A0A023UIX6_DROME Loading...

Cytochrome c oxidase subunit 1

Component of the cytochrome c oxidase, the last enzyme in the mitochondrial electron transport chain which drives oxidative phosphorylation. The respiratory chain contains 3 multisubunit complexes succinate dehydrogenase (complex II, CII), ubiquinol-cytochrome c oxidoreductase (cytochrome b-c1 complex, complex III, CIII) and cytochrome c oxidase (complex IV, CIV), that cooperate to transfer electrons derived from NADH and succinate to molecular oxygen, creating an electrochemical gradient over the inner membrane that drives transmembrane transport and the ATP synthase. Cytochrome c oxidase is the component of the respiratory chain that catalyzes the reduction of oxygen to water. Electrons originating from reduced cytochrome c in the intermembrane space (IMS) are transferred via the dinuclear copper A center (CU(A)) of subunit 2 and heme A of subunit 1 to the active site in subunit 1, a binuclear center (BNC) formed by heme A3 and copper B (CU(B)). The BNC reduces molecular oxygen to 2 water molecules using 4 electrons from cytochrome c in the IMS and 4 protons from the mitochondrial matrix.

AlphaFold DB , UniProt , Accession A0A023UIX6, Species DROME (Drosophila melanogaster, Fruit fly), Gene COI, Length 235 aa.

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

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
1P58Low91.5Very high177 Ų17754.4 Ų54.4100%1.14930%0.296SS*.  0129.20-10.828000109.2
2K72.7Confident92.1Very high87 Ų8754.6 Ų54.638%0.37829%0.292SS..  trans-69.4133.8171.3-69.8-172-178.4-175.40108.5D6 I7 L10K2-D6 HydrophobicContact CB-CB 4.09Å; K2-D6 HydrophobicContact CG-CB 4.47Å; K2-I7 HydrophobicContact CB-CD1 3.84Å; K2-I7 HydrophobicContact CB-CG1 4.23Å; K2-I7 HydrophobicContact CD-CD1 3.96Å; K2-L10 HydrophobicContact CD-CD1 4.05Å
3N91.2Very high92.6Very high64 Ų6458.6 Ų58.634%0.34231%0.312SS..  trans-83.8170178.268.734.5000110.7K5 D6 I7N3-K5 PolarHBondContact O-N 3Å; N3-K5 VanDerWaalsContact O-N 3.14Å; N3-K5 WeakPolarHBondContact OD1-CA 3.05Å; N3-K5 VanDerWaalsContact OD1-CB 3.31Å; N3-K5 WeakPolarHBondContact OD1-CB 3.25Å; N3-K5 PolarHBondContact OD1-N 2.54Å; N3-D6 PolarHBondContact N-OD2 3.36Å; N3-D6 VanDerWaalsContact N-OD2 3.16Å; N3-D6 PolarHBondContact O-N 3.25Å; N3-D6 PolarHBondContact OD1-N 3.16Å; N3-D6 PolarHBondContact OD1-OD2 3.02Å; N3-I7 WeakPolarHBondContact O-CG1 3.39Å; N3-I7 PolarHBondContact O-N 2.88Å; N3-I7 VanDerWaalsContact O-N 3.15Å
4H96.6Very high93Very high8 Ų856 Ų564%0.03730%0.296CS..Hα-helixtrans-54.6-30.3178.668.7100.3000115G8 N72 P76 D83 M84H4-G8 PolarHBondContact O-N 3.31Å; H4-N72 PolarHBondContact ND1-O 2.86Å; H4-P76 HydrophobicContact CB-CG 4.24Å; H4-D83 WeakPolarHBondContact CB-OD1 3.4Å; H4-D83 IonicContact CD2-OD1 3.37Å; H4-D83 PolarHBondContact CD2-OD1 3.22Å; H4-D83 IonicContact CG-OD1 3.61Å; H4-D83 PolarHBondContact N-OD1 3.12Å; H4-D83 VanDerWaalsContact N-OD1 3.11Å; H4-M84 HydrophobicContact CB-CG 3.83Å
5K97.7Very high93.4Very high80 Ų8052.3 Ų52.335%0.34828%0.276SS..Hα-helixtrans-70.6-47.6177.9-59-178-175.7176.40110.8N3 I7 G8 T9 W73N3-K5 PolarHBondContact O-N 3Å; N3-K5 VanDerWaalsContact O-N 3.14Å; N3-K5 WeakPolarHBondContact OD1-CA 3.05Å; N3-K5 VanDerWaalsContact OD1-CB 3.31Å; N3-K5 WeakPolarHBondContact OD1-CB 3.25Å; N3-K5 PolarHBondContact OD1-N 2.54Å; K5-I7 VanDerWaalsContact C-N 3.26Å; K5-I7 PolarHBondContact O-N 3.34Å; K5-G8 PolarHBondContact O-N 3.14Å; K5-G8 VanDerWaalsContact O-N 3.11Å; K5-T9 PolarHBondContact O-N 3.14Å; K5-T9 PolarHBondContact O-OG1 2.97Å; K5-W73 HydrophobicContact CB-CE3 3.87Å; K5-W73 HydrophobicContact CB-CH2 4.13Å; K5-W73 HydrophobicContact CB-CZ3 3.61Å; K5-W73 HydrophobicContact CG-CE3 4.42Å; K5-W73 HydrophobicContact CG-CZ3 4.43Å; K5-W73 VanDerWaalsContact O-CE3 3.26Å; K5-W73 WeakPolarHBondContact O-CZ3 3.15Å
6D97.8Very high93.7Very high74 Ų7452.3 Ų52.340%0.39629%0.286SS..Hα-helixtrans-56.9-44.2177-58.2-35.6000110.7K2 N3 T9 L10K2-D6 HydrophobicContact CB-CB 4.09Å; K2-D6 HydrophobicContact CG-CB 4.47Å; N3-D6 PolarHBondContact N-OD2 3.36Å; N3-D6 VanDerWaalsContact N-OD2 3.16Å; N3-D6 PolarHBondContact O-N 3.25Å; N3-D6 PolarHBondContact OD1-N 3.16Å; N3-D6 PolarHBondContact OD1-OD2 3.02Å; D6-T9 PolarHBondContact O-N 3.31Å; D6-L10 VanDerWaalsContact O-CG 3.29Å; D6-L10 WeakPolarHBondContact O-CG 3.29Å; D6-L10 PolarHBondContact O-N 2.86Å; D6-L10 VanDerWaalsContact O-N 3.08Å
7I98.2Very high94Very high1 Ų156.9 Ų56.91%0.00530%0.298CS..Hα-helixtrans-64.7-44.6176.1-60.8-55.6000111.3K2 N3 K5 T9 L10 Y11 N91 F94K2-I7 HydrophobicContact CB-CD1 3.84Å; K2-I7 HydrophobicContact CB-CG1 4.23Å; K2-I7 HydrophobicContact CD-CD1 3.96Å; N3-I7 WeakPolarHBondContact O-CG1 3.39Å; N3-I7 PolarHBondContact O-N 2.88Å; N3-I7 VanDerWaalsContact O-N 3.15Å; K5-I7 VanDerWaalsContact C-N 3.26Å; K5-I7 PolarHBondContact O-N 3.34Å; I7-T9 PolarHBondContact O-N 3.05Å; I7-L10 HydrophobicContact CD1-CD1 4.26Å; I7-L10 WeakPolarHBondContact O-CB 3.43Å; I7-L10 PolarHBondContact O-N 3.2Å; I7-L10 VanDerWaalsContact O-N 3.15Å; I7-Y11 HydrophobicContact CG2-CD2 3.74Å; I7-Y11 HydrophobicContact CG2-CE2 3.56Å; I7-Y11 VanDerWaalsContact O-CD2 3.28Å; I7-Y11 WeakPolarHBondContact O-CD2 3.37Å; I7-Y11 PolarHBondContact O-N 3.17Å; I7-N91 HydrophobicContact CD1-CB 4Å; I7-N91 VanDerWaalsContact CD1-OD1 3.31Å; I7-N91 WeakPolarHBondContact CD1-OD1 3.38Å; I7-F94 HydrophobicContact CG2-CB 4.17Å
8G98.1Very high94.3Very high0 Ų053.7 Ų53.70%028%0.282CS..Hα-helixtrans-57.7-44175.300000112.9H4 K5 L10 Y11 F12H4-G8 PolarHBondContact O-N 3.31Å; K5-G8 PolarHBondContact O-N 3.14Å; K5-G8 VanDerWaalsContact O-N 3.11Å; G8-L10 VanDerWaalsContact C-N 3.34Å; G8-L10 PolarHBondContact O-N 2.93Å; G8-Y11 WeakPolarHBondContact O-CB 3.32Å; G8-Y11 PolarHBondContact O-N 3.37Å; G8-F12 WeakPolarHBondContact O-CD2 3.25Å; G8-F12 PolarHBondContact O-N 3.23Å
9T98.5Very high94.5Very high54 Ų5451.2 Ų51.233%0.33127%0.27SS..Hα-helixtrans-60.3-43.1173.9-67.60000111.9K5 D6 I7 Y11 F12 I13 W73K5-T9 PolarHBondContact O-N 3.14Å; K5-T9 PolarHBondContact O-OG1 2.97Å; D6-T9 PolarHBondContact O-N 3.31Å; I7-T9 PolarHBondContact O-N 3.05Å; T9-Y11 VanDerWaalsContact C-N 3.33Å; T9-Y11 PolarHBondContact O-N 3.04Å; T9-F12 PolarHBondContact O-N 3.25Å; T9-F12 VanDerWaalsContact O-N 3.17Å; T9-I13 HydrophobicContact CG2-CD1 3.73Å; T9-I13 HydrophobicContact CG2-CG1 4.28Å; T9-I13 WeakPolarHBondContact O-CG1 3.41Å; T9-I13 PolarHBondContact O-N 3.5Å; T9-W73 WeakPolarHBondContact OG1-CZ3 3.28Å
10L98.6Very high94.7Very high43 Ų4354.9 Ų54.923%0.22529%0.287CS..Hα-helixtrans-62.2-41.5178.3-71.6170.8000111.8K2 D6 I7 G8 F12 I13 F14 F94K2-L10 HydrophobicContact CD-CD1 4.05Å; D6-L10 VanDerWaalsContact O-CG 3.29Å; D6-L10 WeakPolarHBondContact O-CG 3.29Å; D6-L10 PolarHBondContact O-N 2.86Å; D6-L10 VanDerWaalsContact O-N 3.08Å; I7-L10 HydrophobicContact CD1-CD1 4.26Å; I7-L10 WeakPolarHBondContact O-CB 3.43Å; I7-L10 PolarHBondContact O-N 3.2Å; I7-L10 VanDerWaalsContact O-N 3.15Å; G8-L10 VanDerWaalsContact C-N 3.34Å; G8-L10 PolarHBondContact O-N 2.93Å; L10-F12 VanDerWaalsContact C-N 3.34Å; L10-F12 PolarHBondContact O-N 3.11Å; L10-I13 PolarHBondContact O-N 3.34Å; L10-F14 VanDerWaalsContact O-CB 3.23Å; L10-F14 WeakPolarHBondContact O-CB 3.15Å; L10-F14 PolarHBondContact O-N 3.35Å; L10-F94 VanDerWaalsContact C-CE2 3.42Å; L10-F94 HydrophobicContact CB-CD1 4.2Å; L10-F94 HydrophobicContact CB-CD2 4.01Å; L10-F94 HydrophobicContact CB-CE1 3.85Å; L10-F94 HydrophobicContact CB-CE2 3.64Å; L10-F94 HydrophobicContact CB-CG 4.29Å; L10-F94 HydrophobicContact CB-CZ 3.57Å; L10-F94 HydrophobicContact CD1-CD1 4.16Å; L10-F94 HydrophobicContact CD1-CE1 4.02Å; L10-F94 HydrophobicContact CD2-CZ 4.47Å; L10-F94 HydrophobicContact CG-CE1 4.35Å; L10-F94 HydrophobicContact CG-CZ 4.41Å; L10-F94 WeakPolarHBondContact O-CE2 3.41Å
11Y98.7Very high94.9Very high10 Ų1053.8 Ų53.84%0.03928%0.283CS..Hα-helixtrans-59.7-41.4172.5-86.2-73.5000112.5I7 G8 T9 G15 P64 G68 S93 F94 L97I7-Y11 HydrophobicContact CG2-CD2 3.74Å; I7-Y11 HydrophobicContact CG2-CE2 3.56Å; I7-Y11 VanDerWaalsContact O-CD2 3.28Å; I7-Y11 WeakPolarHBondContact O-CD2 3.37Å; I7-Y11 PolarHBondContact O-N 3.17Å; G8-Y11 WeakPolarHBondContact O-CB 3.32Å; G8-Y11 PolarHBondContact O-N 3.37Å; T9-Y11 VanDerWaalsContact C-N 3.33Å; T9-Y11 PolarHBondContact O-N 3.04Å; Y11-G15 PolarHBondContact O-N 3.34Å; Y11-P64 HydrophobicContact CD1-CB 3.99Å; Y11-G68 WeakPolarHBondContact CD2-O 3.42Å; Y11-S93 VanDerWaalsContact OH-C 3.25Å; Y11-S93 WeakPolarHBondContact OH-CB 3.38Å; Y11-S93 PolarHBondContact OH-OG 2.85Å; Y11-F94 AromaticContact CD1-CD2 3.98Å; Y11-F94 HydrophobicContact CD1-CD2 3.98Å; Y11-F94 HydrophobicContact CD2-CB 4.34Å; Y11-F94 HydrophobicContact CD2-CD2 4.02Å; Y11-F94 HydrophobicContact CE1-CD2 4.15Å; Y11-F94 HydrophobicContact CE2-CB 3.73Å; Y11-F94 HydrophobicContact CE2-CD2 4.16Å; Y11-F94 HydrophobicContact CE2-CG 4.42Å; Y11-F94 AromaticContact CG-CD2 3.91Å; Y11-F94 HydrophobicContact CG-CD2 3.91Å; Y11-F94 WeakPolarHBondContact OH-CA 3.28Å; Y11-F94 PolarHBondContact OH-N 3.24Å; Y11-F94 VanDerWaalsContact OH-N 3.12Å; Y11-L97 HydrophobicContact CD1-CD1 3.86Å; Y11-L97 HydrophobicContact CE1-CD1 3.43Å; Y11-L97 VanDerWaalsContact CE1-CD1 3.43Å
12F98.8Very high96.8Very high57 Ų5745.4 Ų45.425%0.2523%0.228CC..Hα-helixtrans-64.7-47.7176.2-72.6-54.4000112.7G8 T9 L10 G15 A16 I65 F70 W73G8-F12 WeakPolarHBondContact O-CD2 3.25Å; G8-F12 PolarHBondContact O-N 3.23Å; T9-F12 PolarHBondContact O-N 3.25Å; T9-F12 VanDerWaalsContact O-N 3.17Å; L10-F12 VanDerWaalsContact C-N 3.34Å; L10-F12 PolarHBondContact O-N 3.11Å; F12-G15 PolarHBondContact O-N 3.25Å; F12-A16 VanDerWaalsContact O-CB 3.26Å; F12-A16 WeakPolarHBondContact O-CB 3.39Å; F12-A16 PolarHBondContact O-N 3.01Å; F12-I65 HydrophobicContact CD1-CG2 4.1Å; F12-I65 HydrophobicContact CE1-CG2 4.04Å; F12-F70 HydrophobicContact CE1-CD1 4.11Å; F12-F70 AromaticContact CE1-CD2 3.76Å; F12-F70 HydrophobicContact CE1-CD2 3.76Å; F12-F70 HydrophobicContact CE1-CE1 4.14Å; F12-F70 AromaticContact CE1-CE2 3.8Å; F12-F70 HydrophobicContact CE1-CE2 3.8Å; F12-F70 AromaticContact CE1-CG 3.91Å; F12-F70 HydrophobicContact CE1-CG 3.91Å; F12-F70 AromaticContact CE1-CZ 3.99Å; F12-F70 HydrophobicContact CE1-CZ 3.99Å; F12-F70 HydrophobicContact CZ-CB 4.3Å; F12-F70 AromaticContact CZ-CD1 3.6Å; F12-F70 HydrophobicContact CZ-CD1 3.6Å; F12-F70 HydrophobicContact CZ-CD2 4.06Å; F12-F70 AromaticContact CZ-CE1 3.84Å; F12-F70 HydrophobicContact CZ-CE1 3.84Å; F12-F70 HydrophobicContact CZ-CE2 4.28Å; F12-F70 AromaticContact CZ-CG 3.71Å; F12-F70 HydrophobicContact CZ-CG 3.71Å; F12-F70 HydrophobicContact CZ-CZ 4.17Å; F12-F70 VanDerWaalsContact CZ-N 3.26Å; F12-W73 HydrophobicContact CE2-CB 4.35Å
13I98.8Very high98Very high107 Ų10744.5 Ų44.555%0.54923%0.23SC..Hα-helixtrans-61.7-47.7179.5-66.8169.8000110T9 L10 A16 W17T9-I13 HydrophobicContact CG2-CD1 3.73Å; T9-I13 HydrophobicContact CG2-CG1 4.28Å; T9-I13 WeakPolarHBondContact O-CG1 3.41Å; T9-I13 PolarHBondContact O-N 3.5Å; L10-I13 PolarHBondContact O-N 3.34Å; I13-A16 PolarHBondContact O-N 3.39Å; I13-W17 WeakPolarHBondContact O-CB 3.46Å; I13-W17 PolarHBondContact O-N 3.35Å
14F98.8Very high98.4Very high22 Ų2244.3 Ų44.310%0.09623%0.234CC..Hα-helixtrans-60.6-49.5177.9176.1-94.4000111.7L10 A16 W17 A18 F60 P64 F94 L97 P98 L101L10-F14 VanDerWaalsContact O-CB 3.23Å; L10-F14 WeakPolarHBondContact O-CB 3.15Å; L10-F14 PolarHBondContact O-N 3.35Å; F14-A16 PolarHBondContact O-N 3.03Å; F14-W17 PolarHBondContact O-N 2.83Å; F14-A18 WeakPolarHBondContact O-CB 3.38Å; F14-A18 PolarHBondContact O-N 2.84Å; F14-F60 HydrophobicContact CE1-CB 4.26Å; F14-F60 AromaticContact CE1-CD1 3.99Å; F14-F60 HydrophobicContact CE1-CD1 3.99Å; F14-F60 AromaticContact CZ-CD1 3.83Å; F14-F60 HydrophobicContact CZ-CD1 3.83Å; F14-P64 HydrophobicContact CD1-CB 4.21Å; F14-P64 HydrophobicContact CD1-CG 4.37Å; F14-P64 HydrophobicContact CE1-CG 4.28Å; F14-F94 HydrophobicContact CB-CE2 3.88Å; F14-F94 HydrophobicContact CB-CZ 4.33Å; F14-F94 HydrophobicContact CG-CE2 4.35Å; F14-L97 HydrophobicContact CD1-CB 4.35Å; F14-L97 HydrophobicContact CD1-CD1 4.16Å; F14-L97 HydrophobicContact CE1-CB 3.76Å; F14-L97 HydrophobicContact CE1-CD1 4Å; F14-L97 HydrophobicContact CE1-CG 4.46Å; F14-L97 HydrophobicContact CE2-CB 4.35Å; F14-L97 HydrophobicContact CZ-CB 3.74Å; F14-P98 HydrophobicContact CD2-CG 4.34Å; F14-P98 HydrophobicContact CE2-CB 4.48Å; F14-P98 HydrophobicContact CE2-CG 4.23Å; F14-L101 HydrophobicContact CE2-CB 4.3Å; F14-L101 HydrophobicContact CE2-CD2 3.78Å; F14-L101 HydrophobicContact CZ-CB 3.94Å; F14-L101 HydrophobicContact CZ-CD2 3.67Å; F14-L101 HydrophobicContact CZ-CG 4.47Å
15G98.6Very high98.4Very high0 Ų045.2 Ų45.20%024%0.239CC..Hα-helixtrans-64.6-38.7-178.700000112.9Y11 F12 G19 F60Y11-G15 PolarHBondContact O-N 3.34Å; F12-G15 PolarHBondContact O-N 3.25Å; G15-G19 PolarHBondContact O-N 3.32Å; G15-F60 WeakPolarHBondContact CA-O 3.4Å
16A98.6Very high98.5Very high52 Ų5242.2 Ų42.243%0.4323%0.228SC..Hα-helixtrans-64.5-43.517400000111.5F12 I13 F14 G19 M20F12-A16 VanDerWaalsContact O-CB 3.26Å; F12-A16 WeakPolarHBondContact O-CB 3.39Å; F12-A16 PolarHBondContact O-N 3.01Å; I13-A16 PolarHBondContact O-N 3.39Å; F14-A16 PolarHBondContact O-N 3.03Å; A16-G19 PolarHBondContact O-N 2.98Å; A16-M20 WeakPolarHBondContact O-CG 3.39Å; A16-M20 PolarHBondContact O-N 2.82Å
17W98.6Very high98.5Very high131 Ų13143.6 Ų43.650%0.49623%0.234SC..Hα-helixtrans-63-50176.7-173.491.9000112.1I13 F14 G19 M20 V21 L101I13-W17 WeakPolarHBondContact O-CB 3.46Å; I13-W17 PolarHBondContact O-N 3.35Å; F14-W17 PolarHBondContact O-N 2.83Å; W17-G19 VanDerWaalsContact C-N 3.28Å; W17-G19 PolarHBondContact O-N 2.65Å; W17-M20 HydrophobicContact CB-CE 4.49Å; W17-M20 WeakPolarHBondContact O-CB 3.41Å; W17-M20 PolarHBondContact O-N 2.94Å; W17-M20 VanDerWaalsContact O-N 3.16Å; W17-V21 HydrophobicContact CD2-CG2 4.4Å; W17-V21 HydrophobicContact CE3-CG2 4.1Å; W17-V21 HydrophobicContact CH2-CG2 3.79Å; W17-V21 HydrophobicContact CZ2-CG2 4.1Å; W17-V21 HydrophobicContact CZ3-CG2 3.79Å; W17-V21 PolarHBondContact O-N 3.42Å; W17-L101 HydrophobicContact CE3-CD2 4.05Å; W17-L101 HydrophobicContact CZ3-CD2 3.68Å
18A98.6Very high98.5Very high0 Ų047.8 Ų47.80%026%0.256CS..Hα-helixtrans-60.5-39.9176.300000111.2F14 M20 V21 G22 I56 F60 L101F14-A18 WeakPolarHBondContact O-CB 3.38Å; F14-A18 PolarHBondContact O-N 2.84Å; A18-M20 VanDerWaalsContact C-N 3.34Å; A18-M20 PolarHBondContact O-N 3.01Å; A18-V21 WeakPolarHBondContact O-CB 3.3Å; A18-V21 PolarHBondContact O-N 2.75Å; A18-V21 VanDerWaalsContact O-N 3.16Å; A18-G22 PolarHBondContact O-N 3.26Å; A18-I56 HydrophobicContact CB-CG2 4.31Å; A18-I56 WeakPolarHBondContact O-CG2 3.41Å; A18-F60 HydrophobicContact CB-CB 3.88Å; A18-F60 WeakPolarHBondContact CB-O 3.28Å; A18-L101 HydrophobicContact CB-CD2 3.96Å
