15%0.05222%0.215CC..Hα-helixtrans-63.3-47.5175.500000112.4S50 V58S50-G54 WeakPolarHBondContact O-CA 3.45Å; S50-G54 PolarHBondContact O-N 3.48Å; G54-V58 WeakPolarHBondContact O-CG2 3.38Å; G54-V58 PolarHBondContact O-N 3.42Å
55I93.4Very high90.7Very high106 Ų10644.5 Ų44.554%0.54423%0.23SC..Hα-helixtrans-66.3-44.6176.6-64.8169.4000110.3L51 A57 V58 L59L51-I55 WeakPolarHBondContact O-CB 3.43Å; L51-I55 WeakPolarHBondContact O-CD1 3.26Å; L51-I55 VanDerWaalsContact O-CG1 3.27Å; L51-I55 WeakPolarHBondContact O-CG1 3.48Å; L51-I55 PolarHBondContact O-N 3.47Å; I55-A57 PolarHBondContact O-N 2.91Å; I55-V58 PolarHBondContact O-N 2.88Å; I55-L59 HydrophobicContact CG2-CD1 4.01Å; I55-L59 HydrophobicContact CG2-CG 4.39Å; I55-L59 WeakPolarHBondContact O-CG 3.2Å; I55-L59 PolarHBondContact O-N 3.01Å
56W94.4Very high89.8Confident63 Ų6349.6 Ų49.624%0.23925%0.254CS..Hα-helixtrans-64.5-40.7-178.6-163.6-23000111.8I52 T53 V58 L59 C60 F78 A81 L82I52-W56 HydrophobicContact CG2-CE3 3.89Å; I52-W56 HydrophobicContact CG2-CZ3 4.37Å; I52-W56 WeakPolarHBondContact O-CB 3.44Å; I52-W56 PolarHBondContact O-N 2.97Å; T53-W56 PolarHBondContact O-N 3.28Å; W56-V58 VanDerWaalsContact C-N 3.31Å; W56-V58 PolarHBondContact O-N 3.33Å; W56-L59 CarbonylContact O-C 3.6Å; W56-L59 WeakPolarHBondContact O-CB 3.34Å; W56-L59 PolarHBondContact O-N 3.05Å; W56-L59 VanDerWaalsContact O-N 3.14Å; W56-C60 PolarHBondContact O-N 3.18Å; W56-C60 PolarHBondContact O-SG 3.35Å; W56-C60 VanDerWaalsContact O-SG 3.34Å; W56-F78 AromaticContact CD1-CD1 3.9Å; W56-F78 AromaticContact CD1-CE1 3.24Å; W56-F78 AromaticContact CD1-CE2 3.83Å; W56-F78 AromaticContact CD1-CZ 3.21Å; W56-F78 HydrophobicContact CD2-CZ 4.48Å; W56-F78 AromaticContact CE2-CD2 3.99Å; W56-F78 AromaticContact CE2-CE2 3.59Å; W56-F78 AromaticContact CE2-CZ 3.82Å; W56-F78 HydrophobicContact CG-CE1 4.45Å; W56-F78 HydrophobicContact CG-CZ 4.15Å; W56-F78 HydrophobicContact CZ2-CD2 4.08Å; W56-F78 AromaticContact CZ2-CE2 3.9Å; W56-F78 HydrophobicContact CZ2-CE2 3.9Å; W56-F78 AromaticContact NE1-CD1 3.52Å; W56-F78 AromaticContact NE1-CD2 3.39Å; W56-F78 AromaticContact NE1-CE1 3.2Å; W56-F78 AromaticContact NE1-CE2 3.07Å; W56-F78 AromaticContact NE1-CG 3.61Å; W56-F78 AromaticContact NE1-CZ 2.97Å; W56-F78 PolarHBondContact NE1-O 3.03Å; W56-A81 HydrophobicContact CZ2-CB 4.37Å; W56-L82 HydrophobicContact CB-CD1 3.79Å; W56-L82 HydrophobicContact CB-CD2 4.31Å; W56-L82 HydrophobicContact CD2-CB 4.19Å; W56-L82 HydrophobicContact CD2-CD1 4Å; W56-L82 HydrophobicContact CE3-CD1 4.31Å; W56-L82 HydrophobicContact CG-CB 4.16Å; W56-L82 HydrophobicContact CG-CD1 3.76Å; W56-L82 HydrophobicContact CG-CD2 4.19Å; W56-L82 HydrophobicContact CG-CG 4.24Å
57A91.7Very high88.8Confident0 Ų049.5 Ų49.50%025%0.253CS..Hα-helixtrans-59.1-42.5176.300000111.9T53 I55 C60 F61 L82 V134 L137 L138T53-A57 WeakPolarHBondContact O-CB 3.41Å; T53-A57 PolarHBondContact O-N 3.23Å; I55-A57 PolarHBondContact O-N 2.91Å; A57-C60 WeakPolarHBondContact O-CB 3.39Å; A57-C60 PolarHBondContact O-N 2.92Å; A57-F61 WeakPolarHBondContact O-CD2 3.46Å; A57-F61 PolarHBondContact O-N 2.8Å; A57-L82 HydrophobicContact CB-CD2 3.99Å; A57-V134 HydrophobicContact CB-CG1 4.16Å; A57-L137 HydrophobicContact CB-CB 4.26Å; A57-L138 HydrophobicContact CB-CD2 3.9Å
58V91.6Very high87.7Confident49 Ų4950.6 Ų50.630%0.29727%0.267SS..Hα-helixtrans-64.1-45175172.90000110.9G54 I55 W56 C60 F61 F62 L138 I141G54-V58 WeakPolarHBondContact O-CG2 3.38Å; G54-V58 PolarHBondContact O-N 3.42Å; I55-V58 PolarHBondContact O-N 2.88Å; W56-V58 VanDerWaalsContact C-N 3.31Å; W56-V58 PolarHBondContact O-N 3.33Å; V58-C60 VanDerWaalsContact C-N 3.29Å; V58-C60 PolarHBondContact O-N 3.4Å; V58-F61 PolarHBondContact O-N 2.82Å; V58-F62 HydrophobicContact CG1-CD2 3.58Å; V58-F62 HydrophobicContact CG1-CE2 3.34Å; V58-F62 VanDerWaalsContact O-CD2 3.24Å; V58-F62 WeakPolarHBondContact O-CD2 3.33Å; V58-F62 PolarHBondContact O-N 3.2Å; V58-F62 VanDerWaalsContact O-N 3.13Å; V58-L138 HydrophobicContact CG2-CD2 4.1Å; V58-I141 HydrophobicContact CG2-CD1 3.68Å
59L90Very high86.6Confident79 Ų7956.8 Ų56.841%0.41429%0.293SS..Hα-helixtrans-61-35.2175.9-70.1173.8000112.7I55 W56 F61 F62 V63 F78I55-L59 HydrophobicContact CG2-CD1 4.01Å; I55-L59 HydrophobicContact CG2-CG 4.39Å; I55-L59 WeakPolarHBondContact O-CG 3.2Å; I55-L59 PolarHBondContact O-N 3.01Å; W56-L59 CarbonylContact O-C 3.6Å; W56-L59 WeakPolarHBondContact O-CB 3.34Å; W56-L59 PolarHBondContact O-N 3.05Å; W56-L59 VanDerWaalsContact O-N 3.14Å; L59-F61 VanDerWaalsContact C-N 3.31Å; L59-F61 PolarHBondContact O-N 3.33Å; L59-F62 PolarHBondContact O-N 3.17Å; L59-V63 WeakPolarHBondContact O-CB 3.38Å; L59-V63 VanDerWaalsContact O-CG2 3.31Å; L59-V63 WeakPolarHBondContact O-CG2 3.48Å; L59-V63 PolarHBondContact O-N 3.42Å; L59-F78 HydrophobicContact CB-CE1 3.99Å; L59-F78 HydrophobicContact CB-CZ 4.27Å
60C88.3Confident85.8Confident0 Ų059.4 Ų59.40%031%0.307CS..Hα-helixtrans-58.1-43176-73.50000111.9W56 A57 V58 H64 M67 F78 V134W56-C60 PolarHBondContact O-N 3.18Å; W56-C60 PolarHBondContact O-SG 3.35Å; W56-C60 VanDerWaalsContact O-SG 3.34Å; A57-C60 WeakPolarHBondContact O-CB 3.39Å; A57-C60 PolarHBondContact O-N 2.92Å; V58-C60 VanDerWaalsContact C-N 3.29Å; V58-C60 PolarHBondContact O-N 3.4Å; C60-H64 PolarHBondContact O-N 3.02Å; C60-M67 HydrophobicContact CB-CE 4.5Å; C60-F78 HydrophobicContact CB-CD1 4.41Å; C60-F78 WeakPolarHBondContact SG-CD1 3.07Å; C60-V134 HydrophobicContact CB-CG1 3.9Å
61F86.4Confident85.1Confident41 Ų4159.5 Ų59.518%0.1831%0.308CS..Hα-helixtrans-73.2-32.5177.8-69.4-64.7000113.1A57 V58 L59 P65 A68 V134 V135 L138A57-F61 WeakPolarHBondContact O-CD2 3.46Å; A57-F61 PolarHBondContact O-N 2.8Å; V58-F61 PolarHBondContact O-N 2.82Å; L59-F61 VanDerWaalsContact C-N 3.31Å; L59-F61 PolarHBondContact O-N 3.33Å; F61-P65 WeakPolarHBondContact O-CA 3.41Å; F61-A68 HydrophobicContact CD1-CB 4.09Å; F61-A68 HydrophobicContact CE1-CB 4.35Å; F61-V134 HydrophobicContact CD2-CG1 4.35Å; F61-V134 HydrophobicContact CE2-CG1 3.63Å; F61-V134 HydrophobicContact CZ-CB 4.28Å; F61-V134 HydrophobicContact CZ-CG1 3.82Å; F61-V135 HydrophobicContact CE1-CG2 4.21Å; F61-V135 HydrophobicContact CE2-CG2 4.36Å; F61-V135 HydrophobicContact CZ-CB 4.44Å; F61-V135 HydrophobicContact CZ-CG2 3.49Å; F61-V135 VanDerWaalsContact CZ-CG2 3.49Å; F61-L138 HydrophobicContact CD2-CD2 4.38Å; F61-L138 HydrophobicContact CE2-CD1 3.9Å; F61-L138 HydrophobicContact CE2-CD2 4.18Å; F61-L138 HydrophobicContact CE2-CG 4.15Å
62F85.8Confident84.2Confident161 Ų16157.7 Ų57.771%0.70630%0.298SS*.Hα-helixtrans-69.9-41.5175.4-82.4-65.3000113V58 L59V58-F62 HydrophobicContact CG1-CD2 3.58Å; V58-F62 HydrophobicContact CG1-CE2 3.34Å; V58-F62 VanDerWaalsContact O-CD2 3.24Å; V58-F62 WeakPolarHBondContact O-CD2 3.33Å; V58-F62 PolarHBondContact O-N 3.2Å; V58-F62 VanDerWaalsContact O-N 3.13Å; L59-F62 PolarHBondContact O-N 3.17Å
63V83.6Confident83.1Confident86 Ų8657 Ų5752%0.52130%0.304SS..Hα-helixtrans-78.6-33.7-177.51780000111.5L59L59-V63 WeakPolarHBondContact O-CB 3.38Å; L59-V63 VanDerWaalsContact O-CG2 3.31Å; L59-V63 WeakPolarHBondContact O-CG2 3.48Å; L59-V63 PolarHBondContact O-N 3.42Å
64H81.8Confident82.1Confident70 Ų7059.5 Ų59.532%0.32432%0.32SS..  trans-131.673.7-178.4-66.8-63000111.1C60 Q66 M67 S76C60-H64 PolarHBondContact O-N 3.02Å; H64-Q66 PolarHBondContact O-N 3.09Å; H64-Q66 VanDerWaalsContact O-N 3.15Å; H64-M67 HydrophobicContact CB-CE 3.96Å; H64-M67 WeakPolarHBondContact O-CB 3.38Å; H64-M67 PolarHBondContact O-N 3.34Å; H64-S76 WeakPolarHBondContact CD2-CB 3.08Å; H64-S76 PolarHBondContact CD2-OG 3.16Å; H64-S76 WeakPolarHBondContact NE2-CB 3.33Å
65P79.8Confident81.5Confident67 Ų6762.8 Ų62.844%0.43533%0.333SS..THydrogen-bonded Turntrans-60.5-26-178.124.4-34.3000113F61 M67 A68F61-P65 WeakPolarHBondContact O-CA 3.41Å; P65-M67 PolarHBondContact O-N 2.98Å; P65-M67 VanDerWaalsContact O-N 3.1Å; P65-A68 WeakPolarHBondContact O-CB 3.13Å; P65-A68 PolarHBondContact O-N 3.42Å
66Q73.9Confident80.9Confident108 Ų10858.3 Ų58.351%0.50531%0.312SS..Hα-helixtrans-59.5-22.3175.6-61.682.82.400113H64 A68 E69 D70 T74H64-Q66 PolarHBondContact O-N 3.09Å; H64-Q66 VanDerWaalsContact O-N 3.15Å; Q66-A68 PolarHBondContact O-N 3.14Å; Q66-E69 PolarHBondContact O-N 2.91Å; Q66-D70 PolarHBondContact O-N 3.4Å; Q66-T74 HydrophobicContact CB-CG2 4.34Å
67M73.8Confident80.5Confident1 Ų160.3 Ų60.31%0.00533%0.331CS..Hα-helixtrans-67.7-24.3174.2-166.8-177-44.600112.7C60 H64 P65 E69 L71 S79 V134C60-M67 HydrophobicContact CB-CE 4.5Å; H64-M67 HydrophobicContact CB-CE 3.96Å; H64-M67 WeakPolarHBondContact O-CB 3.38Å; H64-M67 PolarHBondContact O-N 3.34Å; P65-M67 PolarHBondContact O-N 2.98Å; P65-M67 VanDerWaalsContact O-N 3.1Å; M67-E69 VanDerWaalsContact C-N 3.33Å; M67-L71 VanDerWaalsContact O-CD2 3.24Å; M67-L71 WeakPolarHBondContact O-CD2 3.42Å; M67-S79 VanDerWaalsContact CE-CB 3.49Å; M67-S79 VanDerWaalsContact CE-OG 3.25Å; M67-S79 WeakPolarHBondContact CE-OG 3.47Å; M67-V134 HydrophobicContact SD-CB 4.43Å; M67-V134 HydrophobicContact SD-CG2 4.21Å
68A69Low80.3Confident55 Ų5563.9 Ų63.946%0.45535%0.346SS..Hα-helixtrans-76.3-23.3174.100000112.4F61 P65 Q66F61-A68 HydrophobicContact CD1-CB 4.09Å; F61-A68 HydrophobicContact CE1-CB 4.35Å; P65-A68 WeakPolarHBondContact O-CB 3.13Å; P65-A68 PolarHBondContact O-N 3.42Å; Q66-A68 PolarHBondContact O-N 3.14Å
69E71.8Confident80.1Confident171 Ų17161.5 Ų61.580%0.79933%0.332SS*.Hα-helixtrans-88.9-41.8-179.4-63-179.9178.200111.6Q66 M67Q66-E69 PolarHBondContact O-N 2.91Å; M67-E69 VanDerWaalsContact C-N 3.33Å
70D77.8Confident80.1Confident57 Ų5757.9 Ų57.931%0.30531%0.313SS..  trans-12293.3174.5172.528.4000111.4Q66 I72 G73 T74Q66-D70 PolarHBondContact O-N 3.4Å; D70-I72 PolarHBondContact O-N 3.13Å; D70-I72 WeakPolarHBondContact OD1-CB 3.23Å; D70-I72 PolarHBondContact OD1-N 3Å; D70-G73 PolarHBondContact OD1-N 3.01Å; D70-G73 WeakPolarHBondContact OD2-CA 3.34Å; D70-G73 PolarHBondContact OD2-N 3.08Å; D70-T74 WeakPolarHBondContact O-CB 3.29Å; D70-T74 PolarHBondContact OD2-N 2.91Å; D70-T74 PolarHBondContact OD2-OG1 2.88Å
71L78.5Confident80.3Confident2 Ų258.7 Ų58.71%0.0132%0.32CS..THydrogen-bonded Turntrans-74.7-12.3176.5-65167.7000113.4M67 Y129 G131 F132 V135 W184 W188M67-L71 VanDerWaalsContact O-CD2 3.24Å; M67-L71 WeakPolarHBondContact O-CD2 3.42Å; L71-Y129 VanDerWaalsContact O-CA 3.27Å; L71-Y129 WeakPolarHBondContact O-CA 3.31Å; L71-G131 VanDerWaalsContact CD2-C 3.41Å; L71-F132 HydrophobicContact CB-CB 4.43Å; L71-F132 HydrophobicContact CD1-CD2 4.39Å; L71-V135 HydrophobicContact CD2-CG2 3.77Å; L71-W184 HydrophobicContact CD1-CH2 3.38Å; L71-W184 HydrophobicContact CD1-CZ2 4.45Å; L71-W184 HydrophobicContact CD1-CZ3 3.83Å; L71-W188 HydrophobicContact CB-CH2 4.29Å; L71-W188 HydrophobicContact CB-CZ2 3.8Å; L71-W188 HydrophobicContact CD1-CD2 3.89Å; L71-W188 HydrophobicContact CD1-CG 4.09Å; L71-W188 HydrophobicContact CD1-CZ2 4Å; L71-W188 HydrophobicContact CG-CZ2 4.47Å
72I76.4Confident80.6Confident35 Ų3556.8 Ų56.818%0.17931%0.311CS..THydrogen-bonded Turntrans-91.3-57.4-170.7-63.6175.8000110.6D70 R128 Y129 W188 N195D70-I72 PolarHBondContact O-N 3.13Å; D70-I72 WeakPolarHBondContact OD1-CB 3.23Å; D70-I72 PolarHBondContact OD1-N 3Å; I72-R128 WeakPolarHBondContact O-CA 3.17Å; I72-Y129 HydrophobicContact CB-CD1 4.42Å; I72-Y129 HydrophobicContact CB-CE1 4.26Å; I72-Y129 HydrophobicContact CG1-CD1 4.15Å; I72-Y129 HydrophobicContact CG1-CE1 3.97Å; I72-Y129 HydrophobicContact CG2-CD1 4.28Å; I72-Y129 HydrophobicContact CG2-CE1 3.74Å; I72-Y129 PolarHBondContact O-N 3.4Å; I72-W188 HydrophobicContact CD1-CH2 3.82Å; I72-W188 HydrophobicContact CD1-CZ2 4Å; I72-W188 HydrophobicContact CG1-CH2 3.47Å; I72-W188 VanDerWaalsContact CG1-CH2 3.47Å; I72-W188 HydrophobicContact CG1-CZ2 3.73Å; I72-N195 HydrophobicContact CD1-CB 4.12Å
73G71.6Confident80.9Confident41 Ų4149.1 Ų49.142%0.42328%0.278SS..THydrogen-bonded Turntrans-97.2-33.5-172.100000113.5D70 H75D70-G73 PolarHBondContact OD1-N 3.01Å; D70-G73 WeakPolarHBondContact OD2-CA 3.34Å; D70-G73 PolarHBondContact OD2-N 3.08Å; G73-H75 PolarHBondContact O-N 3.21Å; G73-H75 PolarHBondContact O-ND1 3.25Å
74T74Confident81.4Confident52 Ų5245 Ų4532%0.31925%0.253SS..  trans-83.9118-171.7-56.90000111.1Q66 D70Q66-T74 HydrophobicContact CB-CG2 4.34Å; D70-T74 WeakPolarHBondContact O-CB 3.29Å; D70-T74 PolarHBondContact OD2-N 2.91Å; D70-T74 PolarHBondContact OD2-OG1 2.88Å
75H78Confident82Confident74 Ų7442.9 Ų42.934%0.34325%0.245SC..  trans-142.314617267.5-84.1000110.4G73 G127 V130G73-H75 PolarHBondContact O-N 3.21Å; G73-H75 PolarHBondContact O-ND1 3.25Å; H75-G127 PolarHBondContact CE1-O 3.12Å; H75-G127 PolarHBondContact ND1-O 3.03Å; H75-G127 VanDerWaalsContact ND1-O 3.17Å; H75-V130 HydrophobicContact CB-CB 3.71Å; H75-V130 HydrophobicContact CB-CG1 4.03Å; H75-V130 HydrophobicContact CB-CG2 3.97Å
76S82.1Confident82.7Confident13 Ų1339.7 Ų39.79%0.09122%0.224CC..  trans-101.3158.7169.9680000110H64 F78 S79 H80H64-S76 WeakPolarHBondContact CD2-CB 3.08Å; H64-S76 PolarHBondContact CD2-OG 3.16Å; H64-S76 WeakPolarHBondContact NE2-CB 3.33Å; S76-F78 PolarHBondContact O-N 3.45Å; S76-F78 PolarHBondContact OG-N 3.47Å; S76-S79 PolarHBondContact N-OG 3.5Å; S76-S79 PolarHBondContact O-N 3.28Å; S76-S79 PolarHBondContact O-OG 3.39Å; S76-S79 PolarHBondContact OG-N 3.02Å; S76-S79 PolarHBondContact OG-OG 2.91Å; S76-H80 WeakPolarHBondContact O-CB 3.29Å; S76-H80 PolarHBondContact O-N 2.98Å
77V84.8Confident83.7Confident105 Ų10535.3 Ų35.364%0.63620%0.204SC*.Hα-helixtrans-55.9-34.4169.7-178.90000110.2M1 H80 A81M1-V77 HydrophobicContact CE-CG1 3.63Å; V77-H80 PolarHBondContact O-N 3.39Å; V77-A81 VanDerWaalsContact O-CB 3.25Å; V77-A81 WeakPolarHBondContact O-CB 3.42Å; V77-A81 PolarHBondContact O-N 3.32Å
78F86.9Confident84.7Confident74 Ų7435.3 Ų35.333%0.32520%0.204SC..Hα-helixtrans-65.8-47.3179.2-170.5-113.8000112.9W56 L59 C60 S76 L82W56-F78 AromaticContact CD1-CD1 3.9Å; W56-F78 AromaticContact CD1-CE1 3.24Å; W56-F78 AromaticContact CD1-CE2 3.83Å; W56-F78 AromaticContact CD1-CZ 3.21Å; W56-F78 HydrophobicContact CD2-CZ 4.48Å; W56-F78 AromaticContact CE2-CD2 3.99Å; W56-F78 AromaticContact CE2-CE2 3.59Å; W56-F78 AromaticContact CE2-CZ 3.82Å; W56-F78 HydrophobicContact CG-CE1 4.45Å; W56-F78 HydrophobicContact CG-CZ 4.15Å; W56-F78 HydrophobicContact CZ2-CD2 4.08Å; W56-F78 AromaticContact CZ2-CE2 3.9Å; W56-F78 HydrophobicContact CZ2-CE2 3.9Å; W56-F78 AromaticContact NE1-CD1 3.52Å; W56-F78 AromaticContact NE1-CD2 3.39Å; W56-F78 AromaticContact NE1-CE1 3.2Å; W56-F78 AromaticContact NE1-CE2 3.07Å; W56-F78 AromaticContact NE1-CG 3.61Å; W56-F78 AromaticContact NE1-CZ 2.97Å; W56-F78 PolarHBondContact NE1-O 3.03Å; L59-F78 HydrophobicContact CB-CE1 3.99Å; L59-F78 HydrophobicContact CB-CZ 4.27Å; C60-F78 HydrophobicContact CB-CD1 4.41Å; C60-F78 WeakPolarHBondContact SG-CD1 3.07Å; S76-F78 PolarHBondContact O-N 3.45Å; S76-F78 PolarHBondContact OG-N 3.47Å; F78-L82 PolarHBondContact O-N 3.04Å
79S88.4Confident85.9Confident0 Ų033 Ų330%018%0.183CC..Hα-helixtrans-68.2-36.8174.6460000112.9M67 S76 L82 V83M67-S79 VanDerWaalsContact CE-CB 3.49Å; M67-S79 VanDerWaalsContact CE-OG 3.25Å; M67-S79 WeakPolarHBondContact CE-OG 3.47Å; S76-S79 PolarHBondContact N-OG 3.5Å; S76-S79 PolarHBondContact O-N 3.28Å; S76-S79 PolarHBondContact O-OG 3.39Å; S76-S79 PolarHBondContact OG-N 3.02Å; S76-S79 PolarHBondContact OG-OG 2.91Å; S79-L82 WeakPolarHBondContact O-CB 3.5Å; S79-L82 PolarHBondContact O-N 3.29Å; S79-V83 WeakPolarHBondContact O-CG2 3.35Å; S79-V83 PolarHBondContact O-N 2.67Å; S79-V83 VanDerWaalsContact O-N 3.08Å