19G98.4Very high98.5Very high5 Ų548.8 Ų48.85%0.05226%0.261CS..Hα-helixtrans-61.1-36.8175.400000113.8G15 A16 W17 G22 T23 M61G15-G19 PolarHBondContact O-N 3.32Å; A16-G19 PolarHBondContact O-N 2.98Å; W17-G19 VanDerWaalsContact C-N 3.28Å; W17-G19 PolarHBondContact O-N 2.65Å; G19-G22 PolarHBondContact O-N 3.34Å; G19-T23 WeakPolarHBondContact O-CB 3.11Å; G19-T23 PolarHBondContact O-N 3.42Å; G19-T23 PolarHBondContact O-OG1 3.03Å; G19-M61 VanDerWaalsContact CA-SD 3.59Å
20M98.5Very high98.4Very high126 Ų12654.8 Ų54.862%0.62128%0.278SS*.Hα-helixtrans-64.3-42.4172.8-71.4-173.1-68.800111.6A16 W17 A18 T23 S24A16-M20 WeakPolarHBondContact O-CG 3.39Å; A16-M20 PolarHBondContact O-N 2.82Å; W17-M20 HydrophobicContact CB-CE 4.49Å; W17-M20 WeakPolarHBondContact O-CB 3.41Å; W17-M20 PolarHBondContact O-N 2.94Å; W17-M20 VanDerWaalsContact O-N 3.16Å; A18-M20 VanDerWaalsContact C-N 3.34Å; A18-M20 PolarHBondContact O-N 3.01Å; M20-T23 PolarHBondContact O-N 3.4Å; M20-S24 PolarHBondContact O-N 3.42Å
21V98.4Very high98.3Very high32 Ų3254.7 Ų54.719%0.19428%0.283CS..Hα-helixtrans-63.8-45.2174.3-1790000111W17 A18 T23 S24 L25 I56 L105W17-V21 HydrophobicContact CD2-CG2 4.4Å; W17-V21 HydrophobicContact CE3-CG2 4.1Å; W17-V21 HydrophobicContact CH2-CG2 3.79Å; W17-V21 HydrophobicContact CZ2-CG2 4.1Å; W17-V21 HydrophobicContact CZ3-CG2 3.79Å; W17-V21 PolarHBondContact O-N 3.42Å; A18-V21 WeakPolarHBondContact O-CB 3.3Å; A18-V21 PolarHBondContact O-N 2.75Å; A18-V21 VanDerWaalsContact O-N 3.16Å; V21-T23 VanDerWaalsContact C-N 3.3Å; V21-T23 PolarHBondContact O-N 3.43Å; V21-S24 PolarHBondContact O-N 3.23Å; V21-S24 PolarHBondContact O-OG 2.97Å; V21-L25 WeakPolarHBondContact O-CG 3.37Å; V21-L25 PolarHBondContact O-N 2.96Å; V21-L25 VanDerWaalsContact O-N 3.16Å; V21-I56 HydrophobicContact CG1-CD1 3.93Å; V21-L105 HydrophobicContact CG1-CD2 4.43Å
22G98.4Very high98.2Very high0 Ų055.3 Ų55.30%029%0.287CS..Hα-helixtrans-61.3-40.3176.800000112A18 G19 L25 S26 H53A18-G22 PolarHBondContact O-N 3.26Å; G19-G22 PolarHBondContact O-N 3.34Å; G22-L25 PolarHBondContact O-N 2.78Å; G22-S26 PolarHBondContact O-N 3.37Å; G22-H53 PolarHBondContact O-CE1 3.4Å; G22-H53 PolarHBondContact O-ND1 2.99Å
23T98.4Very high98.1Very high68 Ų6858.1 Ų58.142%0.41730%0.303SS..Hα-helixtrans-68.1-38.4178.5-57.40000112G19 M20 V21 L25 S26 I27G19-T23 WeakPolarHBondContact O-CB 3.11Å; G19-T23 PolarHBondContact O-N 3.42Å; G19-T23 PolarHBondContact O-OG1 3.03Å; M20-T23 PolarHBondContact O-N 3.4Å; V21-T23 VanDerWaalsContact C-N 3.3Å; V21-T23 PolarHBondContact O-N 3.43Å; T23-L25 VanDerWaalsContact C-N 3.34Å; T23-L25 PolarHBondContact O-N 3.38Å; T23-S26 VanDerWaalsContact O-CB 3.29Å; T23-S26 WeakPolarHBondContact O-CB 3.33Å; T23-S26 PolarHBondContact O-N 2.87Å; T23-S26 VanDerWaalsContact O-N 3.14Å; T23-I27 HydrophobicContact CG2-CD1 4.4Å; T23-I27 WeakPolarHBondContact O-CG1 3.31Å; T23-I27 PolarHBondContact O-N 3.45Å
24S98.3Very high98Very high60 Ų6055.8 Ų55.842%0.4231%0.306SS..Hα-helixtrans-63.2-40.7175.767.40000111.7M20 V21 S26 I27 L28M20-S24 PolarHBondContact O-N 3.42Å; V21-S24 PolarHBondContact O-N 3.23Å; V21-S24 PolarHBondContact O-OG 2.97Å; S24-S26 VanDerWaalsContact C-N 3.32Å; S24-S26 PolarHBondContact O-N 3.42Å; S24-I27 PolarHBondContact O-N 2.86Å; S24-L28 PolarHBondContact O-N 3.18Å; S24-L28 VanDerWaalsContact O-N 3.12Å
25L98.4Very high97.7Very high28 Ų2860.2 Ų60.215%0.14733%0.327CS..Hα-helixtrans-61.9-39.2172.1-61.8175.1000111.9V21 G22 T23 I27 L28 I29 I49 A52 H53 I56V21-L25 WeakPolarHBondContact O-CG 3.37Å; V21-L25 PolarHBondContact O-N 2.96Å; V21-L25 VanDerWaalsContact O-N 3.16Å; G22-L25 PolarHBondContact O-N 2.78Å; T23-L25 VanDerWaalsContact C-N 3.34Å; T23-L25 PolarHBondContact O-N 3.38Å; L25-I27 VanDerWaalsContact C-N 3.3Å; L25-I27 PolarHBondContact O-N 2.92Å; L25-L28 HydrophobicContact CD2-CD1 4.46Å; L25-L28 PolarHBondContact O-N 3.32Å; L25-I29 VanDerWaalsContact O-CG1 3.3Å; L25-I29 WeakPolarHBondContact O-CG1 3.35Å; L25-I29 PolarHBondContact O-N 2.93Å; L25-I49 HydrophobicContact CB-CG2 4.01Å; L25-I49 HydrophobicContact CD2-CG2 4.04Å; L25-A52 HydrophobicContact CD1-CB 3.89Å; L25-H53 HydrophobicContact CB-CB 3.91Å; L25-H53 HydrophobicContact CD1-CB 4.33Å; L25-I56 HydrophobicContact CD1-CD1 3.81Å
26S98.3Very high97.4Very high16 Ų1666.6 Ų66.611%0.11237%0.368CS..Hα-helixtrans-60.8-38.9175-162.70000112.8G22 T23 S24 I29 R30 H53G22-S26 PolarHBondContact O-N 3.37Å; T23-S26 VanDerWaalsContact O-CB 3.29Å; T23-S26 WeakPolarHBondContact O-CB 3.33Å; T23-S26 PolarHBondContact O-N 2.87Å; T23-S26 VanDerWaalsContact O-N 3.14Å; S24-S26 VanDerWaalsContact C-N 3.32Å; S24-S26 PolarHBondContact O-N 3.42Å; S26-I29 PolarHBondContact O-N 3.43Å; S26-R30 WeakPolarHBondContact O-CG 3.47Å; S26-R30 PolarHBondContact O-N 3.36Å; S26-H53 VanDerWaalsContact CB-CE1 3.47Å; S26-H53 WeakPolarHBondContact CB-CE1 3.09Å
27I98.3Very high96.9Very high104 Ų10467.1 Ų67.153%0.53338%0.379SS..Hα-helixtrans-65.2-42.4176.6-67.8166.5000110.2T23 S24 L25 R30 A31T23-I27 HydrophobicContact CG2-CD1 4.4Å; T23-I27 WeakPolarHBondContact O-CG1 3.31Å; T23-I27 PolarHBondContact O-N 3.45Å; S24-I27 PolarHBondContact O-N 2.86Å; L25-I27 VanDerWaalsContact C-N 3.3Å; L25-I27 PolarHBondContact O-N 2.92Å; I27-R30 PolarHBondContact O-N 3.39Å; I27-A31 WeakPolarHBondContact O-CB 3.32Å; I27-A31 PolarHBondContact O-N 3.48Å
28L97.6Very high96.3Very high88 Ų8864.4 Ų64.446%0.46138%0.384SS..Hα-helixtrans-61.3-44.5175.7-66.7175.4000112S24 L25 R30 A31 E32 I49S24-L28 PolarHBondContact O-N 3.18Å; S24-L28 VanDerWaalsContact O-N 3.12Å; L25-L28 HydrophobicContact CD2-CD1 4.46Å; L25-L28 PolarHBondContact O-N 3.32Å; L28-R30 VanDerWaalsContact C-N 3.32Å; L28-R30 PolarHBondContact O-N 3.26Å; L28-A31 PolarHBondContact O-N 3.38Å; L28-E32 PolarHBondContact O-N 3Å; L28-I49 HydrophobicContact CB-CG2 4.44Å; L28-I49 HydrophobicContact CD1-CD1 4.4Å
29I98.2Very high96Very high21 Ų2169.5 Ų69.511%0.10841%0.411CS..Hα-helixtrans-57.5-47175.6-65.5162.4000110.5L25 S26 A31 E32 L33 Y46 I49 V50 H53L25-I29 VanDerWaalsContact O-CG1 3.3Å; L25-I29 WeakPolarHBondContact O-CG1 3.35Å; L25-I29 PolarHBondContact O-N 2.93Å; S26-I29 PolarHBondContact O-N 3.43Å; I29-A31 VanDerWaalsContact C-N 3.34Å; I29-E32 PolarHBondContact O-N 3.14Å; I29-L33 HydrophobicContact CG2-CD1 4.13Å; I29-L33 WeakPolarHBondContact O-CG 3.48Å; I29-L33 PolarHBondContact O-N 3.23Å; I29-L33 VanDerWaalsContact O-N 3.12Å; I29-Y46 HydrophobicContact CB-CE2 4.49Å; I29-Y46 HydrophobicContact CG2-CE2 4Å; I29-I49 HydrophobicContact CD1-CG2 4.08Å; I29-I49 HydrophobicContact CG1-CG2 3.67Å; I29-V50 HydrophobicContact CD1-CB 4.37Å; I29-V50 HydrophobicContact CD1-CG2 3.83Å; I29-V50 HydrophobicContact CG1-CG2 3.88Å; I29-V50 HydrophobicContact CG2-CG2 4.38Å; I29-H53 HydrophobicContact CD1-CB 3.91Å
30R97.8Very high95.8Very high180 Ų18072 Ų7268%0.67942%0.423SS*.Hα-helixtrans-70.1-31179.9-71.5178.6-176.2153.72.9113.1S26 I27 L28 L33 G34S26-R30 WeakPolarHBondContact O-CG 3.47Å; S26-R30 PolarHBondContact O-N 3.36Å; I27-R30 PolarHBondContact O-N 3.39Å; L28-R30 VanDerWaalsContact C-N 3.32Å; L28-R30 PolarHBondContact O-N 3.26Å; R30-L33 PolarHBondContact O-N 2.83Å; R30-G34 PolarHBondContact O-N 2.94Å; R30-G34 VanDerWaalsContact O-N 3.11Å
31A96.7Very high95.6Very high42 Ų4269 Ų6935%0.34742%0.424SS..Hα-helixtrans-66.6-43.9174.200000110.9I27 L28 I29 L33 G34 L39I27-A31 WeakPolarHBondContact O-CB 3.32Å; I27-A31 PolarHBondContact O-N 3.48Å; L28-A31 PolarHBondContact O-N 3.38Å; I29-A31 VanDerWaalsContact C-N 3.34Å; A31-L33 VanDerWaalsContact C-N 3.31Å; A31-L33 PolarHBondContact O-N 2.94Å; A31-G34 PolarHBondContact O-N 3.45Å; A31-L39 HydrophobicContact CB-CD2 3.91Å
32E96.6Very high95.5Very high23 Ų2370.9 Ų70.911%0.10743%0.433CS..Hα-helixtrans-58.4-43.5174-172.362.6-151.400111.7L28 I29 G34 A38 L39 I40 Y46L28-E32 PolarHBondContact O-N 3Å; I29-E32 PolarHBondContact O-N 3.14Å; E32-G34 VanDerWaalsContact C-N 3.28Å; E32-G34 PolarHBondContact O-N 3.45Å; E32-A38 WeakPolarHBondContact OE1-CA 3.31Å; E32-L39 PolarHBondContact OE1-N 3.49Å; E32-L39 WeakPolarHBondContact OE2-CA 3.37Å; E32-L39 VanDerWaalsContact OE2-CB 3.23Å; E32-L39 WeakPolarHBondContact OE2-CB 3.29Å; E32-L39 PolarHBondContact OE2-N 2.94Å; E32-I40 HydrophobicContact CB-CD1 4.19Å; E32-I40 HydrophobicContact CG-CD1 4.2Å; E32-I40 VanDerWaalsContact OE2-CB 3.32Å; E32-I40 WeakPolarHBondContact OE2-CB 3.45Å; E32-I40 WeakPolarHBondContact OE2-CD1 3.36Å; E32-I40 WeakPolarHBondContact OE2-CG1 3.21Å; E32-I40 PolarHBondContact OE2-N 3.42Å; E32-Y46 HydrophobicContact CB-CD2 4.13Å; E32-Y46 HydrophobicContact CB-CE2 4.2Å; E32-Y46 HydrophobicContact CG-CD2 3.85Å; E32-Y46 HydrophobicContact CG-CE2 4.16Å
33L96.9Very high95.3Very high115 Ų11577.1 Ų77.160%0.60247%0.466SS*.THydrogen-bonded Turntrans-844.3-178.1-62.1177.1000114.2I29 R30 A31 H35 Y46I29-L33 HydrophobicContact CG2-CD1 4.13Å; I29-L33 WeakPolarHBondContact O-CG 3.48Å; I29-L33 PolarHBondContact O-N 3.23Å; I29-L33 VanDerWaalsContact O-N 3.12Å; R30-L33 PolarHBondContact O-N 2.83Å; A31-L33 VanDerWaalsContact C-N 3.31Å; A31-L33 PolarHBondContact O-N 2.94Å; L33-H35 VanDerWaalsContact C-N 3.33Å; L33-H35 PolarHBondContact O-N 3.47Å; L33-Y46 HydrophobicContact CG-CE2 4.42Å
34G96.1Very high95.3Very high59 Ų5976.2 Ų76.261%0.60846%0.457SS*.THydrogen-bonded Turntrans-70.1-26.5-172.700000114.2R30 A31 E32R30-G34 PolarHBondContact O-N 2.94Å; R30-G34 VanDerWaalsContact O-N 3.11Å; A31-G34 PolarHBondContact O-N 3.45Å; E32-G34 VanDerWaalsContact C-N 3.28Å; E32-G34 PolarHBondContact O-N 3.45Å
35H92.2Very high95.2Very high115 Ų11577.3 Ų77.353%0.53246%0.457SS..SBendtrans-153.5156174.453.567.3000110L33L33-H35 VanDerWaalsContact C-N 3.33Å; L33-H35 PolarHBondContact O-N 3.47Å
36P91.4Very high95.2Very high133 Ų13378.6 Ų78.686%0.86446%0.461SS*.SBendtrans-57146.6170.9-22.433.5000111.9
37G89Confident95.2Very high63 Ų6380.9 Ų80.965%0.64947%0.472SS*.SBendtrans112.7177.1-171.900000111.4
38A86.7Confident95.2Very high75 Ų7576.5 Ų76.562%0.6245%0.45SS*.  trans-111.1122.918000000110.3E32E32-A38 WeakPolarHBondContact OE1-CA 3.31Å
39L92.1Very high95.2Very high107 Ų10773.4 Ų73.456%0.5643%0.434SS*.SBendtrans-91.9-45.3172.4170.274.9000110.4A31 E32A31-L39 HydrophobicContact CB-CD2 3.91Å; E32-L39 PolarHBondContact OE1-N 3.49Å; E32-L39 WeakPolarHBondContact OE2-CA 3.37Å; E32-L39 VanDerWaalsContact OE2-CB 3.23Å; E32-L39 WeakPolarHBondContact OE2-CB 3.29Å; E32-L39 PolarHBondContact OE2-N 2.94Å
40I94.4Very high95.2Very high57 Ų5774.6 Ų74.629%0.29244%0.442SS..SBendtrans-75.4-40.1175.2-69.9163.1000110.4E32 D42 I45 Y46 I49E32-I40 HydrophobicContact CB-CD1 4.19Å; E32-I40 HydrophobicContact CG-CD1 4.2Å; E32-I40 VanDerWaalsContact OE2-CB 3.32Å; E32-I40 WeakPolarHBondContact OE2-CB 3.45Å; E32-I40 WeakPolarHBondContact OE2-CD1 3.36Å; E32-I40 WeakPolarHBondContact OE2-CG1 3.21Å; E32-I40 PolarHBondContact OE2-N 3.42Å; I40-D42 VanDerWaalsContact C-N 3.27Å; I40-D42 HydrophobicContact CG2-CB 4.24Å; I40-D42 PolarHBondContact O-N 2.86Å; I40-I45 HydrophobicContact CG2-CB 3.98Å; I40-I45 HydrophobicContact CG2-CG2 3.83Å; I40-Y46 HydrophobicContact CD1-CD2 4.39Å; I40-I49 HydrophobicContact CD1-CD1 4.06Å
41G93.8Very high95.3Very high63 Ų6366.1 Ų66.165%0.64941%0.41SS*.  trans777.9-179.100000115.1
42D95.3Very high95.4Very high71 Ų7164.4 Ų64.438%0.3840%0.396SS..  trans-144.9111.3179.3-173.7-34.3000110.6I40 Q44 I45 Y46I40-D42 VanDerWaalsContact C-N 3.27Å; I40-D42 HydrophobicContact CG2-CB 4.24Å; I40-D42 PolarHBondContact O-N 2.86Å; D42-Q44 VanDerWaalsContact C-N 3.3Å; D42-Q44 PolarHBondContact O-N 2.89Å; D42-Q44 WeakPolarHBondContact OD1-CA 3.49Å; D42-Q44 WeakPolarHBondContact OD1-CB 3.42Å; D42-Q44 PolarHBondContact OD1-N 3.3Å; D42-I45 HydrophobicContact CB-CB 4.14Å; D42-I45 HydrophobicContact CB-CD1 3.92Å; D42-I45 HydrophobicContact CB-CG1 4.03Å; D42-I45 PolarHBondContact O-N 3.42Å; D42-I45 PolarHBondContact OD1-N 3.11Å; D42-I45 VanDerWaalsContact OD1-N 3.16Å; D42-Y46 PolarHBondContact O-N 3.38Å
43D95.2Very high95.5Very high131 Ų13165.3 Ų65.370%0.70140%0.4SS*.Hα-helixtrans-65.7-30.7-178.3-64.9-18.3000112.7Y46 N47D43-Y46 WeakPolarHBondContact O-CB 3.26Å; D43-Y46 PolarHBondContact O-N 3.23Å; D43-N47 VanDerWaalsContact O-CG 3.27Å; D43-N47 PolarHBondContact O-N 3.41Å; D43-N47 PolarHBondContact O-ND2 2.91Å; D43-N47 VanDerWaalsContact O-ND2 3.16Å
44Q97.3Very high95.5Very high49 Ų4960.7 Ų60.723%0.22938%0.378CS..Hα-helixtrans-70.1-43.4178.4176.363.3900110.4D42 Y46 N47 V48 N112 H130D42-Q44 VanDerWaalsContact C-N 3.3Å; D42-Q44 PolarHBondContact O-N 2.89Å; D42-Q44 WeakPolarHBondContact OD1-CA 3.49Å; D42-Q44 WeakPolarHBondContact OD1-CB 3.42Å; D42-Q44 PolarHBondContact OD1-N 3.3Å; Q44-Y46 VanDerWaalsContact C-N 3.27Å; Q44-Y46 PolarHBondContact O-N 3Å; Q44-N47 PolarHBondContact O-N 3.28Å; Q44-N47 VanDerWaalsContact O-N 3.14Å; Q44-V48 VanDerWaalsContact O-CG2 3.3Å; Q44-V48 WeakPolarHBondContact O-CG2 3.17Å; Q44-V48 PolarHBondContact O-N 3.39Å; Q44-N112 HydrophobicContact CG-CB 4.26Å; Q44-N112 WeakPolarHBondContact CG-O 3.27Å; Q44-N112 PolarHBondContact NE2-O 2.67Å; Q44-H130 PolarHBondContact NE2-NE2 3.23Å; Q44-H130 VanDerWaalsContact NE2-NE2 3.11Å
45I97.6Very high95.6Very high83 Ų8358 Ų5843%0.42635%0.35SS..Hα-helixtrans-59.5-42.8174.9-67.7178.9000110.1I40 D42 N47 V48 I49I40-I45 HydrophobicContact CG2-CB 3.98Å; I40-I45 HydrophobicContact CG2-CG2 3.83Å; D42-I45 HydrophobicContact CB-CB 4.14Å; D42-I45 HydrophobicContact CB-CD1 3.92Å; D42-I45 HydrophobicContact CB-CG1 4.03Å; D42-I45 PolarHBondContact O-N 3.42Å; D42-I45 PolarHBondContact OD1-N 3.11Å; D42-I45 VanDerWaalsContact OD1-N 3.16Å; I45-N47 PolarHBondContact O-N 3.01Å; I45-V48 PolarHBondContact O-N 3.48Å; I45-I49 HydrophobicContact CG2-CD1 3.91Å; I45-I49 HydrophobicContact CG2-CG1 4.46Å; I45-I49 VanDerWaalsContact O-CG1 3.3Å; I45-I49 WeakPolarHBondContact O-CG1 3.41Å; I45-I49 PolarHBondContact O-N 2.92Å
46Y97.6Very high96Very high56 Ų5652.5 Ų52.522%0.2232%0.324CS..Hα-helixtrans-57.1-47.9173.9174.8-94.9000111.9I29 E32 L33 I40 D42 D43 Q44 V48 I49 V50I29-Y46 HydrophobicContact CB-CE2 4.49Å; I29-Y46 HydrophobicContact CG2-CE2 4Å; E32-Y46 HydrophobicContact CB-CD2 4.13Å; E32-Y46 HydrophobicContact CB-CE2 4.2Å; E32-Y46 HydrophobicContact CG-CD2 3.85Å; E32-Y46 HydrophobicContact CG-CE2 4.16Å; L33-Y46 HydrophobicContact CG-CE2 4.42Å; I40-Y46 HydrophobicContact CD1-CD2 4.39Å; D42-Y46 PolarHBondContact O-N 3.38Å; D43-Y46 WeakPolarHBondContact O-CB 3.26Å; D43-Y46 PolarHBondContact O-N 3.23Å; Q44-Y46 VanDerWaalsContact C-N 3.27Å; Q44-Y46 PolarHBondContact O-N 3Å; Y46-V48 VanDerWaalsContact C-N 3.33Å; Y46-V48 PolarHBondContact O-N 3.23Å; Y46-I49 PolarHBondContact O-N 3.49Å; Y46-V50 HydrophobicContact CD1-CG2 4.16Å; Y46-V50 HydrophobicContact CE1-CG2 3.71Å; Y46-V50 HydrophobicContact CE2-CG2 4.12Å; Y46-V50 WeakPolarHBondContact O-CG2 3.37Å; Y46-V50 PolarHBondContact O-N 2.98Å
47N98.2Very high96.3Very high63 Ų6348.1 Ų48.134%0.33729%0.293SS..Hα-helixtrans-63.1-36.7178.5-70.3-32.5000113D43 Q44 I45 V50 T51D43-N47 VanDerWaalsContact O-CG 3.27Å; D43-N47 PolarHBondContact O-N 3.41Å; D43-N47 PolarHBondContact O-ND2 2.91Å; D43-N47 VanDerWaalsContact O-ND2 3.16Å; Q44-N47 PolarHBondContact O-N 3.28Å; Q44-N47 VanDerWaalsContact O-N 3.14Å; I45-N47 PolarHBondContact O-N 3.01Å; N47-V50 PolarHBondContact O-N 3.41Å; N47-T51 WeakPolarHBondContact O-CB 3.01Å; N47-T51 PolarHBondContact O-N 3.21Å; N47-T51 PolarHBondContact O-OG1 3.45Å
48V98.6Very high96.6Very high12 Ų1246.7 Ų46.77%0.07327%0.27CS..Hα-helixtrans-64.2-44.9174.8172.70000110.7Q44 I45 Y46 T51 A52 N112Q44-V48 VanDerWaalsContact O-CG2 3.3Å; Q44-V48 WeakPolarHBondContact O-CG2 3.17Å; Q44-V48 PolarHBondContact O-N 3.39Å; I45-V48 PolarHBondContact O-N 3.48Å; Y46-V48 VanDerWaalsContact C-N 3.33Å; Y46-V48 PolarHBondContact O-N 3.23Å; V48-T51 PolarHBondContact O-N 3.17Å; V48-A52 WeakPolarHBondContact O-CB 3.14Å; V48-A52 PolarHBondContact O-N 3.2Å; V48-N112 WeakPolarHBondContact CG2-O 3.31Å
49I98.4Very high97.1Very high24 Ų2443.5 Ų43.512%0.12324%0.242CC..Hα-helixtrans-61.2-46.4176.7-68.4169.1000110.5L25 L28 I29 I40 I45 Y46 T51 A52 H53L25-I49 HydrophobicContact CB-CG2 4.01Å; L25-I49 HydrophobicContact CD2-CG2 4.04Å; L28-I49 HydrophobicContact CB-CG2 4.44Å; L28-I49 HydrophobicContact CD1-CD1 4.4Å; I29-I49 HydrophobicContact CD1-CG2 4.08Å; I29-I49 HydrophobicContact CG1-CG2 3.67Å; I40-I49 HydrophobicContact CD1-CD1 4.06Å; I45-I49 HydrophobicContact CG2-CD1 3.91Å; I45-I49 HydrophobicContact CG2-CG1 4.46Å; I45-I49 VanDerWaalsContact O-CG1 3.3Å; I45-I49 WeakPolarHBondContact O-CG1 3.41Å; I45-I49 PolarHBondContact O-N 2.92Å; Y46-I49 PolarHBondContact O-N 3.49Å; I49-T51 VanDerWaalsContact C-N 3.35Å; I49-T51 PolarHBondContact O-N 2.89Å; I49-A52 PolarHBondContact O-N 3.42Å; I49-H53 VanDerWaalsContact O-CB 3.25Å; I49-H53 WeakPolarHBondContact O-CB 3.38Å; I49-H53 PolarHBondContact O-N 2.94Å
50V98.6Very high97.4Very high46 Ų4638.4 Ų38.428%0.27922%0.216SC..Hα-helixtrans-60.4-45.1177.6171.30000111.2I29 Y46 N47 A54I29-V50 HydrophobicContact CD1-CB 4.37Å; I29-V50 HydrophobicContact CD1-CG2 3.83Å; I29-V50 HydrophobicContact CG1-CG2 3.88Å; I29-V50 HydrophobicContact CG2-CG2 4.38Å; Y46-V50 HydrophobicContact CD1-CG2 4.16Å; Y46-V50 HydrophobicContact CE1-CG2 3.71Å; Y46-V50 HydrophobicContact CE2-CG2 4.12Å; Y46-V50 WeakPolarHBondContact O-CG2 3.37Å; Y46-V50 PolarHBondContact O-N 2.98Å; N47-V50 PolarHBondContact O-N 3.41Å; V50-A54 PolarHBondContact O-N 3.21Å; V50-A54 VanDerWaalsContact O-N 3.11Å
51T98.4Very high97.6Very high2 Ų237.8 Ų37.81%0.01221%0.212CC..Hα-helixtrans-64.3-48.9-180-57.10000111.2N47 V48 I49 A54 F55 A114 G117N47-T51 WeakPolarHBondContact O-CB 3.01Å; N47-T51 PolarHBondContact O-N 3.21Å; N47-T51 PolarHBondContact O-OG1 3.45Å; V48-T51 PolarHBondContact O-N 3.17Å; I49-T51 VanDerWaalsContact C-N 3.35Å; I49-T51 PolarHBondContact O-N 2.89Å; T51-A54 PolarHBondContact O-N 3.43Å; T51-F55 HydrophobicContact CG2-CD2 3.79Å; T51-F55 HydrophobicContact CG2-CE2 3.46Å; T51-F55 VanDerWaalsContact CG2-CE2 3.46Å; T51-F55 HydrophobicContact CG2-CZ 4.44Å; T51-F55 WeakPolarHBondContact O-CD2 3.43Å; T51-F55 PolarHBondContact O-N 3.5Å; T51-F55 VanDerWaalsContact O-N 3.12Å; T51-A114 VanDerWaalsContact CB-O 3.25Å; T51-A114 WeakPolarHBondContact CB-O 3.43Å; T51-A114 VanDerWaalsContact CG2-O 3.3Å; T51-A114 WeakPolarHBondContact CG2-O 3.04Å; T51-A114 PolarHBondContact OG1-O 3.12Å; T51-G117 VanDerWaalsContact OG1-CA 3.24Å; T51-G117 WeakPolarHBondContact OG1-CA 3.48Å; T51-G117 PolarHBondContact OG1-N 2.93Å
52A98.6Very high97.8Very high6 Ų638.2 Ų38.25%0.0520%0.202CC..Hα-helixtrans-62.9-43.2178.100000112L25 V48 I49 A54 F55 I56L25-A52 HydrophobicContact CD1-CB 3.89Å; V48-A52 WeakPolarHBondContact O-CB 3.14Å; V48-A52 PolarHBondContact O-N 3.2Å; I49-A52 PolarHBondContact O-N 3.42Å; A52-A54 PolarHBondContact O-N 3.14Å; A52-F55 PolarHBondContact O-N 3.33Å; A52-I56 WeakPolarHBondContact O-CB 3.31Å; A52-I56 WeakPolarHBondContact O-CG1 3.25Å; A52-I56 PolarHBondContact O-N 2.77Å
53H98.7Very high97.8Very high41 Ų4135.5 Ų35.519%0.1919%0.187CC..Hα-helixtrans-54.1-54.2175.5169.767.1000111.1G22 L25 S26 I29 I49 F55 I56 M57G22-H53 PolarHBondContact O-CE1 3.4Å; G22-H53 PolarHBondContact O-ND1 2.99Å; L25-H53 HydrophobicContact CB-CB 3.91Å; L25-H53 HydrophobicContact CD1-CB 4.33Å; S26-H53 VanDerWaalsContact CB-CE1 3.47Å; S26-H53 WeakPolarHBondContact CB-CE1 3.09Å; I29-H53 HydrophobicContact CD1-CB 3.91Å; I49-H53 VanDerWaalsContact O-CB 3.25Å; I49-H53 WeakPolarHBondContact O-CB 3.38Å; I49-H53 PolarHBondContact O-N 2.94Å; H53-F55 PolarHBondContact O-N 3.37Å; H53-I56 PolarHBondContact O-N 2.83Å; H53-M57 WeakPolarHBondContact CE1-CG 3.47Å; H53-M57 VanDerWaalsContact O-CG 3.26Å; H53-M57 WeakPolarHBondContact O-CG 3.26Å; H53-M57 PolarHBondContact O-N 3.22Å
54A98.3Very high98Very high18 Ų1829.4 Ų29.415%0.14916%0.155CC..Hα-helixtrans-60.4-45.7-177.500000112.2V50 T51 A52 M57 I58 W118V50-A54 PolarHBondContact O-N 3.21Å; V50-A54 VanDerWaalsContact O-N 3.11Å; T51-A54 PolarHBondContact O-N 3.43Å; A52-A54 PolarHBondContact O-N 3.14Å; A54-M57 PolarHBondContact O-N 2.86Å; A54-I58 WeakPolarHBondContact O-CG1 3.48Å; A54-I58 PolarHBondContact O-N 3.37Å; A54-I58 VanDerWaalsContact O-N 3.1Å; A54-W118 HydrophobicContact CB-CB 3.51Å; A54-W118 HydrophobicContact CB-CG 4.05Å
55F98.3Very high98Very high2 Ų229 Ų291%0.00915%0.153CC..Hα-helixtrans-63.3-44177.1-73.8-43.7000112.8T51 A52 H53 M57 I58 F59 L104 W118 V120 L142T51-F55 HydrophobicContact CG2-CD2 3.79Å; T51-F55 HydrophobicContact CG2-CE2 3.46Å; T51-F55 VanDerWaalsContact CG2-CE2 3.46Å; T51-F55 HydrophobicContact CG2-CZ 4.44Å; T51-F55 WeakPolarHBondContact O-CD2 3.43Å; T51-F55 PolarHBondContact O-N 3.5Å; T51-F55 VanDerWaalsContact O-N 3.12Å; A52-F55 PolarHBondContact O-N 3.33Å; H53-F55 PolarHBondContact O-N 3.37Å; F55-M57 PolarHBondContact O-N 3.42Å; F55-I58 PolarHBondContact O-N 2.83Å; F55-F59 AromaticContact CD1-CD2 3.9Å; F55-F59 HydrophobicContact CD1-CD2 3.9Å; F55-F59 AromaticContact CD1-CE2 3.86Å; F55-F59 HydrophobicContact CD1-CE2 3.86Å; F55-F59 HydrophobicContact CE1-CE2 4.28Å; F55-F59 WeakPolarHBondContact O-CB 3.28Å; F55-F59 PolarHBondContact O-N 3.48Å; F55-L104 HydrophobicContact CB-CD1 4.15Å; F55-L104 HydrophobicContact CB-CD2 3.62Å; F55-L104 HydrophobicContact CD2-CD1 3.79Å; F55-L104 HydrophobicContact CG-CD1 4.36Å; F55-W118 HydrophobicContact CD1-CB 4.42Å; F55-W118 HydrophobicContact CE1-CB 4.12Å; F55-W118 WeakPolarHBondContact CE1-O 3.42Å; F55-W118 HydrophobicContact CZ-CB 4.34Å; F55-W118 VanDerWaalsContact CZ-O 3.23Å; F55-W118 WeakPolarHBondContact CZ-O 3.35Å; F55-V120 HydrophobicContact CE2-CG2 4.22Å; F55-V120 HydrophobicContact CZ-CG2 3.56Å; F55-L142 HydrophobicContact CD1-CD1 4.47Å; F55-L142 HydrophobicContact CD1-CD2 3.77Å; F55-L142 HydrophobicContact CE1-CD1 3.75Å; F55-L142 HydrophobicContact CE1-CD2 3.87Å; F55-L142 HydrophobicContact CE1-CG 4.35Å; F55-L142 HydrophobicContact CG-CD2 4.38Å; F55-L142 HydrophobicContact CZ-CD1 3.81Å
56I98.8Very high98Very high0 Ų029.4 Ų29.40%016%0.155CC..Iπ-helixtrans-59.6-49177.8-71.4168.7000110.6A18 V21 L25 A52 H53 I58 F60 M61 L101 L104 L105A18-I56 HydrophobicContact CB-CG2 4.31Å; A18-I56 WeakPolarHBondContact O-CG2 3.41Å; V21-I56 HydrophobicContact CG1-CD1 3.93Å; L25-I56 HydrophobicContact CD1-CD1 3.81Å; A52-I56 WeakPolarHBondContact O-CB 3.31Å; A52-I56 WeakPolarHBondContact O-CG1 3.25Å; A52-I56 PolarHBondContact O-N 2.77Å; H53-I56 PolarHBondContact O-N 2.83Å; I56-I58 PolarHBondContact O-N 2.71Å; I56-F60 CarbonylContact O-C 3.35Å; I56-F60 VanDerWaalsContact O-CA 3.32Å; I56-F60 WeakPolarHBondContact O-CA 3.37Å; I56-F60 WeakPolarHBondContact O-CB 3.49Å; I56-F60 PolarHBondContact O-N 3.38Å; I56-M61 PolarHBondContact O-N 3.38Å; I56-L101 HydrophobicContact CD1-CD1 4.49Å; I56-L101 HydrophobicContact CG1-CD1 4.02Å; I56-L104 HydrophobicContact CG1-CD2 3.71Å; I56-L105 HydrophobicContact CD1-CD2 4.17Å
57M98.4Very high97.9Very high42 Ų4228.1 Ų28.121%0.20715%0.152CC..Iπ-helixtrans-64.1-42.3-176.7-65.2-55.3-75.400112H53 A54 F55 M61 V62H53-M57 WeakPolarHBondContact CE1-CG 3.47Å; H53-M57 VanDerWaalsContact O-CG 3.26Å; H53-M57 WeakPolarHBondContact O-CG 3.26Å; H53-M57 PolarHBondContact O-N 3.22Å; A54-M57 PolarHBondContact O-N 2.86Å; F55-M57 PolarHBondContact O-N 3.42Å; M57-M61 HydrophobicContact CE-CE 3.4Å; M57-M61 HydrophobicContact CE-SD 3.53Å; M57-M61 VanDerWaalsContact CE-SD 3.53Å; M57-M61 WeakPolarHBondContact O-CB 3.38Å; M57-M61 HydrophobicContact SD-CE 4.35Å; M57-M61 HydrophobicContact SD-SD 3.97Å; M57-V62 WeakPolarHBondContact O-CG2 3.46Å; M57-V62 PolarHBondContact O-N 3.38Å
58I95.8Very high97.8Very high33 Ų3325.4 Ų25.417%0.16914%0.138CC..Iπ-helixtrans-79.2-56.4-176.7-63.6165.7000111.2A54 F55 I56 M63 W118 F235A54-I58 WeakPolarHBondContact O-CG1 3.48Å; A54-I58 PolarHBondContact O-N 3.37Å; A54-I58 VanDerWaalsContact O-N 3.1Å; F55-I58 PolarHBondContact O-N 2.83Å; I56-I58 PolarHBondContact O-N 2.71Å; I58-M63 HydrophobicContact CG2-CE 4.11Å; I58-M63 WeakPolarHBondContact O-CB 3.33Å; I58-M63 PolarHBondContact O-N 3.45Å; I58-W118 HydrophobicContact CD1-CE3 4.08Å; I58-W118 HydrophobicContact CD1-CZ3 4.32Å; I58-F235 HydrophobicContact CD1-CE1 3.82Å; I58-F235 HydrophobicContact CD1-CZ 3.89Å; I58-F235 HydrophobicContact CG1-CE1 4.25Å; I58-F235 HydrophobicContact CG2-CE1 4.46Å
59F97.2Very high97.8Very high8 Ų824.8 Ų24.84%0.03514%0.135CC..Iπ-helixtrans-88.2-23.6-168.7-66-92.3000114.1F55 M63 P64 L142 A145 L194 F230F55-F59 AromaticContact CD1-CD2 3.9Å; F55-F59 HydrophobicContact CD1-CD2 3.9Å; F55-F59 AromaticContact CD1-CE2 3.86Å; F55-F59 HydrophobicContact CD1-CE2 3.86Å; F55-F59 HydrophobicContact CE1-CE2 4.28Å; F55-F59 WeakPolarHBondContact O-CB 3.28Å; F55-F59 PolarHBondContact O-N 3.48Å; F59-M63 HydrophobicContact CB-CE 3.95Å; F59-M63 HydrophobicContact CD1-CE 3.04Å; F59-M63 HydrophobicContact CD2-CE 4.41Å; F59-M63 HydrophobicContact CE1-CE 3.51Å; F59-M63 HydrophobicContact CG-CE 3.55Å; F59-M63 HydrophobicContact CZ-CE 4.37Å; F59-P64 VanDerWaalsContact O-CD 3.25Å; F59-P64 WeakPolarHBondContact O-CD 3.29Å; F59-P64 WeakPolarHBondContact O-CG 3.46Å; F59-L142 HydrophobicContact CD1-CD2 4.3Å; F59-L142 HydrophobicContact CD2-CD2 3.97Å; F59-L142 HydrophobicContact CE1-CD2 4.35Å; F59-L142 HydrophobicContact CE2-CD2 3.99Å; F59-L142 HydrophobicContact CG-CD2 4.15Å; F59-L142 HydrophobicContact CZ-CD2 4.2Å; F59-A145 HydrophobicContact CD1-CB 4.48Å; F59-L194 HydrophobicContact CZ-CD2 4.44Å; F59-F230 HydrophobicContact CE1-CZ 4.1Å; F59-F230 HydrophobicContact CZ-CE1 4.13Å; F59-F230 AromaticContact CZ-CZ 3.95Å; F59-F230 HydrophobicContact CZ-CZ 3.95Å
60F98.6Very high97.8Very high0 Ų027.5 Ų27.50%015%0.146CC..Iπ-helixtrans-116.6-15.9-173-60.1-78.9000114F14 G15 A18 I56 P64 A100 L101 L104 S141 A145F14-F60 HydrophobicContact CE1-CB 4.26Å; F14-F60 AromaticContact CE1-CD1 3.99Å; F14-F60 HydrophobicContact CE1-CD1 3.99Å; F14-F60 AromaticContact CZ-CD1 3.83Å; F14-F60 HydrophobicContact CZ-CD1 3.83Å; G15-F60 WeakPolarHBondContact CA-O 3.4Å; A18-F60 HydrophobicContact CB-CB 3.88Å; A18-F60 WeakPolarHBondContact CB-O 3.28Å; I56-F60 CarbonylContact O-C 3.35Å; I56-F60 VanDerWaalsContact O-CA 3.32Å; I56-F60 WeakPolarHBondContact O-CA 3.37Å; I56-F60 WeakPolarHBondContact O-CB 3.49Å; I56-F60 PolarHBondContact O-N 3.38Å; F60-P64 WeakPolarHBondContact O-CG 3.39Å; F60-A100 HydrophobicContact CE1-CB 3.67Å; F60-A100 HydrophobicContact CZ-CB 3.89Å; F60-L101 HydrophobicContact CB-CD1 4.28Å; F60-L101 HydrophobicContact CD1-CB 3.78Å; F60-L101 HydrophobicContact CD1-CD1 4.18Å; F60-L101 HydrophobicContact CD1-CG 4.42Å; F60-L101 HydrophobicContact CD2-CD1 4.17Å; F60-L101 HydrophobicContact CE1-CB 3.81Å; F60-L101 HydrophobicContact CG-CB 4.4Å; F60-L101 HydrophobicContact CG-CD1 3.93Å; F60-L101 HydrophobicContact CZ-CB 4.47Å; F60-L104 HydrophobicContact CD2-CD2 3.99Å; F60-L104 HydrophobicContact CE2-CD2 3.69Å; F60-S141 WeakPolarHBondContact CZ-OG 3.26Å; F60-A145 HydrophobicContact CE1-CB 4.34Å; F60-A145 HydrophobicContact CZ-CB 4.1Å
61M98.3Very high97.8Very high43 Ų4325.3 Ų25.321%0.21213%0.132CC..Iπ-helixtrans-109-71172.6-172.1-165.481.600112.4G19 I56 M57 M63 P64 I65G19-M61 VanDerWaalsContact CA-SD 3.59Å; I56-M61 PolarHBondContact O-N 3.38Å; M57-M61 HydrophobicContact CE-CE 3.4Å; M57-M61 HydrophobicContact CE-SD 3.53Å; M57-M61 VanDerWaalsContact CE-SD 3.53Å; M57-M61 WeakPolarHBondContact O-CB 3.38Å; M57-M61 HydrophobicContact SD-CE 4.35Å; M57-M61 HydrophobicContact SD-SD 3.97Å; M61-M63 PolarHBondContact O-N 3.05Å; M61-P64 WeakPolarHBondContact O-CD 3.43Å; M61-I65 HydrophobicContact CG-CD1 3.8Å; M61-I65 WeakPolarHBondContact O-CB 3.1Å; M61-I65 VanDerWaalsContact O-CG1 3.28Å; M61-I65 WeakPolarHBondContact O-CG1 3.4Å; M61-I65 PolarHBondContact O-N 2.86Å
62V97.6Very high97.8Very high73 Ų7325.3 Ų25.344%0.44213%0.132SC..Iπ-helixtrans-60.4-52.6-170.8172.60000111.5M57 I65 M66M57-V62 WeakPolarHBondContact O-CG2 3.46Å; M57-V62 PolarHBondContact O-N 3.38Å; V62-I65 PolarHBondContact O-N 2.77Å; V62-M66 HydrophobicContact CG1-CG 4.25Å; V62-M66 VanDerWaalsContact O-CB 3.31Å; V62-M66 WeakPolarHBondContact O-CB 3.32Å; V62-M66 WeakPolarHBondContact O-CG 3.35Å; V62-M66 PolarHBondContact O-N 3.48Å
63M96.1Very high97.8Very high13 Ų1329.3 Ų29.36%0.06415%0.146CC..Hα-helixtrans-60.9-51.1179.9-87.7-165-81.500113I58 F59 M61 I65 I67 G68 L187 K234I58-M63 HydrophobicContact CG2-CE 4.11Å; I58-M63 WeakPolarHBondContact O-CB 3.33Å; I58-M63 PolarHBondContact O-N 3.45Å; F59-M63 HydrophobicContact CB-CE 3.95Å; F59-M63 HydrophobicContact CD1-CE 3.04Å; F59-M63 HydrophobicContact CD2-CE 4.41Å; F59-M63 HydrophobicContact CE1-CE 3.51Å; F59-M63 HydrophobicContact CG-CE 3.55Å; F59-M63 HydrophobicContact CZ-CE 4.37Å; M61-M63 PolarHBondContact O-N 3.05Å; M63-I65 PolarHBondContact O-N 2.88Å; M63-I67 PolarHBondContact O-N 2.98Å; M63-G68 PolarHBondContact O-N 3.29Å; M63-L187 HydrophobicContact SD-CD2 4.36Å; M63-K234 HydrophobicContact CE-CD 4.47Å; M63-K234 HydrophobicContact SD-CD 4.18Å; M63-K234 WeakPolarHBondContact SD-CE 3.32Å; M63-K234 PolarHBondContact SD-NZ 2.8Å