80H90Very high87Confident3 Ų325 Ų251%0.01415%0.146CC..Hα-helixtrans-67.5-39.3178.7-162.4-95.2000111.3M1 V6 S76 V77 V83 S84 V124 V130M1-H80 WeakPolarHBondContact CB-ND1 3.33Å; V6-H80 VanDerWaalsContact CG2-CE1 3.41Å; V6-H80 WeakPolarHBondContact CG2-CE1 3.36Å; S76-H80 WeakPolarHBondContact O-CB 3.29Å; S76-H80 PolarHBondContact O-N 2.98Å; V77-H80 PolarHBondContact O-N 3.39Å; H80-V83 PolarHBondContact O-N 3.18Å; H80-S84 WeakPolarHBondContact O-CB 3.37Å; H80-S84 PolarHBondContact O-N 2.89Å; H80-S84 PolarHBondContact O-OG 3.2Å; H80-V124 PolarHBondContact NE2-O 3.15Å; H80-V130 HydrophobicContact CB-CG1 4.45Å
81A91.1Very high87.8Confident17 Ų1725 Ų2514%0.1415%0.145CC..Hα-helixtrans-63.1-44.8171.500000112.1M1 W56 V77 V83 S84 V85M1-A81 HydrophobicContact CE-CB 4.26Å; W56-A81 HydrophobicContact CZ2-CB 4.37Å; V77-A81 VanDerWaalsContact O-CB 3.25Å; V77-A81 WeakPolarHBondContact O-CB 3.42Å; V77-A81 PolarHBondContact O-N 3.32Å; A81-V83 PolarHBondContact O-N 3Å; A81-S84 PolarHBondContact O-N 3.41Å; A81-V85 WeakPolarHBondContact O-CB 3.35Å; A81-V85 VanDerWaalsContact O-CG2 3.29Å; A81-V85 WeakPolarHBondContact O-CG2 3.33Å; A81-V85 PolarHBondContact O-N 2.98Å
82L93.3Very high88.5Confident0 Ų025.9 Ų25.90%015%0.149CC..Hα-helixtrans-54.7-50175.2169.359.1000111.8T53 W56 A57 F78 S79 S84 V85 S86 V134 L137T53-L82 HydrophobicContact CG2-CD1 3.88Å; W56-L82 HydrophobicContact CB-CD1 3.79Å; W56-L82 HydrophobicContact CB-CD2 4.31Å; W56-L82 HydrophobicContact CD2-CB 4.19Å; W56-L82 HydrophobicContact CD2-CD1 4Å; W56-L82 HydrophobicContact CE3-CD1 4.31Å; W56-L82 HydrophobicContact CG-CB 4.16Å; W56-L82 HydrophobicContact CG-CD1 3.76Å; W56-L82 HydrophobicContact CG-CD2 4.19Å; W56-L82 HydrophobicContact CG-CG 4.24Å; A57-L82 HydrophobicContact CB-CD2 3.99Å; F78-L82 PolarHBondContact O-N 3.04Å; S79-L82 WeakPolarHBondContact O-CB 3.5Å; S79-L82 PolarHBondContact O-N 3.29Å; L82-S84 VanDerWaalsContact C-N 3.34Å; L82-S84 PolarHBondContact O-N 2.95Å; L82-V85 PolarHBondContact O-N 3.22Å; L82-S86 WeakPolarHBondContact O-CB 3.44Å; L82-S86 PolarHBondContact O-N 3Å; L82-S86 PolarHBondContact O-OG 2.96Å; L82-V134 HydrophobicContact CD2-CG1 4.15Å; L82-V134 HydrophobicContact CD2-CG2 4.24Å; L82-L137 HydrophobicContact CD1-CD1 4.1Å; L82-L137 HydrophobicContact CD2-CD1 4.1Å; L82-L137 HydrophobicContact CG-CD1 3.73Å
83V93.1Very high89.3Confident0 Ų024.4 Ų24.40%014%0.141CC..Hα-helixtrans-66.1-39.5-179.4-177.80000110.6S79 H80 A81 S86 I87 F120 V124 V130 A133 V134 L137S79-V83 WeakPolarHBondContact O-CG2 3.35Å; S79-V83 PolarHBondContact O-N 2.67Å; S79-V83 VanDerWaalsContact O-N 3.08Å; H80-V83 PolarHBondContact O-N 3.18Å; A81-V83 PolarHBondContact O-N 3Å; V83-S86 WeakPolarHBondContact O-CB 3.38Å; V83-S86 PolarHBondContact O-N 3.43Å; V83-I87 HydrophobicContact CG1-CD1 4.33Å; V83-I87 WeakPolarHBondContact O-CG1 3.17Å; V83-I87 PolarHBondContact O-N 2.76Å; V83-F120 HydrophobicContact CG1-CB 3.81Å; V83-F120 HydrophobicContact CG1-CD2 3.82Å; V83-F120 HydrophobicContact CG1-CG 3.87Å; V83-V124 HydrophobicContact CB-CG2 3.83Å; V83-V124 HydrophobicContact CG1-CG2 3.4Å; V83-V130 HydrophobicContact CG2-CG1 4.2Å; V83-A133 HydrophobicContact CG1-CB 3.97Å; V83-A133 HydrophobicContact CG2-CB 3.79Å; V83-V134 HydrophobicContact CG2-CG2 3.98Å; V83-L137 HydrophobicContact CG2-CD1 4.22Å
84S93.4Very high90.3Very high0 Ų025.2 Ų25.20%013%0.133CC..Hα-helixtrans-67.8-41.6178.9-61.50000112.8T9 H80 A81 L82 S86 I87 G88 V124T9-S84 WeakPolarHBondContact OG1-CB 3.22Å; H80-S84 WeakPolarHBondContact O-CB 3.37Å; H80-S84 PolarHBondContact O-N 2.89Å; H80-S84 PolarHBondContact O-OG 3.2Å; A81-S84 PolarHBondContact O-N 3.41Å; L82-S84 VanDerWaalsContact C-N 3.34Å; L82-S84 PolarHBondContact O-N 2.95Å; S84-S86 VanDerWaalsContact C-N 3.26Å; S84-S86 PolarHBondContact O-N 3.35Å; S84-I87 PolarHBondContact O-N 3.39Å; S84-G88 PolarHBondContact O-N 3.29Å; S84-V124 WeakPolarHBondContact OG-CG1 3.2Å
85V94.1Very high91.1Very high26 Ų2627 Ų2716%0.15814%0.14CC..Hα-helixtrans-60.2-40.5171.1167.70000110.1S13 F17 A81 L82 G88 Y89S13-V85 WeakPolarHBondContact CB-O 3.49Å; S13-V85 PolarHBondContact OG-O 2.96Å; F17-V85 HydrophobicContact CE2-CG1 4.47Å; A81-V85 WeakPolarHBondContact O-CB 3.35Å; A81-V85 VanDerWaalsContact O-CG2 3.29Å; A81-V85 WeakPolarHBondContact O-CG2 3.33Å; A81-V85 PolarHBondContact O-N 2.98Å; L82-V85 PolarHBondContact O-N 3.22Å; V85-G88 PolarHBondContact O-N 3.3Å; V85-Y89 PolarHBondContact O-N 3.44Å
86S95Very high91.7Very high0 Ų024.6 Ų24.60%013%0.13CC..Hα-helixtrans-66.4-42.2178.7-54.20000112.8T53 L82 V83 S84 G88 Y89 F90 L137T53-S86 WeakPolarHBondContact CG2-OG 3.25Å; L82-S86 WeakPolarHBondContact O-CB 3.44Å; L82-S86 PolarHBondContact O-N 3Å; L82-S86 PolarHBondContact O-OG 2.96Å; V83-S86 WeakPolarHBondContact O-CB 3.38Å; V83-S86 PolarHBondContact O-N 3.43Å; S84-S86 VanDerWaalsContact C-N 3.26Å; S84-S86 PolarHBondContact O-N 3.35Å; S86-G88 VanDerWaalsContact C-N 3.31Å; S86-G88 PolarHBondContact O-N 3.38Å; S86-Y89 WeakPolarHBondContact O-CB 3.45Å; S86-Y89 PolarHBondContact O-N 3.48Å; S86-F90 WeakPolarHBondContact O-CD2 3.44Å; S86-F90 WeakPolarHBondContact O-CG 3.31Å; S86-F90 PolarHBondContact O-N 3.34Å; S86-L137 WeakPolarHBondContact OG-CD1 3.49Å
87I94.9Very high92Very high16 Ų1624.2 Ų24.28%0.08213%0.127CC..Hα-helixtrans-56.9-47.1172.4-67.8165.4000110.4V83 S84 Y89 F90 I91 F120 V124V83-I87 HydrophobicContact CG1-CD1 4.33Å; V83-I87 WeakPolarHBondContact O-CG1 3.17Å; V83-I87 PolarHBondContact O-N 2.76Å; S84-I87 PolarHBondContact O-N 3.39Å; I87-Y89 VanDerWaalsContact C-N 3.31Å; I87-Y89 PolarHBondContact O-N 2.93Å; I87-F90 PolarHBondContact O-N 3.32Å; I87-I91 HydrophobicContact CG2-CD1 3.72Å; I87-I91 HydrophobicContact CG2-CG1 4.35Å; I87-I91 WeakPolarHBondContact O-CG1 3.31Å; I87-I91 PolarHBondContact O-N 2.93Å; I87-F120 HydrophobicContact CD1-CB 3.82Å; I87-F120 HydrophobicContact CG1-CB 3.62Å; I87-F120 HydrophobicContact CG1-CD2 4.41Å; I87-V124 HydrophobicContact CD1-CB 4.16Å; I87-V124 HydrophobicContact CD1-CG2 3.8Å
88G93.7Very high92.2Very high0 Ų021.9 Ų21.90%011%0.113CC..Hα-helixtrans-58.5-42.117800000112.9I14 S84 V85 S86 Y92I14-G88 WeakPolarHBondContact CG1-O 3.39Å; S84-G88 PolarHBondContact O-N 3.29Å; V85-G88 PolarHBondContact O-N 3.3Å; S86-G88 VanDerWaalsContact C-N 3.31Å; S86-G88 PolarHBondContact O-N 3.38Å; G88-Y92 WeakPolarHBondContact O-CB 3.34Å; G88-Y92 PolarHBondContact O-N 2.88Å
89Y95.4Very high92.2Very high7 Ų725 Ų253%0.02713%0.132CC..Hα-helixtrans-62.4-49.2173.1168-98.3000112.3S13 F17 S46 H49 V85 S86 I87 I91 Y92 D93S13-Y89 PolarHBondContact OG-N 2.99Å; F17-Y89 HydrophobicContact CB-CD2 4.39Å; F17-Y89 AromaticContact CD1-CD2 3.65Å; F17-Y89 HydrophobicContact CD1-CD2 3.65Å; F17-Y89 HydrophobicContact CD1-CE2 4.22Å; F17-Y89 AromaticContact CD2-CD2 3.85Å; F17-Y89 HydrophobicContact CD2-CD2 3.85Å; F17-Y89 HydrophobicContact CD2-CG 4.26Å; F17-Y89 AromaticContact CE1-CD2 3.81Å; F17-Y89 HydrophobicContact CE1-CD2 3.81Å; F17-Y89 HydrophobicContact CE1-CE2 4.4Å; F17-Y89 HydrophobicContact CE2-CD2 4.02Å; F17-Y89 HydrophobicContact CE2-CG 4.18Å; F17-Y89 AromaticContact CG-CD2 3.68Å; F17-Y89 HydrophobicContact CG-CD2 3.68Å; F17-Y89 AromaticContact CZ-CD2 3.99Å; F17-Y89 HydrophobicContact CZ-CD2 3.99Å; F17-Y89 HydrophobicContact CZ-CG 4.34Å; S46-Y89 WeakPolarHBondContact CA-OH 3.49Å; S46-Y89 WeakPolarHBondContact CB-OH 3.45Å; S46-Y89 PolarHBondContact OG-OH 3.17Å; H49-Y89 HydrophobicContact CB-CD1 4.03Å; H49-Y89 HydrophobicContact CB-CD2 3.59Å; H49-Y89 HydrophobicContact CB-CE1 3.99Å; H49-Y89 HydrophobicContact CB-CE2 3.51Å; H49-Y89 HydrophobicContact CB-CG 3.85Å; H49-Y89 AromaticContact CD2-CD1 3.32Å; H49-Y89 WeakPolarHBondContact CD2-CD1 3.42Å; H49-Y89 AromaticContact CD2-CE1 3.4Å; H49-Y89 WeakPolarHBondContact CD2-CE1 3.48Å; H49-Y89 AromaticContact CD2-CG 3.92Å; H49-Y89 AromaticContact CE1-CD1 3.38Å; H49-Y89 WeakPolarHBondContact CE1-CD1 3.39Å; H49-Y89 AromaticContact CE1-CG 3.59Å; H49-Y89 AromaticContact CG-CD1 3.26Å; H49-Y89 AromaticContact CG-CD2 3.66Å; H49-Y89 AromaticContact CG-CE1 3.54Å; H49-Y89 AromaticContact CG-CE2 3.88Å; H49-Y89 AromaticContact CG-CG 3.34Å; H49-Y89 AromaticContact CG-CZ 3.84Å; H49-Y89 VanDerWaalsContact ND1-CB 3.33Å; H49-Y89 WeakPolarHBondContact ND1-CB 3.1Å; H49-Y89 AromaticContact ND1-CD1 3.32Å; H49-Y89 VanDerWaalsContact ND1-CD1 3.32Å; H49-Y89 WeakPolarHBondContact ND1-CD1 3.29Å; H49-Y89 AromaticContact ND1-CD2 3.76Å; H49-Y89 AromaticContact ND1-CG 3.13Å; H49-Y89 AromaticContact NE2-CD1 3.42Å; H49-Y89 WeakPolarHBondContact NE2-CD1 3.32Å; H49-Y89 AromaticContact NE2-CE1 3.9Å; V85-Y89 PolarHBondContact O-N 3.44Å; S86-Y89 WeakPolarHBondContact O-CB 3.45Å; S86-Y89 PolarHBondContact O-N 3.48Å; I87-Y89 VanDerWaalsContact C-N 3.31Å; I87-Y89 PolarHBondContact O-N 2.93Å; Y89-I91 VanDerWaalsContact C-N 3.27Å; Y89-I91 PolarHBondContact O-N 3.35Å; Y89-Y92 WeakPolarHBondContact O-CA 3.34Å; Y89-Y92 WeakPolarHBondContact O-CB 3.36Å; Y89-Y92 PolarHBondContact O-N 2.9Å; Y89-D93 HydrophobicContact CE1-CB 4.22Å; Y89-D93 HydrophobicContact CE2-CB 4.19Å; Y89-D93 PolarHBondContact O-N 3.46Å; Y89-D93 PolarHBondContact OH-OD2 2.98Å
90F94.4Very high92.1Very high4 Ų429 Ų292%0.01815%0.153CC..Hα-helixtrans-62.3-36.6-178-68.1-52000112H49 S86 I87 F94 H113 V116 I117 F120H49-F90 AromaticContact NE2-CZ 4Å; S86-F90 WeakPolarHBondContact O-CD2 3.44Å; S86-F90 WeakPolarHBondContact O-CG 3.31Å; S86-F90 PolarHBondContact O-N 3.34Å; I87-F90 PolarHBondContact O-N 3.32Å; F90-F94 WeakPolarHBondContact O-CB 3.24Å; F90-F94 PolarHBondContact O-N 3.31Å; F90-H113 AromaticContact CD1-CD2 3.65Å; F90-H113 AromaticContact CD1-NE2 3.78Å; F90-V116 HydrophobicContact CD2-CG1 3.72Å; F90-V116 HydrophobicContact CE2-CG1 3.45Å; F90-V116 VanDerWaalsContact CE2-CG1 3.45Å; F90-V116 HydrophobicContact CZ-CG1 4.02Å; F90-I117 HydrophobicContact CB-CD1 3.93Å; F90-I117 HydrophobicContact CB-CG1 3.62Å; F90-F120 HydrophobicContact CE2-CD2 4.25Å; F90-F120 AromaticContact CE2-CE2 3.98Å; F90-F120 HydrophobicContact CE2-CE2 3.98Å
91I94.1Very high91.7Very high55 Ų5531.5 Ų31.528%0.28217%0.165SC..Hα-helixtrans-63.5-47.2172.5-68168.7000110.4I14 I87 Y89 F94 L95 I117I14-I91 HydrophobicContact CD1-CB 4.36Å; I14-I91 HydrophobicContact CD1-CG2 3.94Å; I87-I91 HydrophobicContact CG2-CD1 3.72Å; I87-I91 HydrophobicContact CG2-CG1 4.35Å; I87-I91 WeakPolarHBondContact O-CG1 3.31Å; I87-I91 PolarHBondContact O-N 2.93Å; Y89-I91 VanDerWaalsContact C-N 3.27Å; Y89-I91 PolarHBondContact O-N 3.35Å; I91-F94 PolarHBondContact O-N 2.97Å; I91-L95 HydrophobicContact CG2-CD1 4.05Å; I91-L95 VanDerWaalsContact O-CG 3.31Å; I91-L95 WeakPolarHBondContact O-CG 3.43Å; I91-L95 PolarHBondContact O-N 3.04Å; I91-I117 HydrophobicContact CG1-CD1 3.9Å; I91-I117 HydrophobicContact CG1-CG1 4.31Å; I91-I117 HydrophobicContact CG1-CG2 4.33Å
92Y94.1Very high91.1Very high22 Ų2238.4 Ų38.49%0.08619%0.192CC..Hα-helixtrans-58.1-51.4177.4169-97.5000112.1I14 F17 K18 N21 T45 G88 Y89 F94 L95 D96I14-Y92 HydrophobicContact CG2-CD2 4.3Å; F17-Y92 HydrophobicContact CB-CD1 3.71Å; F17-Y92 HydrophobicContact CB-CE1 4.02Å; F17-Y92 HydrophobicContact CB-CG 4.12Å; K18-Y92 HydrophobicContact CB-CD2 4.4Å; K18-Y92 HydrophobicContact CB-CE2 3.85Å; K18-Y92 HydrophobicContact CG-CE2 4.36Å; N21-Y92 WeakPolarHBondContact CB-OH 3.49Å; N21-Y92 PolarHBondContact ND2-OH 2.95Å; T45-Y92 HydrophobicContact CG2-CE1 4.04Å; G88-Y92 WeakPolarHBondContact O-CB 3.34Å; G88-Y92 PolarHBondContact O-N 2.88Å; Y89-Y92 WeakPolarHBondContact O-CA 3.34Å; Y89-Y92 WeakPolarHBondContact O-CB 3.36Å; Y89-Y92 PolarHBondContact O-N 2.9Å; Y92-F94 VanDerWaalsContact C-N 3.34Å; Y92-F94 PolarHBondContact O-N 3.29Å; Y92-L95 PolarHBondContact O-N 2.88Å; Y92-D96 WeakPolarHBondContact O-CB 3.43Å; Y92-D96 PolarHBondContact O-N 3.11Å
93D92.3Very high90Very high3 Ų341.7 Ų41.72%0.01621%0.208CC..Hα-helixtrans-67.5-35.5-177.8-15956.8000111.3N42 Y89 D96 M97 H113N42-D93 PolarHBondContact ND2-OD1 2.99Å; N42-D93 PolarHBondContact OD1-OD1 3.13Å; Y89-D93 HydrophobicContact CE1-CB 4.22Å; Y89-D93 HydrophobicContact CE2-CB 4.19Å; Y89-D93 PolarHBondContact O-N 3.46Å; Y89-D93 PolarHBondContact OH-OD2 2.98Å; D93-D96 PolarHBondContact O-N 2.89Å; D93-M97 WeakPolarHBondContact O-CB 3.32Å; D93-M97 WeakPolarHBondContact O-CE 3.27Å; D93-M97 VanDerWaalsContact O-CG 3.29Å; D93-M97 WeakPolarHBondContact O-CG 3.1Å; D93-M97 PolarHBondContact O-N 3.42Å; D93-H113 IonicContact OD2-CE1 3.93Å; D93-H113 PolarHBondContact OD2-CE1 2.84Å; D93-H113 IonicContact OD2-NE2 2.76Å
94F92.3Very high88.8Confident58 Ų5848.5 Ų48.525%0.25424%0.243SC..Hα-helixtrans-58.8-50.9171.1-179.2-87.2000111.7F90 I91 Y92 M97 V98 L110 H113F90-F94 WeakPolarHBondContact O-CB 3.24Å; F90-F94 PolarHBondContact O-N 3.31Å; I91-F94 PolarHBondContact O-N 2.97Å; Y92-F94 VanDerWaalsContact C-N 3.34Å; Y92-F94 PolarHBondContact O-N 3.29Å; F94-M97 PolarHBondContact O-N 3.35Å; F94-V98 HydrophobicContact CD1-CG2 4.18Å; F94-V98 HydrophobicContact CE1-CG2 3.86Å; F94-V98 HydrophobicContact CZ-CG2 4.12Å; F94-V98 VanDerWaalsContact O-CG2 3.3Å; F94-V98 WeakPolarHBondContact O-CG2 3.21Å; F94-V98 PolarHBondContact O-N 3Å; F94-L110 HydrophobicContact CD2-CB 4.39Å; F94-L110 HydrophobicContact CD2-CD2 3.52Å; F94-L110 HydrophobicContact CE2-CB 4.07Å; F94-L110 HydrophobicContact CE2-CD2 3.68Å; F94-L110 HydrophobicContact CE2-CG 4.46Å; F94-L110 HydrophobicContact CG-CD2 4.12Å; F94-L110 HydrophobicContact CZ-CD2 4.36Å; F94-H113 HydrophobicContact CB-CB 4.28Å; F94-H113 HydrophobicContact CD2-CB 3.96Å
95L92.3Very high87.8Confident90 Ų9054.5 Ų54.547%0.47127%0.274SS..Hα-helixtrans-65-42179.5-67.8173.5000111.6I91 Y92 M97 V98 L99I91-L95 HydrophobicContact CG2-CD1 4.05Å; I91-L95 VanDerWaalsContact O-CG 3.31Å; I91-L95 WeakPolarHBondContact O-CG 3.43Å; I91-L95 PolarHBondContact O-N 3.04Å; Y92-L95 PolarHBondContact O-N 2.88Å; L95-M97 VanDerWaalsContact C-N 3.33Å; L95-M97 PolarHBondContact O-N 3.36Å; L95-V98 PolarHBondContact O-N 2.84Å; L95-L99 WeakPolarHBondContact O-CB 3.08Å; L95-L99 VanDerWaalsContact O-CG 3.25Å; L95-L99 WeakPolarHBondContact O-CG 3.29Å; L95-L99 PolarHBondContact O-N 3.09Å; L95-L99 VanDerWaalsContact O-N 3.09Å
96D90.5Very high87.1Confident24 Ų2453.8 Ų53.813%0.12827%0.271CS..Hα-helixtrans-62.2-41.7178.4-162.263000111.4W38 Y92 D93 L99 N100W38-D96 PolarHBondContact NE1-OD2 3.23Å; Y92-D96 WeakPolarHBondContact O-CB 3.43Å; Y92-D96 PolarHBondContact O-N 3.11Å; D93-D96 PolarHBondContact O-N 2.89Å; D96-L99 PolarHBondContact O-N 3.35Å; D96-N100 WeakPolarHBondContact O-CB 3.39Å; D96-N100 PolarHBondContact O-N 2.8Å; D96-N100 VanDerWaalsContact O-N 3.07Å; D96-N100 PolarHBondContact O-ND2 3.2Å; D96-N100 PolarHBondContact OD1-ND2 2.97Å; D96-N100 VanDerWaalsContact OD1-ND2 3.16Å