64P97.9Very high97.7Very high4 Ų429.6 Ų29.63%0.02615%0.149CC..Iπ-helixtrans-58.1-41.3176-34.443.4000114Y11 F14 F59 F60 M61 G68 G69 L97Y11-P64 HydrophobicContact CD1-CB 3.99Å; F14-P64 HydrophobicContact CD1-CB 4.21Å; F14-P64 HydrophobicContact CD1-CG 4.37Å; F14-P64 HydrophobicContact CE1-CG 4.28Å; F59-P64 VanDerWaalsContact O-CD 3.25Å; F59-P64 WeakPolarHBondContact O-CD 3.29Å; F59-P64 WeakPolarHBondContact O-CG 3.46Å; F60-P64 WeakPolarHBondContact O-CG 3.39Å; M61-P64 WeakPolarHBondContact O-CD 3.43Å; P64-G68 CarbonylContact O-C 3.3Å; P64-G68 VanDerWaalsContact O-C 3.3Å; P64-G68 WeakPolarHBondContact O-CA 3.36Å; P64-G68 PolarHBondContact O-N 3.23Å; P64-G69 PolarHBondContact O-N 3.11Å; P64-L97 HydrophobicContact CB-CD1 4.11Å; P64-L97 HydrophobicContact CG-CD1 3.72Å
65I98.4Very high97.7Very high39 Ų3928.7 Ų28.720%0.214%0.141CC..Iπ-helixtrans-72.2-51.4-179.2-68.1175.1000111.2F12 M61 V62 M63 G69 F70F12-I65 HydrophobicContact CD1-CG2 4.1Å; F12-I65 HydrophobicContact CE1-CG2 4.04Å; M61-I65 HydrophobicContact CG-CD1 3.8Å; M61-I65 WeakPolarHBondContact O-CB 3.1Å; M61-I65 VanDerWaalsContact O-CG1 3.28Å; M61-I65 WeakPolarHBondContact O-CG1 3.4Å; M61-I65 PolarHBondContact O-N 2.86Å; V62-I65 PolarHBondContact O-N 2.77Å; M63-I65 PolarHBondContact O-N 2.88Å; I65-G69 WeakPolarHBondContact O-CA 3.31Å; I65-G69 PolarHBondContact O-N 2.72Å; I65-F70 HydrophobicContact CG2-CD2 4.24Å; I65-F70 HydrophobicContact CG2-CE2 4.02Å; I65-F70 WeakPolarHBondContact O-CD2 3.33Å; I65-F70 PolarHBondContact O-N 2.86Å
66M96.9Very high97.7Very high93 Ų9328.6 Ų28.646%0.45814%0.141SC..Iπ-helixtrans-75.4-48.1-170.5-64.2-56.7-66.400112.5V62 F70 G71V62-M66 HydrophobicContact CG1-CG 4.25Å; V62-M66 VanDerWaalsContact O-CB 3.31Å; V62-M66 WeakPolarHBondContact O-CB 3.32Å; V62-M66 WeakPolarHBondContact O-CG 3.35Å; V62-M66 PolarHBondContact O-N 3.48Å; M66-F70 HydrophobicContact SD-CD2 4.03Å; M66-F70 HydrophobicContact SD-CE2 4.2Å; M66-G71 PolarHBondContact O-N 3.11Å
67I96Very high97.7Very high29 Ų2932.5 Ų32.515%0.14916%0.161CC..Iπ-helixtrans-93.6-44.5-176.5-56-56.9000110.4M63 G71 F156 T183M63-I67 PolarHBondContact O-N 2.98Å; I67-G71 VanDerWaalsContact O-CA 3.29Å; I67-G71 WeakPolarHBondContact O-CA 3.49Å; I67-G71 PolarHBondContact O-N 3Å; I67-F156 HydrophobicContact CG2-CD2 4.24Å; I67-F156 HydrophobicContact CG2-CE2 3.81Å; I67-F156 WeakPolarHBondContact O-CE2 3.39Å; I67-F156 VanDerWaalsContact O-CZ 3.26Å; I67-F156 WeakPolarHBondContact O-CZ 3.28Å; I67-T183 HydrophobicContact CD1-CG2 3.64Å; I67-T183 HydrophobicContact CG1-CG2 4.11Å
68G96.9Very high97.6Very high5 Ų533.8 Ų33.85%0.05217%0.168CC..Iπ-helixtrans-69.3-56.5177.900000113Y11 M63 P64 N72Y11-G68 WeakPolarHBondContact CD2-O 3.42Å; M63-G68 PolarHBondContact O-N 3.29Å; P64-G68 CarbonylContact O-C 3.3Å; P64-G68 VanDerWaalsContact O-C 3.3Å; P64-G68 WeakPolarHBondContact O-CA 3.36Å; P64-G68 PolarHBondContact O-N 3.23Å; G68-N72 WeakPolarHBondContact O-CB 3.29Å; G68-N72 PolarHBondContact O-N 2.87Å; G68-N72 PolarHBondContact O-ND2 2.92Å
69G98.2Very high97.7Very high0 Ų032.2 Ų32.20%016%0.159CC..Iπ-helixtrans-73.8-69.1-173.300000112P64 I65 G71 N72 W73P64-G69 PolarHBondContact O-N 3.11Å; I65-G69 WeakPolarHBondContact O-CA 3.31Å; I65-G69 PolarHBondContact O-N 2.72Å; G69-G71 VanDerWaalsContact C-N 3.35Å; G69-G71 PolarHBondContact O-N 3.46Å; G69-N72 PolarHBondContact O-N 3.41Å; G69-W73 VanDerWaalsContact O-CB 3.27Å; G69-W73 WeakPolarHBondContact O-CB 3.49Å; G69-W73 PolarHBondContact O-N 3.16Å
70F98.5Very high97.7Very high81 Ų8134.4 Ų34.436%0.35518%0.184SC..Iπ-helixtrans-63.1-40.8-178.5-73.8-65.7000112.2F12 I65 M66 W73 L74 F176F12-F70 HydrophobicContact CE1-CD1 4.11Å; F12-F70 AromaticContact CE1-CD2 3.76Å; F12-F70 HydrophobicContact CE1-CD2 3.76Å; F12-F70 HydrophobicContact CE1-CE1 4.14Å; F12-F70 AromaticContact CE1-CE2 3.8Å; F12-F70 HydrophobicContact CE1-CE2 3.8Å; F12-F70 AromaticContact CE1-CG 3.91Å; F12-F70 HydrophobicContact CE1-CG 3.91Å; F12-F70 AromaticContact CE1-CZ 3.99Å; F12-F70 HydrophobicContact CE1-CZ 3.99Å; F12-F70 HydrophobicContact CZ-CB 4.3Å; F12-F70 AromaticContact CZ-CD1 3.6Å; F12-F70 HydrophobicContact CZ-CD1 3.6Å; F12-F70 HydrophobicContact CZ-CD2 4.06Å; F12-F70 AromaticContact CZ-CE1 3.84Å; F12-F70 HydrophobicContact CZ-CE1 3.84Å; F12-F70 HydrophobicContact CZ-CE2 4.28Å; F12-F70 AromaticContact CZ-CG 3.71Å; F12-F70 HydrophobicContact CZ-CG 3.71Å; F12-F70 HydrophobicContact CZ-CZ 4.17Å; F12-F70 VanDerWaalsContact CZ-N 3.26Å; I65-F70 HydrophobicContact CG2-CD2 4.24Å; I65-F70 HydrophobicContact CG2-CE2 4.02Å; I65-F70 WeakPolarHBondContact O-CD2 3.33Å; I65-F70 PolarHBondContact O-N 2.86Å; M66-F70 HydrophobicContact SD-CD2 4.03Å; M66-F70 HydrophobicContact SD-CE2 4.2Å; F70-W73 PolarHBondContact O-N 3.01Å; F70-L74 HydrophobicContact CB-CD1 4.32Å; F70-L74 HydrophobicContact CD1-CD1 3.8Å; F70-L74 VanDerWaalsContact O-CB 3.29Å; F70-L74 WeakPolarHBondContact O-CB 3.2Å; F70-L74 PolarHBondContact O-N 3.24Å; F70-F176 HydrophobicContact CB-CE2 4.33Å; F70-F176 HydrophobicContact CB-CZ 3.75Å
71G98.2Very high97.6Very high0 Ų034.8 Ų34.80%019%0.188CC..Iπ-helixtrans-56.7-54.7176.600000111.9M66 I67 G69 W73 V75 F156M66-G71 PolarHBondContact O-N 3.11Å; I67-G71 VanDerWaalsContact O-CA 3.29Å; I67-G71 WeakPolarHBondContact O-CA 3.49Å; I67-G71 PolarHBondContact O-N 3Å; G69-G71 VanDerWaalsContact C-N 3.35Å; G69-G71 PolarHBondContact O-N 3.46Å; G71-W73 VanDerWaalsContact C-N 3.34Å; G71-W73 PolarHBondContact O-N 3.49Å; G71-V75 WeakPolarHBondContact O-CB 3.46Å; G71-V75 VanDerWaalsContact O-CG2 3.31Å; G71-V75 WeakPolarHBondContact O-CG2 3.49Å; G71-V75 PolarHBondContact O-N 3.46Å; G71-F156 WeakPolarHBondContact O-CE1 3.47Å
72N98.3Very high97.4Very high1 Ų138.3 Ų38.31%0.00521%0.214CC..Hα-helixtrans-66.2-35.6-179.9-80.5-69.2000113.1H4 G68 G69 P76 N90H4-N72 PolarHBondContact ND1-O 2.86Å; G68-N72 WeakPolarHBondContact O-CB 3.29Å; G68-N72 PolarHBondContact O-N 2.87Å; G68-N72 PolarHBondContact O-ND2 2.92Å; G69-N72 PolarHBondContact O-N 3.41Å; N72-P76 WeakPolarHBondContact O-CD 3.35Å; N72-N90 PolarHBondContact ND2-OD1 3.42Å; N72-N90 PolarHBondContact OD1-ND2 3.42Å; N72-N90 PolarHBondContact OD1-OD1 2.94Å
73W97.8Very high97.4Very high90 Ų9036.5 Ų36.534%0.34120%0.201SC..Hα-helixtrans-72-47-178.3-165.3-86.1000112.3K5 T9 F12 G69 F70 G71 L77K5-W73 HydrophobicContact CB-CE3 3.87Å; K5-W73 HydrophobicContact CB-CH2 4.13Å; K5-W73 HydrophobicContact CB-CZ3 3.61Å; K5-W73 HydrophobicContact CG-CE3 4.42Å; K5-W73 HydrophobicContact CG-CZ3 4.43Å; K5-W73 VanDerWaalsContact O-CE3 3.26Å; K5-W73 WeakPolarHBondContact O-CZ3 3.15Å; T9-W73 WeakPolarHBondContact OG1-CZ3 3.28Å; F12-W73 HydrophobicContact CE2-CB 4.35Å; G69-W73 VanDerWaalsContact O-CB 3.27Å; G69-W73 WeakPolarHBondContact O-CB 3.49Å; G69-W73 PolarHBondContact O-N 3.16Å; F70-W73 PolarHBondContact O-N 3.01Å; G71-W73 VanDerWaalsContact C-N 3.34Å; G71-W73 PolarHBondContact O-N 3.49Å; W73-L77 VanDerWaalsContact O-CD1 3.25Å; W73-L77 WeakPolarHBondContact O-CD1 3.4Å; W73-L77 WeakPolarHBondContact O-CG 3.23Å
74L98.4Very high97.4Very high47 Ų4736 Ų3625%0.24620%0.199CC..Hα-helixtrans-98.1-35.2-166.4-62.7174.1000113.8F70 L77 M78 F176F70-L74 HydrophobicContact CB-CD1 4.32Å; F70-L74 HydrophobicContact CD1-CD1 3.8Å; F70-L74 VanDerWaalsContact O-CB 3.29Å; F70-L74 WeakPolarHBondContact O-CB 3.2Å; F70-L74 PolarHBondContact O-N 3.24Å; L74-L77 PolarHBondContact O-N 3.47Å; L74-M78 HydrophobicContact CB-CE 4.09Å; L74-M78 HydrophobicContact CB-SD 4.31Å; L74-M78 HydrophobicContact CD1-CE 4.23Å; L74-M78 HydrophobicContact CD2-CE 4.44Å; L74-M78 HydrophobicContact CG-CE 4.5Å; L74-M78 WeakPolarHBondContact O-CB 3.29Å; L74-M78 VanDerWaalsContact O-CG 3.32Å; L74-M78 WeakPolarHBondContact O-CG 3.45Å; L74-M78 PolarHBondContact O-N 3.17Å; L74-F176 HydrophobicContact CB-CD1 4.24Å; L74-F176 HydrophobicContact CB-CE1 3.8Å; L74-F176 HydrophobicContact CD1-CD1 4.46Å; L74-F176 HydrophobicContact CD1-CE1 4.07Å; L74-F176 HydrophobicContact CD1-CZ 4.29Å
75V98.3Very high97.4Very high0 Ų037.1 Ų37.10%021%0.209CC..Hα-helixtrans-60.6-50.4-172.4171.40000112.2G71 L77 M78 L79 F156 V160 F176 V177 V180G71-V75 WeakPolarHBondContact O-CB 3.46Å; G71-V75 VanDerWaalsContact O-CG2 3.31Å; G71-V75 WeakPolarHBondContact O-CG2 3.49Å; G71-V75 PolarHBondContact O-N 3.46Å; V75-L77 VanDerWaalsContact C-N 3.3Å; V75-L77 PolarHBondContact O-N 3.15Å; V75-M78 PolarHBondContact O-N 3.08Å; V75-L79 HydrophobicContact CG1-CD1 3.93Å; V75-L79 WeakPolarHBondContact O-CG 3.5Å; V75-L79 PolarHBondContact O-N 3.16Å; V75-L79 VanDerWaalsContact O-N 3.11Å; V75-F156 HydrophobicContact CB-CD1 4.48Å; V75-F156 HydrophobicContact CB-CE1 4.39Å; V75-F156 HydrophobicContact CG1-CD1 4.46Å; V75-F156 HydrophobicContact CG2-CD1 4.43Å; V75-F156 HydrophobicContact CG2-CE1 4.33Å; V75-V160 HydrophobicContact CG1-CG2 3.74Å; V75-F176 HydrophobicContact CG2-CE1 4.04Å; V75-V177 HydrophobicContact CG1-CG1 4.37Å; V75-V180 HydrophobicContact CG2-CB 4.15Å; V75-V180 HydrophobicContact CG2-CG1 4.06Å; V75-V180 HydrophobicContact CG2-CG2 4.05Å
76P97.8Very high97.4Very high0 Ų039.2 Ų39.20%022%0.217CC..Hα-helixtrans-59.4-41.6176.8-27.338.3000112.6H4 N72 M78 L79 G80 A81 M84H4-P76 HydrophobicContact CB-CG 4.24Å; N72-P76 WeakPolarHBondContact O-CD 3.35Å; P76-M78 PolarHBondContact O-N 3.15Å; P76-L79 PolarHBondContact O-N 3.36Å; P76-G80 PolarHBondContact O-N 3Å; P76-A81 HydrophobicContact CB-CB 4.2Å; P76-A81 PolarHBondContact O-N 3Å; P76-M84 HydrophobicContact CG-CG 4.17Å; P76-M84 HydrophobicContact CG-SD 3.42Å; P76-M84 WeakPolarHBondContact CG-SD 3.43Å
77L97.7Very high97.4Very high81 Ų8136.9 Ų36.942%0.42421%0.208SC..Hα-helixtrans-63.1-45.4179.6-63.4-179.8000112.2W73 L74 V75 L79 G80W73-L77 VanDerWaalsContact O-CD1 3.25Å; W73-L77 WeakPolarHBondContact O-CD1 3.4Å; W73-L77 WeakPolarHBondContact O-CG 3.23Å; L74-L77 PolarHBondContact O-N 3.47Å; V75-L77 VanDerWaalsContact C-N 3.3Å; V75-L77 PolarHBondContact O-N 3.15Å; L77-L79 PolarHBondContact O-N 3.14Å; L77-G80 PolarHBondContact O-N 3.49Å; L77-G80 VanDerWaalsContact O-N 3.17Å
78M97.9Very high97.4Very high69 Ų6946.1 Ų46.134%0.3424%0.241SC..Hα-helixtrans-67.5-23.3179.5-74.6-177.7178.100113.1L74 V75 P76 P174 F176 V177L74-M78 HydrophobicContact CB-CE 4.09Å; L74-M78 HydrophobicContact CB-SD 4.31Å; L74-M78 HydrophobicContact CD1-CE 4.23Å; L74-M78 HydrophobicContact CD2-CE 4.44Å; L74-M78 HydrophobicContact CG-CE 4.5Å; L74-M78 WeakPolarHBondContact O-CB 3.29Å; L74-M78 VanDerWaalsContact O-CG 3.32Å; L74-M78 WeakPolarHBondContact O-CG 3.45Å; L74-M78 PolarHBondContact O-N 3.17Å; V75-M78 PolarHBondContact O-N 3.08Å; P76-M78 PolarHBondContact O-N 3.15Å; M78-P174 HydrophobicContact CB-CG 4.21Å; M78-P174 HydrophobicContact SD-CB 4.26Å; M78-F176 HydrophobicContact CE-CB 4.42Å; M78-F176 HydrophobicContact CE-CD1 4.15Å; M78-F176 HydrophobicContact SD-CB 4.12Å; M78-F176 HydrophobicContact SD-CD1 3.7Å; M78-F176 HydrophobicContact SD-CG 4.32Å; M78-V177 HydrophobicContact CB-CG2 3.72Å; M78-V177 HydrophobicContact SD-CG2 4.03Å
79L97.3Very high97.4Very high0 Ų048.6 Ų48.60%025%0.252CS..Hα-helixtrans-91.3-11.6175.1-67.8-179.1000113.6V75 P76 L77 A81 V160 R164 S165 M173 V177V75-L79 HydrophobicContact CG1-CD1 3.93Å; V75-L79 WeakPolarHBondContact O-CG 3.5Å; V75-L79 PolarHBondContact O-N 3.16Å; V75-L79 VanDerWaalsContact O-N 3.11Å; P76-L79 PolarHBondContact O-N 3.36Å; L77-L79 PolarHBondContact O-N 3.14Å; L79-A81 VanDerWaalsContact C-N 3.25Å; L79-A81 HydrophobicContact CB-CB 4.41Å; L79-V160 HydrophobicContact CD1-CB 4.2Å; L79-V160 HydrophobicContact CD1-CG1 4.33Å; L79-V160 HydrophobicContact CD1-CG2 3.93Å; L79-R164 HydrophobicContact CD1-CG 4.37Å; L79-R164 HydrophobicContact CD2-CG 3.84Å; L79-S165 WeakPolarHBondContact O-CB 3.32Å; L79-S165 PolarHBondContact O-N 2.96Å; L79-S165 PolarHBondContact O-OG 3.32Å; L79-S165 VanDerWaalsContact O-OG 3.05Å; L79-M173 HydrophobicContact CD2-CG 4.41Å; L79-M173 HydrophobicContact CD2-SD 4.34Å; L79-V177 HydrophobicContact CD1-CG1 4.33Å; L79-V177 HydrophobicContact CD2-CG1 4Å; L79-V177 HydrophobicContact CD2-CG2 4.45Å; L79-V177 HydrophobicContact CG-CG1 4.3Å
80G96.4Very high97.4Very high54 Ų5448.7 Ų48.756%0.55725%0.253SS*.THydrogen-bonded Turntrans69.722.8-16900000113.2P76 L77P76-G80 PolarHBondContact O-N 3Å; L77-G80 PolarHBondContact O-N 3.49Å; L77-G80 VanDerWaalsContact O-N 3.17Å
81A96.5Very high97.3Very high9 Ų947.3 Ų47.37%0.07425%0.249CC..  trans-81.5142.6177.200000110.7P76 L79 M163P76-A81 HydrophobicContact CB-CB 4.2Å; P76-A81 PolarHBondContact O-N 3Å; L79-A81 VanDerWaalsContact C-N 3.25Å; L79-A81 HydrophobicContact CB-CB 4.41Å; A81-M163 HydrophobicContact CB-CB 3.99Å; A81-M163 HydrophobicContact CB-CE 4.48Å; A81-M163 WeakPolarHBondContact CB-O 3.24Å
82P95.2Very high97.3Very high116 Ų11652.3 Ų52.375%0.75327%0.274SS*.SBendtrans-70.7-29.617927.5-34.7000113.5M163P82-M163 HydrophobicContact CG-CE 4.36Å
83D96.4Very high97.2Very high35 Ų3552.2 Ų52.219%0.18727%0.273CS..SBendtrans-161.7-175.5177.7-155.5-9.8000109.3H4 M163H4-D83 WeakPolarHBondContact CB-OD1 3.4Å; H4-D83 IonicContact CD2-OD1 3.37Å; H4-D83 PolarHBondContact CD2-OD1 3.22Å; H4-D83 IonicContact CG-OD1 3.61Å; H4-D83 PolarHBondContact N-OD1 3.12Å; H4-D83 VanDerWaalsContact N-OD1 3.11Å; D83-M163 WeakPolarHBondContact O-CE 3.07Å
84M97.3Very high97.3Very high3 Ų348.4 Ų48.42%0.01526%0.259CS..  trans-71.3156.9168.5-61.3-65.6-71.900112.1H4 P76 F86 P87 N155 F156 T159H4-M84 HydrophobicContact CB-CG 3.83Å; P76-M84 HydrophobicContact CG-CG 4.17Å; P76-M84 HydrophobicContact CG-SD 3.42Å; P76-M84 WeakPolarHBondContact CG-SD 3.43Å; M84-F86 VanDerWaalsContact C-N 3.32Å; M84-F86 PolarHBondContact O-N 3.33Å; M84-P87 VanDerWaalsContact O-CD 3.29Å; M84-P87 WeakPolarHBondContact O-CD 3.25Å; M84-P87 VanDerWaalsContact O-CG 3.31Å; M84-P87 WeakPolarHBondContact O-CG 3.38Å; M84-N155 HydrophobicContact CE-CB 4.4Å; M84-N155 WeakPolarHBondContact CE-ND2 3.36Å; M84-F156 HydrophobicContact CE-CD1 3.45Å; M84-F156 VanDerWaalsContact CE-CD1 3.45Å; M84-F156 HydrophobicContact CE-CE1 3.5Å; M84-F156 HydrophobicContact CE-CG 4.1Å; M84-F156 HydrophobicContact CE-CZ 4.23Å; M84-F156 HydrophobicContact SD-CD1 4.46Å; M84-F156 HydrophobicContact SD-CE1 4.22Å; M84-T159 HydrophobicContact SD-CG2 4.07Å
85A97.4Very high97.3Very high28 Ų2852.1 Ų52.123%0.23127%0.27CS..SBendtrans-61.4-37.8178.800000113.2P87 N155 T158 T159 M163A85-P87 WeakPolarHBondContact O-CD 3.43Å; A85-N155 PolarHBondContact N-OD1 3.47Å; A85-T158 HydrophobicContact CB-CG2 3.7Å; A85-T159 WeakPolarHBondContact CB-OG1 3.47Å; A85-T159 PolarHBondContact N-OG1 3.32Å; A85-M163 WeakPolarHBondContact CA-SD 3.3Å; A85-M163 HydrophobicContact CB-SD 3.7Å; A85-M163 PolarHBondContact N-SD 3.45Å
86F97.8Very high97.3Very high82 Ų8253.4 Ų53.436%0.3628%0.277SS..  trans-123.876.2178.7-52.2-57.3000111.7M84 R88 M89 N90 V154 N155 T158M84-F86 VanDerWaalsContact C-N 3.32Å; M84-F86 PolarHBondContact O-N 3.33Å; F86-R88 VanDerWaalsContact C-N 3.3Å; F86-R88 PolarHBondContact O-N 3.31Å; F86-M89 HydrophobicContact CB-CB 3.69Å; F86-M89 HydrophobicContact CB-SD 4.36Å; F86-M89 HydrophobicContact CD2-CE 4.29Å; F86-M89 HydrophobicContact CD2-SD 4.18Å; F86-M89 HydrophobicContact CG-CE 4.44Å; F86-M89 PolarHBondContact O-N 3.18Å; F86-M89 VanDerWaalsContact O-N 3.15Å; F86-N90 PolarHBondContact O-N 2.89Å; F86-V154 HydrophobicContact CE2-CG1 4.29Å; F86-N155 HydrophobicContact CD2-CB 4.32Å; F86-N155 PolarHBondContact N-OD1 2.99Å; F86-T158 HydrophobicContact CE2-CG2 3.72Å; F86-T158 WeakPolarHBondContact CE2-OG1 3.15Å; F86-T158 HydrophobicContact CZ-CG2 3.74Å
87P96.9Very high97.3Very high44 Ų4453.6 Ų53.629%0.28628%0.278SS..Hα-helixtrans-60.4-33.8-174-25.835.4000114.4M84 A85 N90 N91M84-P87 VanDerWaalsContact O-CD 3.29Å; M84-P87 WeakPolarHBondContact O-CD 3.25Å; M84-P87 VanDerWaalsContact O-CG 3.31Å; M84-P87 WeakPolarHBondContact O-CG 3.38Å; A85-P87 WeakPolarHBondContact O-CD 3.43Å; P87-N90 WeakPolarHBondContact O-CB 2.93Å; P87-N90 PolarHBondContact O-N 3.33Å; P87-N91 PolarHBondContact O-N 2.9Å
88R96.6Very high97.4Very high224 Ų22451.6 Ų51.685%0.84527%0.269SS*.Hα-helixtrans-72.3-40.3177.5-65.8-176.6-175.7173.31.4112.4F86 N90 N91 M92F86-R88 VanDerWaalsContact C-N 3.3Å; F86-R88 PolarHBondContact O-N 3.31Å; R88-N90 VanDerWaalsContact C-N 3.26Å; R88-N90 PolarHBondContact O-N 3.47Å; R88-N91 PolarHBondContact O-N 3.32Å; R88-M92 PolarHBondContact O-N 2.96Å
89M96.3Very high97.4Very high57 Ų5751 Ų5128%0.28127%0.271SS..Hα-helixtrans-62.8-38.3173.8-174.5-174.8-6900110.3F86 M92 S93 L151 V154F86-M89 HydrophobicContact CB-CB 3.69Å; F86-M89 HydrophobicContact CB-SD 4.36Å; F86-M89 HydrophobicContact CD2-CE 4.29Å; F86-M89 HydrophobicContact CD2-SD 4.18Å; F86-M89 HydrophobicContact CG-CE 4.44Å; F86-M89 PolarHBondContact O-N 3.18Å; F86-M89 VanDerWaalsContact O-N 3.15Å; M89-M92 WeakPolarHBondContact O-CB 3.34Å; M89-M92 PolarHBondContact O-N 2.86Å; M89-S93 PolarHBondContact O-N 3.43Å; M89-L151 HydrophobicContact CE-CD2 4.47Å; M89-L151 HydrophobicContact CG-CB 3.91Å; M89-L151 HydrophobicContact CG-CD1 4.44Å; M89-L151 HydrophobicContact CG-CD2 3.89Å; M89-L151 HydrophobicContact CG-CG 4.28Å; M89-L151 HydrophobicContact SD-CB 4.31Å; M89-L151 HydrophobicContact SD-CD2 3.98Å; M89-V154 HydrophobicContact SD-CG1 4.5Å
90N97.6Very high97.5Very high1 Ų151 Ų511%0.00527%0.271CS..Hα-helixtrans-62.6-40.9174.1-159.339.1000113.6N72 F86 P87 R88 S93 F94 N155N72-N90 PolarHBondContact ND2-OD1 3.42Å; N72-N90 PolarHBondContact OD1-ND2 3.42Å; N72-N90 PolarHBondContact OD1-OD1 2.94Å; F86-N90 PolarHBondContact O-N 2.89Å; P87-N90 WeakPolarHBondContact O-CB 2.93Å; P87-N90 PolarHBondContact O-N 3.33Å; R88-N90 VanDerWaalsContact C-N 3.26Å; R88-N90 PolarHBondContact O-N 3.47Å; N90-S93 PolarHBondContact O-N 2.96Å; N90-S93 PolarHBondContact O-OG 3.38Å; N90-F94 PolarHBondContact O-N 3.13Å; N90-N155 WeakPolarHBondContact CB-ND2 3.43Å
91N97.3Very high97.6Very high53 Ų5348.8 Ų48.828%0.28325%0.246SC..Hα-helixtrans-66.1-42.3174.2-179.464.6000110.6I7 P87 R88 S93 F94 W95I7-N91 HydrophobicContact CD1-CB 4Å; I7-N91 VanDerWaalsContact CD1-OD1 3.31Å; I7-N91 WeakPolarHBondContact CD1-OD1 3.38Å; P87-N91 PolarHBondContact O-N 2.9Å; R88-N91 PolarHBondContact O-N 3.32Å; N91-S93 PolarHBondContact O-N 3.29Å; N91-F94 PolarHBondContact O-N 2.97Å; N91-W95 PolarHBondContact O-N 2.97Å; N91-W95 VanDerWaalsContact OD1-CD1 3.3Å; N91-W95 PolarHBondContact OD1-NE1 3.48Å; N91-W95 VanDerWaalsContact OD1-NE1 3.08Å
92M97.4Very high97.7Very high104 Ų10451.5 Ų51.551%0.51227%0.265SS..Hα-helixtrans-61.8-41.6176.1-176.5177.7177.400112.1R88 M89 F94 W95 L96 L151R88-M92 PolarHBondContact O-N 2.96Å; M89-M92 WeakPolarHBondContact O-CB 3.34Å; M89-M92 PolarHBondContact O-N 2.86Å; M92-F94 VanDerWaalsContact C-N 3.28Å; M92-F94 PolarHBondContact O-N 3.04Å; M92-W95 PolarHBondContact O-N 3.2Å; M92-L96 HydrophobicContact CE-CD1 4.47Å; M92-L96 HydrophobicContact CG-CD1 4.46Å; M92-L96 WeakPolarHBondContact O-CG 3.48Å; M92-L96 PolarHBondContact O-N 3.43Å; M92-L151 HydrophobicContact CE-CD1 4.41Å; M92-L151 HydrophobicContact CG-CD1 4.11Å; M92-L151 HydrophobicContact SD-CD1 4.09Å
93S97.8Very high97.9Very high0 Ų048.1 Ų48.10%024%0.24CC..Hα-helixtrans-57.8-43.2178.565.10000111.1Y11 M89 N90 N91 S148Y11-S93 VanDerWaalsContact OH-C 3.25Å; Y11-S93 WeakPolarHBondContact OH-CB 3.38Å; Y11-S93 PolarHBondContact OH-OG 2.85Å; M89-S93 PolarHBondContact O-N 3.43Å; N90-S93 PolarHBondContact O-N 2.96Å; N90-S93 PolarHBondContact O-OG 3.38Å; N91-S93 PolarHBondContact O-N 3.29Å; S93-S148 WeakPolarHBondContact CB-O 3.36Å; S93-S148 VanDerWaalsContact O-CB 3.26Å; S93-S148 WeakPolarHBondContact O-CB 3.42Å; S93-S148 PolarHBondContact O-OG 2.88Å
94F98.6Very high98Very high10 Ų1046.6 Ų46.64%0.04423%0.232CC..Hα-helixtrans-62.5-49.3175.4172.4-100.1000112.1I7 L10 Y11 F14 N90 N91 M92 L96 L97 P98I7-F94 HydrophobicContact CG2-CB 4.17Å; L10-F94 VanDerWaalsContact C-CE2 3.42Å; L10-F94 HydrophobicContact CB-CD1 4.2Å; L10-F94 HydrophobicContact CB-CD2 4.01Å; L10-F94 HydrophobicContact CB-CE1 3.85Å; L10-F94 HydrophobicContact CB-CE2 3.64Å; L10-F94 HydrophobicContact CB-CG 4.29Å; L10-F94 HydrophobicContact CB-CZ 3.57Å; L10-F94 HydrophobicContact CD1-CD1 4.16Å; L10-F94 HydrophobicContact CD1-CE1 4.02Å; L10-F94 HydrophobicContact CD2-CZ 4.47Å; L10-F94 HydrophobicContact CG-CE1 4.35Å; L10-F94 HydrophobicContact CG-CZ 4.41Å; L10-F94 WeakPolarHBondContact O-CE2 3.41Å; Y11-F94 AromaticContact CD1-CD2 3.98Å; Y11-F94 HydrophobicContact CD1-CD2 3.98Å; Y11-F94 HydrophobicContact CD2-CB 4.34Å; Y11-F94 HydrophobicContact CD2-CD2 4.02Å; Y11-F94 HydrophobicContact CE1-CD2 4.15Å; Y11-F94 HydrophobicContact CE2-CB 3.73Å; Y11-F94 HydrophobicContact CE2-CD2 4.16Å; Y11-F94 HydrophobicContact CE2-CG 4.42Å; Y11-F94 AromaticContact CG-CD2 3.91Å; Y11-F94 HydrophobicContact CG-CD2 3.91Å; Y11-F94 WeakPolarHBondContact OH-CA 3.28Å; Y11-F94 PolarHBondContact OH-N 3.24Å; Y11-F94 VanDerWaalsContact OH-N 3.12Å; F14-F94 HydrophobicContact CB-CE2 3.88Å; F14-F94 HydrophobicContact CB-CZ 4.33Å; F14-F94 HydrophobicContact CG-CE2 4.35Å; N90-F94 PolarHBondContact O-N 3.13Å; N91-F94 PolarHBondContact O-N 2.97Å; M92-F94 VanDerWaalsContact C-N 3.28Å; M92-F94 PolarHBondContact O-N 3.04Å; F94-L96 PolarHBondContact O-N 3.12Å; F94-L96 VanDerWaalsContact O-N 3.12Å; F94-L97 WeakPolarHBondContact O-CB 3.32Å; F94-L97 PolarHBondContact O-N 3.46Å; F94-P98 VanDerWaalsContact O-CD 3.28Å; F94-P98 WeakPolarHBondContact O-CD 3.45Å
95W98.4Very high98Very high125 Ų12548.6 Ų48.647%0.47324%0.243SC..Hα-helixtrans-69.5-11.3-171.9-77.1113.2000115.1N91 M92 L97 P98 P99N91-W95 PolarHBondContact O-N 2.97Å; N91-W95 VanDerWaalsContact OD1-CD1 3.3Å; N91-W95 PolarHBondContact OD1-NE1 3.48Å; N91-W95 VanDerWaalsContact OD1-NE1 3.08Å; M92-W95 PolarHBondContact O-N 3.2Å; W95-L97 VanDerWaalsContact C-N 3.34Å; W95-P98 HydrophobicContact CE3-CG 4.38Å; W95-P99 WeakPolarHBondContact O-CD 3.26Å
96L98.6Very high98.1Very high27 Ų2750 Ų5014%0.14125%0.248CC..THydrogen-bonded Turntrans-75.4-20.8169.5-69.9170.4000113.1M92 F94 P99 A100 L144 I147 L151M92-L96 HydrophobicContact CE-CD1 4.47Å; M92-L96 HydrophobicContact CG-CD1 4.46Å; M92-L96 WeakPolarHBondContact O-CG 3.48Å; M92-L96 PolarHBondContact O-N 3.43Å; F94-L96 PolarHBondContact O-N 3.12Å; F94-L96 VanDerWaalsContact O-N 3.12Å; L96-P99 WeakPolarHBondContact O-CD 3.28Å; L96-P99 WeakPolarHBondContact O-CG 3.43Å; L96-A100 VanDerWaalsContact O-CB 3.24Å; L96-A100 WeakPolarHBondContact O-CB 3.43Å; L96-A100 PolarHBondContact O-N 3.4Å; L96-L144 HydrophobicContact CD2-CD2 4.27Å; L96-I147 HydrophobicContact CD1-CB 4.1Å; L96-I147 HydrophobicContact CD1-CG2 3.55Å; L96-L151 HydrophobicContact CD1-CD1 4.07Å
97L98.7Very high98.1Very high4 Ų446.2 Ų46.22%0.02123%0.232CC..Hα-helixtrans-73.8-43.6-176.5-65.4-178.8000114.6Y11 F14 P64 F94 W95 A100 L101 A145Y11-L97 HydrophobicContact CD1-CD1 3.86Å; Y11-L97 HydrophobicContact CE1-CD1 3.43Å; Y11-L97 VanDerWaalsContact CE1-CD1 3.43Å; F14-L97 HydrophobicContact CD1-CB 4.35Å; F14-L97 HydrophobicContact CD1-CD1 4.16Å; F14-L97 HydrophobicContact CE1-CB 3.76Å; F14-L97 HydrophobicContact CE1-CD1 4Å; F14-L97 HydrophobicContact CE1-CG 4.46Å; F14-L97 HydrophobicContact CE2-CB 4.35Å; F14-L97 HydrophobicContact CZ-CB 3.74Å; P64-L97 HydrophobicContact CB-CD1 4.11Å; P64-L97 HydrophobicContact CG-CD1 3.72Å; F94-L97 WeakPolarHBondContact O-CB 3.32Å; F94-L97 PolarHBondContact O-N 3.46Å; W95-L97 VanDerWaalsContact C-N 3.34Å; L97-A100 WeakPolarHBondContact O-CB 3.37Å; L97-A100 PolarHBondContact O-N 3.4Å; L97-L101 PolarHBondContact O-N 3.29Å; L97-A145 HydrophobicContact CD2-CB 4.39Å
98P98.7Very high98.1Very high38 Ų3846 Ų4625%0.24723%0.232CC..Hα-helixtrans-56.4-50.3175.6-25.334.4000114.3F14 F94 W95 A100 L101 S102F14-P98 HydrophobicContact CD2-CG 4.34Å; F14-P98 HydrophobicContact CE2-CB 4.48Å; F14-P98 HydrophobicContact CE2-CG 4.23Å; F94-P98 VanDerWaalsContact O-CD 3.28Å; F94-P98 WeakPolarHBondContact O-CD 3.45Å; W95-P98 HydrophobicContact CE3-CG 4.38Å; P98-A100 VanDerWaalsContact C-N 3.31Å; P98-A100 PolarHBondContact O-N 3.43Å; P98-L101 PolarHBondContact O-N 3.43Å; P98-S102 PolarHBondContact O-N 3.11Å; P98-S102 PolarHBondContact O-OG 2.75Å; P98-S102 VanDerWaalsContact O-OG 3.13Å
99P98.7Very high98Very high58 Ų5842 Ų4238%0.37722%0.224SC..Hα-helixtrans-66.1-33.6176.525.4-32.5000112.3W95 L96 S102 L103 L144W95-P99 WeakPolarHBondContact O-CD 3.26Å; L96-P99 WeakPolarHBondContact O-CD 3.28Å; L96-P99 WeakPolarHBondContact O-CG 3.43Å; P99-S102 PolarHBondContact O-N 3.1Å; P99-L103 WeakPolarHBondContact O-CG 3.25Å; P99-L103 PolarHBondContact O-N 3.49Å; P99-L144 HydrophobicContact CB-CD1 4.28Å; P99-L144 HydrophobicContact CG-CD1 4.38Å
100A98.8Very high98Very high0 Ų041.4 Ų41.40%022%0.223CC..Hα-helixtrans-60.3-47.2173.600000111.8F60 L96 L97 P98 L103 L104 S141 L144 A145F60-A100 HydrophobicContact CE1-CB 3.67Å; F60-A100 HydrophobicContact CZ-CB 3.89Å; L96-A100 VanDerWaalsContact O-CB 3.24Å; L96-A100 WeakPolarHBondContact O-CB 3.43Å; L96-A100 PolarHBondContact O-N 3.4Å; L97-A100 WeakPolarHBondContact O-CB 3.37Å; L97-A100 PolarHBondContact O-N 3.4Å; P98-A100 VanDerWaalsContact C-N 3.31Å; P98-A100 PolarHBondContact O-N 3.43Å; A100-L103 PolarHBondContact O-N 2.94Å; A100-L104 PolarHBondContact O-N 2.87Å; A100-L104 VanDerWaalsContact O-N 3.11Å; A100-S141 VanDerWaalsContact O-CB 3.26Å; A100-S141 WeakPolarHBondContact O-CB 3.41Å; A100-S141 PolarHBondContact O-OG 3.39Å; A100-L144 HydrophobicContact CB-CB 3.63Å; A100-L144 HydrophobicContact CB-CD1 4.42Å; A100-A145 HydrophobicContact CB-CB 4.39Å
101L98.8Very high97.8Very high6 Ų648 Ų483%0.03125%0.254CS..Hα-helixtrans-64.9-41.2177.5-178.455.8000111.4F14 W17 A18 I56 F60 L97 P98 L103 L104 L105F14-L101 HydrophobicContact CE2-CB 4.3Å; F14-L101 HydrophobicContact CE2-CD2 3.78Å; F14-L101 HydrophobicContact CZ-CB 3.94Å; F14-L101 HydrophobicContact CZ-CD2 3.67Å; F14-L101 HydrophobicContact CZ-CG 4.47Å; W17-L101 HydrophobicContact CE3-CD2 4.05Å; W17-L101 HydrophobicContact CZ3-CD2 3.68Å; A18-L101 HydrophobicContact CB-CD2 3.96Å; I56-L101 HydrophobicContact CD1-CD1 4.49Å; I56-L101 HydrophobicContact CG1-CD1 4.02Å; F60-L101 HydrophobicContact CB-CD1 4.28Å; F60-L101 HydrophobicContact CD1-CB 3.78Å; F60-L101 HydrophobicContact CD1-CD1 4.18Å; F60-L101 HydrophobicContact CD1-CG 4.42Å; F60-L101 HydrophobicContact CD2-CD1 4.17Å; F60-L101 HydrophobicContact CE1-CB 3.81Å; F60-L101 HydrophobicContact CG-CB 4.4Å; F60-L101 HydrophobicContact CG-CD1 3.93Å; F60-L101 HydrophobicContact CZ-CB 4.47Å; L97-L101 PolarHBondContact O-N 3.29Å; P98-L101 PolarHBondContact O-N 3.43Å; L101-L103 VanDerWaalsContact C-N 3.32Å; L101-L103 PolarHBondContact O-N 3.47Å; L101-L104 HydrophobicContact CD1-CD2 4.46Å; L101-L104 WeakPolarHBondContact O-CB 3.38Å; L101-L104 PolarHBondContact O-N 2.99Å; L101-L104 VanDerWaalsContact O-N 3.15Å; L101-L105 HydrophobicContact CD1-CD1 4.49Å; L101-L105 HydrophobicContact CD1-CG 4.28Å; L101-L105 HydrophobicContact CG-CD1 4.26Å; L101-L105 HydrophobicContact CG-CG 4.47Å; L101-L105 WeakPolarHBondContact O-CG 3.43Å; L101-L105 PolarHBondContact O-N 3.02Å
102S98.6Very high97.7Very high67 Ų6751.5 Ų51.547%0.46927%0.273SS..Hα-helixtrans-58.1-44.2174.4-63.10000112P98 P99 L104 L105 V106P98-S102 PolarHBondContact O-N 3.11Å; P98-S102 PolarHBondContact O-OG 2.75Å; P98-S102 VanDerWaalsContact O-OG 3.13Å; P99-S102 PolarHBondContact O-N 3.1Å; S102-L104 VanDerWaalsContact C-N 3.31Å; S102-L104 PolarHBondContact O-N 2.9Å; S102-L105 PolarHBondContact O-N 3.03Å; S102-V106 WeakPolarHBondContact O-CB 3.3Å; S102-V106 VanDerWaalsContact O-CG2 3.26Å; S102-V106 WeakPolarHBondContact O-CG2 3.25Å; S102-V106 PolarHBondContact O-N 2.87Å
103L98.8Very high97.7Very high45 Ų4546.6 Ų46.624%0.23625%0.249CC..Hα-helixtrans-60.6-39.8175.8-73.3171000112.2P99 A100 L101 S107 L137 F140 L144P99-L103 WeakPolarHBondContact O-CG 3.25Å; P99-L103 PolarHBondContact O-N 3.49Å; A100-L103 PolarHBondContact O-N 2.94Å; L101-L103 VanDerWaalsContact C-N 3.32Å; L101-L103 PolarHBondContact O-N 3.47Å; L103-S107 WeakPolarHBondContact O-CB 3.4Å; L103-S107 PolarHBondContact O-N 3.44Å; L103-L137 HydrophobicContact CD2-CD2 3.83Å; L103-F140 HydrophobicContact CD1-CB 3.95Å; L103-L144 HydrophobicContact CD1-CD1 3.69Å; L103-L144 HydrophobicContact CD1-CG 4.48Å
104L98.6Very high97.6Very high3 Ų346.8 Ų46.82%0.01625%0.25CS..Hα-helixtrans-65.7-43.3176.3179.764000112F55 I56 F60 A100 L101 S102 S107 S108 S141F55-L104 HydrophobicContact CB-CD1 4.15Å; F55-L104 HydrophobicContact CB-CD2 3.62Å; F55-L104 HydrophobicContact CD2-CD1 3.79Å; F55-L104 HydrophobicContact CG-CD1 4.36Å; I56-L104 HydrophobicContact CG1-CD2 3.71Å; F60-L104 HydrophobicContact CD2-CD2 3.99Å; F60-L104 HydrophobicContact CE2-CD2 3.69Å; A100-L104 PolarHBondContact O-N 2.87Å; A100-L104 VanDerWaalsContact O-N 3.11Å; L101-L104 HydrophobicContact CD1-CD2 4.46Å; L101-L104 WeakPolarHBondContact O-CB 3.38Å; L101-L104 PolarHBondContact O-N 2.99Å; L101-L104 VanDerWaalsContact O-N 3.15Å; S102-L104 VanDerWaalsContact C-N 3.31Å; S102-L104 PolarHBondContact O-N 2.9Å; L104-S107 VanDerWaalsContact O-CB 3.25Å; L104-S107 WeakPolarHBondContact O-CB 3.5Å; L104-S107 PolarHBondContact O-N 2.86Å; L104-S108 PolarHBondContact O-N 3Å; L104-S141 WeakPolarHBondContact CB-OG 3.32Å
105L98.3Very high97.6Very high45 Ų4546.4 Ų46.424%0.23625%0.25CC..Hα-helixtrans-66.2-43.3178-65.2176.3000110.7V21 I56 L101 S102 S107 S108 M109V21-L105 HydrophobicContact CG1-CD2 4.43Å; I56-L105 HydrophobicContact CD1-CD2 4.17Å; L101-L105 HydrophobicContact CD1-CD1 4.49Å; L101-L105 HydrophobicContact CD1-CG 4.28Å; L101-L105 HydrophobicContact CG-CD1 4.26Å; L101-L105 HydrophobicContact CG-CG 4.47Å; L101-L105 WeakPolarHBondContact O-CG 3.43Å; L101-L105 PolarHBondContact O-N 3.02Å; S102-L105 PolarHBondContact O-N 3.03Å; L105-S107 VanDerWaalsContact C-N 3.31Å; L105-S107 PolarHBondContact O-N 2.97Å; L105-S108 WeakPolarHBondContact O-CB 3.34Å; L105-S108 PolarHBondContact O-N 3.21Å; L105-S108 VanDerWaalsContact O-N 3.08Å; L105-S108 PolarHBondContact O-OG 3.45Å; L105-M109 WeakPolarHBondContact O-CE 3.46Å; L105-M109 PolarHBondContact O-N 3.03Å