97M88.7Confident86.5Confident5 Ų561.3 Ų61.33%0.02530%0.299CS..Hα-helixtrans-65.6-44.1175.2-77.8-166.7-74.500113.5W38 D93 F94 L95 L99 N100 Q101 L109 L110 H113W38-M97 HydrophobicContact CH2-CG 3.97Å; W38-M97 HydrophobicContact CZ2-CG 4.18Å; D93-M97 WeakPolarHBondContact O-CB 3.32Å; D93-M97 WeakPolarHBondContact O-CE 3.27Å; D93-M97 VanDerWaalsContact O-CG 3.29Å; D93-M97 WeakPolarHBondContact O-CG 3.1Å; D93-M97 PolarHBondContact O-N 3.42Å; F94-M97 PolarHBondContact O-N 3.35Å; L95-M97 VanDerWaalsContact C-N 3.33Å; L95-M97 PolarHBondContact O-N 3.36Å; M97-L99 PolarHBondContact O-N 3.26Å; M97-N100 PolarHBondContact O-N 2.85Å; M97-Q101 WeakPolarHBondContact O-CB 3.49Å; M97-Q101 PolarHBondContact O-N 3.45Å; M97-L109 HydrophobicContact CE-CB 4.36Å; M97-L109 HydrophobicContact CE-CD2 4.02Å; M97-L109 HydrophobicContact CE-CG 4.23Å; M97-L109 HydrophobicContact SD-CB 4.17Å; M97-L109 HydrophobicContact SD-CD2 3.65Å; M97-L109 HydrophobicContact SD-CG 4.28Å; M97-L110 HydrophobicContact CB-CD2 3.97Å; M97-L110 HydrophobicContact CE-CD2 3.93Å; M97-H113 WeakPolarHBondContact CE-CE1 3.38Å; M97-H113 VanDerWaalsContact CE-ND1 3.27Å; M97-H113 WeakPolarHBondContact CE-ND1 3.34Å
98V88.3Confident85.9Confident56 Ų5665 Ų6534%0.33932%0.316SS..Hα-helixtrans-62.2-36.6179.8169.30000111F94 L95 M103 L110F94-V98 HydrophobicContact CD1-CG2 4.18Å; F94-V98 HydrophobicContact CE1-CG2 3.86Å; F94-V98 HydrophobicContact CZ-CG2 4.12Å; F94-V98 VanDerWaalsContact O-CG2 3.3Å; F94-V98 WeakPolarHBondContact O-CG2 3.21Å; F94-V98 PolarHBondContact O-N 3Å; L95-V98 PolarHBondContact O-N 2.84Å; V98-M103 HydrophobicContact CB-SD 4.42Å; V98-M103 HydrophobicContact CG1-SD 4.31Å; V98-M103 HydrophobicContact CG2-CE 4.42Å; V98-M103 HydrophobicContact CG2-SD 4.08Å; V98-L110 HydrophobicContact CG2-CD1 4.26Å; V98-L110 HydrophobicContact CG2-CD2 3.69Å
99L87.4Confident85.6Confident140 Ų14068.5 Ų68.573%0.73333%0.334SS*.Hα-helixtrans-80.5-31.1-177.7-66.2173.2000113.5L95 D96 M97L95-L99 WeakPolarHBondContact O-CB 3.08Å; L95-L99 VanDerWaalsContact O-CG 3.25Å; L95-L99 WeakPolarHBondContact O-CG 3.29Å; L95-L99 PolarHBondContact O-N 3.09Å; L95-L99 VanDerWaalsContact O-N 3.09Å; D96-L99 PolarHBondContact O-N 3.35Å; M97-L99 PolarHBondContact O-N 3.26Å
100N85Confident85.2Confident82 Ų8268.4 Ų68.444%0.43933%0.334SS..Hα-helixtrans-116.7-10.1-168.4-63.3-83000115.1W38 D96 M97W38-N100 HydrophobicContact CD2-CB 3.79Å; W38-N100 HydrophobicContact CG-CB 3.81Å; W38-N100 HydrophobicContact CZ2-CB 4.04Å; W38-N100 PolarHBondContact NE1-ND2 3.33Å; D96-N100 WeakPolarHBondContact O-CB 3.39Å; D96-N100 PolarHBondContact O-N 2.8Å; D96-N100 VanDerWaalsContact O-N 3.07Å; D96-N100 PolarHBondContact O-ND2 3.2Å; D96-N100 PolarHBondContact OD1-ND2 2.97Å; D96-N100 VanDerWaalsContact OD1-ND2 3.16Å; M97-N100 PolarHBondContact O-N 2.85Å
101Q81.4Confident84.9Confident56 Ų5673.1 Ų73.126%0.26236%0.355SS..SBendtrans-117.8151.7175.8-84.2-72.4-67.800112.6W38 M97 M103W38-Q101 HydrophobicContact CD2-CG 4.47Å; W38-Q101 HydrophobicContact CE3-CG 3.65Å; W38-Q101 HydrophobicContact CH2-CB 4.3Å; W38-Q101 HydrophobicContact CH2-CG 3.29Å; W38-Q101 HydrophobicContact CZ2-CG 4.13Å; W38-Q101 HydrophobicContact CZ3-CB 4.37Å; W38-Q101 HydrophobicContact CZ3-CG 3.02Å; M97-Q101 WeakPolarHBondContact O-CB 3.49Å; M97-Q101 PolarHBondContact O-N 3.45Å; Q101-M103 PolarHBondContact O-N 3.1Å
102K78.9Confident84.8Confident162 Ų16271.6 Ų71.670%0.70435%0.346SS*.  trans-66.1121.6166.8-65.9-175179.7-175.80108.3I104 L105K102-I104 PolarHBondContact O-N 2.9Å; K102-L105 HydrophobicContact CB-CD1 4.1Å; K102-L105 PolarHBondContact O-N 3.1Å
103M70.9Confident84.7Confident69 Ų6970.8 Ų70.834%0.3434%0.343SS..Hα-helixtrans-46.3-42.6179.4-62.5-66.7-73.700112.3V98 Q101 L105 S106 W107 L110V98-M103 HydrophobicContact CB-SD 4.42Å; V98-M103 HydrophobicContact CG1-SD 4.31Å; V98-M103 HydrophobicContact CG2-CE 4.42Å; V98-M103 HydrophobicContact CG2-SD 4.08Å; Q101-M103 PolarHBondContact O-N 3.1Å; M103-L105 PolarHBondContact O-N 3.43Å; M103-L105 VanDerWaalsContact O-N 3.09Å; M103-S106 CarbonylContact O-C 3.6Å; M103-S106 PolarHBondContact O-N 3.23Å; M103-W107 HydrophobicContact CE-CZ2 4.22Å; M103-W107 PolarHBondContact O-N 3.17Å; M103-W107 PolarHBondContact O-NE1 3.27Å; M103-L110 HydrophobicContact CE-CD1 3.51Å; M103-L110 HydrophobicContact SD-CD1 3.6Å
104I67.9Low84.7Confident144 Ų14473.8 Ų73.874%0.73836%0.362SS*.Hα-helixtrans-57.6-27.2-179.1-151.7156.4000114.6K102K102-I104 PolarHBondContact O-N 2.9Å
105L71.3Confident84.6Confident126 Ų12671.9 Ų71.966%0.6636%0.355SS*.Hα-helixtrans-86.1-21.3177.2-86.484.7000113.2K102 M103K102-L105 HydrophobicContact CB-CD1 4.1Å; K102-L105 PolarHBondContact O-N 3.1Å; M103-L105 PolarHBondContact O-N 3.43Å; M103-L105 VanDerWaalsContact O-N 3.09Å
106S79.8Confident84.6Confident11 Ų1168.3 Ų68.38%0.07734%0.337CS..Hα-helixtrans-119.71.3-170.3550000114.7M103 E108 L109 L110M103-S106 CarbonylContact O-C 3.6Å; M103-S106 PolarHBondContact O-N 3.23Å; S106-E108 PolarHBondContact O-N 3.13Å; S106-E108 VanDerWaalsContact O-N 3.16Å; S106-L109 PolarHBondContact O-N 3.22Å; S106-L110 WeakPolarHBondContact O-CG 3.46Å; S106-L110 PolarHBondContact O-N 2.99Å
107W82.1Confident84.8Confident157 Ų15769 Ų6960%0.59534%0.34SS*.Hα-helixtrans-52.1-39.8-179.8-85.5102.2000113.9M103 L109 L110 F111M103-W107 HydrophobicContact CE-CZ2 4.22Å; M103-W107 PolarHBondContact O-N 3.17Å; M103-W107 PolarHBondContact O-NE1 3.27Å; W107-L109 VanDerWaalsContact C-N 3.32Å; W107-L109 PolarHBondContact O-N 3.08Å; W107-L110 PolarHBondContact O-N 2.72Å; W107-F111 VanDerWaalsContact O-CB 3.28Å; W107-F111 WeakPolarHBondContact O-CB 3.41Å; W107-F111 PolarHBondContact O-N 2.96Å
108E84.1Confident84.9Confident93 Ų9371.8 Ų71.844%0.43536%0.36SS..Hα-helixtrans-55.7-49.8176.6-67.917817800110.3S106 H112 M214 R221S106-E108 PolarHBondContact O-N 3.13Å; S106-E108 VanDerWaalsContact O-N 3.16Å; E108-H112 PolarHBondContact O-N 3.49Å; E108-H112 VanDerWaalsContact O-N 3.12Å; E108-M214 HydrophobicContact CB-CE 4.23Å; E108-M214 WeakPolarHBondContact O-CE 3.29Å; E108-R221 IonicContact OE1-CZ 3.37Å; E108-R221 IonicContact OE1-NH1 2.68Å; E108-R221 IonicContact OE1-NH2 3.43Å; E108-R221 PolarHBondContact OE1-NH2 2.91Å; E108-R221 IonicContact OE2-CZ 3.23Å; E108-R221 IonicContact OE2-NH1 3.36Å; E108-R221 PolarHBondContact OE2-NH1 3.09Å; E108-R221 IonicContact OE2-NH2 3.14Å; E108-R221 PolarHBondContact OE2-NH2 3.46Å
109L85.6Confident85.1Confident75 Ų7570.9 Ų70.939%0.39336%0.356SS..Hα-helixtrans-75.2-34.1-177-150.970.9000112.9M97 S106 W107 H112 H113M97-L109 HydrophobicContact CE-CB 4.36Å; M97-L109 HydrophobicContact CE-CD2 4.02Å; M97-L109 HydrophobicContact CE-CG 4.23Å; M97-L109 HydrophobicContact SD-CB 4.17Å; M97-L109 HydrophobicContact SD-CD2 3.65Å; M97-L109 HydrophobicContact SD-CG 4.28Å; S106-L109 PolarHBondContact O-N 3.22Å; W107-L109 VanDerWaalsContact C-N 3.32Å; W107-L109 PolarHBondContact O-N 3.08Å; L109-H112 WeakPolarHBondContact O-CB 3.43Å; L109-H112 PolarHBondContact O-N 2.83Å; L109-H113 PolarHBondContact O-N 2.99Å
110L88.4Confident85.3Confident5 Ų564.9 Ų64.93%0.02632%0.324CS..Hα-helixtrans-63.9-42.9173.9-70172000111.4F94 M97 V98 M103 S106 W107 H112 H113 T114F94-L110 HydrophobicContact CD2-CB 4.39Å; F94-L110 HydrophobicContact CD2-CD2 3.52Å; F94-L110 HydrophobicContact CE2-CB 4.07Å; F94-L110 HydrophobicContact CE2-CD2 3.68Å; F94-L110 HydrophobicContact CE2-CG 4.46Å; F94-L110 HydrophobicContact CG-CD2 4.12Å; F94-L110 HydrophobicContact CZ-CD2 4.36Å; M97-L110 HydrophobicContact CB-CD2 3.97Å; M97-L110 HydrophobicContact CE-CD2 3.93Å; V98-L110 HydrophobicContact CG2-CD1 4.26Å; V98-L110 HydrophobicContact CG2-CD2 3.69Å; M103-L110 HydrophobicContact CE-CD1 3.51Å; M103-L110 HydrophobicContact SD-CD1 3.6Å; S106-L110 WeakPolarHBondContact O-CG 3.46Å; S106-L110 PolarHBondContact O-N 2.99Å; W107-L110 PolarHBondContact O-N 2.72Å; L110-H112 VanDerWaalsContact C-N 3.34Å; L110-H113 PolarHBondContact O-N 2.89Å; L110-T114 PolarHBondContact O-N 3.29Å; L110-T114 PolarHBondContact O-OG1 3.23Å; L110-T114 VanDerWaalsContact O-OG1 3.1Å
111F88.7Confident85.6Confident102 Ų10261.8 Ų61.845%0.44731%0.311SS..Hα-helixtrans-63.8-41.8176.4-172.3-115.4000111.6W107 H113 T114 V115 I210W107-F111 VanDerWaalsContact O-CB 3.28Å; W107-F111 WeakPolarHBondContact O-CB 3.41Å; W107-F111 PolarHBondContact O-N 2.96Å; F111-H113 PolarHBondContact O-N 3.2Å; F111-T114 PolarHBondContact O-N 3.11Å; F111-V115 HydrophobicContact CE1-CG2 4.33Å; F111-V115 HydrophobicContact CZ-CG2 4.31Å; F111-V115 WeakPolarHBondContact O-CG2 3.38Å; F111-V115 PolarHBondContact O-N 2.94Å; F111-I210 HydrophobicContact CD1-CG2 3.78Å; F111-I210 HydrophobicContact CE1-CB 4.31Å; F111-I210 HydrophobicContact CE1-CD1 3.65Å; F111-I210 HydrophobicContact CE1-CG1 3.97Å; F111-I210 HydrophobicContact CE1-CG2 3.39Å; F111-I210 HydrophobicContact CZ-CD1 3.68Å; F111-I210 HydrophobicContact CZ-CG1 4.43Å; F111-I210 HydrophobicContact CZ-CG2 4.46Å
112H90.5Very high86Confident23 Ų2361 Ų6111%0.10631%0.309CS..Hα-helixtrans-54.3-50.1171.3165.7-91.7000112.3E108 L109 L110 T114 V115 V116 M211 M214E108-H112 PolarHBondContact O-N 3.49Å; E108-H112 VanDerWaalsContact O-N 3.12Å; L109-H112 WeakPolarHBondContact O-CB 3.43Å; L109-H112 PolarHBondContact O-N 2.83Å; L110-H112 VanDerWaalsContact C-N 3.34Å; H112-T114 PolarHBondContact O-N 2.67Å; H112-V115 PolarHBondContact O-N 3.48Å; H112-V116 WeakPolarHBondContact O-CG2 3.41Å; H112-V116 PolarHBondContact O-N 3.5Å; H112-M211 WeakPolarHBondContact CD2-CE 3.47Å; H112-M211 PolarHBondContact CD2-SD 2.71Å; H112-M211 WeakPolarHBondContact NE2-CE 3.17Å; H112-M214 HydrophobicContact CB-CE 3.69Å; H112-M214 HydrophobicContact CB-SD 3.98Å
113H92.4Very high86.5Confident5 Ų553.5 Ų53.52%0.02328%0.277CS..Hα-helixtrans-62.6-41.7178.2-70.7171.6000112.4F90 D93 F94 M97 L109 L110 F111 V115 V116 I117F90-H113 AromaticContact CD1-CD2 3.65Å; F90-H113 AromaticContact CD1-NE2 3.78Å; D93-H113 IonicContact OD2-CE1 3.93Å; D93-H113 PolarHBondContact OD2-CE1 2.84Å; D93-H113 IonicContact OD2-NE2 2.76Å; F94-H113 HydrophobicContact CB-CB 4.28Å; F94-H113 HydrophobicContact CD2-CB 3.96Å; M97-H113 WeakPolarHBondContact CE-CE1 3.38Å; M97-H113 VanDerWaalsContact CE-ND1 3.27Å; M97-H113 WeakPolarHBondContact CE-ND1 3.34Å; L109-H113 PolarHBondContact O-N 2.99Å; L110-H113 PolarHBondContact O-N 2.89Å; F111-H113 PolarHBondContact O-N 3.2Å; H113-V115 VanDerWaalsContact C-N 3.31Å; H113-V115 PolarHBondContact O-N 3.48Å; H113-V116 PolarHBondContact O-N 2.9Å; H113-I117 HydrophobicContact CB-CD1 4.15Å; H113-I117 WeakPolarHBondContact O-CB 3.33Å; H113-I117 WeakPolarHBondContact O-CD1 3.1Å; H113-I117 WeakPolarHBondContact O-CG1 3.39Å; H113-I117 PolarHBondContact O-N 2.97Å
114T91.6Very high87.4Confident66 Ų6650.5 Ų50.541%0.40526%0.262SS..Hα-helixtrans-57.3-45.4176.5-59.10000111.8L110 F111 H112 S118L110-T114 PolarHBondContact O-N 3.29Å; L110-T114 PolarHBondContact O-OG1 3.23Å; L110-T114 VanDerWaalsContact O-OG1 3.1Å; F111-T114 PolarHBondContact O-N 3.11Å; H112-T114 PolarHBondContact O-N 2.67Å; T114-S118 WeakPolarHBondContact O-CB 3.27Å; T114-S118 PolarHBondContact O-N 3.45Å; T114-S118 VanDerWaalsContact O-N 3.08Å; T114-S118 PolarHBondContact O-OG 2.76Å
115V91.4Very high88.4Confident19 Ų1949.2 Ų49.212%0.11526%0.256CS..Hα-helixtrans-64.8-50.6178.31720000110.9F111 H112 H113 S118 C119 I210F111-V115 HydrophobicContact CE1-CG2 4.33Å; F111-V115 HydrophobicContact CZ-CG2 4.31Å; F111-V115 WeakPolarHBondContact O-CG2 3.38Å; F111-V115 PolarHBondContact O-N 2.94Å; H112-V115 PolarHBondContact O-N 3.48Å; H113-V115 VanDerWaalsContact C-N 3.31Å; H113-V115 PolarHBondContact O-N 3.48Å; V115-S118 PolarHBondContact O-N 2.93Å; V115-C119 PolarHBondContact O-N 2.82Å; V115-C119 PolarHBondContact O-SG 3.43Å; V115-C119 VanDerWaalsContact O-SG 3.4Å; V115-I210 HydrophobicContact CG2-CD1 4.08Å; V115-I210 HydrophobicContact CG2-CG2 4.43Å
116V92.3Very high89Confident15 Ų1546.5 Ų46.59%0.09125%0.245CC..Hα-helixtrans-65.1-43.8-176.9176.60000111.5F90 H112 H113 S118 C119 F120 M211F90-V116 HydrophobicContact CD2-CG1 3.72Å; F90-V116 HydrophobicContact CE2-CG1 3.45Å; F90-V116 VanDerWaalsContact CE2-CG1 3.45Å; F90-V116 HydrophobicContact CZ-CG1 4.02Å; H112-V116 WeakPolarHBondContact O-CG2 3.41Å; H112-V116 PolarHBondContact O-N 3.5Å; H113-V116 PolarHBondContact O-N 2.9Å; V116-S118 VanDerWaalsContact C-N 3.3Å; V116-S118 PolarHBondContact O-N 3.31Å; V116-C119 PolarHBondContact O-N 2.98Å; V116-F120 HydrophobicContact CG1-CD1 4.29Å; V116-F120 HydrophobicContact CG1-CD2 3.85Å; V116-F120 HydrophobicContact CG1-CE1 4.22Å; V116-F120 HydrophobicContact CG1-CE2 3.77Å; V116-F120 HydrophobicContact CG1-CG 4.12Å; V116-F120 HydrophobicContact CG1-CZ 3.97Å; V116-F120 VanDerWaalsContact O-CB 3.28Å; V116-F120 WeakPolarHBondContact O-CB 3.45Å; V116-F120 WeakPolarHBondContact O-CG 3.28Å; V116-F120 PolarHBondContact O-N 3.36Å; V116-M211 HydrophobicContact CG2-CE 4.18Å; V116-M211 HydrophobicContact CG2-SD 4.12Å
117I93.6Very high89.2Confident38 Ų3846.9 Ų46.920%0.19525%0.25CS..Hα-helixtrans-59.5-42.7175.9-68.3164.2000110.3F90 I91 H113 G121F90-I117 HydrophobicContact CB-CD1 3.93Å; F90-I117 HydrophobicContact CB-CG1 3.62Å; I91-I117 HydrophobicContact CG1-CD1 3.9Å; I91-I117 HydrophobicContact CG1-CG1 4.31Å; I91-I117 HydrophobicContact CG1-CG2 4.33Å; H113-I117 HydrophobicContact CB-CD1 4.15Å; H113-I117 WeakPolarHBondContact O-CB 3.33Å; H113-I117 WeakPolarHBondContact O-CD1 3.1Å; H113-I117 WeakPolarHBondContact O-CG1 3.39Å; H113-I117 PolarHBondContact O-N 2.97Å; I117-G121 WeakPolarHBondContact O-CA 3.12Å; I117-G121 PolarHBondContact O-N 3.37Å
118S91.9Very high89.3Confident64 Ų6446.3 Ų46.345%0.44825%0.248SC..Hα-helixtrans-65.5-49.5179.1-590000111.7T114 V115 V116 G121 I122T114-S118 WeakPolarHBondContact O-CB 3.27Å; T114-S118 PolarHBondContact O-N 3.45Å; T114-S118 VanDerWaalsContact O-N 3.08Å; T114-S118 PolarHBondContact O-OG 2.76Å; V115-S118 PolarHBondContact O-N 2.93Å; V116-S118 VanDerWaalsContact C-N 3.3Å; V116-S118 PolarHBondContact O-N 3.31Å; S118-G121 PolarHBondContact O-N 3.14Å; S118-I122 VanDerWaalsContact O-CG1 3.31Å; S118-I122 WeakPolarHBondContact O-CG1 3.42Å; S118-I122 PolarHBondContact O-N 2.89Å
119C91.3Very high89.4Confident36 Ų3643 Ų4324%0.24323%0.232CC..Hα-helixtrans-64.9-45.2-179.6-69.30000112.4V115 V116 I122 A123V115-C119 PolarHBondContact O-N 2.82Å; V115-C119 PolarHBondContact O-SG 3.43Å; V115-C119 VanDerWaalsContact O-SG 3.4Å; V116-C119 PolarHBondContact O-N 2.98Å; C119-I122 PolarHBondContact O-N 3.17Å; C119-A123 PolarHBondContact O-N 2.69Å; C119-A123 VanDerWaalsContact O-N 3.15Å
120F93.4Very high89.6Confident15 Ų1539.5 Ų39.57%0.06621%0.213CC..Hα-helixtrans-70.4-36.1178.4-74.210.5000111.4V83 I87 F90 V116 I122 A123 V124 A133 A136 L137V83-F120 HydrophobicContact CG1-CB 3.81Å; V83-F120 HydrophobicContact CG1-CD2 3.82Å; V83-F120 HydrophobicContact CG1-CG 3.87Å; I87-F120 HydrophobicContact CD1-CB 3.82Å; I87-F120 HydrophobicContact CG1-CB 3.62Å; I87-F120 HydrophobicContact CG1-CD2 4.41Å; F90-F120 HydrophobicContact CE2-CD2 4.25Å; F90-F120 AromaticContact CE2-CE2 3.98Å; F90-F120 HydrophobicContact CE2-CE2 3.98Å; V116-F120 HydrophobicContact CG1-CD1 4.29Å; V116-F120 HydrophobicContact CG1-CD2 3.85Å; V116-F120 HydrophobicContact CG1-CE1 4.22Å; V116-F120 HydrophobicContact CG1-CE2 3.77Å; V116-F120 HydrophobicContact CG1-CG 4.12Å; V116-F120 HydrophobicContact CG1-CZ 3.97Å; V116-F120 VanDerWaalsContact O-CB 3.28Å; V116-F120 WeakPolarHBondContact O-CB 3.45Å; V116-F120 WeakPolarHBondContact O-CG 3.28Å; V116-F120 PolarHBondContact O-N 3.36Å; F120-I122 PolarHBondContact O-N 2.91Å; F120-A123 PolarHBondContact O-N 3.15Å; F120-V124 WeakPolarHBondContact O-CB 3.46Å; F120-V124 WeakPolarHBondContact O-CG2 3.12Å; F120-V124 PolarHBondContact O-N 3.34Å; F120-A133 HydrophobicContact CD1-CB 3.78Å; F120-A133 HydrophobicContact CE1-CB 3.78Å; F120-A133 HydrophobicContact CG-CB 4.36Å; F120-A133 HydrophobicContact CZ-CB 4.35Å; F120-A136 HydrophobicContact CE1-CB 3.79Å; F120-A136 HydrophobicContact CZ-CB 3.87Å; F120-L137 HydrophobicContact CE2-CD1 4.15Å; F120-L137 HydrophobicContact CE2-CD2 3.73Å; F120-L137 HydrophobicContact CE2-CG 3.75Å; F120-L137 HydrophobicContact CZ-CD2 4.16Å; F120-L137 HydrophobicContact CZ-CG 3.88Å
121G90.4Very high89.6Confident16 Ų1639.3 Ų39.317%0.16521%0.212CC..Hα-helixtrans-57.2-48.3172.400000111.6I117 S118 A123 V124 L125I117-G121 WeakPolarHBondContact O-CA 3.12Å; I117-G121 PolarHBondContact O-N 3.37Å; S118-G121 PolarHBondContact O-N 3.14Å; G121-A123 VanDerWaalsContact C-N 3.33Å; G121-A123 PolarHBondContact O-N 2.71Å; G121-V124 PolarHBondContact O-N 2.94Å; G121-L125 VanDerWaalsContact O-CB 3.22Å; G121-L125 WeakPolarHBondContact O-CB 3.22Å; G121-L125 WeakPolarHBondContact O-CG 3.39Å; G121-L125 PolarHBondContact O-N 3.4Å
122I90.2Very high89.6Confident41 Ų4135.9 Ų35.921%0.2120%0.197CC..Hα-helixtrans-57.5-46.5174.9-67.5163.4000110.8S118 C119 F120 V124 T126 F199 A203S118-I122 VanDerWaalsContact O-CG1 3.31Å; S118-I122 WeakPolarHBondContact O-CG1 3.42Å; S118-I122 PolarHBondContact O-N 2.89Å; C119-I122 PolarHBondContact O-N 3.17Å; F120-I122 PolarHBondContact O-N 2.91Å; I122-V124 PolarHBondContact O-N 3.25Å; I122-T126 HydrophobicContact CG2-CG2 4.34Å; I122-T126 WeakPolarHBondContact O-CB 3.45Å; I122-T126 VanDerWaalsContact O-CG2 3.29Å; I122-T126 WeakPolarHBondContact O-CG2 3.38Å; I122-T126 PolarHBondContact O-N 3.34Å; I122-T126 PolarHBondContact O-OG1 2.94Å; I122-F199 HydrophobicContact CD1-CE1 3.86Å; I122-F199 HydrophobicContact CD1-CZ 4.4Å; I122-F199 HydrophobicContact CG1-CE1 4.42Å; I122-A203 HydrophobicContact CD1-CB 4.16Å
123A89.6Confident89.7Confident4 Ų435 Ų353%0.03319%0.194CC..Hα-helixtrans-62.9-45.2-17800000112.6C119 F120 G121 G127 R128 A133C119-A123 PolarHBondContact O-N 2.69Å; C119-A123 VanDerWaalsContact O-N 3.15Å; F120-A123 PolarHBondContact O-N 3.15Å; G121-A123 VanDerWaalsContact C-N 3.33Å; G121-A123 PolarHBondContact O-N 2.71Å; A123-G127 WeakPolarHBondContact O-CA 3.15Å; A123-G127 PolarHBondContact O-N 3.26Å; A123-R128 CarbonylContact C-O 3.58Å; A123-R128 WeakPolarHBondContact CA-O 3.34Å; A123-R128 WeakPolarHBondContact CB-O 3.48Å; A123-R128 PolarHBondContact O-N 3.42Å; A123-R128 VanDerWaalsContact O-O 3.05Å; A123-A133 HydrophobicContact CB-CB 4.34Å
124V89.4Confident89.7Confident5 Ų534.7 Ų34.73%0.0319%0.193CC..Hα-helixtrans-71.4-42-178.2170.80000111.7V6 H80 V83 S84 I87 F120 G121 I122 G127V6-V124 HydrophobicContact CB-CG1 4.05Å; V6-V124 HydrophobicContact CG1-CG1 3.36Å; V6-V124 HydrophobicContact CG2-CG1 3.46Å; V6-V124 VanDerWaalsContact CG2-CG1 3.46Å; H80-V124 PolarHBondContact NE2-O 3.15Å; V83-V124 HydrophobicContact CB-CG2 3.83Å; V83-V124 HydrophobicContact CG1-CG2 3.4Å; S84-V124 WeakPolarHBondContact OG-CG1 3.2Å; I87-V124 HydrophobicContact CD1-CB 4.16Å; I87-V124 HydrophobicContact CD1-CG2 3.8Å; F120-V124 WeakPolarHBondContact O-CB 3.46Å; F120-V124 WeakPolarHBondContact O-CG2 3.12Å; F120-V124 PolarHBondContact O-N 3.34Å; G121-V124 PolarHBondContact O-N 2.94Å; I122-V124 PolarHBondContact O-N 3.25Å; V124-G127 PolarHBondContact O-N 2.86Å
125L88.2Confident89.7Confident118 Ų11832 Ų3262%0.61818%0.176SC*.Hα-helixtrans-69.1-37.3179.9-68.6174.6000112.6L3 G121L3-L125 HydrophobicContact CD1-CD2 3.27Å; G121-L125 VanDerWaalsContact O-CB 3.22Å; G121-L125 WeakPolarHBondContact O-CB 3.22Å; G121-L125 WeakPolarHBondContact O-CG 3.39Å; G121-L125 PolarHBondContact O-N 3.4Å
126T85.4Confident89.8Confident69 Ų6932 Ų3242%0.42318%0.178SC..Hα-helixtrans-84.3-14.7177.861.40000113I122 R128I122-T126 HydrophobicContact CG2-CG2 4.34Å; I122-T126 WeakPolarHBondContact O-CB 3.45Å; I122-T126 VanDerWaalsContact O-CG2 3.29Å; I122-T126 WeakPolarHBondContact O-CG2 3.38Å; I122-T126 PolarHBondContact O-N 3.34Å; I122-T126 PolarHBondContact O-OG1 2.94Å; T126-R128 PolarHBondContact O-N 3.38Å; T126-R128 PolarHBondContact OG1-N 3Å
127G82.9Confident89.9Confident18 Ų1831.4 Ų31.419%0.18617%0.174CC..THydrogen-bonded Turntrans64.512.8-172.200000113.6H75 A123 V124H75-G127 PolarHBondContact CE1-O 3.12Å; H75-G127 PolarHBondContact ND1-O 3.03Å; H75-G127 VanDerWaalsContact ND1-O 3.17Å; A123-G127 WeakPolarHBondContact O-CA 3.15Å; A123-G127 PolarHBondContact O-N 3.26Å; V124-G127 PolarHBondContact O-N 2.86Å
128R83.8Confident89.8Confident145 Ų14531 Ų3155%0.54717%0.172SC..  trans-114.2155.1179.2-65.9-171.5176.2119.7-2109.7I72 A123 T126 V130I72-R128 WeakPolarHBondContact O-CA 3.17Å; A123-R128 CarbonylContact C-O 3.58Å; A123-R128 WeakPolarHBondContact CA-O 3.34Å; A123-R128 WeakPolarHBondContact CB-O 3.48Å; A123-R128 PolarHBondContact O-N 3.42Å; A123-R128 VanDerWaalsContact O-O 3.05Å; T126-R128 PolarHBondContact O-N 3.38Å; T126-R128 PolarHBondContact OG1-N 3Å; R128-V130 PolarHBondContact O-N 3.36Å
129Y87.2Confident89.9Confident25 Ų2528.5 Ų28.510%0.09815%0.154CC..SBendtrans64.616.6177.9-39.6-66.5000114.6L71 I72 G131 F132 A133 V196 P197L71-Y129 VanDerWaalsContact O-CA 3.27Å; L71-Y129 WeakPolarHBondContact O-CA 3.31Å; I72-Y129 HydrophobicContact CB-CD1 4.42Å; I72-Y129 HydrophobicContact CB-CE1 4.26Å; I72-Y129 HydrophobicContact CG1-CD1 4.15Å; I72-Y129 HydrophobicContact CG1-CE1 3.97Å; I72-Y129 HydrophobicContact CG2-CD1 4.28Å; I72-Y129 HydrophobicContact CG2-CE1 3.74Å; I72-Y129 PolarHBondContact O-N 3.4Å; Y129-G131 VanDerWaalsContact C-N 3.3Å; Y129-G131 PolarHBondContact O-N 3.45Å; Y129-F132 WeakPolarHBondContact O-CB 3.36Å; Y129-F132 PolarHBondContact O-N 3.39Å; Y129-F132 VanDerWaalsContact O-N 3.16Å; Y129-A133 PolarHBondContact O-N 3.41Å; Y129-V196 HydrophobicContact CE1-CG1 4.22Å; Y129-V196 HydrophobicContact CE1-CG2 3.94Å; Y129-P197 WeakPolarHBondContact OH-CD 3.36Å
130V88.3Confident90Very high1 Ų127.4 Ų27.41%0.00615%0.145CC..Hα-helixtrans-63.4-41178.1179.50000109.8H75 H80 V83 R128 F132 A133 V134H75-V130 HydrophobicContact CB-CB 3.71Å; H75-V130 HydrophobicContact CB-CG1 4.03Å; H75-V130 HydrophobicContact CB-CG2 3.97Å; H80-V130 HydrophobicContact CB-CG1 4.45Å; V83-V130 HydrophobicContact CG2-CG1 4.2Å; R128-V130 PolarHBondContact O-N 3.36Å; V130-F132 VanDerWaalsContact C-N 3.29Å; V130-F132 PolarHBondContact O-N 2.96Å; V130-A133 WeakPolarHBondContact O-CB 3.37Å; V130-A133 PolarHBondContact O-N 3.49Å; V130-A133 VanDerWaalsContact O-N 3.13Å; V130-V134 WeakPolarHBondContact O-CG2 3.42Å; V130-V134 PolarHBondContact O-N 3.5Å
131G88.4Confident89.9Confident0 Ų028 Ų280%015%0.149CC..Hα-helixtrans-58.4-42.3173.500000112.1L71 Y129 A133 V134 V135L71-G131 VanDerWaalsContact CD2-C 3.41Å; Y129-G131 VanDerWaalsContact C-N 3.3Å; Y129-G131 PolarHBondContact O-N 3.45Å; G131-A133 VanDerWaalsContact C-N 3.34Å; G131-A133 PolarHBondContact O-N 2.98Å; G131-V134 PolarHBondContact O-N 3.44Å; G131-V134 VanDerWaalsContact O-N 3.14Å; G131-V135 WeakPolarHBondContact O-CG2 3.5Å; G131-V135 PolarHBondContact O-N 2.95Å
132F89.8Confident90.1Very high30 Ų3027.3 Ų27.313%0.13214%0.142CC..Hα-helixtrans-61.9-39.6175.1-169.7-99.3000112.5L71 Y129 V130 V135 A136 M185 W188 L208L71-F132 HydrophobicContact CB-CB 4.43Å; L71-F132 HydrophobicContact CD1-CD2 4.39Å; Y129-F132 WeakPolarHBondContact O-CB 3.36Å; Y129-F132 PolarHBondContact O-N 3.39Å; Y129-F132 VanDerWaalsContact O-N 3.16Å; V130-F132 VanDerWaalsContact C-N 3.29Å; V130-F132 PolarHBondContact O-N 2.96Å; F132-V135 PolarHBondContact O-N 3.31Å; F132-A136 PolarHBondContact O-N 2.99Å; F132-M185 HydrophobicContact CD1-CE 3.74Å; F132-M185 HydrophobicContact CD2-CE 4.22Å; F132-M185 HydrophobicContact CE1-CE 3.32Å; F132-M185 HydrophobicContact CE2-CB 3.96Å; F132-M185 HydrophobicContact CE2-CE 3.84Å; F132-M185 HydrophobicContact CE2-CG 4.12Å; F132-M185 HydrophobicContact CG-CE 4.19Å; F132-M185 HydrophobicContact CZ-CB 4.02Å; F132-M185 HydrophobicContact CZ-CE 3.41Å; F132-M185 VanDerWaalsContact CZ-CE 3.41Å; F132-M185 HydrophobicContact CZ-CG 4.37Å; F132-W188 HydrophobicContact CD2-CD2 4.34Å; F132-W188 AromaticContact CD2-CE3 3.67Å; F132-W188 HydrophobicContact CD2-CE3 3.67Å; F132-W188 AromaticContact CD2-CZ3 3.87Å; F132-W188 HydrophobicContact CD2-CZ3 3.87Å; F132-W188 HydrophobicContact CE2-CD2 4.38Å; F132-W188 AromaticContact CE2-CE3 3.57Å; F132-W188 HydrophobicContact CE2-CE3 3.57Å; F132-W188 HydrophobicContact CE2-CZ3 4.06Å; F132-L208 HydrophobicContact CZ-CD1 3.97Å
133A92.1Very high90.1Very high4 Ų425.6 Ų25.63%0.03313%0.133CC..Hα-helixtrans-66.7-35.2173.400000112.6V83 F120 A123 Y129 V130 G131 A136 L137V83-A133 HydrophobicContact CG1-CB 3.97Å; V83-A133 HydrophobicContact CG2-CB 3.79Å; F120-A133 HydrophobicContact CD1-CB 3.78Å; F120-A133 HydrophobicContact CE1-CB 3.78Å; F120-A133 HydrophobicContact CG-CB 4.36Å; F120-A133 HydrophobicContact CZ-CB 4.35Å; A123-A133 HydrophobicContact CB-CB 4.34Å; Y129-A133 PolarHBondContact O-N 3.41Å; V130-A133 WeakPolarHBondContact O-CB 3.37Å; V130-A133 PolarHBondContact O-N 3.49Å; V130-A133 VanDerWaalsContact O-N 3.13Å; G131-A133 VanDerWaalsContact C-N 3.34Å; G131-A133 PolarHBondContact O-N 2.98Å; A133-A136 WeakPolarHBondContact O-CB 3.46Å; A133-A136 PolarHBondContact O-N 3.27Å; A133-L137 PolarHBondContact O-N 2.99Å
134V92.2Very high90.3Very high0 Ų026.4 Ų26.40%014%0.138CC..Hα-helixtrans-66.9-41.3173.4177.90000111.4A57 C60 F61 M67 L82 V83 V130 G131 A136 L137 L138A57-V134 HydrophobicContact CB-CG1 4.16Å; C60-V134 HydrophobicContact CB-CG1 3.9Å; F61-V134 HydrophobicContact CD2-CG1 4.35Å; F61-V134 HydrophobicContact CE2-CG1 3.63Å; F61-V134 HydrophobicContact CZ-CB 4.28Å; F61-V134 HydrophobicContact CZ-CG1 3.82Å; M67-V134 HydrophobicContact SD-CB 4.43Å; M67-V134 HydrophobicContact SD-CG2 4.21Å; L82-V134 HydrophobicContact CD2-CG1 4.15Å; L82-V134 HydrophobicContact CD2-CG2 4.24Å; V83-V134 HydrophobicContact CG2-CG2 3.98Å; V130-V134 WeakPolarHBondContact O-CG2 3.42Å; V130-V134 PolarHBondContact O-N 3.5Å; G131-V134 PolarHBondContact O-N 3.44Å; G131-V134 VanDerWaalsContact O-N 3.14Å; V134-A136 VanDerWaalsContact C-N 3.27Å; V134-A136 PolarHBondContact O-N 2.81Å; V134-L137 WeakPolarHBondContact O-CB 3.38Å; V134-L137 PolarHBondContact O-N 3.19Å; V134-L137 VanDerWaalsContact O-N 3.09Å; V134-L138 PolarHBondContact O-N 3.26Å
135V92.4Very high90.4Very high10 Ų1028.9 Ų28.96%0.06115%0.148CC..Hα-helixtrans-58.8-43.5171.6176.90000110.3F61 L71 G131 F132 L137 L138 T181 W184 M185F61-V135 HydrophobicContact CE1-CG2 4.21Å; F61-V135 HydrophobicContact CE2-CG2 4.36Å; F61-V135 HydrophobicContact CZ-CB 4.44Å; F61-V135 HydrophobicContact CZ-CG2 3.49Å; F61-V135 VanDerWaalsContact CZ-CG2 3.49Å; L71-V135 HydrophobicContact CD2-CG2 3.77Å; G131-V135 WeakPolarHBondContact O-CG2 3.5Å; G131-V135 PolarHBondContact O-N 2.95Å; F132-V135 PolarHBondContact O-N 3.31Å; V135-L137 PolarHBondContact O-N 3.17Å; V135-L138 HydrophobicContact CG1-CD1 4.36Å; V135-L138 VanDerWaalsContact O-CB 3.27Å; V135-L138 WeakPolarHBondContact O-CB 3.49Å; V135-L138 PolarHBondContact O-N 3.06Å; V135-T181 HydrophobicContact CG1-CG2 3.71Å; V135-W184 HydrophobicContact CB-CZ3 4.38Å; V135-W184 HydrophobicContact CG1-CE3 4.02Å; V135-W184 HydrophobicContact CG1-CZ3 3.78Å; V135-W184 HydrophobicContact CG2-CH2 4.41Å; V135-W184 HydrophobicContact CG2-CZ3 4.01Å; V135-M185 HydrophobicContact CG1-CG 3.77Å; V135-M185 HydrophobicContact CG1-SD 4Å
136A93.1Very high90.5Very high19 Ų1924.9 Ų24.916%0.15713%0.127CC..Hα-helixtrans-58.6-34.8176.600000112.2F120 F132 A133 V134 L138 V139 M185F120-A136 HydrophobicContact CE1-CB 3.79Å; F120-A136 HydrophobicContact CZ-CB 3.87Å; F132-A136 PolarHBondContact O-N 2.99Å; A133-A136 WeakPolarHBondContact O-CB 3.46Å; A133-A136 PolarHBondContact O-N 3.27Å; V134-A136 VanDerWaalsContact C-N 3.27Å; V134-A136 PolarHBondContact O-N 2.81Å; A136-L138 VanDerWaalsContact C-N 3.29Å; A136-L138 PolarHBondContact O-N 3.16Å; A136-V139 WeakPolarHBondContact O-CG1 3.35Å; A136-V139 WeakPolarHBondContact O-CG2 3.41Å; A136-V139 PolarHBondContact O-N 3.42Å; A136-M185 HydrophobicContact CB-CE 3.58Å; A136-M185 HydrophobicContact CB-SD 4.08Å
137L93.7Very high90.8Very high2 Ų223 Ų231%0.0111%0.114CC..Hα-helixtrans-72.3-14.5176.4-75.9169.3000114.1A57 L82 V83 S86 F120 A133 V134 V135 V139 E140A57-L137 HydrophobicContact CB-CB 4.26Å; L82-L137 HydrophobicContact CD1-CD1 4.1Å; L82-L137 HydrophobicContact CD2-CD1 4.1Å; L82-L137 HydrophobicContact CG-CD1 3.73Å; V83-L137 HydrophobicContact CG2-CD1 4.22Å; S86-L137 WeakPolarHBondContact OG-CD1 3.49Å; F120-L137 HydrophobicContact CE2-CD1 4.15Å; F120-L137 HydrophobicContact CE2-CD2 3.73Å; F120-L137 HydrophobicContact CE2-CG 3.75Å; F120-L137 HydrophobicContact CZ-CD2 4.16Å; F120-L137 HydrophobicContact CZ-CG 3.88Å; A133-L137 PolarHBondContact O-N 2.99Å; V134-L137 WeakPolarHBondContact O-CB 3.38Å; V134-L137 PolarHBondContact O-N 3.19Å; V134-L137 VanDerWaalsContact O-N 3.09Å; V135-L137 PolarHBondContact O-N 3.17Å; L137-V139 PolarHBondContact O-N 3.42Å; L137-V139 VanDerWaalsContact O-N 3.16Å; L137-E140 HydrophobicContact CD2-CG 4.1Å; L137-E140 VanDerWaalsContact O-CB 3.26Å; L137-E140 WeakPolarHBondContact O-CB 3.32Å; L137-E140 WeakPolarHBondContact O-CG 3.27Å; L137-E140 PolarHBondContact O-N 2.95Å
138L93Very high91.1Very high29 Ų2925.3 Ų25.315%0.15212%0.121CC..THydrogen-bonded Turntrans-61.5-23173.3-66.1173.7000112.3A57 V58 F61 V134 V135 A136 E140 I141A57-L138 HydrophobicContact CB-CD2 3.9Å; V58-L138 HydrophobicContact CG2-CD2 4.1Å; F61-L138 HydrophobicContact CD2-CD2 4.38Å; F61-L138 HydrophobicContact CE2-CD1 3.9Å; F61-L138 HydrophobicContact CE2-CD2 4.18Å; F61-L138 HydrophobicContact CE2-CG 4.15Å; V134-L138 PolarHBondContact O-N 3.26Å; V135-L138 HydrophobicContact CG1-CD1 4.36Å; V135-L138 VanDerWaalsContact O-CB 3.27Å; V135-L138 WeakPolarHBondContact O-CB 3.49Å; V135-L138 PolarHBondContact O-N 3.06Å; A136-L138 VanDerWaalsContact C-N 3.29Å; A136-L138 PolarHBondContact O-N 3.16Å; L138-E140 PolarHBondContact O-N 3.04Å; L138-I141 HydrophobicContact CD2-CD1 4.12Å; L138-I141 WeakPolarHBondContact O-CB 3.25Å; L138-I141 WeakPolarHBondContact O-CG1 3.37Å; L138-I141 PolarHBondContact O-N 3.35Å
139V93Very high91.4Very high11 Ų1119.3 Ų19.37%0.06710%0.099CC..THydrogen-bonded Turntrans-61.9-22.4174-52.60000112.4A136 L137 I141 N142 S143 F177 R178 T181A136-V139 WeakPolarHBondContact O-CG1 3.35Å; A136-V139 WeakPolarHBondContact O-CG2 3.41Å; A136-V139 PolarHBondContact O-N 3.42Å; L137-V139 PolarHBondContact O-N 3.42Å; L137-V139 VanDerWaalsContact O-N 3.16Å; V139-I141 PolarHBondContact O-N 3.44Å; V139-N142 PolarHBondContact O-N 2.68Å; V139-N142 VanDerWaalsContact O-N 3.17Å; V139-S143 PolarHBondContact O-N 3.46Å; V139-F177 WeakPolarHBondContact CG1-O 3.42Å; V139-R178 HydrophobicContact CB-CG 4.22Å; V139-T181 HydrophobicContact CG1-CG2 4.4Å
140E92.8Very high91.4Very high13 Ų1320.4 Ų20.46%0.06111%0.105CC..Hα-helixtrans-67.6-23178.4-65-58.3153.500112.8L137 L138 N142 S143 V144L137-E140 HydrophobicContact CD2-CG 4.1Å; L137-E140 VanDerWaalsContact O-CB 3.26Å; L137-E140 WeakPolarHBondContact O-CB 3.32Å; L137-E140 WeakPolarHBondContact O-CG 3.27Å; L137-E140 PolarHBondContact O-N 2.95Å; L138-E140 PolarHBondContact O-N 3.04Å; E140-N142 PolarHBondContact O-N 2.88Å; E140-S143 WeakPolarHBondContact O-CA 3.47Å; E140-S143 VanDerWaalsContact O-CB 3.29Å; E140-S143 WeakPolarHBondContact O-CB 3.42Å; E140-S143 PolarHBondContact O-N 2.97Å; E140-S143 WeakPolarHBondContact OE2-CB 3.4Å; E140-S143 PolarHBondContact OE2-OG 3Å; E140-V144 PolarHBondContact O-N 2.89Å; E140-V144 VanDerWaalsContact O-N 3.08Å