106V98.4Very high97.5Very high58 Ų5841 Ų4135%0.35223%0.23SC..Hα-helixtrans-64.1-38.5175.3177.20000111.1S102 S108 M109 V110 L137S102-V106 WeakPolarHBondContact O-CB 3.3Å; S102-V106 VanDerWaalsContact O-CG2 3.26Å; S102-V106 WeakPolarHBondContact O-CG2 3.25Å; S102-V106 PolarHBondContact O-N 2.87Å; V106-S108 PolarHBondContact O-N 3.12Å; V106-M109 HydrophobicContact CG2-CE 4.14Å; V106-M109 PolarHBondContact O-N 3.39Å; V106-V110 HydrophobicContact CG1-CG2 3.58Å; V106-V110 WeakPolarHBondContact O-CG2 3.36Å; V106-V110 PolarHBondContact O-N 3.16Å; V106-L137 HydrophobicContact CG1-CD1 3.84Å
107S98.4Very high97.4Very high2 Ų240.9 Ų40.91%0.01424%0.236CC..Hα-helixtrans-52.8-33.9171.4150.30000112.7L103 L104 L105 G113 A114 S134L103-S107 WeakPolarHBondContact O-CB 3.4Å; L103-S107 PolarHBondContact O-N 3.44Å; L104-S107 VanDerWaalsContact O-CB 3.25Å; L104-S107 WeakPolarHBondContact O-CB 3.5Å; L104-S107 PolarHBondContact O-N 2.86Å; L105-S107 VanDerWaalsContact C-N 3.31Å; L105-S107 PolarHBondContact O-N 2.97Å; S107-G113 VanDerWaalsContact O-CA 3.29Å; S107-G113 WeakPolarHBondContact O-CA 3.35Å; S107-A114 PolarHBondContact O-N 3.16Å; S107-A114 WeakPolarHBondContact OG-CB 3.23Å; S107-S134 VanDerWaalsContact CB-O 3.25Å; S107-S134 WeakPolarHBondContact CB-O 3.16Å; S107-S134 WeakPolarHBondContact O-CB 3.35Å; S107-S134 PolarHBondContact OG-O 3.47Å
108S96.1Very high97.3Very high40 Ų4043.5 Ų43.528%0.2825%0.245SC..Hα-helixtrans-79.4-16.2177.173.20000114.7L104 L105 V106L104-S108 PolarHBondContact O-N 3Å; L105-S108 WeakPolarHBondContact O-CB 3.34Å; L105-S108 PolarHBondContact O-N 3.21Å; L105-S108 VanDerWaalsContact O-N 3.08Å; L105-S108 PolarHBondContact O-OG 3.45Å; V106-S108 PolarHBondContact O-N 3.12Å
109M95.8Very high97.2Very high139 Ų13942.6 Ų42.669%0.68524%0.239SC*.Hα-helixtrans-108.8-14.7-174.2-63.7-176.6-68.600113.8L105 V106L105-M109 WeakPolarHBondContact O-CE 3.46Å; L105-M109 PolarHBondContact O-N 3.03Å; V106-M109 HydrophobicContact CG2-CE 4.14Å; V106-M109 PolarHBondContact O-N 3.39Å
110V95.7Very high97.1Very high44 Ų4440 Ų4027%0.26722%0.222SC..SBendtrans-95.7137.6-178.7168.50000109.9V106 N112 G113 S134 L137V106-V110 HydrophobicContact CG1-CG2 3.58Å; V106-V110 WeakPolarHBondContact O-CG2 3.36Å; V106-V110 PolarHBondContact O-N 3.16Å; V110-N112 PolarHBondContact O-N 2.83Å; V110-G113 PolarHBondContact O-N 2.81Å; V110-S134 WeakPolarHBondContact O-CB 3.36Å; V110-L137 HydrophobicContact CB-CD1 4.29Å; V110-L137 HydrophobicContact CG1-CD1 4.44Å; V110-L137 HydrophobicContact CG2-CD1 4.29Å
111E94.5Very high97.1Very high140 Ų14042.7 Ų42.765%0.65423%0.233SC*.THydrogen-bonded Turntrans51.1-134-175.2-54.2-57.3152.800111.2G113E111-G113 VanDerWaalsContact C-N 3.28Å; E111-G113 PolarHBondContact O-N 3.31Å
112N93.8Very high97Very high127 Ų12742.9 Ų42.968%0.67923%0.234SC*.THydrogen-bonded Turntrans-89.415.3176.6-66-32.9000113.4Q44 V48 V110Q44-N112 HydrophobicContact CG-CB 4.26Å; Q44-N112 WeakPolarHBondContact CG-O 3.27Å; Q44-N112 PolarHBondContact NE2-O 2.67Å; V48-N112 WeakPolarHBondContact CG2-O 3.31Å; V110-N112 PolarHBondContact O-N 2.83Å
113G97Very high96.9Very high0 Ų043.5 Ų43.50%024%0.237CC..  trans67.5171.8-176.400000114.4S107 V110 E111 G115 S134S107-G113 VanDerWaalsContact O-CA 3.29Å; S107-G113 WeakPolarHBondContact O-CA 3.35Å; V110-G113 PolarHBondContact O-N 2.81Å; E111-G113 VanDerWaalsContact C-N 3.28Å; E111-G113 PolarHBondContact O-N 3.31Å; G113-G115 PolarHBondContact O-N 3.34Å; G113-S134 WeakPolarHBondContact O-CB 3.49Å; G113-S134 PolarHBondContact O-OG 3.42Å
114A97.4Very high96.8Very high4 Ų445.6 Ų45.63%0.03325%0.248CC..  trans-88.982.3174.900000111T51 S107 T116 V135 A138T51-A114 VanDerWaalsContact CB-O 3.25Å; T51-A114 WeakPolarHBondContact CB-O 3.43Å; T51-A114 VanDerWaalsContact CG2-O 3.3Å; T51-A114 WeakPolarHBondContact CG2-O 3.04Å; T51-A114 PolarHBondContact OG1-O 3.12Å; S107-A114 PolarHBondContact O-N 3.16Å; S107-A114 WeakPolarHBondContact OG-CB 3.23Å; A114-T116 VanDerWaalsContact C-N 3.31Å; A114-T116 PolarHBondContact O-N 3.35Å; A114-V135 HydrophobicContact CB-CG2 4.36Å; A114-A138 HydrophobicContact CB-CB 4.11Å
115G97.1Very high96.7Very high3 Ų345.4 Ų45.43%0.03125%0.247CC..  trans-90.838.2-178.600000114.3G113 H130G113-G115 PolarHBondContact O-N 3.34Å; G115-H130 PolarHBondContact N-NE2 3.36Å
116T97Very high96.6Very high11 Ų1144.1 Ų44.17%0.06724%0.243CC..SBendtrans-99.4-0.5-168.862.20000114.1A114 L124 V135A114-T116 VanDerWaalsContact C-N 3.31Å; A114-T116 PolarHBondContact O-N 3.35Å; T116-L124 HydrophobicContact CG2-CG 4.47Å; T116-V135 HydrophobicContact CG2-CG2 3.95Å
117G96.7Very high96.4Very high25 Ų2543 Ų4326%0.25824%0.243SC..THydrogen-bonded Turntrans76.5164-164.800000111.8T51 T119 V120T51-G117 VanDerWaalsContact OG1-CA 3.24Å; T51-G117 WeakPolarHBondContact OG1-CA 3.48Å; T51-G117 PolarHBondContact OG1-N 2.93Å; G117-T119 PolarHBondContact O-N 2.78Å; G117-T119 VanDerWaalsContact O-N 3.17Å; G117-V120 PolarHBondContact O-N 3.26Å; G117-V120 VanDerWaalsContact O-N 3.15Å
118W96.3Very high96.1Very high58 Ų5849.7 Ų49.722%0.2228%0.277CS..THydrogen-bonded Turntrans-67.7-15.4-178.381.6-79000113.6A54 F55 I58 F227 W228 F235A54-W118 HydrophobicContact CB-CB 3.51Å; A54-W118 HydrophobicContact CB-CG 4.05Å; F55-W118 HydrophobicContact CD1-CB 4.42Å; F55-W118 HydrophobicContact CE1-CB 4.12Å; F55-W118 WeakPolarHBondContact CE1-O 3.42Å; F55-W118 HydrophobicContact CZ-CB 4.34Å; F55-W118 VanDerWaalsContact CZ-O 3.23Å; F55-W118 WeakPolarHBondContact CZ-O 3.35Å; I58-W118 HydrophobicContact CD1-CE3 4.08Å; I58-W118 HydrophobicContact CD1-CZ3 4.32Å; W118-F227 HydrophobicContact CD2-CZ 4.31Å; W118-F227 AromaticContact CE3-CZ 3.75Å; W118-F227 HydrophobicContact CE3-CZ 3.75Å; W118-F227 AromaticContact CH2-CE1 3.51Å; W118-F227 HydrophobicContact CH2-CE1 3.51Å; W118-F227 AromaticContact CH2-CZ 3.53Å; W118-F227 HydrophobicContact CH2-CZ 3.53Å; W118-F227 HydrophobicContact CZ2-CE1 4.02Å; W118-F227 HydrophobicContact CZ2-CZ 4.18Å; W118-F227 AromaticContact CZ3-CE1 3.85Å; W118-F227 HydrophobicContact CZ3-CE1 3.85Å; W118-F227 HydrophobicContact CZ3-CE2 4.44Å; W118-F227 AromaticContact CZ3-CZ 3.34Å; W118-F227 HydrophobicContact CZ3-CZ 3.34Å; W118-W228 HydrophobicContact CH2-CH2 4.22Å; W118-W228 HydrophobicContact CH2-CZ3 4.19Å; W118-W228 AromaticContact CZ2-CH2 3.78Å; W118-W228 HydrophobicContact CZ2-CH2 3.78Å; W118-W228 HydrophobicContact CZ2-CZ3 4.18Å; W118-F235 AromaticContact CH2-CE2 3.42Å; W118-F235 HydrophobicContact CH2-CE2 3.42Å; W118-F235 VanDerWaalsContact CH2-CE2 3.42Å; W118-F235 AromaticContact CH2-CZ 3.45Å; W118-F235 HydrophobicContact CH2-CZ 3.45Å; W118-F235 VanDerWaalsContact CH2-CZ 3.45Å; W118-F235 HydrophobicContact CZ2-CE2 4.23Å; W118-F235 HydrophobicContact CZ2-CZ 4.21Å; W118-F235 AromaticContact CZ3-CE2 3.99Å; W118-F235 HydrophobicContact CZ3-CE2 3.99Å; W118-F235 AromaticContact CZ3-CZ 3.65Å; W118-F235 HydrophobicContact CZ3-CZ 3.65Å
119T96.7Very high96Very high19 Ų1950.6 Ų50.612%0.11729%0.286CS..THydrogen-bonded Turntrans-85.1-17.4176.3630000113.3G117 Y121 Y223 F227 W228G117-T119 PolarHBondContact O-N 2.78Å; G117-T119 VanDerWaalsContact O-N 3.17Å; T119-Y121 VanDerWaalsContact C-N 3.3Å; T119-Y121 HydrophobicContact CG2-CE1 4.35Å; T119-Y121 HydrophobicContact CG2-CE2 4.35Å; T119-Y121 PolarHBondContact O-N 3.04Å; T119-Y121 WeakPolarHBondContact OG1-CD2 3.42Å; T119-Y121 WeakPolarHBondContact OG1-CE2 3.35Å; T119-Y223 WeakPolarHBondContact O-CE1 3.48Å; T119-Y223 PolarHBondContact O-OH 3.36Å; T119-F227 HydrophobicContact CG2-CD1 4.41Å; T119-F227 HydrophobicContact CG2-CE1 3.69Å; T119-F227 HydrophobicContact CG2-CZ 3.92Å; T119-W228 HydrophobicContact CG2-CZ2 4.37Å
120V97.4Very high96Very high4 Ų444.6 Ų44.62%0.02426%0.257CS..THydrogen-bonded Turntrans54.741.4173.7-158.90000113.1F55 G117 S125 V135 L201F55-V120 HydrophobicContact CE2-CG2 4.22Å; F55-V120 HydrophobicContact CZ-CG2 3.56Å; G117-V120 PolarHBondContact O-N 3.26Å; G117-V120 VanDerWaalsContact O-N 3.15Å; V120-S125 VanDerWaalsContact O-CB 3.31Å; V120-S125 WeakPolarHBondContact O-CB 3.42Å; V120-S125 PolarHBondContact O-OG 3.19Å; V120-V135 HydrophobicContact CG1-CG1 4.1Å; V120-L201 HydrophobicContact CG1-CD2 3.8Å
121Y97.9Very high95.7Very high57 Ų5745.8 Ų45.822%0.22428%0.278CS..  trans-68.9130-174.9-69.9-26.2000113.8T119 L124 S125 Y223 Q224 F227 W228T119-Y121 VanDerWaalsContact C-N 3.3Å; T119-Y121 HydrophobicContact CG2-CE1 4.35Å; T119-Y121 HydrophobicContact CG2-CE2 4.35Å; T119-Y121 PolarHBondContact O-N 3.04Å; T119-Y121 WeakPolarHBondContact OG1-CD2 3.42Å; T119-Y121 WeakPolarHBondContact OG1-CE2 3.35Å; Y121-L124 WeakPolarHBondContact O-CB 3.37Å; Y121-L124 PolarHBondContact O-N 2.95Å; Y121-S125 PolarHBondContact O-N 3.49Å; Y121-S125 PolarHBondContact O-OG 3.15Å; Y121-Y223 AromaticContact CD1-CD1 3.52Å; Y121-Y223 HydrophobicContact CD1-CD1 3.52Å; Y121-Y223 AromaticContact CD1-CE1 3.66Å; Y121-Y223 HydrophobicContact CD1-CE1 3.66Å; Y121-Y223 AromaticContact CE1-CD1 3.99Å; Y121-Y223 HydrophobicContact CE1-CD1 3.99Å; Y121-Y223 HydrophobicContact CE1-CE1 4.11Å; Y121-Q224 HydrophobicContact CD1-CG 4.13Å; Y121-Q224 HydrophobicContact CE1-CB 4.32Å; Y121-Q224 HydrophobicContact CE1-CG 3.77Å; Y121-Q224 HydrophobicContact CE2-CG 4.37Å; Y121-F227 HydrophobicContact CE1-CD1 4.44Å; Y121-F227 HydrophobicContact CE1-CG 4.46Å; Y121-W228 AromaticContact CZ-NE1 3.99Å; Y121-W228 VanDerWaalsContact OH-CE2 3.28Å; Y121-W228 PolarHBondContact OH-NE1 2.86Å
122P96.8Very high95.7Very high10 Ų1040.1 Ų40.17%0.06526%0.257CS..THydrogen-bonded Turntrans-70.2153.6162.129.3-31.5000110.1L124 S125 L201 F212 Y223P122-L124 VanDerWaalsContact C-N 3.35Å; P122-S125 VanDerWaalsContact N-OG 3.11Å; P122-L201 HydrophobicContact CB-CD1 4.12Å; P122-L201 HydrophobicContact CG-CD1 4.43Å; P122-F212 HydrophobicContact CB-CB 3.95Å; P122-F212 HydrophobicContact CG-CB 3.57Å; P122-F212 HydrophobicContact CG-CD2 4.1Å; P122-F212 HydrophobicContact CG-CG 3.85Å; P122-Y223 VanDerWaalsContact CD-CG 3.42Å; P122-Y223 HydrophobicContact CG-CD2 4.02Å; P122-Y223 HydrophobicContact CG-CG 3.88Å
123P96.1Very high95.9Very high80 Ų8036.2 Ų36.252%0.51924%0.243SC..THydrogen-bonded Turncis-81.1-4.82.433.6-36000114.1S125 A126P123-S125 VanDerWaalsContact C-N 3.29Å; P123-S125 PolarHBondContact O-N 3.48Å; P123-A126 VanDerWaalsContact O-CB 3.31Å; P123-A126 WeakPolarHBondContact O-CB 3.31Å; P123-A126 PolarHBondContact O-N 3.46Å
124L97.3Very high95.9Very high88 Ų8836.3 Ų36.346%0.46124%0.243SC..THydrogen-bonded Turntrans-60.9-38.9-178.7-179.263.3000112T116 Y121 P122 A126 A129 H130T116-L124 HydrophobicContact CG2-CG 4.47Å; Y121-L124 WeakPolarHBondContact O-CB 3.37Å; Y121-L124 PolarHBondContact O-N 2.95Å; P122-L124 VanDerWaalsContact C-N 3.35Å; L124-A126 VanDerWaalsContact C-N 3.32Å; L124-A129 HydrophobicContact CD1-CB 4.18Å; L124-A129 WeakPolarHBondContact O-CB 3.43Å; L124-H130 PolarHBondContact O-ND1 3.41Å
125S96.8Very high96Very high0 Ų036.1 Ų36.10%024%0.242CC..THydrogen-bonded Turntrans-83-2.4175.463.50000114.5V120 Y121 P122 P123 L201 R205V120-S125 VanDerWaalsContact O-CB 3.31Å; V120-S125 WeakPolarHBondContact O-CB 3.42Å; V120-S125 PolarHBondContact O-OG 3.19Å; Y121-S125 PolarHBondContact O-N 3.49Å; Y121-S125 PolarHBondContact O-OG 3.15Å; P122-S125 VanDerWaalsContact N-OG 3.11Å; P123-S125 VanDerWaalsContact C-N 3.29Å; P123-S125 PolarHBondContact O-N 3.48Å; S125-L201 WeakPolarHBondContact OG-CD2 3.27Å; S125-R205 WeakPolarHBondContact O-CD 3.18Å; S125-R205 PolarHBondContact O-NH1 2.88Å
126A95.9Very high96.1Very high18 Ų1836.7 Ų36.715%0.14924%0.244CC..SBendtrans-81.3167.5177.400000111.8P123 L124 I128 A129 H130P123-A126 VanDerWaalsContact O-CB 3.31Å; P123-A126 WeakPolarHBondContact O-CB 3.31Å; P123-A126 PolarHBondContact O-N 3.46Å; L124-A126 VanDerWaalsContact C-N 3.32Å; A126-I128 PolarHBondContact O-N 3.08Å; A126-I128 VanDerWaalsContact O-N 3.13Å; A126-A129 PolarHBondContact O-N 2.87Å; A126-A129 VanDerWaalsContact O-N 3.17Å; A126-H130 PolarHBondContact O-N 2.73Å
127G93.1Very high96.1Very high34 Ų3437.9 Ų37.935%0.35125%0.249SC..THydrogen-bonded Turntrans-60.6-23.5-177.900000114.5A129 G131G127-A129 VanDerWaalsContact C-N 3.33Å; G127-A129 PolarHBondContact O-N 3.26Å; G127-G131 VanDerWaalsContact O-CA 3.27Å; G127-G131 WeakPolarHBondContact O-CA 3.23Å; G127-G131 PolarHBondContact O-N 2.71Å
128I91.9Very high96.2Very high143 Ų14336.8 Ų36.873%0.73324%0.238SC*.THydrogen-bonded Turntrans-64.8-36.8178.2-60.1173.1000111.6A126A126-I128 PolarHBondContact O-N 3.08Å; A126-I128 VanDerWaalsContact O-N 3.13Å
129A94.1Very high96.3Very high58 Ų5834.1 Ų34.148%0.47923%0.228SC..THydrogen-bonded Turntrans-105.5-33.5-178.800000113.1L124 A126 G127L124-A129 HydrophobicContact CD1-CB 4.18Å; L124-A129 WeakPolarHBondContact O-CB 3.43Å; A126-A129 PolarHBondContact O-N 2.87Å; A126-A129 VanDerWaalsContact O-N 3.17Å; G127-A129 VanDerWaalsContact C-N 3.33Å; G127-A129 PolarHBondContact O-N 3.26Å
130H95.8Very high96.4Very high14 Ų1437.7 Ų37.77%0.06524%0.242CC..  trans-126.779.1175.4-77.678.8000110.1Q44 G115 L124 A126 G132 V135 R205Q44-H130 PolarHBondContact NE2-NE2 3.23Å; Q44-H130 VanDerWaalsContact NE2-NE2 3.11Å; G115-H130 PolarHBondContact N-NE2 3.36Å; L124-H130 PolarHBondContact O-ND1 3.41Å; A126-H130 PolarHBondContact O-N 2.73Å; H130-G132 VanDerWaalsContact C-N 3.29Å; H130-G132 PolarHBondContact O-N 3.31Å; H130-V135 HydrophobicContact CB-CG2 3.74Å; H130-R205 PolarHBondContact O-NH1 3.39Å; H130-R205 PolarHBondContact O-NH2 3.46Å
131G90.9Very high96.5Very high68 Ų6837.5 Ų37.570%0.70124%0.241SC*.  trans-72-16.5-176.500000115.7G127G127-G131 VanDerWaalsContact O-CA 3.27Å; G127-G131 WeakPolarHBondContact O-CA 3.23Å; G127-G131 PolarHBondContact O-N 2.71Å
132G94.6Very high96.5Very high21 Ų2135.2 Ų35.222%0.21623%0.233CC..SBendtrans-79168.8-179.300000114.3H130 S134 R205H130-G132 VanDerWaalsContact C-N 3.29Å; H130-G132 PolarHBondContact O-N 3.31Å; G132-S134 PolarHBondContact O-N 2.9Å; G132-R205 PolarHBondContact O-NH2 3.04Å
133A97Very high96.6Very high46 Ų4636.5 Ų36.538%0.3824%0.238SC..THydrogen-bonded Turntrans-73.1-3.2-178.700000114.8V135 D136 L137A133-V135 VanDerWaalsContact C-N 3.35Å; A133-V135 PolarHBondContact O-N 3.04Å; A133-D136 WeakPolarHBondContact CA-OD2 3.4Å; A133-D136 PolarHBondContact O-N 3.4Å; A133-D136 VanDerWaalsContact O-N 3.17Å; A133-L137 WeakPolarHBondContact O-CG 3.42Å; A133-L137 PolarHBondContact O-N 3.15Å