141I92.2Very high91.4Very high29 Ų2921.4 Ų21.415%0.14911%0.11CC..Hα-helixtrans-59-40.6172.7-60.9170.2000110.1V58 L138 V139 F145 F177V58-I141 HydrophobicContact CG2-CD1 3.68Å; L138-I141 HydrophobicContact CD2-CD1 4.12Å; L138-I141 WeakPolarHBondContact O-CB 3.25Å; L138-I141 WeakPolarHBondContact O-CG1 3.37Å; L138-I141 PolarHBondContact O-N 3.35Å; V139-I141 PolarHBondContact O-N 3.44Å; I141-F145 HydrophobicContact CG2-CE2 4.48Å; I141-F145 VanDerWaalsContact O-CD2 3.25Å; I141-F145 WeakPolarHBondContact O-CD2 3.31Å; I141-F145 WeakPolarHBondContact O-CE2 3.33Å; I141-F177 HydrophobicContact CB-CD1 4.36Å; I141-F177 HydrophobicContact CB-CD2 4.3Å; I141-F177 HydrophobicContact CB-CG 4.21Å; I141-F177 HydrophobicContact CD1-CD1 3.83Å; I141-F177 HydrophobicContact CD1-CE1 3.55Å; I141-F177 HydrophobicContact CD1-CZ 4.01Å; I141-F177 HydrophobicContact CG2-CD2 3.93Å; I141-F177 HydrophobicContact CG2-CE2 3.81Å; I141-F177 HydrophobicContact CG2-CG 4.33Å; I141-F177 HydrophobicContact CG2-CZ 4.12Å
142N93.6Very high91.3Very high0 Ų022.8 Ų22.80%012%0.117CC..Hα-helixtrans-71.1-36.5172.9173.1-107.9000112V139 E140 V144 F145 L146 N170 T173 Y174 F177 R178V139-N142 PolarHBondContact O-N 2.68Å; V139-N142 VanDerWaalsContact O-N 3.17Å; E140-N142 PolarHBondContact O-N 2.88Å; N142-V144 PolarHBondContact O-N 3.32Å; N142-F145 PolarHBondContact O-N 3.43Å; N142-F145 VanDerWaalsContact O-N 3.13Å; N142-L146 PolarHBondContact O-N 2.89Å; N142-L146 VanDerWaalsContact O-N 3.1Å; N142-N170 PolarHBondContact ND2-O 2.76Å; N142-N170 PolarHBondContact ND2-OD1 3.47Å; N142-T173 PolarHBondContact ND2-OG1 2.91Å; N142-Y174 VanDerWaalsContact ND2-CA 3.33Å; N142-Y174 WeakPolarHBondContact ND2-CA 3.49Å; N142-Y174 PolarHBondContact ND2-N 3.38Å; N142-Y174 VanDerWaalsContact ND2-N 3.12Å; N142-Y174 VanDerWaalsContact OD1-CD2 3.27Å; N142-Y174 WeakPolarHBondContact OD1-CD2 3.24Å; N142-F177 HydrophobicContact CB-CB 4.37Å; N142-R178 HydrophobicContact CB-CG 4.1Å; N142-R178 WeakPolarHBondContact OD1-CD 3.5Å; N142-R178 PolarHBondContact OD1-NE 2.78Å
143S91.8Very high91Very high5 Ų526.5 Ų26.54%0.03513%0.13CC..Hα-helixtrans-56.3-33.5177.1-570000112.5V139 E140 F145 L146 H147 R178V139-S143 PolarHBondContact O-N 3.46Å; E140-S143 WeakPolarHBondContact O-CA 3.47Å; E140-S143 VanDerWaalsContact O-CB 3.29Å; E140-S143 WeakPolarHBondContact O-CB 3.42Å; E140-S143 PolarHBondContact O-N 2.97Å; E140-S143 WeakPolarHBondContact OE2-CB 3.4Å; E140-S143 PolarHBondContact OE2-OG 3Å; S143-F145 PolarHBondContact O-N 2.92Å; S143-L146 PolarHBondContact O-N 3.47Å; S143-H147 WeakPolarHBondContact O-CB 3.35Å; S143-H147 PolarHBondContact O-CD2 2.97Å; S143-H147 PolarHBondContact O-N 3.42Å; S143-R178 PolarHBondContact OG-NH2 3.26Å
144V93.1Very high90.7Very high22 Ų2227.9 Ų27.913%0.13314%0.136CC..Hα-helixtrans-54.2-53.5174.2175.70000111.2L47 L51 E140 N142 L146 H147 L148L47-V144 HydrophobicContact CD1-CB 4.42Å; L47-V144 HydrophobicContact CD1-CG1 3.9Å; L51-V144 HydrophobicContact CD2-CB 4.49Å; L51-V144 HydrophobicContact CD2-CG1 3.63Å; L51-V144 HydrophobicContact CD2-CG2 3.94Å; L51-V144 HydrophobicContact CG-CG1 4.17Å; L51-V144 HydrophobicContact CG-CG2 4.1Å; E140-V144 PolarHBondContact O-N 2.89Å; E140-V144 VanDerWaalsContact O-N 3.08Å; N142-V144 PolarHBondContact O-N 3.32Å; V144-L146 VanDerWaalsContact C-N 3.3Å; V144-L146 PolarHBondContact O-N 3Å; V144-H147 PolarHBondContact O-N 3.02Å; V144-L148 WeakPolarHBondContact O-CB 3.47Å; V144-L148 PolarHBondContact O-N 2.96Å
145F91.7Very high90.3Very high56 Ų5628.8 Ų28.825%0.24614%0.144CC..Hα-helixtrans-68.4-32.2-179-59.5-76.9000112.1I141 N142 S143 R149 N166 V169 N170 T173I141-F145 HydrophobicContact CG2-CE2 4.48Å; I141-F145 VanDerWaalsContact O-CD2 3.25Å; I141-F145 WeakPolarHBondContact O-CD2 3.31Å; I141-F145 WeakPolarHBondContact O-CE2 3.33Å; N142-F145 PolarHBondContact O-N 3.43Å; N142-F145 VanDerWaalsContact O-N 3.13Å; S143-F145 PolarHBondContact O-N 2.92Å; F145-R149 VanDerWaalsContact O-CB 3.27Å; F145-R149 WeakPolarHBondContact O-CB 3.38Å; F145-R149 PolarHBondContact O-N 3.41Å; F145-N166 PolarHBondContact O-ND2 3.44Å; F145-N166 VanDerWaalsContact O-ND2 3.1Å; F145-V169 HydrophobicContact CD1-CB 4.4Å; F145-V169 HydrophobicContact CD1-CG1 3.67Å; F145-V169 HydrophobicContact CD2-CG1 4.44Å; F145-V169 HydrophobicContact CE1-CG1 3.45Å; F145-V169 VanDerWaalsContact CE1-CG1 3.45Å; F145-V169 HydrophobicContact CE2-CG1 4.27Å; F145-V169 HydrophobicContact CG-CG1 4.17Å; F145-V169 HydrophobicContact CZ-CG1 3.78Å; F145-N170 HydrophobicContact CB-CB 3.78Å; F145-T173 HydrophobicContact CD2-CG2 3.95Å; F145-T173 HydrophobicContact CE2-CG2 3.74Å; F145-T173 HydrophobicContact CZ-CG2 4.47Å
146L90.4Very high89.7Confident34 Ų3432.5 Ų32.518%0.17817%0.17CC..Hα-helixtrans-66.9-46.2176.1-171.2151.9000111.5N142 S143 V144 R149 Q150 N170N142-L146 PolarHBondContact O-N 2.89Å; N142-L146 VanDerWaalsContact O-N 3.1Å; S143-L146 PolarHBondContact O-N 3.47Å; V144-L146 VanDerWaalsContact C-N 3.3Å; V144-L146 PolarHBondContact O-N 3Å; L146-R149 WeakPolarHBondContact O-CB 3.4Å; L146-R149 PolarHBondContact O-N 2.89Å; L146-Q150 PolarHBondContact O-N 3.05Å; L146-N170 WeakPolarHBondContact CA-OD1 3.11Å; L146-N170 PolarHBondContact N-OD1 3.36Å; L146-N170 VanDerWaalsContact N-OD1 3.17Å
147H91.8Very high89.1Confident30 Ų3036.6 Ų36.614%0.13919%0.189CC..Hα-helixtrans-67.7-42176.7-69.5-51.2000111.5V43 S46 L47 S143 V144 R149 Q150 I151V43-H147 HydrophobicContact CG1-CB 4.02Å; S46-H147 VanDerWaalsContact CB-CE1 3.47Å; S46-H147 WeakPolarHBondContact CB-CE1 3.44Å; S46-H147 WeakPolarHBondContact CB-NE2 3.39Å; L47-H147 HydrophobicContact CB-CB 3.99Å; L47-H147 HydrophobicContact CD1-CB 4.11Å; S143-H147 WeakPolarHBondContact O-CB 3.35Å; S143-H147 PolarHBondContact O-CD2 2.97Å; S143-H147 PolarHBondContact O-N 3.42Å; V144-H147 PolarHBondContact O-N 3.02Å; H147-R149 VanDerWaalsContact C-N 3.29Å; H147-R149 PolarHBondContact O-N 3.08Å; H147-Q150 WeakPolarHBondContact O-CB 3.35Å; H147-Q150 PolarHBondContact O-N 3.37Å; H147-Q150 VanDerWaalsContact O-N 3.08Å; H147-I151 WeakPolarHBondContact O-CG1 3.5Å; H147-I151 PolarHBondContact O-N 3.38Å
148L89.3Confident88.1Confident66 Ų6638.7 Ų38.735%0.34621%0.206SC..Hα-helixtrans-59-42.4173.9-177.156.3000111.3V144 Q150 I151 L152 N166V144-L148 WeakPolarHBondContact O-CB 3.47Å; V144-L148 PolarHBondContact O-N 2.96Å; L148-Q150 VanDerWaalsContact C-N 3.32Å; L148-Q150 PolarHBondContact O-N 3.33Å; L148-I151 PolarHBondContact O-N 3.41Å; L148-L152 HydrophobicContact CD1-CG 4.47Å; L148-L152 HydrophobicContact CG-CD1 4.31Å; L148-L152 VanDerWaalsContact O-CG 3.31Å; L148-L152 WeakPolarHBondContact O-CG 3.33Å; L148-L152 PolarHBondContact O-N 2.92Å; L148-N166 WeakPolarHBondContact CD2-OD1 3.38Å
149R88.9Confident87.2Confident20 Ų2042 Ų428%0.07524%0.238CC..Hα-helixtrans-58.6-45.2173.7-172.3179.5158.4-86.85.6111.4F145 L146 H147 L152 R153 Y163 N166 S225 D226F145-R149 VanDerWaalsContact O-CB 3.27Å; F145-R149 WeakPolarHBondContact O-CB 3.38Å; F145-R149 PolarHBondContact O-N 3.41Å; L146-R149 WeakPolarHBondContact O-CB 3.4Å; L146-R149 PolarHBondContact O-N 2.89Å; H147-R149 VanDerWaalsContact C-N 3.29Å; H147-R149 PolarHBondContact O-N 3.08Å; R149-L152 PolarHBondContact O-N 3.4Å; R149-R153 WeakPolarHBondContact O-CG 3.42Å; R149-R153 PolarHBondContact O-N 2.83Å; R149-Y163 HydrophobicContact CG-CD2 4.39Å; R149-Y163 HydrophobicContact CG-CE2 3.56Å; R149-Y163 PolarHBondContact NE-OH 3.44Å; R149-Y163 PolarHBondContact NH2-OH 3.01Å; R149-N166 WeakPolarHBondContact CA-ND2 3.4Å; R149-N166 VanDerWaalsContact CB-ND2 3.32Å; R149-N166 WeakPolarHBondContact CB-ND2 3.37Å; R149-N166 PolarHBondContact N-ND2 3Å; R149-S225 PolarHBondContact NH2-OG 3.1Å; R149-D226 IonicContact CZ-OD1 2.74Å; R149-D226 IonicContact CZ-OD2 2.76Å; R149-D226 IonicContact NE-OD1 3.5Å; R149-D226 PolarHBondContact NE-OD1 3.08Å; R149-D226 IonicContact NE-OD2 3.54Å; R149-D226 PolarHBondContact NE-OD2 3.23Å; R149-D226 VanDerWaalsContact NH2-CG 3.26Å; R149-D226 IonicContact NH2-OD1 3.5Å; R149-D226 PolarHBondContact NH2-OD1 2.96Å; R149-D226 IonicContact NH2-OD2 3.56Å; R149-D226 PolarHBondContact NH2-OD2 2.81Å
150Q87.7Confident86.5Confident47 Ų4743 Ų4322%0.2225%0.251CS..Hα-helixtrans-65.8-40.3-179.2-175.2167.5-19.400112V43 L146 H147 L148 R153 M154V43-Q150 HydrophobicContact CG1-CB 4.18Å; V43-Q150 HydrophobicContact CG1-CG 4.24Å; V43-Q150 HydrophobicContact CG2-CG 4.09Å; L146-Q150 PolarHBondContact O-N 3.05Å; H147-Q150 WeakPolarHBondContact O-CB 3.35Å; H147-Q150 PolarHBondContact O-N 3.37Å; H147-Q150 VanDerWaalsContact O-N 3.08Å; L148-Q150 VanDerWaalsContact C-N 3.32Å; L148-Q150 PolarHBondContact O-N 3.33Å; Q150-R153 PolarHBondContact O-N 2.82Å; Q150-M154 HydrophobicContact CG-SD 4.16Å; Q150-M154 WeakPolarHBondContact O-CB 3.38Å; Q150-M154 VanDerWaalsContact O-CG 3.27Å; Q150-M154 WeakPolarHBondContact O-CG 3.32Å; Q150-M154 PolarHBondContact O-N 3.03Å
151I88.2Confident86Confident23 Ų2348.1 Ų48.112%0.11828%0.279CS..Hα-helixtrans-59.4-51.4173.4-71.4169.7000110.3W40 V43 L47 H147 L148 R153 M154 A155W40-I151 HydrophobicContact CH2-CG2 3.54Å; W40-I151 HydrophobicContact CZ2-CG2 4.43Å; W40-I151 HydrophobicContact CZ3-CB 4.28Å; W40-I151 HydrophobicContact CZ3-CG2 3.65Å; V43-I151 HydrophobicContact CG1-CD1 4.09Å; V43-I151 HydrophobicContact CG1-CG1 3.63Å; L47-I151 HydrophobicContact CB-CD1 4.48Å; L47-I151 HydrophobicContact CD2-CD1 3.68Å; H147-I151 WeakPolarHBondContact O-CG1 3.5Å; H147-I151 PolarHBondContact O-N 3.38Å; L148-I151 PolarHBondContact O-N 3.41Å; I151-R153 VanDerWaalsContact C-N 3.28Å; I151-R153 PolarHBondContact O-N 3.22Å; I151-M154 PolarHBondContact O-N 3.38Å; I151-M154 VanDerWaalsContact O-N 3.1Å; I151-A155 WeakPolarHBondContact O-CB 3.32Å; I151-A155 PolarHBondContact O-N 2.87Å
152L86.1Confident85.6Confident28 Ų2853.2 Ų53.215%0.14731%0.305CS..Hα-helixtrans-58.8-38.9179.1-70.2171.4000112.3L148 R149 A155 S156 L157 Y163 N166L148-L152 HydrophobicContact CD1-CG 4.47Å; L148-L152 HydrophobicContact CG-CD1 4.31Å; L148-L152 VanDerWaalsContact O-CG 3.31Å; L148-L152 WeakPolarHBondContact O-CG 3.33Å; L148-L152 PolarHBondContact O-N 2.92Å; R149-L152 PolarHBondContact O-N 3.4Å; L152-A155 PolarHBondContact O-N 2.91Å; L152-S156 PolarHBondContact O-N 3.47Å; L152-L157 HydrophobicContact CD2-CB 4.44Å; L152-L157 HydrophobicContact CD2-CD1 4.39Å; L152-L157 PolarHBondContact O-N 3.3Å; L152-Y163 HydrophobicContact CB-CD2 4.09Å; L152-N166 HydrophobicContact CD1-CB 4.34Å
153R84.9Confident85.2Confident109 Ų10954.1 Ų54.141%0.41131%0.309SS..Hα-helixtrans-67.2-40.9175-71.5179.767.9165.42.3112.9R149 Q150 I151 A155 S156 A158 Y163 S225R149-R153 WeakPolarHBondContact O-CG 3.42Å; R149-R153 PolarHBondContact O-N 2.83Å; Q150-R153 PolarHBondContact O-N 2.82Å; I151-R153 VanDerWaalsContact C-N 3.28Å; I151-R153 PolarHBondContact O-N 3.22Å; R153-A155 VanDerWaalsContact C-N 3.28Å; R153-S156 PolarHBondContact O-N 3.42Å; R153-A158 HydrophobicContact CG-CB 4.4Å; R153-Y163 WeakPolarHBondContact CD-OH 3.05Å; R153-Y163 HydrophobicContact CG-CD2 4.27Å; R153-Y163 HydrophobicContact CG-CE2 3.4Å; R153-Y163 VanDerWaalsContact CG-CE2 3.4Å; R153-S225 PolarHBondContact NH1-OG 3.3Å; R153-S225 PolarHBondContact NH2-OG 3.37Å
154M84Confident84.9Confident32 Ų3262.1 Ų62.116%0.15834%0.339CS..Hα-helixtrans-69.3-29.1178.7-71.5179.662.900112S32 A33 N36 K39 W40 Q150 I151 S156S32-M154 CarbonylContact C-O 3.47Å; S32-M154 WeakPolarHBondContact CB-O 3.5Å; S32-M154 PolarHBondContact OG-O 2.93Å; A33-M154 HydrophobicContact CB-CB 4.3Å; A33-M154 HydrophobicContact CB-CE 4.48Å; N36-M154 HydrophobicContact CB-CE 4.42Å; K39-M154 HydrophobicContact CB-CE 4.15Å; K39-M154 HydrophobicContact CD-SD 4.44Å; K39-M154 HydrophobicContact CG-CE 4.21Å; K39-M154 HydrophobicContact CG-SD 4.21Å; W40-M154 HydrophobicContact CB-CE 3.85Å; W40-M154 HydrophobicContact CE3-CB 4.07Å; W40-M154 HydrophobicContact CE3-CE 4.33Å; W40-M154 HydrophobicContact CZ3-CB 4.23Å; Q150-M154 HydrophobicContact CG-SD 4.16Å; Q150-M154 WeakPolarHBondContact O-CB 3.38Å; Q150-M154 VanDerWaalsContact O-CG 3.27Å; Q150-M154 WeakPolarHBondContact O-CG 3.32Å; Q150-M154 PolarHBondContact O-N 3.03Å; I151-M154 PolarHBondContact O-N 3.38Å; I151-M154 VanDerWaalsContact O-N 3.1Å; M154-S156 PolarHBondContact O-N 3.42Å
155A84Confident84.6Confident19 Ų1966 Ų6616%0.15736%0.358CS..THydrogen-bonded Turntrans-79.66.417300000114P30 S32 W40 I151 L152 R153 L157P30-A155 HydrophobicContact CB-CB 4.38Å; P30-A155 HydrophobicContact CG-CB 4.06Å; S32-A155 WeakPolarHBondContact OG-CA 3.06Å; W40-A155 HydrophobicContact CZ3-CB 4.44Å; I151-A155 WeakPolarHBondContact O-CB 3.32Å; I151-A155 PolarHBondContact O-N 2.87Å; L152-A155 PolarHBondContact O-N 2.91Å; R153-A155 VanDerWaalsContact C-N 3.28Å; A155-L157 HydrophobicContact CB-CD1 4.21Å; A155-L157 HydrophobicContact CB-CG 4.19Å; A155-L157 PolarHBondContact O-N 3.07Å; A155-L157 VanDerWaalsContact O-N 3.16Å
156S81.5Confident84.5Confident89 Ų8964 Ų6462%0.62235%0.349SS*.THydrogen-bonded Turntrans5920.3-175.6-61.80000115S32 L152 R153 M154 A158S32-S156 VanDerWaalsContact CB-OG 3.26Å; S32-S156 WeakPolarHBondContact CB-OG 3.45Å; L152-S156 PolarHBondContact O-N 3.47Å; R153-S156 PolarHBondContact O-N 3.42Å; M154-S156 PolarHBondContact O-N 3.42Å; S156-A158 VanDerWaalsContact C-N 3.28Å; S156-A158 PolarHBondContact O-N 3.37Å
157L79.1Confident84.3Confident105 Ų10562.6 Ų62.655%0.5534%0.343SS..  trans-92.823.2179.2-63176.9000112.8L152 A155 A159 G160L152-L157 HydrophobicContact CD2-CB 4.44Å; L152-L157 HydrophobicContact CD2-CD1 4.39Å; L152-L157 PolarHBondContact O-N 3.3Å; A155-L157 HydrophobicContact CB-CD1 4.21Å; A155-L157 HydrophobicContact CB-CG 4.19Å; A155-L157 PolarHBondContact O-N 3.07Å; A155-L157 VanDerWaalsContact O-N 3.16Å; L157-A159 PolarHBondContact O-N 2.85Å; L157-G160 PolarHBondContact O-N 2.99Å
158A73.9Confident84.1Confident45 Ų4567.7 Ų67.737%0.37237%0.368SS..THydrogen-bonded Turntrans-70.7-11.4-175.300000114.4R153 S156 Y163R153-A158 HydrophobicContact CG-CB 4.4Å; S156-A158 VanDerWaalsContact C-N 3.28Å; S156-A158 PolarHBondContact O-N 3.37Å; A158-Y163 HydrophobicContact CB-CD1 4.47Å; A158-Y163 HydrophobicContact CB-CD2 4.46Å; A158-Y163 HydrophobicContact CB-CG 4.44Å; A158-Y163 WeakPolarHBondContact O-CD1 3.44Å
159A72.5Confident84.1Confident98 Ų9867.5 Ų67.581%0.8137%0.369SS*.THydrogen-bonded Turntrans-93.3-10178.900000113.9L157L157-A159 PolarHBondContact O-N 2.85Å
160G78.5Confident84.2Confident34 Ų3466.5 Ų66.535%0.35137%0.366SS..SBendtrans-79.8157-176.800000113.7L157 L162 Y163 R164L157-G160 PolarHBondContact O-N 2.99Å; G160-L162 PolarHBondContact O-N 3.21Å; G160-Y163 WeakPolarHBondContact O-CB 3.28Å; G160-Y163 PolarHBondContact O-N 3.19Å; G160-R164 PolarHBondContact O-N 3.2Å
161D83Confident84.3Confident120 Ų12066.2 Ų66.264%0.64237%0.365SS*.Hα-helixtrans-59.3-34176.8-65.3-35.2000112.4Y163 R164 I165D161-Y163 VanDerWaalsContact C-N 3.26Å; D161-Y163 PolarHBondContact O-N 2.72Å; D161-R164 PolarHBondContact O-N 3.36Å; D161-R164 VanDerWaalsContact O-N 3.13Å; D161-I165 WeakPolarHBondContact O-CG1 3.38Å; D161-I165 PolarHBondContact O-N 2.68Å
162L83.8Confident84.3Confident135 Ų13567 Ų6771%0.70738%0.379SS*.Hα-helixtrans-57.6-38.3173.9-66177.3000112.4G160 N166G160-L162 PolarHBondContact O-N 3.21Å; L162-N166 VanDerWaalsContact O-CB 3.24Å; L162-N166 WeakPolarHBondContact O-CB 3.33Å; L162-N166 PolarHBondContact O-N 2.82Å
163Y85.9Confident84.6Confident20 Ų2066.6 Ų66.68%0.07838%0.378CS..Hα-helixtrans-68.3-42.7176.4177.6-96.9000111.5R149 L152 R153 A158 G160 D161 N166 S167 D226R149-Y163 HydrophobicContact CG-CD2 4.39Å; R149-Y163 HydrophobicContact CG-CE2 3.56Å; R149-Y163 PolarHBondContact NE-OH 3.44Å; R149-Y163 PolarHBondContact NH2-OH 3.01Å; L152-Y163 HydrophobicContact CB-CD2 4.09Å; R153-Y163 WeakPolarHBondContact CD-OH 3.05Å; R153-Y163 HydrophobicContact CG-CD2 4.27Å; R153-Y163 HydrophobicContact CG-CE2 3.4Å; R153-Y163 VanDerWaalsContact CG-CE2 3.4Å; A158-Y163 HydrophobicContact CB-CD1 4.47Å; A158-Y163 HydrophobicContact CB-CD2 4.46Å; A158-Y163 HydrophobicContact CB-CG 4.44Å; A158-Y163 WeakPolarHBondContact O-CD1 3.44Å; G160-Y163 WeakPolarHBondContact O-CB 3.28Å; G160-Y163 PolarHBondContact O-N 3.19Å; D161-Y163 VanDerWaalsContact C-N 3.26Å; D161-Y163 PolarHBondContact O-N 2.72Å; Y163-N166 PolarHBondContact O-N 3.44Å; Y163-S167 WeakPolarHBondContact O-CB 3.42Å; Y163-S167 PolarHBondContact O-N 3.27Å; Y163-D226 PolarHBondContact OH-OD1 3.19Å
164R84Confident84.8Confident173 Ų17361.5 Ų61.565%0.65336%0.359SS*.Hα-helixtrans-64.3-47.5178.9-67.6179.173.4156.91.7111.4G160 D161 S167 M168G160-R164 PolarHBondContact O-N 3.2Å; D161-R164 PolarHBondContact O-N 3.36Å; D161-R164 VanDerWaalsContact O-N 3.13Å; R164-S167 PolarHBondContact O-N 3.47Å; R164-M168 WeakPolarHBondContact O-CG 3.44Å; R164-M168 PolarHBondContact O-N 2.95Å
165I87.9Confident85.1Confident104 Ų10463 Ų6353%0.53337%0.369SS..Hα-helixtrans-59.4-49.7176.5-65.7167000109.8D161 S167 M168 V169D161-I165 WeakPolarHBondContact O-CG1 3.38Å; D161-I165 PolarHBondContact O-N 2.68Å; I165-S167 VanDerWaalsContact C-N 3.32Å; I165-S167 PolarHBondContact O-N 2.82Å; I165-M168 PolarHBondContact O-N 3.3Å; I165-V169 HydrophobicContact CG2-CG2 4.37Å; I165-V169 WeakPolarHBondContact O-CG2 3.21Å; I165-V169 PolarHBondContact O-N 3.28Å
166N89.2Confident85.5Confident12 Ų1265.7 Ų65.76%0.06438%0.384CS..Hα-helixtrans-62.1-37.9178.7-177.373.7000112.4F145 L148 R149 L152 L162 Y163 N170F145-N166 PolarHBondContact O-ND2 3.44Å; F145-N166 VanDerWaalsContact O-ND2 3.1Å; L148-N166 WeakPolarHBondContact CD2-OD1 3.38Å; R149-N166 WeakPolarHBondContact CA-ND2 3.4Å; R149-N166 VanDerWaalsContact CB-ND2 3.32Å; R149-N166 WeakPolarHBondContact CB-ND2 3.37Å; R149-N166 PolarHBondContact N-ND2 3Å; L152-N166 HydrophobicContact CD1-CB 4.34Å; L162-N166 VanDerWaalsContact O-CB 3.24Å; L162-N166 WeakPolarHBondContact O-CB 3.33Å; L162-N166 PolarHBondContact O-N 2.82Å; Y163-N166 PolarHBondContact O-N 3.44Å; N166-N170 WeakPolarHBondContact O-CB 3.26Å; N166-N170 PolarHBondContact O-N 3.1Å
167S85.9Confident85.9Confident6 Ų664.3 Ų64.34%0.04237%0.367CS..Hα-helixtrans-64-42.4175.4176.60000111.9Y163 R164 I165 N170 L171 D226Y163-S167 WeakPolarHBondContact O-CB 3.42Å; Y163-S167 PolarHBondContact O-N 3.27Å; R164-S167 PolarHBondContact O-N 3.47Å; I165-S167 VanDerWaalsContact C-N 3.32Å; I165-S167 PolarHBondContact O-N 2.82Å; S167-N170 PolarHBondContact O-N 2.99Å; S167-L171 PolarHBondContact O-N 3.12Å; S167-D226 PolarHBondContact OG-OD2 3.47Å
168M87Confident86.5Confident137 Ų13760.2 Ų60.268%0.67534%0.344SS*.Hα-helixtrans-64.9-45.8175.9-70.1-172.17300112.3R164 I165 N170 L171 G172R164-M168 WeakPolarHBondContact O-CG 3.44Å; R164-M168 PolarHBondContact O-N 2.95Å; I165-M168 PolarHBondContact O-N 3.3Å; M168-N170 VanDerWaalsContact C-N 3.34Å; M168-L171 PolarHBondContact O-N 3.44Å; M168-G172 PolarHBondContact O-N 3Å
169V90.7Very high87.2Confident61 Ų6161 Ų6137%0.3734%0.341SS..Hα-helixtrans-63.9-41.9176.2175.70000110.7F145 I165 L171 G172 T173F145-V169 HydrophobicContact CD1-CB 4.4Å; F145-V169 HydrophobicContact CD1-CG1 3.67Å; F145-V169 HydrophobicContact CD2-CG1 4.44Å; F145-V169 HydrophobicContact CE1-CG1 3.45Å; F145-V169 VanDerWaalsContact CE1-CG1 3.45Å; F145-V169 HydrophobicContact CE2-CG1 4.27Å; F145-V169 HydrophobicContact CG-CG1 4.17Å; F145-V169 HydrophobicContact CZ-CG1 3.78Å; I165-V169 HydrophobicContact CG2-CG2 4.37Å; I165-V169 WeakPolarHBondContact O-CG2 3.21Å; I165-V169 PolarHBondContact O-N 3.28Å; V169-L171 VanDerWaalsContact C-N 3.3Å; V169-L171 PolarHBondContact O-N 3.37Å; V169-G172 PolarHBondContact O-N 3.28Å; V169-T173 HydrophobicContact CG1-CG2 4.14Å; V169-T173 WeakPolarHBondContact O-CB 3.34Å; V169-T173 VanDerWaalsContact O-CG2 3.31Å; V169-T173 WeakPolarHBondContact O-CG2 3.1Å; V169-T173 PolarHBondContact O-N 3.08Å; V169-T173 PolarHBondContact O-OG1 2.71Å
170N91Very high88.1Confident0 Ų060.7 Ų60.70%033%0.326CS..Hα-helixtrans-58.1-43.5174.1176.581.7000111.1N142 F145 L146 N166 S167 M168 T173 Y174 L222N142-N170 PolarHBondContact ND2-O 2.76Å; N142-N170 PolarHBondContact ND2-OD1 3.47Å; F145-N170 HydrophobicContact CB-CB 3.78Å; L146-N170 WeakPolarHBondContact CA-OD1 3.11Å; L146-N170 PolarHBondContact N-OD1 3.36Å; L146-N170 VanDerWaalsContact N-OD1 3.17Å; N166-N170 WeakPolarHBondContact O-CB 3.26Å; N166-N170 PolarHBondContact O-N 3.1Å; S167-N170 PolarHBondContact O-N 2.99Å; M168-N170 VanDerWaalsContact C-N 3.34Å; N170-T173 WeakPolarHBondContact CA-OG1 3.29Å; N170-T173 PolarHBondContact O-OG1 3.05Å; N170-T173 VanDerWaalsContact O-OG1 3.05Å; N170-Y174 WeakPolarHBondContact O-CB 3.32Å; N170-Y174 PolarHBondContact O-N 3.5Å; N170-L222 WeakPolarHBondContact ND2-CD1 3.36Å
171L88.7Confident88.7Confident40 Ų4059.9 Ų59.921%0.20932%0.315CS..Hα-helixtrans-64.3-46.3178.5-173.969.8000111.9S167 M168 V169 Y174 V175 F219 L222 L223 F227S167-L171 PolarHBondContact O-N 3.12Å; M168-L171 PolarHBondContact O-N 3.44Å; V169-L171 VanDerWaalsContact C-N 3.3Å; V169-L171 PolarHBondContact O-N 3.37Å; L171-Y174 WeakPolarHBondContact O-CB 3.28Å; L171-Y174 PolarHBondContact O-N 3.05Å; L171-V175 PolarHBondContact O-N 2.86Å; L171-F219 HydrophobicContact CD1-CD2 4.33Å; L171-F219 HydrophobicContact CD1-CE2 3.48Å; L171-F219 VanDerWaalsContact CD1-CE2 3.48Å; L171-F219 HydrophobicContact CD1-CZ 4.12Å; L171-L222 HydrophobicContact CD1-CD2 4.33Å; L171-L223 HydrophobicContact CD1-CD2 3.86Å; L171-F227 HydrophobicContact CD2-CE2 3.94Å; L171-F227 HydrophobicContact CD2-CZ 3.98Å
172G89Confident89.1Confident40 Ų4054.7 Ų54.741%0.41229%0.286SS..Hα-helixtrans-61.7-48.517800000112M168 V169 Y174 V175 V176M168-G172 PolarHBondContact O-N 3Å; V169-G172 PolarHBondContact O-N 3.28Å; G172-Y174 PolarHBondContact O-N 2.74Å; G172-V175 PolarHBondContact O-N 2.97Å; G172-V176 WeakPolarHBondContact O-CG2 3.39Å; G172-V176 PolarHBondContact O-N 3.44Å; G172-V176 VanDerWaalsContact O-N 3.16Å
173T91.6Very high89.4Confident20 Ų2051 Ų5112%0.12328%0.276CS..Hα-helixtrans-65.5-2817756.10000112.5N142 F145 V169 N170 F177N142-T173 PolarHBondContact ND2-OG1 2.91Å; F145-T173 HydrophobicContact CD2-CG2 3.95Å; F145-T173 HydrophobicContact CE2-CG2 3.74Å; F145-T173 HydrophobicContact CZ-CG2 4.47Å; V169-T173 HydrophobicContact CG1-CG2 4.14Å; V169-T173 WeakPolarHBondContact O-CB 3.34Å; V169-T173 VanDerWaalsContact O-CG2 3.31Å; V169-T173 WeakPolarHBondContact O-CG2 3.1Å; V169-T173 PolarHBondContact O-N 3.08Å; V169-T173 PolarHBondContact O-OG1 2.71Å; N170-T173 WeakPolarHBondContact CA-OG1 3.29Å; N170-T173 PolarHBondContact O-OG1 3.05Å; N170-T173 VanDerWaalsContact O-OG1 3.05Å; T173-F177 HydrophobicContact CG2-CD2 4.27Å; T173-F177 HydrophobicContact CG2-CE2 4.37Å; T173-F177 WeakPolarHBondContact O-CB 3.44Å; T173-F177 PolarHBondContact O-N 3Å
174Y90.5Very high89.7Confident1 Ų155.1 Ų55.10%0.00429%0.291CS..Iπ-helixtrans-63.6-47175.8-164.6-80000111.3N142 N170 L171 G172 R178 I179 N215 F219N142-Y174 VanDerWaalsContact ND2-CA 3.33Å; N142-Y174 WeakPolarHBondContact ND2-CA 3.49Å; N142-Y174 PolarHBondContact ND2-N 3.38Å; N142-Y174 VanDerWaalsContact ND2-N 3.12Å; N142-Y174 VanDerWaalsContact OD1-CD2 3.27Å; N142-Y174 WeakPolarHBondContact OD1-CD2 3.24Å; N170-Y174 WeakPolarHBondContact O-CB 3.32Å; N170-Y174 PolarHBondContact O-N 3.5Å; L171-Y174 WeakPolarHBondContact O-CB 3.28Å; L171-Y174 PolarHBondContact O-N 3.05Å; G172-Y174 PolarHBondContact O-N 2.74Å; Y174-R178 HydrophobicContact CD1-CB 4.46Å; Y174-R178 HydrophobicContact CE1-CB 4.38Å; Y174-R178 VanDerWaalsContact CE2-CD 3.47Å; Y174-R178 WeakPolarHBondContact O-CA 3.47Å; Y174-R178 VanDerWaalsContact O-CB 3.23Å; Y174-R178 WeakPolarHBondContact O-CB 3.48Å; Y174-R178 PolarHBondContact O-N 3.47Å; Y174-I179 HydrophobicContact CD1-CD1 4.45Å; Y174-I179 HydrophobicContact CD1-CG1 4.16Å; Y174-I179 HydrophobicContact CE1-CD1 3.93Å; Y174-I179 HydrophobicContact CE1-CG1 4.14Å; Y174-I179 PolarHBondContact O-N 3.26Å; Y174-N215 WeakPolarHBondContact OH-CA 3.5Å; Y174-N215 WeakPolarHBondContact OH-CB 3.27Å; Y174-N215 PolarHBondContact OH-O 2.87Å; Y174-N215 PolarHBondContact OH-OD1 3.17Å; Y174-F219 HydrophobicContact CD1-CB 4.38Å; Y174-F219 AromaticContact CD1-CD2 3.39Å; Y174-F219 HydrophobicContact CD1-CD2 3.39Å; Y174-F219 AromaticContact CD1-CE2 3.98Å; Y174-F219 HydrophobicContact CD1-CE2 3.98Å; Y174-F219 HydrophobicContact CD1-CG 4.21Å; Y174-F219 HydrophobicContact CE1-CB 3.62Å; Y174-F219 AromaticContact CE1-CD2 3.53Å; Y174-F219 HydrophobicContact CE1-CD2 3.53Å; Y174-F219 HydrophobicContact CE1-CE2 4.49Å; Y174-F219 AromaticContact CE1-CG 3.9Å; Y174-F219 HydrophobicContact CE1-CG 3.9Å; Y174-F219 HydrophobicContact CG-CD2 4.08Å
175V89.8Confident90.1Very high63 Ų6347 Ų4738%0.38226%0.261SS..Iπ-helixtrans-64.7-46.6178.4177.70000110.5L171 G172 I179 N180L171-V175 PolarHBondContact O-N 2.86Å; G172-V175 PolarHBondContact O-N 2.97Å; V175-I179 WeakPolarHBondContact O-CB 3.21Å; V175-I179 PolarHBondContact O-N 3.36Å; V175-N180 PolarHBondContact O-N 3.3Å
176V91.1Very high90.2Very high77 Ų7744.8 Ų44.847%0.46725%0.252SS..Iπ-helixtrans-70-55-176.4176.50000112.1G172 N180G172-V176 WeakPolarHBondContact O-CG2 3.39Å; G172-V176 PolarHBondContact O-N 3.44Å; G172-V176 VanDerWaalsContact O-N 3.16Å; V176-N180 WeakPolarHBondContact O-CB 3.48Å
177F91.1Very high90.3Very high59 Ų5951.8 Ų51.826%0.25928%0.278SS..Iπ-helixtrans-91.3-20.6-170.1-69.5-73.6000114.1V139 I141 N142 T173 T181V139-F177 WeakPolarHBondContact CG1-O 3.42Å; I141-F177 HydrophobicContact CB-CD1 4.36Å; I141-F177 HydrophobicContact CB-CD2 4.3Å; I141-F177 HydrophobicContact CB-CG 4.21Å; I141-F177 HydrophobicContact CD1-CD1 3.83Å; I141-F177 HydrophobicContact CD1-CE1 3.55Å; I141-F177 HydrophobicContact CD1-CZ 4.01Å; I141-F177 HydrophobicContact CG2-CD2 3.93Å; I141-F177 HydrophobicContact CG2-CE2 3.81Å; I141-F177 HydrophobicContact CG2-CG 4.33Å; I141-F177 HydrophobicContact CG2-CZ 4.12Å; N142-F177 HydrophobicContact CB-CB 4.37Å; T173-F177 HydrophobicContact CG2-CD2 4.27Å; T173-F177 HydrophobicContact CG2-CE2 4.37Å; T173-F177 WeakPolarHBondContact O-CB 3.44Å; T173-F177 PolarHBondContact O-N 3Å; F177-T181 VanDerWaalsContact C-OG1 3.32Å; F177-T181 WeakPolarHBondContact O-CB 3.38Å; F177-T181 PolarHBondContact O-OG1 3.4Å
178R90.7Very high90.4Very high19 Ų1953.1 Ų53.17%0.07228%0.282CS..Iπ-helixtrans-98.7-62173.7-63.8-164.2174.1-120.1-11.7112.1V139 N142 S143 Y174 L182 N215V139-R178 HydrophobicContact CB-CG 4.22Å; N142-R178 HydrophobicContact CB-CG 4.1Å; N142-R178 WeakPolarHBondContact OD1-CD 3.5Å; N142-R178 PolarHBondContact OD1-NE 2.78Å; S143-R178 PolarHBondContact OG-NH2 3.26Å; Y174-R178 HydrophobicContact CD1-CB 4.46Å; Y174-R178 HydrophobicContact CE1-CB 4.38Å; Y174-R178 VanDerWaalsContact CE2-CD 3.47Å; Y174-R178 WeakPolarHBondContact O-CA 3.47Å; Y174-R178 VanDerWaalsContact O-CB 3.23Å; Y174-R178 WeakPolarHBondContact O-CB 3.48Å; Y174-R178 PolarHBondContact O-N 3.47Å; R178-L182 VanDerWaalsContact O-CB 3.29Å; R178-L182 WeakPolarHBondContact O-CB 3.42Å; R178-L182 VanDerWaalsContact O-CG 3.26Å; R178-L182 WeakPolarHBondContact O-CG 3.47Å; R178-L182 PolarHBondContact O-N 2.99Å; R178-N215 WeakPolarHBondContact CD-OD1 3.1Å; R178-N215 PolarHBondContact NH1-OD1 3.41Å
179I89.4Confident90.5Very high62 Ų6247 Ų4732%0.31825%0.252SS..Iπ-helixtrans-65.9-52-171.3-57-58.4000110.9Y174 V175 T181 L182 A183Y174-I179 HydrophobicContact CD1-CD1 4.45Å; Y174-I179 HydrophobicContact CD1-CG1 4.16Å; Y174-I179 HydrophobicContact CE1-CD1 3.93Å; Y174-I179 HydrophobicContact CE1-CG1 4.14Å; Y174-I179 PolarHBondContact O-N 3.26Å; V175-I179 WeakPolarHBondContact O-CB 3.21Å; V175-I179 PolarHBondContact O-N 3.36Å; I179-T181 PolarHBondContact O-N 3.22Å; I179-L182 PolarHBondContact O-N 3.16Å; I179-A183 VanDerWaalsContact O-CB 3.26Å; I179-A183 WeakPolarHBondContact O-CB 3.46Å; I179-A183 PolarHBondContact O-N 3.49Å
180N90.9Very high90.3Very high92 Ų9248.3 Ų48.349%0.49226%0.259SS..Iπ-helixtrans-66.5-40.9-179-63.9-20.8000112.1V175 V176 A183 W184V175-N180 PolarHBondContact O-N 3.3Å; V176-N180 WeakPolarHBondContact O-CB 3.48Å; N180-A183 PolarHBondContact O-N 2.82Å; N180-W184 WeakPolarHBondContact O-CB 3.46Å; N180-W184 PolarHBondContact O-N 3.09Å
181T91.6Very high90.1Very high17 Ų1753.4 Ų53.410%0.10429%0.286CS..Hα-helixtrans-60.9-47.8177-52.40000111.6V135 V139 F177 I179 W184 M185V135-T181 HydrophobicContact CG1-CG2 3.71Å; V139-T181 HydrophobicContact CG1-CG2 4.4Å; F177-T181 VanDerWaalsContact C-OG1 3.32Å; F177-T181 WeakPolarHBondContact O-CB 3.38Å; F177-T181 PolarHBondContact O-OG1 3.4Å; I179-T181 PolarHBondContact O-N 3.22Å; T181-W184 PolarHBondContact O-N 3.1Å; T181-M185 HydrophobicContact CG2-CG 4.45Å; T181-M185 HydrophobicContact CG2-SD 4.13Å; T181-M185 WeakPolarHBondContact O-CB 3.41Å; T181-M185 VanDerWaalsContact O-CG 3.24Å; T181-M185 WeakPolarHBondContact O-CG 3.28Å; T181-M185 PolarHBondContact O-N 3.3Å
182L90.9Very high89.9Confident10 Ų1053.1 Ų53.15%0.05229%0.285CS..Hα-helixtrans-67.5-38.9179.2-72.2169.8000112.5R178 I179 W184 M185 T186 L208 M211 N215R178-L182 VanDerWaalsContact O-CB 3.29Å; R178-L182 WeakPolarHBondContact O-CB 3.42Å; R178-L182 VanDerWaalsContact O-CG 3.26Å; R178-L182 WeakPolarHBondContact O-CG 3.47Å; R178-L182 PolarHBondContact O-N 2.99Å; I179-L182 PolarHBondContact O-N 3.16Å; L182-W184 VanDerWaalsContact C-N 3.34Å; L182-M185 PolarHBondContact O-N 2.8Å; L182-T186 WeakPolarHBondContact O-CB 3.49Å; L182-T186 PolarHBondContact O-N 3.29Å; L182-T186 PolarHBondContact O-OG1 3.37Å; L182-L208 HydrophobicContact CD2-CD2 3.65Å; L182-M211 HydrophobicContact CD2-CB 4.28Å; L182-N215 HydrophobicContact CD1-CB 4.47Å; L182-N215 WeakPolarHBondContact CD1-ND2 3.46Å
183A90.4Very high89.5Confident58 Ų5858.2 Ų58.248%0.47929%0.291SS..Hα-helixtrans-62.3-44.5174.200000111.1I179 N180 T186 R187I179-A183 VanDerWaalsContact O-CB 3.26Å; I179-A183 WeakPolarHBondContact O-CB 3.46Å; I179-A183 PolarHBondContact O-N 3.49Å; N180-A183 PolarHBondContact O-N 2.82Å; A183-T186 PolarHBondContact O-N 3.46Å; A183-R187 WeakPolarHBondContact O-CB 3.14Å; A183-R187 PolarHBondContact O-N 2.83Å
184W92.7Very high89.1Confident106 Ų10664.5 Ų64.540%0.40233%0.325SS..Hα-helixtrans-63.7-46176.8-178.592.6000111.9L71 V135 N180 T181 L182 T186 R187 W188L71-W184 HydrophobicContact CD1-CH2 3.38Å; L71-W184 HydrophobicContact CD1-CZ2 4.45Å; L71-W184 HydrophobicContact CD1-CZ3 3.83Å; V135-W184 HydrophobicContact CB-CZ3 4.38Å; V135-W184 HydrophobicContact CG1-CE3 4.02Å; V135-W184 HydrophobicContact CG1-CZ3 3.78Å; V135-W184 HydrophobicContact CG2-CH2 4.41Å; V135-W184 HydrophobicContact CG2-CZ3 4.01Å; N180-W184 WeakPolarHBondContact O-CB 3.46Å; N180-W184 PolarHBondContact O-N 3.09Å; T181-W184 PolarHBondContact O-N 3.1Å; L182-W184 VanDerWaalsContact C-N 3.34Å; W184-T186 VanDerWaalsContact C-N 3.31Å; W184-T186 PolarHBondContact O-N 2.96Å; W184-R187 PolarHBondContact O-N 2.92Å; W184-W188 HydrophobicContact CH2-CG 4.47Å; W184-W188 HydrophobicContact CZ3-CB 4.48Å; W184-W188 WeakPolarHBondContact O-CB 3.18Å; W184-W188 PolarHBondContact O-N 2.91Å