134S98Very high96.7Very high2 Ų234.8 Ų34.81%0.01422%0.224CC..Hα-helixtrans-60.2-40.8-174.360.20000113.2S107 V110 G113 G132 A138S107-S134 VanDerWaalsContact CB-O 3.25Å; S107-S134 WeakPolarHBondContact CB-O 3.16Å; S107-S134 WeakPolarHBondContact O-CB 3.35Å; S107-S134 PolarHBondContact OG-O 3.47Å; V110-S134 WeakPolarHBondContact O-CB 3.36Å; G113-S134 WeakPolarHBondContact O-CB 3.49Å; G113-S134 PolarHBondContact O-OG 3.42Å; G132-S134 PolarHBondContact O-N 2.9Å; S134-A138 PolarHBondContact O-N 3.17Å
135V98.5Very high96.8Very high0 Ų030.7 Ų30.70%020%0.203CC..Hα-helixtrans-73.1-35.8176.9178.30000110.9A114 T116 V120 H130 A133 L137 A138 I139A114-V135 HydrophobicContact CB-CG2 4.36Å; T116-V135 HydrophobicContact CG2-CG2 3.95Å; V120-V135 HydrophobicContact CG1-CG1 4.1Å; H130-V135 HydrophobicContact CB-CG2 3.74Å; A133-V135 VanDerWaalsContact C-N 3.35Å; A133-V135 PolarHBondContact O-N 3.04Å; V135-L137 PolarHBondContact O-N 3.42Å; V135-A138 WeakPolarHBondContact O-CB 3.48Å; V135-A138 PolarHBondContact O-N 2.96Å; V135-I139 HydrophobicContact CG1-CD1 4.05Å; V135-I139 HydrophobicContact CG1-CG1 4.47Å; V135-I139 WeakPolarHBondContact O-CG1 3.34Å; V135-I139 PolarHBondContact O-N 3.43Å
136D98.5Very high96.8Very high15 Ų1531 Ų318%0.0821%0.207CC..Hα-helixtrans-64.6-42.5177.8-54.1-51.4000111A133 A138 I139 F140 L202 R205 N206A133-D136 WeakPolarHBondContact CA-OD2 3.4Å; A133-D136 PolarHBondContact O-N 3.4Å; A133-D136 VanDerWaalsContact O-N 3.17Å; D136-A138 PolarHBondContact O-N 2.91Å; D136-I139 WeakPolarHBondContact O-CB 3.2Å; D136-I139 PolarHBondContact O-N 3.48Å; D136-F140 HydrophobicContact CB-CE2 4.45Å; D136-F140 WeakPolarHBondContact O-CD2 3.34Å; D136-F140 PolarHBondContact O-N 3.34Å; D136-L202 HydrophobicContact CB-CD1 3.87Å; D136-L202 VanDerWaalsContact OD1-CD1 3.23Å; D136-L202 WeakPolarHBondContact OD1-CD1 3.23Å; D136-R205 IonicContact OD1-CZ 3.5Å; D136-R205 IonicContact OD1-NE 2.74Å; D136-R205 PolarHBondContact OD1-NE 2.86Å; D136-R205 IonicContact OD1-NH2 3.37Å; D136-R205 PolarHBondContact OD1-NH2 3.47Å; D136-R205 IonicContact OD2-CZ 3.84Å; D136-R205 IonicContact OD2-NE 3.83Å; D136-R205 IonicContact OD2-NH2 2.97Å; D136-R205 PolarHBondContact OD2-NH2 3.45Å; D136-N206 PolarHBondContact OD1-ND2 3.12Å
137L98.7Very high97Very high35 Ų3533.8 Ų33.818%0.18322%0.218CC..Hα-helixtrans-62.7-39.2173.9-69.4173.9000112.4L103 V106 V110 A133 V135 F140 S141L103-L137 HydrophobicContact CD2-CD2 3.83Å; V106-L137 HydrophobicContact CG1-CD1 3.84Å; V110-L137 HydrophobicContact CB-CD1 4.29Å; V110-L137 HydrophobicContact CG1-CD1 4.44Å; V110-L137 HydrophobicContact CG2-CD1 4.29Å; A133-L137 WeakPolarHBondContact O-CG 3.42Å; A133-L137 PolarHBondContact O-N 3.15Å; V135-L137 PolarHBondContact O-N 3.42Å; L137-F140 PolarHBondContact O-N 2.93Å; L137-S141 WeakPolarHBondContact O-CB 3.26Å; L137-S141 PolarHBondContact O-N 3.48Å
138A98.5Very high97.2Very high3 Ų332.4 Ų32.43%0.02520%0.203CC..Hα-helixtrans-63.3-43.1173.200000111.3A114 S134 V135 D136 F140 S141 L142A114-A138 HydrophobicContact CB-CB 4.11Å; S134-A138 PolarHBondContact O-N 3.17Å; V135-A138 WeakPolarHBondContact O-CB 3.48Å; V135-A138 PolarHBondContact O-N 2.96Å; D136-A138 PolarHBondContact O-N 2.91Å; A138-F140 PolarHBondContact O-N 3.28Å; A138-S141 WeakPolarHBondContact O-CB 3.35Å; A138-S141 PolarHBondContact O-N 3.14Å; A138-L142 WeakPolarHBondContact O-CG 3.35Å; A138-L142 PolarHBondContact O-N 3.45Å
139I98.6Very high97.5Very high1 Ų126.6 Ų26.61%0.00518%0.175CC..Hα-helixtrans-60.5-46.1175.5-71168.4000110.5V135 D136 S141 L142 H143 I198 L201 L202V135-I139 HydrophobicContact CG1-CD1 4.05Å; V135-I139 HydrophobicContact CG1-CG1 4.47Å; V135-I139 WeakPolarHBondContact O-CG1 3.34Å; V135-I139 PolarHBondContact O-N 3.43Å; D136-I139 WeakPolarHBondContact O-CB 3.2Å; D136-I139 PolarHBondContact O-N 3.48Å; I139-S141 VanDerWaalsContact C-N 3.33Å; I139-S141 PolarHBondContact O-N 2.87Å; I139-L142 PolarHBondContact O-N 3.22Å; I139-H143 WeakPolarHBondContact CG2-CE1 3.42Å; I139-H143 WeakPolarHBondContact CG2-ND1 3.5Å; I139-H143 PolarHBondContact O-N 3.4Å; I139-H143 PolarHBondContact O-ND1 3.22Å; I139-I198 HydrophobicContact CG1-CB 4.37Å; I139-I198 HydrophobicContact CG2-CB 4.07Å; I139-I198 HydrophobicContact CG2-CD1 4.26Å; I139-I198 HydrophobicContact CG2-CG1 4.21Å; I139-L201 HydrophobicContact CD1-CD2 4.03Å; I139-L201 HydrophobicContact CD1-CG 4.17Å; I139-L202 HydrophobicContact CD1-CB 4.28Å; I139-L202 HydrophobicContact CD1-CD1 4.21Å; I139-L202 HydrophobicContact CG2-CB 4.26Å; I139-L202 HydrophobicContact CG2-CD1 4.32Å; I139-L202 HydrophobicContact CG2-CD2 4.38Å
140F98.8Very high97.7Very high94 Ų9426 Ų2641%0.41216%0.163SC..Hα-helixtrans-63.7-37.7176.8-71.3-55.2000112.7L103 D136 L137 A138 H143 L144 L202L103-F140 HydrophobicContact CD1-CB 3.95Å; D136-F140 HydrophobicContact CB-CE2 4.45Å; D136-F140 WeakPolarHBondContact O-CD2 3.34Å; D136-F140 PolarHBondContact O-N 3.34Å; L137-F140 PolarHBondContact O-N 2.93Å; A138-F140 PolarHBondContact O-N 3.28Å; F140-H143 PolarHBondContact O-N 3.12Å; F140-L144 PolarHBondContact O-N 2.94Å; F140-L144 VanDerWaalsContact O-N 3.07Å; F140-L202 HydrophobicContact CE1-CD2 3.88Å; F140-L202 HydrophobicContact CZ-CD2 3.86Å
141S98.8Very high97.8Very high0 Ų026.9 Ų26.90%017%0.168CC..Hα-helixtrans-56.5-50.2172.3177.90000111.8F60 A100 L104 L137 A138 I139 H143 L144 A145F60-S141 WeakPolarHBondContact CZ-OG 3.26Å; A100-S141 VanDerWaalsContact O-CB 3.26Å; A100-S141 WeakPolarHBondContact O-CB 3.41Å; A100-S141 PolarHBondContact O-OG 3.39Å; L104-S141 WeakPolarHBondContact CB-OG 3.32Å; L137-S141 WeakPolarHBondContact O-CB 3.26Å; L137-S141 PolarHBondContact O-N 3.48Å; A138-S141 WeakPolarHBondContact O-CB 3.35Å; A138-S141 PolarHBondContact O-N 3.14Å; I139-S141 VanDerWaalsContact C-N 3.33Å; I139-S141 PolarHBondContact O-N 2.87Å; S141-H143 VanDerWaalsContact C-N 3.34Å; S141-H143 PolarHBondContact O-N 3.49Å; S141-L144 PolarHBondContact O-N 3.47Å; S141-A145 PolarHBondContact O-N 2.89Å
142L98.3Very high98.2Very high9 Ų924 Ų245%0.04714%0.138CC..Hα-helixtrans-64.9-35.6179.5-66.6178.6000112.5F55 F59 A138 I139 G146 I198F55-L142 HydrophobicContact CD1-CD1 4.47Å; F55-L142 HydrophobicContact CD1-CD2 3.77Å; F55-L142 HydrophobicContact CE1-CD1 3.75Å; F55-L142 HydrophobicContact CE1-CD2 3.87Å; F55-L142 HydrophobicContact CE1-CG 4.35Å; F55-L142 HydrophobicContact CG-CD2 4.38Å; F55-L142 HydrophobicContact CZ-CD1 3.81Å; F59-L142 HydrophobicContact CD1-CD2 4.3Å; F59-L142 HydrophobicContact CD2-CD2 3.97Å; F59-L142 HydrophobicContact CE1-CD2 4.35Å; F59-L142 HydrophobicContact CE2-CD2 3.99Å; F59-L142 HydrophobicContact CG-CD2 4.15Å; F59-L142 HydrophobicContact CZ-CD2 4.2Å; A138-L142 WeakPolarHBondContact O-CG 3.35Å; A138-L142 PolarHBondContact O-N 3.45Å; I139-L142 PolarHBondContact O-N 3.22Å; L142-G146 PolarHBondContact O-N 3.31Å; L142-I198 HydrophobicContact CB-CD1 3.85Å
143H98.8Very high98.4Very high37 Ų3723 Ų2317%0.17113%0.128CC..Hα-helixtrans-60.3-49.4172.5-79.498.4000112I139 F140 S141 A145 G146 I147 I198 T199I139-H143 WeakPolarHBondContact CG2-CE1 3.42Å; I139-H143 WeakPolarHBondContact CG2-ND1 3.5Å; I139-H143 PolarHBondContact O-N 3.4Å; I139-H143 PolarHBondContact O-ND1 3.22Å; F140-H143 PolarHBondContact O-N 3.12Å; S141-H143 VanDerWaalsContact C-N 3.34Å; S141-H143 PolarHBondContact O-N 3.49Å; H143-A145 PolarHBondContact O-N 2.81Å; H143-G146 PolarHBondContact O-N 2.56Å; H143-I147 VanDerWaalsContact O-CG1 3.28Å; H143-I147 WeakPolarHBondContact O-CG1 3.31Å; H143-I147 PolarHBondContact O-N 2.7Å; H143-I198 VanDerWaalsContact CE1-CG1 3.42Å; H143-I198 WeakPolarHBondContact CE1-CG1 3.42Å; H143-T199 PolarHBondContact NE2-OG1 2.77Å
144L98.8Very high98.4Very high45 Ų4523 Ų2324%0.23612%0.124CC..Hα-helixtrans-64.6-41.7-179.7-67.7-172.3000111.9L96 P99 A100 L103 F140 S141 G146 I147 S148L96-L144 HydrophobicContact CD2-CD2 4.27Å; P99-L144 HydrophobicContact CB-CD1 4.28Å; P99-L144 HydrophobicContact CG-CD1 4.38Å; A100-L144 HydrophobicContact CB-CB 3.63Å; A100-L144 HydrophobicContact CB-CD1 4.42Å; L103-L144 HydrophobicContact CD1-CD1 3.69Å; L103-L144 HydrophobicContact CD1-CG 4.48Å; F140-L144 PolarHBondContact O-N 2.94Å; F140-L144 VanDerWaalsContact O-N 3.07Å; S141-L144 PolarHBondContact O-N 3.47Å; L144-G146 VanDerWaalsContact C-N 3.32Å; L144-G146 PolarHBondContact O-N 2.99Å; L144-I147 PolarHBondContact O-N 2.97Å; L144-S148 PolarHBondContact O-N 3.31Å
145A98.4Very high98.4Very high1 Ų123 Ų231%0.00812%0.123CC..Hα-helixtrans-64.6-36.4174.300000112.4F59 F60 L97 A100 S141 H143 S148 S149F59-A145 HydrophobicContact CD1-CB 4.48Å; F60-A145 HydrophobicContact CE1-CB 4.34Å; F60-A145 HydrophobicContact CZ-CB 4.1Å; L97-A145 HydrophobicContact CD2-CB 4.39Å; A100-A145 HydrophobicContact CB-CB 4.39Å; S141-A145 PolarHBondContact O-N 2.89Å; H143-A145 PolarHBondContact O-N 2.81Å; A145-S148 WeakPolarHBondContact O-CB 3.11Å; A145-S149 PolarHBondContact O-N 3.1Å; A145-S149 VanDerWaalsContact O-N 3.1Å; A145-S149 PolarHBondContact O-OG 3.22Å
146G97.9Very high98.4Very high8 Ų823.1 Ų23.18%0.08212%0.124CC..Hα-helixtrans-64.7-47.6174.200000112.3L142 H143 L144 S148 S149 I150L142-G146 PolarHBondContact O-N 3.31Å; H143-G146 PolarHBondContact O-N 2.56Å; L144-G146 VanDerWaalsContact C-N 3.32Å; L144-G146 PolarHBondContact O-N 2.99Å; G146-S148 VanDerWaalsContact C-N 3.34Å; G146-S148 PolarHBondContact O-N 3.37Å; G146-S149 PolarHBondContact O-N 2.91Å; G146-S149 VanDerWaalsContact O-N 3.14Å; G146-I150 WeakPolarHBondContact O-CG1 3.3Å; G146-I150 PolarHBondContact O-N 3.12Å
147I98.6Very high98.4Very high76 Ų7623.4 Ų23.439%0.3913%0.125SC..Hα-helixtrans-60.2-45.3176-65163.4000110.2L96 H143 L144 S149 I150 L151L96-I147 HydrophobicContact CD1-CB 4.1Å; L96-I147 HydrophobicContact CD1-CG2 3.55Å; H143-I147 VanDerWaalsContact O-CG1 3.28Å; H143-I147 WeakPolarHBondContact O-CG1 3.31Å; H143-I147 PolarHBondContact O-N 2.7Å; L144-I147 PolarHBondContact O-N 2.97Å; I147-S149 VanDerWaalsContact C-N 3.27Å; I147-S149 PolarHBondContact O-N 3.25Å; I147-I150 PolarHBondContact O-N 3.22Å; I147-L151 HydrophobicContact CG2-CD1 4.05Å; I147-L151 HydrophobicContact CG2-CG 4.2Å; I147-L151 WeakPolarHBondContact O-CB 3.32Å; I147-L151 VanDerWaalsContact O-CG 3.31Å; I147-L151 WeakPolarHBondContact O-CG 3.48Å; I147-L151 PolarHBondContact O-N 2.83Å
148S98.6Very high98.4Very high4 Ų423.3 Ų23.33%0.02813%0.126CC..Hα-helixtrans-50.9-48.9173.8176.20000111.7S93 L144 A145 G146 G152S93-S148 WeakPolarHBondContact CB-O 3.36Å; S93-S148 VanDerWaalsContact O-CB 3.26Å; S93-S148 WeakPolarHBondContact O-CB 3.42Å; S93-S148 PolarHBondContact O-OG 2.88Å; L144-S148 PolarHBondContact O-N 3.31Å; A145-S148 WeakPolarHBondContact O-CB 3.11Å; G146-S148 VanDerWaalsContact C-N 3.34Å; G146-S148 PolarHBondContact O-N 3.37Å; S148-G152 PolarHBondContact O-N 3.49Å
149S97.9Very high98.4Very high21 Ų2123.2 Ų23.215%0.14713%0.125CC..Hα-helixtrans-69.6-38.5-177.6-60.90000113.1A145 G146 I147 G152 A153 L191A145-S149 PolarHBondContact O-N 3.1Å; A145-S149 VanDerWaalsContact O-N 3.1Å; A145-S149 PolarHBondContact O-OG 3.22Å; G146-S149 PolarHBondContact O-N 2.91Å; G146-S149 VanDerWaalsContact O-N 3.14Å; I147-S149 VanDerWaalsContact C-N 3.27Å; I147-S149 PolarHBondContact O-N 3.25Å; S149-G152 PolarHBondContact O-N 2.97Å; S149-A153 VanDerWaalsContact O-CB 3.32Å; S149-A153 WeakPolarHBondContact O-CB 3.43Å; S149-A153 PolarHBondContact O-N 3.24Å; S149-L191 VanDerWaalsContact CB-CD1 3.43Å
150I98.3Very high98.4Very high45 Ų4523.2 Ų23.223%0.23113%0.125CC..Hα-helixtrans-64.7-46.7175.9-69.2168.5000110.7G146 I147 G152 A153 V154 L188 L191 P192G146-I150 WeakPolarHBondContact O-CG1 3.3Å; G146-I150 PolarHBondContact O-N 3.12Å; I147-I150 PolarHBondContact O-N 3.22Å; I150-G152 VanDerWaalsContact C-N 3.31Å; I150-G152 PolarHBondContact O-N 3.18Å; I150-A153 PolarHBondContact O-N 2.96Å; I150-V154 WeakPolarHBondContact O-CG2 3.24Å; I150-V154 PolarHBondContact O-N 3.42Å; I150-L188 HydrophobicContact CG2-CD1 3.98Å; I150-L191 HydrophobicContact CD1-CB 3.93Å; I150-L191 HydrophobicContact CG1-CB 3.88Å; I150-L191 HydrophobicContact CG1-CD1 3.85Å; I150-P192 HydrophobicContact CD1-CG 4.42Å
151L98.5Very high98.3Very high34 Ų3423 Ų2318%0.17813%0.127CC..Hα-helixtrans-60.1-43.3177-68.5-177.9000111.3M89 M92 L96 I147 N155M89-L151 HydrophobicContact CE-CD2 4.47Å; M89-L151 HydrophobicContact CG-CB 3.91Å; M89-L151 HydrophobicContact CG-CD1 4.44Å; M89-L151 HydrophobicContact CG-CD2 3.89Å; M89-L151 HydrophobicContact CG-CG 4.28Å; M89-L151 HydrophobicContact SD-CB 4.31Å; M89-L151 HydrophobicContact SD-CD2 3.98Å; M92-L151 HydrophobicContact CE-CD1 4.41Å; M92-L151 HydrophobicContact CG-CD1 4.11Å; M92-L151 HydrophobicContact SD-CD1 4.09Å; L96-L151 HydrophobicContact CD1-CD1 4.07Å; I147-L151 HydrophobicContact CG2-CD1 4.05Å; I147-L151 HydrophobicContact CG2-CG 4.2Å; I147-L151 WeakPolarHBondContact O-CB 3.32Å; I147-L151 VanDerWaalsContact O-CG 3.31Å; I147-L151 WeakPolarHBondContact O-CG 3.48Å; I147-L151 PolarHBondContact O-N 2.83Å; L151-N155 WeakPolarHBondContact O-CB 3.42Å; L151-N155 PolarHBondContact O-N 3.13Å; L151-N155 VanDerWaalsContact O-N 3.13Å
152G97.9Very high98.2Very high6 Ų628.6 Ų28.66%0.06216%0.157CC..Hα-helixtrans-60.4-46.9173.600000112.2S148 S149 I150 N155 F156S148-G152 PolarHBondContact O-N 3.49Å; S149-G152 PolarHBondContact O-N 2.97Å; I150-G152 VanDerWaalsContact C-N 3.31Å; I150-G152 PolarHBondContact O-N 3.18Å; G152-N155 PolarHBondContact O-N 2.99Å; G152-F156 WeakPolarHBondContact O-CD2 3.44Å; G152-F156 PolarHBondContact O-N 3.23Å
153A98.3Very high98.2Very high2 Ų230.7 Ų30.72%0.01717%0.167CC..Hα-helixtrans-60.2-49-179.700000112.7S149 I150 N155 F156 I157 A184 L187 L188S149-A153 VanDerWaalsContact O-CB 3.32Å; S149-A153 WeakPolarHBondContact O-CB 3.43Å; S149-A153 PolarHBondContact O-N 3.24Å; I150-A153 PolarHBondContact O-N 2.96Å; A153-N155 VanDerWaalsContact C-N 3.28Å; A153-N155 PolarHBondContact O-N 3.17Å; A153-F156 PolarHBondContact O-N 3.42Å; A153-I157 WeakPolarHBondContact O-CD1 3.49Å; A153-I157 VanDerWaalsContact O-CG1 3.26Å; A153-I157 WeakPolarHBondContact O-CG1 3.45Å; A153-I157 PolarHBondContact O-N 3.42Å; A153-A184 HydrophobicContact CB-CB 3.98Å; A153-A184 WeakPolarHBondContact CB-O 3.46Å; A153-L187 HydrophobicContact CB-CB 4.31Å; A153-L188 HydrophobicContact CB-CB 4.37Å
154V98.6Very high98.1Very high46 Ų4632.3 Ų32.328%0.27917%0.172SC..Hα-helixtrans-56.8-46.2175.7172.40000110.3F86 M89 I150 I157 T158 L188F86-V154 HydrophobicContact CE2-CG1 4.29Å; M89-V154 HydrophobicContact SD-CG1 4.5Å; I150-V154 WeakPolarHBondContact O-CG2 3.24Å; I150-V154 PolarHBondContact O-N 3.42Å; V154-I157 PolarHBondContact O-N 3.39Å; V154-T158 PolarHBondContact O-N 3.28Å; V154-T158 PolarHBondContact O-OG1 3.24Å; V154-T158 VanDerWaalsContact O-OG1 3.04Å; V154-L188 HydrophobicContact CG2-CD1 3.78Å; V154-L188 HydrophobicContact CG2-CD2 4.42Å