185M91.3Very high88.6Confident4 Ų469.7 Ų69.72%0.0235%0.352CS..Hα-helixtrans-61-41.1177.2-74.5177.974.600111.7F132 V135 A136 T181 L182 W188 L189 L208F132-M185 HydrophobicContact CD1-CE 3.74Å; F132-M185 HydrophobicContact CD2-CE 4.22Å; F132-M185 HydrophobicContact CE1-CE 3.32Å; F132-M185 HydrophobicContact CE2-CB 3.96Å; F132-M185 HydrophobicContact CE2-CE 3.84Å; F132-M185 HydrophobicContact CE2-CG 4.12Å; F132-M185 HydrophobicContact CG-CE 4.19Å; F132-M185 HydrophobicContact CZ-CB 4.02Å; F132-M185 HydrophobicContact CZ-CE 3.41Å; F132-M185 VanDerWaalsContact CZ-CE 3.41Å; F132-M185 HydrophobicContact CZ-CG 4.37Å; V135-M185 HydrophobicContact CG1-CG 3.77Å; V135-M185 HydrophobicContact CG1-SD 4Å; A136-M185 HydrophobicContact CB-CE 3.58Å; A136-M185 HydrophobicContact CB-SD 4.08Å; T181-M185 HydrophobicContact CG2-CG 4.45Å; T181-M185 HydrophobicContact CG2-SD 4.13Å; T181-M185 WeakPolarHBondContact O-CB 3.41Å; T181-M185 VanDerWaalsContact O-CG 3.24Å; T181-M185 WeakPolarHBondContact O-CG 3.28Å; T181-M185 PolarHBondContact O-N 3.3Å; L182-M185 PolarHBondContact O-N 2.8Å; M185-W188 PolarHBondContact O-N 3.06Å; M185-L189 WeakPolarHBondContact O-CB 3.13Å; M185-L189 PolarHBondContact O-N 3.41Å; M185-L208 HydrophobicContact CB-CD1 4.11Å; M185-L208 HydrophobicContact CB-CD2 4.01Å; M185-L208 HydrophobicContact CE-CD2 3.99Å; M185-L208 HydrophobicContact SD-CD2 4.25Å
186T90.5Very high88.2Confident56 Ų5667.2 Ų67.234%0.34434%0.337SS..Hα-helixtrans-63.2-47.1176.5-56.40000110.6L182 A183 W184 W188 L189 V190L182-T186 WeakPolarHBondContact O-CB 3.49Å; L182-T186 PolarHBondContact O-N 3.29Å; L182-T186 PolarHBondContact O-OG1 3.37Å; A183-T186 PolarHBondContact O-N 3.46Å; W184-T186 VanDerWaalsContact C-N 3.31Å; W184-T186 PolarHBondContact O-N 2.96Å; T186-W188 VanDerWaalsContact C-N 3.35Å; T186-W188 PolarHBondContact O-N 2.99Å; T186-L189 PolarHBondContact O-N 3Å; T186-V190 WeakPolarHBondContact O-CG2 3.31Å; T186-V190 PolarHBondContact O-N 3.01Å; T186-V190 VanDerWaalsContact O-N 3.09Å
187R90.4Very high88Confident160 Ų16067 Ų6760%0.60434%0.338SS*.Hα-helixtrans-59.7-45.5175.2179.4178176.9-106.90.1111.4A183 W184 L189 V190 L191A183-R187 WeakPolarHBondContact O-CB 3.14Å; A183-R187 PolarHBondContact O-N 2.83Å; W184-R187 PolarHBondContact O-N 2.92Å; R187-L189 VanDerWaalsContact C-N 3.32Å; R187-L189 PolarHBondContact O-N 3.3Å; R187-V190 PolarHBondContact O-N 3.36Å; R187-L191 HydrophobicContact CG-CD1 3.92Å; R187-L191 HydrophobicContact CG-CG 4.39Å; R187-L191 WeakPolarHBondContact O-CG 3.42Å; R187-L191 PolarHBondContact O-N 3.07Å
188W89.8Confident87.6Confident34 Ų3470.3 Ų70.313%0.12936%0.357CS..Hα-helixtrans-60.6-42.7179.8-175.696000111.4L71 I72 F132 W184 M185 T186 L191 N192L71-W188 HydrophobicContact CB-CH2 4.29Å; L71-W188 HydrophobicContact CB-CZ2 3.8Å; L71-W188 HydrophobicContact CD1-CD2 3.89Å; L71-W188 HydrophobicContact CD1-CG 4.09Å; L71-W188 HydrophobicContact CD1-CZ2 4Å; L71-W188 HydrophobicContact CG-CZ2 4.47Å; I72-W188 HydrophobicContact CD1-CH2 3.82Å; I72-W188 HydrophobicContact CD1-CZ2 4Å; I72-W188 HydrophobicContact CG1-CH2 3.47Å; I72-W188 VanDerWaalsContact CG1-CH2 3.47Å; I72-W188 HydrophobicContact CG1-CZ2 3.73Å; F132-W188 HydrophobicContact CD2-CD2 4.34Å; F132-W188 AromaticContact CD2-CE3 3.67Å; F132-W188 HydrophobicContact CD2-CE3 3.67Å; F132-W188 AromaticContact CD2-CZ3 3.87Å; F132-W188 HydrophobicContact CD2-CZ3 3.87Å; F132-W188 HydrophobicContact CE2-CD2 4.38Å; F132-W188 AromaticContact CE2-CE3 3.57Å; F132-W188 HydrophobicContact CE2-CE3 3.57Å; F132-W188 HydrophobicContact CE2-CZ3 4.06Å; W184-W188 HydrophobicContact CH2-CG 4.47Å; W184-W188 HydrophobicContact CZ3-CB 4.48Å; W184-W188 WeakPolarHBondContact O-CB 3.18Å; W184-W188 PolarHBondContact O-N 2.91Å; M185-W188 PolarHBondContact O-N 3.06Å; T186-W188 VanDerWaalsContact C-N 3.35Å; T186-W188 PolarHBondContact O-N 2.99Å; W188-L191 PolarHBondContact O-N 3.35Å; W188-N192 VanDerWaalsContact CE2-ND2 3.27Å; W188-N192 HydrophobicContact CH2-CB 4.18Å; W188-N192 HydrophobicContact CZ2-CB 4.26Å; W188-N192 HydrophobicContact CZ3-CB 4.31Å; W188-N192 PolarHBondContact NE1-ND2 3.16Å; W188-N192 WeakPolarHBondContact O-CB 3.27Å; W188-N192 PolarHBondContact O-N 3.46Å; W188-N192 PolarHBondContact O-ND2 3.14Å
189L87.6Confident87.4Confident9 Ų976.6 Ų76.65%0.04739%0.385CS..Hα-helixtrans-64.5-41.6178.9-170.863.9000111.8M185 T186 R187 N192 R193 Y201 S205 L208M185-L189 WeakPolarHBondContact O-CB 3.13Å; M185-L189 PolarHBondContact O-N 3.41Å; T186-L189 PolarHBondContact O-N 3Å; R187-L189 VanDerWaalsContact C-N 3.32Å; R187-L189 PolarHBondContact O-N 3.3Å; L189-N192 PolarHBondContact O-N 3.33Å; L189-R193 PolarHBondContact O-N 3.45Å; L189-Y201 HydrophobicContact CD1-CD2 3.92Å; L189-Y201 HydrophobicContact CD1-CE2 4.41Å; L189-Y201 HydrophobicContact CG-CD2 3.89Å; L189-Y201 HydrophobicContact CG-CE2 3.9Å; L189-Y201 WeakPolarHBondContact O-CE2 3.44Å; L189-S205 VanDerWaalsContact CD2-OG 3.23Å; L189-S205 WeakPolarHBondContact CD2-OG 3.46Å; L189-L208 HydrophobicContact CD2-CD1 4.09Å
190V87.4Confident87.1Confident87 Ų8774.7 Ų74.753%0.52738%0.377SS..Hα-helixtrans-64.4-42.5176.5172.20000111.6T186 R187 N192 R193T186-V190 WeakPolarHBondContact O-CG2 3.31Å; T186-V190 PolarHBondContact O-N 3.01Å; T186-V190 VanDerWaalsContact O-N 3.09Å; R187-V190 PolarHBondContact O-N 3.36Å; V190-N192 VanDerWaalsContact C-N 3.33Å; V190-N192 PolarHBondContact O-N 3.01Å; V190-R193 WeakPolarHBondContact O-CB 3.47Å; V190-R193 PolarHBondContact O-N 2.82Å
191L86.7Confident86.9Confident108 Ų10872.1 Ų72.157%0.56536%0.361SS*.Hα-helixtrans-69.6-29.4179.8-69.8174.2000113.1R187 W188R187-L191 HydrophobicContact CG-CD1 3.92Å; R187-L191 HydrophobicContact CG-CG 4.39Å; R187-L191 WeakPolarHBondContact O-CG 3.42Å; R187-L191 PolarHBondContact O-N 3.07Å; W188-L191 PolarHBondContact O-N 3.35Å
192N84.9Confident86.7Confident33 Ų3374.6 Ų74.618%0.17638%0.376CS..THydrogen-bonded Turntrans-100.519.2-178.9-70.4-82.2000113W188 L189 V190 D194 N195 V196W188-N192 VanDerWaalsContact CE2-ND2 3.27Å; W188-N192 HydrophobicContact CH2-CB 4.18Å; W188-N192 HydrophobicContact CZ2-CB 4.26Å; W188-N192 HydrophobicContact CZ3-CB 4.31Å; W188-N192 PolarHBondContact NE1-ND2 3.16Å; W188-N192 WeakPolarHBondContact O-CB 3.27Å; W188-N192 PolarHBondContact O-N 3.46Å; W188-N192 PolarHBondContact O-ND2 3.14Å; L189-N192 PolarHBondContact O-N 3.33Å; V190-N192 VanDerWaalsContact C-N 3.33Å; V190-N192 PolarHBondContact O-N 3.01Å; N192-D194 PolarHBondContact O-N 2.92Å; N192-N195 PolarHBondContact O-N 2.85Å; N192-V196 HydrophobicContact CB-CG2 4.49Å; N192-V196 WeakPolarHBondContact O-CG2 3.41Å; N192-V196 PolarHBondContact O-N 2.97Å
193R80.6Confident86.5Confident147 Ų14775.5 Ų75.556%0.55539%0.386SS*.G310 helixtrans-51.4-42.3-177.1-179-179.6-174.8-176.61.2113.1L189 V190 N195 Y201L189-R193 PolarHBondContact O-N 3.45Å; V190-R193 WeakPolarHBondContact O-CB 3.47Å; V190-R193 PolarHBondContact O-N 2.82Å; R193-N195 VanDerWaalsContact C-N 3.29Å; R193-N195 PolarHBondContact O-N 3.47Å; R193-Y201 HydrophobicContact CB-CD2 4.36Å; R193-Y201 HydrophobicContact CB-CE2 3.88Å; R193-Y201 HydrophobicContact CG-CD2 4.18Å; R193-Y201 HydrophobicContact CG-CE2 3.8Å
194D82Confident86.3Confident153 Ų15373.4 Ų73.482%0.81837%0.369SS*.G310 helixtrans-76.1-19.4-176-58.2-36000112.8N192N192-D194 PolarHBondContact O-N 2.92Å
195N79.8Confident86.1Confident110 Ų11070 Ų7059%0.58836%0.362SS*.G310 helixtrans-91.5-10.5-180-64.6-35.1000113I72 N192 R193I72-N195 HydrophobicContact CD1-CB 4.12Å; N192-N195 PolarHBondContact O-N 2.85Å; R193-N195 VanDerWaalsContact C-N 3.29Å; R193-N195 PolarHBondContact O-N 3.47Å
196V82.1Confident86Confident11 Ų1173.7 Ų73.77%0.06738%0.384CS..SBendtrans-112.3127.4-175.4-178.50000109.5Y129 N192 L198Y129-V196 HydrophobicContact CE1-CG1 4.22Å; Y129-V196 HydrophobicContact CE1-CG2 3.94Å; N192-V196 HydrophobicContact CB-CG2 4.49Å; N192-V196 WeakPolarHBondContact O-CG2 3.41Å; N192-V196 PolarHBondContact O-N 2.97Å; V196-L198 PolarHBondContact O-N 3.01Å
197P86.6Confident85.9Confident73 Ų7371.3 Ų71.347%0.47437%0.37SS..  trans-54.8141.4174.6-24.334.2000111.6Y129 F199 S200 Y201Y129-P197 WeakPolarHBondContact OH-CD 3.36Å; P197-F199 PolarHBondContact O-N 3.42Å; P197-S200 PolarHBondContact O-N 2.91Å; P197-Y201 PolarHBondContact O-N 3.43Å
198L84.3Confident85.8Confident128 Ų12864.3 Ų64.367%0.6735%0.345SS*.Hα-helixtrans-51.3-37.1-174.2-17763.5000113.2V196 T202V196-L198 PolarHBondContact O-N 3.01Å; L198-T202 VanDerWaalsContact O-CB 3.31Å; L198-T202 WeakPolarHBondContact O-CB 3.37Å; L198-T202 PolarHBondContact O-N 3.1Å; L198-T202 PolarHBondContact O-OG1 3.38Å
199F85.3Confident85.8Confident150 Ų15065.6 Ų65.666%0.65836%0.363SS*.Hα-helixtrans-62.1-54.4177.1-179.9-101.1000112.4I122 P197 Y201 T202 A203I122-F199 HydrophobicContact CD1-CE1 3.86Å; I122-F199 HydrophobicContact CD1-CZ 4.4Å; I122-F199 HydrophobicContact CG1-CE1 4.42Å; P197-F199 PolarHBondContact O-N 3.42Å; F199-Y201 VanDerWaalsContact C-N 3.33Å; F199-Y201 PolarHBondContact O-N 2.97Å; F199-T202 PolarHBondContact O-N 3.08Å; F199-A203 WeakPolarHBondContact O-CB 3.36Å; F199-A203 PolarHBondContact O-N 3.43Å
200S83.7Confident85.8Confident22 Ų2266.9 Ų66.915%0.15437%0.37CS..Hα-helixtrans-65-37.2178.5-60.90000112P197 G204P197-S200 PolarHBondContact O-N 2.91Å; S200-G204 PolarHBondContact O-N 2.84Å
201Y86.7Confident85.8Confident38 Ų3863.9 Ų63.915%0.14935%0.35CS..Hα-helixtrans-62.5-45.9175.3177-91.5000111.8L189 R193 P197 F199 G204 S205L189-Y201 HydrophobicContact CD1-CD2 3.92Å; L189-Y201 HydrophobicContact CD1-CE2 4.41Å; L189-Y201 HydrophobicContact CG-CD2 3.89Å; L189-Y201 HydrophobicContact CG-CE2 3.9Å; L189-Y201 WeakPolarHBondContact O-CE2 3.44Å; R193-Y201 HydrophobicContact CB-CD2 4.36Å; R193-Y201 HydrophobicContact CB-CE2 3.88Å; R193-Y201 HydrophobicContact CG-CD2 4.18Å; R193-Y201 HydrophobicContact CG-CE2 3.8Å; P197-Y201 PolarHBondContact O-N 3.43Å; F199-Y201 VanDerWaalsContact C-N 3.33Å; F199-Y201 PolarHBondContact O-N 2.97Å; Y201-G204 PolarHBondContact O-N 3.16Å; Y201-S205 VanDerWaalsContact O-CB 3.26Å; Y201-S205 WeakPolarHBondContact O-CB 3.47Å; Y201-S205 PolarHBondContact O-N 2.92Å; Y201-S205 PolarHBondContact O-OG 2.9Å
202T86.8Confident85.9Confident69 Ų6961 Ų6142%0.42334%0.337SS..Hα-helixtrans-66.2-47.1179.8-56.50000110.6L198 F199 G204 S205 V206L198-T202 VanDerWaalsContact O-CB 3.31Å; L198-T202 WeakPolarHBondContact O-CB 3.37Å; L198-T202 PolarHBondContact O-N 3.1Å; L198-T202 PolarHBondContact O-OG1 3.38Å; F199-T202 PolarHBondContact O-N 3.08Å; T202-G204 PolarHBondContact O-N 2.81Å; T202-S205 PolarHBondContact O-N 3.06Å; T202-V206 HydrophobicContact CG2-CG2 4.31Å; T202-V206 WeakPolarHBondContact O-CB 3.44Å; T202-V206 VanDerWaalsContact O-CG2 3.31Å; T202-V206 WeakPolarHBondContact O-CG2 3.48Å; T202-V206 PolarHBondContact O-N 3.24Å
203A86.4Confident86Confident30 Ų3062 Ų6225%0.24835%0.35CS..Hα-helixtrans-59.2-45.9176.900000111.9I122 F199 G207I122-A203 HydrophobicContact CD1-CB 4.16Å; F199-A203 WeakPolarHBondContact O-CB 3.36Å; F199-A203 PolarHBondContact O-N 3.43Å; A203-G207 PolarHBondContact O-N 3.32Å
204G86.7Confident86.2Confident13 Ų1356.5 Ų56.513%0.13433%0.331CS..Hα-helixtrans-65.3-42177.200000113.3S200 Y201 T202 G207 L208S200-G204 PolarHBondContact O-N 2.84Å; Y201-G204 PolarHBondContact O-N 3.16Å; T202-G204 PolarHBondContact O-N 2.81Å; G204-G207 PolarHBondContact O-N 3.48Å; G204-L208 WeakPolarHBondContact O-CB 3.26Å; G204-L208 WeakPolarHBondContact O-CG 3.42Å; G204-L208 PolarHBondContact O-N 3.37Å
205S88.2Confident86.4Confident35 Ų3549.4 Ų49.425%0.24529%0.293CS..Hα-helixtrans-67.1-48.3-179.2-61.90000111.5L189 Y201 T202 G207 L208 A209L189-S205 VanDerWaalsContact CD2-OG 3.23Å; L189-S205 WeakPolarHBondContact CD2-OG 3.46Å; Y201-S205 VanDerWaalsContact O-CB 3.26Å; Y201-S205 WeakPolarHBondContact O-CB 3.47Å; Y201-S205 PolarHBondContact O-N 2.92Å; Y201-S205 PolarHBondContact O-OG 2.9Å; T202-S205 PolarHBondContact O-N 3.06Å; S205-G207 VanDerWaalsContact C-N 3.34Å; S205-L208 PolarHBondContact O-N 2.97Å; S205-A209 WeakPolarHBondContact O-CB 3.45Å; S205-A209 PolarHBondContact O-N 3.35Å
206V89Confident86.6Confident82 Ų8249 Ų4950%0.49729%0.289SS..Hα-helixtrans-63.2-44.3177.1172.30000110T202 A209 I210T202-V206 HydrophobicContact CG2-CG2 4.31Å; T202-V206 WeakPolarHBondContact O-CB 3.44Å; T202-V206 VanDerWaalsContact O-CG2 3.31Å; T202-V206 WeakPolarHBondContact O-CG2 3.48Å; T202-V206 PolarHBondContact O-N 3.24Å; V206-A209 PolarHBondContact O-N 3.03Å; V206-I210 HydrophobicContact CG1-CD1 3.74Å; V206-I210 WeakPolarHBondContact O-CD1 3.44Å; V206-I210 VanDerWaalsContact O-CG1 3.31Å; V206-I210 WeakPolarHBondContact O-CG1 3.12Å; V206-I210 PolarHBondContact O-N 3.21Å
207G88.3Confident86.8Confident5 Ų551.4 Ų51.45%0.05230%0.304CS..Hα-helixtrans-56.9-53175.800000112A203 G204 S205 A209 I210 M211A203-G207 PolarHBondContact O-N 3.32Å; G204-G207 PolarHBondContact O-N 3.48Å; S205-G207 VanDerWaalsContact C-N 3.34Å; G207-A209 VanDerWaalsContact C-N 3.34Å; G207-A209 PolarHBondContact O-N 3.38Å; G207-I210 PolarHBondContact O-N 2.88Å; G207-M211 WeakPolarHBondContact O-CB 3.45Å; G207-M211 WeakPolarHBondContact O-CG 3.36Å; G207-M211 PolarHBondContact O-N 3.34Å
208L89.9Confident86.6Confident14 Ų1450.6 Ų50.67%0.07330%0.296CS..Hα-helixtrans-61.2-38.8178.6-78.2174.9000113.6F132 L182 M185 L189 G204 S205 M211 T212F132-L208 HydrophobicContact CZ-CD1 3.97Å; L182-L208 HydrophobicContact CD2-CD2 3.65Å; M185-L208 HydrophobicContact CB-CD1 4.11Å; M185-L208 HydrophobicContact CB-CD2 4.01Å; M185-L208 HydrophobicContact CE-CD2 3.99Å; M185-L208 HydrophobicContact SD-CD2 4.25Å; L189-L208 HydrophobicContact CD2-CD1 4.09Å; G204-L208 WeakPolarHBondContact O-CB 3.26Å; G204-L208 WeakPolarHBondContact O-CG 3.42Å; G204-L208 PolarHBondContact O-N 3.37Å; S205-L208 PolarHBondContact O-N 2.97Å; L208-M211 PolarHBondContact O-N 3Å; L208-T212 WeakPolarHBondContact O-CB 3.47Å; L208-T212 PolarHBondContact O-N 3.12Å; L208-T212 PolarHBondContact O-OG1 3.3Å
209A89.3Confident86.4Confident61 Ų6147.3 Ų47.350%0.50428%0.276SS..Hα-helixtrans-62.6-46.4177.400000111.3S205 V206 G207 T212 A213S205-A209 WeakPolarHBondContact O-CB 3.45Å; S205-A209 PolarHBondContact O-N 3.35Å; V206-A209 PolarHBondContact O-N 3.03Å; G207-A209 VanDerWaalsContact C-N 3.34Å; G207-A209 PolarHBondContact O-N 3.38Å; A209-T212 PolarHBondContact O-N 3.1Å; A209-A213 PolarHBondContact O-N 2.78Å
210I88Confident86.2Confident36 Ų3646.8 Ų46.819%0.18527%0.271CS..Hα-helixtrans-59.2-50.8174.8-70.4162.4000110.3F111 V115 V206 G207 T212 A213 M214F111-I210 HydrophobicContact CD1-CG2 3.78Å; F111-I210 HydrophobicContact CE1-CB 4.31Å; F111-I210 HydrophobicContact CE1-CD1 3.65Å; F111-I210 HydrophobicContact CE1-CG1 3.97Å; F111-I210 HydrophobicContact CE1-CG2 3.39Å; F111-I210 HydrophobicContact CZ-CD1 3.68Å; F111-I210 HydrophobicContact CZ-CG1 4.43Å; F111-I210 HydrophobicContact CZ-CG2 4.46Å; V115-I210 HydrophobicContact CG2-CD1 4.08Å; V115-I210 HydrophobicContact CG2-CG2 4.43Å; V206-I210 HydrophobicContact CG1-CD1 3.74Å; V206-I210 WeakPolarHBondContact O-CD1 3.44Å; V206-I210 VanDerWaalsContact O-CG1 3.31Å; V206-I210 WeakPolarHBondContact O-CG1 3.12Å; V206-I210 PolarHBondContact O-N 3.21Å; G207-I210 PolarHBondContact O-N 2.88Å; I210-T212 VanDerWaalsContact C-N 3.26Å; I210-T212 PolarHBondContact O-N 3.44Å; I210-A213 PolarHBondContact O-N 2.9Å; I210-M214 HydrophobicContact CG2-CG 4.42Å; I210-M214 HydrophobicContact CG2-SD 4.06Å; I210-M214 WeakPolarHBondContact O-CG 3.5Å; I210-M214 PolarHBondContact O-N 2.75Å
211M86.9Confident86.1Confident23 Ų2351.6 Ų51.611%0.11329%0.285CS..Hα-helixtrans-58-40.5-179.7-68.6-58.4-71.400112H112 V116 L182 G207 L208 N215H112-M211 WeakPolarHBondContact CD2-CE 3.47Å; H112-M211 PolarHBondContact CD2-SD 2.71Å; H112-M211 WeakPolarHBondContact NE2-CE 3.17Å; V116-M211 HydrophobicContact CG2-CE 4.18Å; V116-M211 HydrophobicContact CG2-SD 4.12Å; L182-M211 HydrophobicContact CD2-CB 4.28Å; G207-M211 WeakPolarHBondContact O-CB 3.45Å; G207-M211 WeakPolarHBondContact O-CG 3.36Å; G207-M211 PolarHBondContact O-N 3.34Å; L208-M211 PolarHBondContact O-N 3Å; M211-N215 WeakPolarHBondContact O-CB 3.36Å; M211-N215 PolarHBondContact O-N 2.78Å; M211-N215 PolarHBondContact O-ND2 2.96Å
212T87.8Confident85.8Confident47 Ų4750.3 Ų50.329%0.28828%0.281SS..Hα-helixtrans-66.3-48178.2-58.80000111.1L208 A209 I210 M214 N215 I216L208-T212 WeakPolarHBondContact O-CB 3.47Å; L208-T212 PolarHBondContact O-N 3.12Å; L208-T212 PolarHBondContact O-OG1 3.3Å; A209-T212 PolarHBondContact O-N 3.1Å; I210-T212 VanDerWaalsContact C-N 3.26Å; I210-T212 PolarHBondContact O-N 3.44Å; T212-M214 VanDerWaalsContact C-N 3.35Å; T212-M214 PolarHBondContact O-N 3.42Å; T212-N215 PolarHBondContact O-N 3.1Å; T212-I216 HydrophobicContact CG2-CD1 4.1Å; T212-I216 WeakPolarHBondContact O-CG1 3.25Å; T212-I216 PolarHBondContact O-N 3.45Å
213A87.4Confident85.4Confident54 Ų5449.6 Ų49.645%0.44628%0.275SS..Hα-helixtrans-59.3-45.7177.800000111.8A209 I210 N215 I216 V217A209-A213 PolarHBondContact O-N 2.78Å; I210-A213 PolarHBondContact O-N 2.9Å; A213-N215 VanDerWaalsContact C-N 3.32Å; A213-N215 PolarHBondContact O-N 2.85Å; A213-I216 PolarHBondContact O-N 2.8Å; A213-V217 WeakPolarHBondContact O-CG2 3.42Å; A213-V217 PolarHBondContact O-N 3.49Å
214M85.9Confident85.1Confident33 Ų3355.4 Ų55.416%0.16329%0.29CS..Hα-helixtrans-59.8-42.9175.8-72-174.26300112.2E108 H112 I210 T212 V217 L218E108-M214 HydrophobicContact CB-CE 4.23Å; E108-M214 WeakPolarHBondContact O-CE 3.29Å; H112-M214 HydrophobicContact CB-CE 3.69Å; H112-M214 HydrophobicContact CB-SD 3.98Å; I210-M214 HydrophobicContact CG2-CG 4.42Å; I210-M214 HydrophobicContact CG2-SD 4.06Å; I210-M214 WeakPolarHBondContact O-CG 3.5Å; I210-M214 PolarHBondContact O-N 2.75Å; T212-M214 VanDerWaalsContact C-N 3.35Å; T212-M214 PolarHBondContact O-N 3.42Å; M214-V217 PolarHBondContact O-N 2.89Å; M214-L218 WeakPolarHBondContact O-CG 3.3Å; M214-L218 PolarHBondContact O-N 3.35Å
215N85.6Confident84.5Confident3 Ų356.6 Ų56.62%0.01630%0.296CS..Hα-helixtrans-64.7-41177.9-81.1-41.5000112.4Y174 R178 L182 M211 T212 A213 V217 L218 F219Y174-N215 WeakPolarHBondContact OH-CA 3.5Å; Y174-N215 WeakPolarHBondContact OH-CB 3.27Å; Y174-N215 PolarHBondContact OH-O 2.87Å; Y174-N215 PolarHBondContact OH-OD1 3.17Å; R178-N215 WeakPolarHBondContact CD-OD1 3.1Å; R178-N215 PolarHBondContact NH1-OD1 3.41Å; L182-N215 HydrophobicContact CD1-CB 4.47Å; L182-N215 WeakPolarHBondContact CD1-ND2 3.46Å; M211-N215 WeakPolarHBondContact O-CB 3.36Å; M211-N215 PolarHBondContact O-N 2.78Å; M211-N215 PolarHBondContact O-ND2 2.96Å; T212-N215 PolarHBondContact O-N 3.1Å; A213-N215 VanDerWaalsContact C-N 3.32Å; A213-N215 PolarHBondContact O-N 2.85Å; N215-V217 VanDerWaalsContact C-N 3.28Å; N215-V217 PolarHBondContact O-N 3.09Å; N215-L218 PolarHBondContact O-N 3.26Å; N215-F219 VanDerWaalsContact O-CB 3.29Å; N215-F219 WeakPolarHBondContact O-CB 3.45Å; N215-F219 PolarHBondContact O-N 3.26Å
216I85.1Confident83.8Confident101 Ų10155.8 Ų55.852%0.51829%0.289SS..Hα-helixtrans-57.5-44174.7-67164.6000111T212 A213 F219 Y220T212-I216 HydrophobicContact CG2-CD1 4.1Å; T212-I216 WeakPolarHBondContact O-CG1 3.25Å; T212-I216 PolarHBondContact O-N 3.45Å; A213-I216 PolarHBondContact O-N 2.8Å; I216-F219 PolarHBondContact O-N 3.01Å; I216-Y220 PolarHBondContact O-N 3.38Å
217V85.7Confident82.9Confident62 Ų6256.2 Ų56.238%0.37628%0.284SS..Hα-helixtrans-63.7-45.7177.1175.30000111.6A213 M214 N215 F219 Y220 R221A213-V217 WeakPolarHBondContact O-CG2 3.42Å; A213-V217 PolarHBondContact O-N 3.49Å; M214-V217 PolarHBondContact O-N 2.89Å; N215-V217 VanDerWaalsContact C-N 3.28Å; N215-V217 PolarHBondContact O-N 3.09Å; V217-F219 PolarHBondContact O-N 3.46Å; V217-Y220 PolarHBondContact O-N 2.92Å; V217-R221 WeakPolarHBondContact O-CG 3.48Å; V217-R221 PolarHBondContact O-N 2.98Å
218L80.9Confident81.6Confident57 Ų5761.4 Ų61.430%0.29831%0.31SS..Hα-helixtrans-63-41.5178.2-71.8175.5000111.9M214 N215 R221 L222M214-L218 WeakPolarHBondContact O-CG 3.3Å; M214-L218 PolarHBondContact O-N 3.35Å; N215-L218 PolarHBondContact O-N 3.26Å; L218-R221 PolarHBondContact O-N 2.92Å; L218-L222 WeakPolarHBondContact O-CB 3.4Å; L218-L222 PolarHBondContact O-N 3.05Å
219F80.4Confident80Confident58 Ų5868.8 Ų68.825%0.25434%0.342SS..Hα-helixtrans-60.9-47.8176.2-175.4-112.4000111.5L171 Y174 N215 I216 V217 R221 L222 L223L171-F219 HydrophobicContact CD1-CD2 4.33Å; L171-F219 HydrophobicContact CD1-CE2 3.48Å; L171-F219 VanDerWaalsContact CD1-CE2 3.48Å; L171-F219 HydrophobicContact CD1-CZ 4.12Å; Y174-F219 HydrophobicContact CD1-CB 4.38Å; Y174-F219 AromaticContact CD1-CD2 3.39Å; Y174-F219 HydrophobicContact CD1-CD2 3.39Å; Y174-F219 AromaticContact CD1-CE2 3.98Å; Y174-F219 HydrophobicContact CD1-CE2 3.98Å; Y174-F219 HydrophobicContact CD1-CG 4.21Å; Y174-F219 HydrophobicContact CE1-CB 3.62Å; Y174-F219 AromaticContact CE1-CD2 3.53Å; Y174-F219 HydrophobicContact CE1-CD2 3.53Å; Y174-F219 HydrophobicContact CE1-CE2 4.49Å; Y174-F219 AromaticContact CE1-CG 3.9Å; Y174-F219 HydrophobicContact CE1-CG 3.9Å; Y174-F219 HydrophobicContact CG-CD2 4.08Å; N215-F219 VanDerWaalsContact O-CB 3.29Å; N215-F219 WeakPolarHBondContact O-CB 3.45Å; N215-F219 PolarHBondContact O-N 3.26Å; I216-F219 PolarHBondContact O-N 3.01Å; V217-F219 PolarHBondContact O-N 3.46Å; F219-R221 PolarHBondContact O-N 2.95Å; F219-L222 WeakPolarHBondContact O-CB 3.46Å; F219-L222 PolarHBondContact O-N 3.44Å; F219-L222 VanDerWaalsContact O-N 3.14Å; F219-L223 HydrophobicContact CD1-CD1 3.79Å; F219-L223 HydrophobicContact CD1-CG 4.4Å; F219-L223 HydrophobicContact CE1-CD1 3.33Å; F219-L223 HydrophobicContact CE1-CG 4.09Å; F219-L223 HydrophobicContact CE2-CD1 4.46Å; F219-L223 HydrophobicContact CE2-CG 4.4Å; F219-L223 HydrophobicContact CZ-CD1 3.71Å; F219-L223 HydrophobicContact CZ-CD2 4.3Å; F219-L223 HydrophobicContact CZ-CG 4.09Å; F219-L223 PolarHBondContact O-N 3.3Å
220Y82.4Confident78.1Confident139 Ų13970.7 Ų70.755%0.54535%0.352SS..Hα-helixtrans-59.9-45.1176.1177.9-97.7000112I216 V217 L222 L223 R224I216-Y220 PolarHBondContact O-N 3.38Å; V217-Y220 PolarHBondContact O-N 2.92Å; Y220-L222 VanDerWaalsContact C-N 3.27Å; Y220-L222 PolarHBondContact O-N 3.23Å; Y220-L223 PolarHBondContact O-N 2.61Å; Y220-R224 WeakPolarHBondContact O-CB 3.45Å; Y220-R224 PolarHBondContact O-N 3.49Å
221R81.6Confident75.9Confident123 Ų12373.4 Ų73.446%0.46437%0.374SS..Hα-helixtrans-60.1-38.2175.7-73.6178.8-176.1169.57.4111.7E108 V217 L218 F219 S225E108-R221 IonicContact OE1-CZ 3.37Å; E108-R221 IonicContact OE1-NH1 2.68Å; E108-R221 IonicContact OE1-NH2 3.43Å; E108-R221 PolarHBondContact OE1-NH2 2.91Å; E108-R221 IonicContact OE2-CZ 3.23Å; E108-R221 IonicContact OE2-NH1 3.36Å; E108-R221 PolarHBondContact OE2-NH1 3.09Å; E108-R221 IonicContact OE2-NH2 3.14Å; E108-R221 PolarHBondContact OE2-NH2 3.46Å; V217-R221 WeakPolarHBondContact O-CG 3.48Å; V217-R221 PolarHBondContact O-N 2.98Å; L218-R221 PolarHBondContact O-N 2.92Å; F219-R221 PolarHBondContact O-N 2.95Å; R221-S225 VanDerWaalsContact O-CB 3.26Å; R221-S225 WeakPolarHBondContact O-CB 3.4Å; R221-S225 PolarHBondContact O-N 2.99Å
222L79.5Confident73.5Confident11 Ų1175.7 Ų75.76%0.05840%0.396CS..Hα-helixtrans-69-50179.6-163.4137.4000111.7N170 L171 L218 F219 Y220 R224 S225 D226N170-L222 WeakPolarHBondContact ND2-CD1 3.36Å; L171-L222 HydrophobicContact CD1-CD2 4.33Å; L218-L222 WeakPolarHBondContact O-CB 3.4Å; L218-L222 PolarHBondContact O-N 3.05Å; F219-L222 WeakPolarHBondContact O-CB 3.46Å; F219-L222 PolarHBondContact O-N 3.44Å; F219-L222 VanDerWaalsContact O-N 3.14Å; Y220-L222 VanDerWaalsContact C-N 3.27Å; Y220-L222 PolarHBondContact O-N 3.23Å; L222-R224 VanDerWaalsContact C-N 3.29Å; L222-R224 PolarHBondContact O-N 3.09Å; L222-S225 PolarHBondContact O-N 3.04Å; L222-S225 VanDerWaalsContact O-N 3.17Å; L222-D226 PolarHBondContact O-N 3.2Å
223L78.1Confident71.1Confident55 Ų5579.1 Ų79.129%0.28842%0.419SS..Hα-helixtrans-55.5-45.8175.3-75.6178.7000111.6L171 F219 Y220 S225 F227 L228L171-L223 HydrophobicContact CD1-CD2 3.86Å; F219-L223 HydrophobicContact CD1-CD1 3.79Å; F219-L223 HydrophobicContact CD1-CG 4.4Å; F219-L223 HydrophobicContact CE1-CD1 3.33Å; F219-L223 HydrophobicContact CE1-CG 4.09Å; F219-L223 HydrophobicContact CE2-CD1 4.46Å; F219-L223 HydrophobicContact CE2-CG 4.4Å; F219-L223 HydrophobicContact CZ-CD1 3.71Å; F219-L223 HydrophobicContact CZ-CD2 4.3Å; F219-L223 HydrophobicContact CZ-CG 4.09Å; F219-L223 PolarHBondContact O-N 3.3Å; Y220-L223 PolarHBondContact O-N 2.61Å; L223-S225 PolarHBondContact O-N 3.23Å; L223-F227 HydrophobicContact CD2-CD2 4.04Å; L223-F227 HydrophobicContact CD2-CE2 4.31Å; L223-F227 WeakPolarHBondContact O-CB 3.38Å; L223-F227 PolarHBondContact O-N 3.2Å; L223-L228 PolarHBondContact O-N 3Å
224R79.5Confident68.7Low152 Ų15284.4 Ų84.457%0.57444%0.437SS*.Iπ-helixtrans-64.6-42178.7-174178.3176.8-164.60.7112.4Y220 L222 L228 K229Y220-R224 WeakPolarHBondContact O-CB 3.45Å; Y220-R224 PolarHBondContact O-N 3.49Å; L222-R224 VanDerWaalsContact C-N 3.29Å; L222-R224 PolarHBondContact O-N 3.09Å; R224-L228 HydrophobicContact CB-CD1 4.13Å; R224-L228 HydrophobicContact CG-CB 4.3Å; R224-L228 HydrophobicContact CG-CD1 4.15Å; R224-L228 PolarHBondContact O-N 3.48Å; R224-K229 PolarHBondContact O-N 3.16Å; R224-K229 VanDerWaalsContact O-N 3.1Å
225S75.7Confident66.4Low37 Ų3788.4 Ų88.426%0.25947%0.465SS..Iπ-helixtrans-70.9-35.3-177.1-177.90000113.3R149 R153 R221 L222 L223R149-S225 PolarHBondContact NH2-OG 3.1Å; R153-S225 PolarHBondContact NH1-OG 3.3Å; R153-S225 PolarHBondContact NH2-OG 3.37Å; R221-S225 VanDerWaalsContact O-CB 3.26Å; R221-S225 WeakPolarHBondContact O-CB 3.4Å; R221-S225 PolarHBondContact O-N 2.99Å; L222-S225 PolarHBondContact O-N 3.04Å; L222-S225 VanDerWaalsContact O-N 3.17Å; L223-S225 PolarHBondContact O-N 3.23Å
226D73.1Confident64.1Low18 Ų1894.3 Ų94.310%0.09650%0.501CS..Iπ-helixtrans-97.8-36-172.1-72.6-7.7000112.7R149 Y163 S167 L222R149-D226 IonicContact CZ-OD1 2.74Å; R149-D226 IonicContact CZ-OD2 2.76Å; R149-D226 IonicContact NE-OD1 3.5Å; R149-D226 PolarHBondContact NE-OD1 3.08Å; R149-D226 IonicContact NE-OD2 3.54Å; R149-D226 PolarHBondContact NE-OD2 3.23Å; R149-D226 VanDerWaalsContact NH2-CG 3.26Å; R149-D226 IonicContact NH2-OD1 3.5Å; R149-D226 PolarHBondContact NH2-OD1 2.96Å; R149-D226 IonicContact NH2-OD2 3.56Å; R149-D226 PolarHBondContact NH2-OD2 2.81Å; Y163-D226 PolarHBondContact OH-OD1 3.19Å; S167-D226 PolarHBondContact OG-OD2 3.47Å; L222-D226 PolarHBondContact O-N 3.2Å
227F69.3Low61.9Low91 Ų9197.2 Ų97.240%0.39951%0.513SS..Iπ-helixtrans-108.3-39.2-173.4-61.7-82.7000113.1L171 L223 S231L171-F227 HydrophobicContact CD2-CE2 3.94Å; L171-F227 HydrophobicContact CD2-CZ 3.98Å; L223-F227 HydrophobicContact CD2-CD2 4.04Å; L223-F227 HydrophobicContact CD2-CE2 4.31Å; L223-F227 WeakPolarHBondContact O-CB 3.38Å; L223-F227 PolarHBondContact O-N 3.2Å; F227-S231 PolarHBondContact O-OG 3.28Å
228L61.5Low59.7Low114 Ų114100.5 Ų100.560%0.59753%0.533SS*.Iπ-helixtrans-82.5-30.5-176.3-60.1177000113.2L223 R224L223-L228 PolarHBondContact O-N 3Å; R224-L228 HydrophobicContact CB-CD1 4.13Å; R224-L228 HydrophobicContact CG-CB 4.3Å; R224-L228 HydrophobicContact CG-CD1 4.15Å; R224-L228 PolarHBondContact O-N 3.48Å
229K55.6Low57.8Low169 Ų169106.4 Ų106.474%0.73556%0.556SS**SBendtrans-87.4-20.3-179.4-140179.2-175.1-173.80113.9R224 S231R224-K229 PolarHBondContact O-N 3.16Å; R224-K229 VanDerWaalsContact O-N 3.1Å; K229-S231 PolarHBondContact O-N 2.83Å
230S50.2Low55.8Low102 Ų102111.8 Ų111.871%0.71358%0.582SS**THydrogen-bonded Turntrans-70.2-11.3173.2-169.20000113.1
231S40.9Very low53.5Low92 Ų92110.3 Ų110.364%0.64359%0.592SS**THydrogen-bonded Turntrans-96.72.3-177.8-51.70000114.2F227 K229 P233F227-S231 PolarHBondContact O-OG 3.28Å; K229-S231 PolarHBondContact O-N 2.83Å; S231-P233 WeakPolarHBondContact O-CD 3.33Å
232A37.3Very low51.2Low71 Ų71115.9 Ų115.959%0.58761%0.613SS**SBendtrans-80.2115.8171.400000108.8
233P36.9Very low49.1Very low119 Ų119119.1 Ų119.177%0.77365%0.649SS**PPolyproline II helixtrans-62.3139.3176.5-13.827.9000109.6S231S231-P233 WeakPolarHBondContact O-CD 3.33Å
234M37.6Very low47Very low165 Ų165125 Ų12581%0.81368%0.675SS**PPolyproline II helixtrans-50.4131164.7-78.6-77.8-70.900109.1T236M234-T236 PolarHBondContact O-N 3.07Å; M234-T236 VanDerWaalsContact O-N 3.08Å
235P37.6Very low44.8Very low117 Ų117121.1 Ų121.176%0.7668%0.682SS**PPolyproline II helixtrans-61.5118.8168.224.5-28.2000107.2E237P235-E237 PolarHBondContact O-N 3.49Å
236T37Very low42.8Very low127 Ų127128.7 Ų128.778%0.77971%0.714SS**  trans-45.4124.2176.4-37.80000109.3M234 V238M234-T236 PolarHBondContact O-N 3.07Å; M234-T236 VanDerWaalsContact O-N 3.08Å; T236-V238 PolarHBondContact O-N 3.45Å
237E40.1Very low41Very low162 Ų162131.5 Ų131.576%0.75775%0.747SS**  trans-51.7111.3162.6-86.8-172.3149.200107.8P235 K239P235-E237 PolarHBondContact O-N 3.49Å; E237-K239 PolarHBondContact O-N 3.24Å
238V37.6Very low39.4Very low132 Ų132136.7 Ų136.780%0.877%0.769SS**  trans-70.290.5162.7178.50000106.2T236 E240T236-V238 PolarHBondContact O-N 3.45Å; V238-E240 PolarHBondContact O-N 3.1Å
239K42.8Very low38.2Very low181 Ų181139.7 Ų139.779%0.78778%0.777SS**  trans-75.7106.4154.1-86.5-175.5177.1177.20107.2E237E237-K239 PolarHBondContact O-N 3.24Å
240E36.6Very low37.3Very low171 Ų171140 Ų14080%0.79978%0.781SS**  trans-140.7101.4152.3-120.9172.5-174.300111.6V238V238-E240 PolarHBondContact O-N 3.1Å
241S34.4Very low36.7Very low107 Ų107145.6 Ų145.675%0.74881%0.812SS**  trans44.6100.3146.461.20000119.9G243S241-G243 PolarHBondContact O-N 3.27Å
242R34.4Very low36.5Very low241 Ų241148.3 Ų148.391%0.90982%0.82SS**  trans-72.396.3142.2-145.4-179.6-167.4177.32.2107.7
243G34.5Very low36.5Very low79 Ų79152.4 Ų152.481%0.81483%0.832SS**  trans-92.2110.2163.700000108.8S241S241-G243 PolarHBondContact O-N 3.27Å
244Q35.1Very low36.5Very low178 Ų178154.2 Ų154.283%0.83284%0.836SS**  trans-111.7135.3176.5-154.8176.86.500107.9
245G32.2Very low36.4Very low71 Ų71153.6 Ų153.673%0.73284%0.837SS**  trans114.8134.1174.700000111.7
246E34.9Very low36.3Very low196 Ų196155.9 Ų155.992%0.91684%0.842SS**  cis-156.4141.76.9-71.9174.1137.900104.7
247G33.6Very low36.3Very low76 Ų76157.8 Ų157.878%0.78485%0.846SS**  83.6113.595.600000115.1
248K36.5Very low36Very low201 Ų201157.5 Ų157.587%0.87485%0.852SS**  trans99.7118.4137.7-135.6175.8-169.5174.90120.8
249K36.6Very low35.9Very low176 Ų176159.5 Ų159.577%0.76586%0.856SS**  trans135.3107.4134.1-77.5-174.7172.9-176.10111.6
250E37.6Very low35.3Very low175 Ų175157.7 Ų157.782%0.81886%0.862SS**  52.595.689.2-82-177.2168.100113.2
251T37.7Very low35.2Very low221 Ų221156.5 Ų156.5100%1.35687%0.868SS**  -176.90112.719.40000110.1

Retrieved 251 of 251 residues in 48.2 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).