155N98.3Very high97.9Very high0 Ų032.5 Ų32.50%018%0.177CC..Hα-helixtrans-64.6-42.7-179.9-171.326.1000112.8M84 A85 F86 N90 L151 G152 A153 T159M84-N155 HydrophobicContact CE-CB 4.4Å; M84-N155 WeakPolarHBondContact CE-ND2 3.36Å; A85-N155 PolarHBondContact N-OD1 3.47Å; F86-N155 HydrophobicContact CD2-CB 4.32Å; F86-N155 PolarHBondContact N-OD1 2.99Å; N90-N155 WeakPolarHBondContact CB-ND2 3.43Å; L151-N155 WeakPolarHBondContact O-CB 3.42Å; L151-N155 PolarHBondContact O-N 3.13Å; L151-N155 VanDerWaalsContact O-N 3.13Å; G152-N155 PolarHBondContact O-N 2.99Å; A153-N155 VanDerWaalsContact C-N 3.28Å; A153-N155 PolarHBondContact O-N 3.17Å; N155-T159 VanDerWaalsContact O-CB 3.28Å; N155-T159 WeakPolarHBondContact O-CB 3.27Å; N155-T159 PolarHBondContact O-N 2.95Å; N155-T159 PolarHBondContact O-OG1 3.28Å
156F98.5Very high97.7Very high3 Ų339.7 Ų39.71%0.01322%0.221CC..Hα-helixtrans-61.5-50174.6-78.6-58.9000111.6I67 G71 V75 M84 G152 A153 T158 T159 V160 V180 A184I67-F156 HydrophobicContact CG2-CD2 4.24Å; I67-F156 HydrophobicContact CG2-CE2 3.81Å; I67-F156 WeakPolarHBondContact O-CE2 3.39Å; I67-F156 VanDerWaalsContact O-CZ 3.26Å; I67-F156 WeakPolarHBondContact O-CZ 3.28Å; G71-F156 WeakPolarHBondContact O-CE1 3.47Å; V75-F156 HydrophobicContact CB-CD1 4.48Å; V75-F156 HydrophobicContact CB-CE1 4.39Å; V75-F156 HydrophobicContact CG1-CD1 4.46Å; V75-F156 HydrophobicContact CG2-CD1 4.43Å; V75-F156 HydrophobicContact CG2-CE1 4.33Å; M84-F156 HydrophobicContact CE-CD1 3.45Å; M84-F156 VanDerWaalsContact CE-CD1 3.45Å; M84-F156 HydrophobicContact CE-CE1 3.5Å; M84-F156 HydrophobicContact CE-CG 4.1Å; M84-F156 HydrophobicContact CE-CZ 4.23Å; M84-F156 HydrophobicContact SD-CD1 4.46Å; M84-F156 HydrophobicContact SD-CE1 4.22Å; G152-F156 WeakPolarHBondContact O-CD2 3.44Å; G152-F156 PolarHBondContact O-N 3.23Å; A153-F156 PolarHBondContact O-N 3.42Å; F156-T158 VanDerWaalsContact C-N 3.33Å; F156-T158 PolarHBondContact O-N 2.88Å; F156-T159 PolarHBondContact O-N 3.03Å; F156-V160 WeakPolarHBondContact O-CG2 3.43Å; F156-V160 PolarHBondContact O-N 3.48Å; F156-V180 HydrophobicContact CB-CG1 4.3Å; F156-V180 HydrophobicContact CD1-CG1 3.84Å; F156-V180 HydrophobicContact CD2-CG1 4.23Å; F156-V180 HydrophobicContact CE1-CG1 4.27Å; F156-V180 HydrophobicContact CG-CG1 3.86Å; F156-A184 HydrophobicContact CB-CB 4.16Å
157I98.5Very high97.3Very high22 Ų2242 Ų4211%0.11325%0.245CC..Hα-helixtrans-56.8-49.4179.6-68.2162.1000110.1A153 V154 T159 V160 I161 A184 L185 L188A153-I157 WeakPolarHBondContact O-CD1 3.49Å; A153-I157 VanDerWaalsContact O-CG1 3.26Å; A153-I157 WeakPolarHBondContact O-CG1 3.45Å; A153-I157 PolarHBondContact O-N 3.42Å; V154-I157 PolarHBondContact O-N 3.39Å; I157-T159 PolarHBondContact O-N 3.47Å; I157-V160 PolarHBondContact O-N 2.82Å; I157-I161 HydrophobicContact CG2-CD1 3.61Å; I157-I161 HydrophobicContact CG2-CG1 4.47Å; I157-I161 WeakPolarHBondContact O-CB 3.15Å; I157-I161 VanDerWaalsContact O-CG1 3.25Å; I157-I161 WeakPolarHBondContact O-CG1 3.41Å; I157-I161 PolarHBondContact O-N 3.27Å; I157-A184 HydrophobicContact CD1-CB 4.15Å; I157-A184 HydrophobicContact CG1-CB 3.85Å; I157-L185 HydrophobicContact CD1-CD2 3.77Å; I157-L185 HydrophobicContact CD1-CG 4.14Å; I157-L185 HydrophobicContact CG1-CD2 4.31Å; I157-L185 HydrophobicContact CG1-CG 4.38Å; I157-L188 HydrophobicContact CD1-CD2 3.89Å
158T98.4Very high97.2Very high33 Ų3340.2 Ų40.220%0.20224%0.236CC..Hα-helixtrans-64.5-42179.5-55.90000112.3A85 F86 V154 F156 I161 N162A85-T158 HydrophobicContact CB-CG2 3.7Å; F86-T158 HydrophobicContact CE2-CG2 3.72Å; F86-T158 WeakPolarHBondContact CE2-OG1 3.15Å; F86-T158 HydrophobicContact CZ-CG2 3.74Å; V154-T158 PolarHBondContact O-N 3.28Å; V154-T158 PolarHBondContact O-OG1 3.24Å; V154-T158 VanDerWaalsContact O-OG1 3.04Å; F156-T158 VanDerWaalsContact C-N 3.33Å; F156-T158 PolarHBondContact O-N 2.88Å; T158-I161 PolarHBondContact O-N 3.35Å; T158-N162 WeakPolarHBondContact CG2-ND2 3.36Å; T158-N162 WeakPolarHBondContact O-CB 3.38Å; T158-N162 PolarHBondContact O-N 3.02Å; T158-N162 PolarHBondContact O-ND2 3.27Å
159T97.9Very high97Very high0 Ų042.1 Ų42.10%025%0.25CC..Hα-helixtrans-61.6-49.8178.3-570000110.6M84 A85 N155 F156 I157 I161 M163M84-T159 HydrophobicContact SD-CG2 4.07Å; A85-T159 WeakPolarHBondContact CB-OG1 3.47Å; A85-T159 PolarHBondContact N-OG1 3.32Å; N155-T159 VanDerWaalsContact O-CB 3.28Å; N155-T159 WeakPolarHBondContact O-CB 3.27Å; N155-T159 PolarHBondContact O-N 2.95Å; N155-T159 PolarHBondContact O-OG1 3.28Å; F156-T159 PolarHBondContact O-N 3.03Å; I157-T159 PolarHBondContact O-N 3.47Å; T159-I161 PolarHBondContact O-N 2.98Å; T159-M163 HydrophobicContact CG2-CB 4.33Å; T159-M163 HydrophobicContact CG2-SD 4.16Å; T159-M163 WeakPolarHBondContact O-CB 3.48Å; T159-M163 PolarHBondContact O-N 3.3Å
160V97.9Very high96.8Very high2 Ų245.1 Ų45.11%0.01226%0.263CS..Hα-helixtrans-65.8-39.6-179.2179.80000111.5V75 L79 F156 I157 R164 M173 V177 V181V75-V160 HydrophobicContact CG1-CG2 3.74Å; L79-V160 HydrophobicContact CD1-CB 4.2Å; L79-V160 HydrophobicContact CD1-CG1 4.33Å; L79-V160 HydrophobicContact CD1-CG2 3.93Å; F156-V160 WeakPolarHBondContact O-CG2 3.43Å; F156-V160 PolarHBondContact O-N 3.48Å; I157-V160 PolarHBondContact O-N 2.82Å; V160-R164 WeakPolarHBondContact O-CD 3.43Å; V160-R164 WeakPolarHBondContact O-CG 3.26Å; V160-R164 PolarHBondContact O-NH1 2.93Å; V160-M173 HydrophobicContact CG1-CE 4.06Å; V160-M173 HydrophobicContact CG1-SD 3.41Å; V160-M173 WeakPolarHBondContact CG1-SD 3.46Å; V160-V177 HydrophobicContact CB-CG1 4.45Å; V160-V177 HydrophobicContact CG1-CG1 3.79Å; V160-V177 HydrophobicContact CG2-CG1 3.77Å; V160-V181 HydrophobicContact CB-CG2 3.52Å; V160-V181 HydrophobicContact CG1-CG2 3.5Å; V160-V181 VanDerWaalsContact CG1-CG2 3.5Å; V160-V181 HydrophobicContact CG2-CG2 3.35Å
161I96.9Very high96.7Very high90 Ų9049 Ų4946%0.46229%0.285SS..Hα-helixtrans-69.5-41.2-178.6-68.9172.9000111.8I157 T158 T159 R164I157-I161 HydrophobicContact CG2-CD1 3.61Å; I157-I161 HydrophobicContact CG2-CG1 4.47Å; I157-I161 WeakPolarHBondContact O-CB 3.15Å; I157-I161 VanDerWaalsContact O-CG1 3.25Å; I157-I161 WeakPolarHBondContact O-CG1 3.41Å; I157-I161 PolarHBondContact O-N 3.27Å; T158-I161 PolarHBondContact O-N 3.35Å; T159-I161 PolarHBondContact O-N 2.98Å; I161-R164 VanDerWaalsContact C-NH1 3.31Å; I161-R164 VanDerWaalsContact CA-NH1 3.26Å; I161-R164 PolarHBondContact O-NH1 2.95Å; I161-R164 PolarHBondContact O-NH2 3.16Å
162N97.3Very high96.5Very high116 Ų11655.9 Ų55.962%0.6231%0.308SS*.Hα-helixtrans-109.9-17.8-164.7-64.5-53.1000115.7T158T158-N162 WeakPolarHBondContact CG2-ND2 3.36Å; T158-N162 WeakPolarHBondContact O-CB 3.38Å; T158-N162 PolarHBondContact O-N 3.02Å; T158-N162 PolarHBondContact O-ND2 3.27Å
163M97.1Very high96.4Very high53 Ų5356.1 Ų56.126%0.26131%0.308SS..  trans-112.716.8-169.5-57.5-172.669.300114.3A81 P82 D83 A85 T159A81-M163 HydrophobicContact CB-CB 3.99Å; A81-M163 HydrophobicContact CB-CE 4.48Å; A81-M163 WeakPolarHBondContact CB-O 3.24Å; P82-M163 HydrophobicContact CG-CE 4.36Å; D83-M163 WeakPolarHBondContact O-CE 3.07Å; A85-M163 WeakPolarHBondContact CA-SD 3.3Å; A85-M163 HydrophobicContact CB-SD 3.7Å; A85-M163 PolarHBondContact N-SD 3.45Å; T159-M163 HydrophobicContact CG2-CB 4.33Å; T159-M163 HydrophobicContact CG2-SD 4.16Å; T159-M163 WeakPolarHBondContact O-CB 3.48Å; T159-M163 PolarHBondContact O-N 3.3Å
164R96.6Very high96.4Very high71 Ų7158.5 Ų58.527%0.26832%0.323SS..PPolyproline II helixtrans-67.9140.2175.7-54-171.1-65.2-77.9-11.7110.3L79 V160 I161 I168 M173L79-R164 HydrophobicContact CD1-CG 4.37Å; L79-R164 HydrophobicContact CD2-CG 3.84Å; V160-R164 WeakPolarHBondContact O-CD 3.43Å; V160-R164 WeakPolarHBondContact O-CG 3.26Å; V160-R164 PolarHBondContact O-NH1 2.93Å; I161-R164 VanDerWaalsContact C-NH1 3.31Å; I161-R164 VanDerWaalsContact CA-NH1 3.26Å; I161-R164 PolarHBondContact O-NH1 2.95Å; I161-R164 PolarHBondContact O-NH2 3.16Å; R164-I168 HydrophobicContact CB-CB 4.34Å; R164-I168 PolarHBondContact NE-O 3.45Å; R164-M173 VanDerWaalsContact CD-SD 3.55Å
165S95.2Very high96.3Very high49 Ų4963.5 Ų63.534%0.34335%0.347SS..PPolyproline II helixtrans-65.4155.2171.860.40000112.1L79 G167 I168L79-S165 WeakPolarHBondContact O-CB 3.32Å; L79-S165 PolarHBondContact O-N 2.96Å; L79-S165 PolarHBondContact O-OG 3.32Å; L79-S165 VanDerWaalsContact O-OG 3.05Å; S165-G167 PolarHBondContact O-N 3.15Å; S165-I168 PolarHBondContact O-N 2.99Å; S165-I168 VanDerWaalsContact O-N 3.14Å; S165-I168 WeakPolarHBondContact OG-CD1 3.3Å
166T93.4Very high96.3Very high152 Ų15266.1 Ų66.193%0.93336%0.359SS*.THydrogen-bonded Turntrans-57.5127.8178.2-50.90000110.5
167G91.2Very high96.3Very high58 Ų5866 Ų6660%0.59836%0.358SS*.THydrogen-bonded Turntrans98.1-12.1-178.400000114.9S165 S169S165-G167 PolarHBondContact O-N 3.15Å; G167-S169 PolarHBondContact O-N 3.14Å
168I95.8Very high96.3Very high38 Ų3869.1 Ų69.120%0.19537%0.369CS..  trans-90.287.5168.6-54.6-177.5000109.2R164 S165 M173R164-I168 HydrophobicContact CB-CB 4.34Å; R164-I168 PolarHBondContact NE-O 3.45Å; S165-I168 PolarHBondContact O-N 2.99Å; S165-I168 VanDerWaalsContact O-N 3.14Å; S165-I168 WeakPolarHBondContact OG-CD1 3.3Å; I168-M173 HydrophobicContact CG2-CG 3.93Å
169S94.5Very high96.3Very high44 Ų4470.1 Ų70.131%0.30838%0.377SS..  trans-71.9163.7165.455.30000111G167 D171 R172 M173G167-S169 PolarHBondContact O-N 3.14Å; S169-D171 VanDerWaalsContact C-N 3.3Å; S169-D171 WeakPolarHBondContact CB-OD1 3.32Å; S169-D171 PolarHBondContact O-N 2.91Å; S169-D171 PolarHBondContact OG-OD1 2.83Å; S169-R172 PolarHBondContact O-N 3.41Å; S169-R172 WeakPolarHBondContact OG-CD 3.25Å; S169-R172 WeakPolarHBondContact OG-CG 3.43Å; S169-M173 PolarHBondContact O-N 3.47Å
170L94.2Very high96.2Very high84 Ų8470.2 Ų70.244%0.4438%0.378SS..G310 helixtrans-58.9-41-175.5-73.2172.6000112.5R172 M173 W178L170-R172 PolarHBondContact O-N 3.43Å; L170-M173 HydrophobicContact CB-CE 4.37Å; L170-M173 HydrophobicContact CD2-CE 3.49Å; L170-M173 VanDerWaalsContact CD2-CE 3.49Å; L170-M173 HydrophobicContact CD2-SD 3.94Å; L170-M173 PolarHBondContact O-N 3.4Å; L170-W178 HydrophobicContact CB-CZ2 4.18Å; L170-W178 VanDerWaalsContact O-CZ2 3.25Å; L170-W178 WeakPolarHBondContact O-CZ2 3.43Å; L170-W178 PolarHBondContact O-NE1 3.25Å
171D94.8Very high96.2Very high127 Ų12770.8 Ų70.868%0.67938%0.381SS*.G310 helixtrans-64.6-17.3176.560.8-52.3000113.6S169S169-D171 VanDerWaalsContact C-N 3.3Å; S169-D171 WeakPolarHBondContact CB-OD1 3.32Å; S169-D171 PolarHBondContact O-N 2.91Å; S169-D171 PolarHBondContact OG-OD1 2.83Å
172R94.6Very high96.2Very high178 Ų17870.8 Ų70.867%0.67238%0.381SS*.G310 helixtrans-104.32.6-179.9-63.2-178.9-177.2-167.8-1.9113.6S169 L170S169-R172 PolarHBondContact O-N 3.41Å; S169-R172 WeakPolarHBondContact OG-CD 3.25Å; S169-R172 WeakPolarHBondContact OG-CG 3.43Å; L170-R172 PolarHBondContact O-N 3.43Å
173M96.9Very high96.3Very high11 Ų1167.3 Ų67.35%0.05436%0.364CS..SBendtrans-67.3142176.8-66.5-170.7-57.900111.1L79 V160 R164 I168 S169 L170 V177 W178L79-M173 HydrophobicContact CD2-CG 4.41Å; L79-M173 HydrophobicContact CD2-SD 4.34Å; V160-M173 HydrophobicContact CG1-CE 4.06Å; V160-M173 HydrophobicContact CG1-SD 3.41Å; V160-M173 WeakPolarHBondContact CG1-SD 3.46Å; R164-M173 VanDerWaalsContact CD-SD 3.55Å; I168-M173 HydrophobicContact CG2-CG 3.93Å; S169-M173 PolarHBondContact O-N 3.47Å; L170-M173 HydrophobicContact CB-CE 4.37Å; L170-M173 HydrophobicContact CD2-CE 3.49Å; L170-M173 VanDerWaalsContact CD2-CE 3.49Å; L170-M173 HydrophobicContact CD2-SD 3.94Å; L170-M173 PolarHBondContact O-N 3.4Å; M173-V177 HydrophobicContact SD-CG1 4.21Å; M173-W178 HydrophobicContact CE-CD2 3.81Å; M173-W178 HydrophobicContact CE-CE3 4.26Å; M173-W178 HydrophobicContact CE-CG 4.35Å; M173-W178 HydrophobicContact CE-CH2 4.02Å; M173-W178 HydrophobicContact CE-CZ2 3.53Å; M173-W178 HydrophobicContact CE-CZ3 4.36Å
174P97.4Very high96.3Very high51 Ų5164.9 Ų64.933%0.33135%0.352SS..  trans-56.8145174-26.937000112.3M78 F176 V177 W178M78-P174 HydrophobicContact CB-CG 4.21Å; M78-P174 HydrophobicContact SD-CB 4.26Å; P174-F176 PolarHBondContact O-N 3.49Å; P174-F176 VanDerWaalsContact O-N 3.16Å; P174-V177 HydrophobicContact CB-CG2 4.28Å; P174-V177 HydrophobicContact CG-CG2 4.41Å; P174-V177 WeakPolarHBondContact O-CB 3.28Å; P174-V177 PolarHBondContact O-N 3.32Å; P174-W178 PolarHBondContact O-N 3.27Å; P174-W178 VanDerWaalsContact O-N 3.14Å
175L97.9Very high96.3Very high151 Ų15165.2 Ų65.279%0.79136%0.359SS*.Hα-helixtrans-57.4-33.3-177.9-67.6177.4000113.2W178 S179L175-W178 WeakPolarHBondContact O-CB 3.4Å; L175-W178 PolarHBondContact O-N 2.71Å; L175-S179 PolarHBondContact O-N 3.33Å
176F98Very high96.4Very high55 Ų5566.3 Ų66.324%0.24136%0.361CS..Hα-helixtrans-64-39.6174.5178.6-100.4000112.5F70 L74 V75 M78 P174 W178 S179 V180F70-F176 HydrophobicContact CB-CE2 4.33Å; F70-F176 HydrophobicContact CB-CZ 3.75Å; L74-F176 HydrophobicContact CB-CD1 4.24Å; L74-F176 HydrophobicContact CB-CE1 3.8Å; L74-F176 HydrophobicContact CD1-CD1 4.46Å; L74-F176 HydrophobicContact CD1-CE1 4.07Å; L74-F176 HydrophobicContact CD1-CZ 4.29Å; V75-F176 HydrophobicContact CG2-CE1 4.04Å; M78-F176 HydrophobicContact CE-CB 4.42Å; M78-F176 HydrophobicContact CE-CD1 4.15Å; M78-F176 HydrophobicContact SD-CB 4.12Å; M78-F176 HydrophobicContact SD-CD1 3.7Å; M78-F176 HydrophobicContact SD-CG 4.32Å; P174-F176 PolarHBondContact O-N 3.49Å; P174-F176 VanDerWaalsContact O-N 3.16Å; F176-W178 VanDerWaalsContact C-N 3.32Å; F176-S179 WeakPolarHBondContact CA-OG 3.25Å; F176-S179 PolarHBondContact O-N 3.43Å; F176-S179 PolarHBondContact O-OG 3.27Å; F176-V180 HydrophobicContact CD1-CG2 4.37Å; F176-V180 HydrophobicContact CE1-CG2 3.82Å; F176-V180 HydrophobicContact CE2-CG2 4.13Å; F176-V180 HydrophobicContact CZ-CG2 3.68Å; F176-V180 WeakPolarHBondContact O-CG2 3.19Å; F176-V180 PolarHBondContact O-N 2.98Å
177V98.1Very high96.5Very high0 Ų059.3 Ų59.30%032%0.318CS..Hα-helixtrans-65.5-41.2176.2178.80000109.8V75 M78 L79 V160 M173 P174 V180 V181V75-V177 HydrophobicContact CG1-CG1 4.37Å; M78-V177 HydrophobicContact CB-CG2 3.72Å; M78-V177 HydrophobicContact SD-CG2 4.03Å; L79-V177 HydrophobicContact CD1-CG1 4.33Å; L79-V177 HydrophobicContact CD2-CG1 4Å; L79-V177 HydrophobicContact CD2-CG2 4.45Å; L79-V177 HydrophobicContact CG-CG1 4.3Å; V160-V177 HydrophobicContact CB-CG1 4.45Å; V160-V177 HydrophobicContact CG1-CG1 3.79Å; V160-V177 HydrophobicContact CG2-CG1 3.77Å; M173-V177 HydrophobicContact SD-CG1 4.21Å; P174-V177 HydrophobicContact CB-CG2 4.28Å; P174-V177 HydrophobicContact CG-CG2 4.41Å; P174-V177 WeakPolarHBondContact O-CB 3.28Å; P174-V177 PolarHBondContact O-N 3.32Å; V177-V180 PolarHBondContact O-N 3.25Å; V177-V181 VanDerWaalsContact O-CG2 3.3Å; V177-V181 WeakPolarHBondContact O-CG2 3.47Å; V177-V181 PolarHBondContact O-N 2.93Å
178W98.1Very high96.7Very high89 Ų8959.4 Ų59.434%0.33730%0.304SS..Hα-helixtrans-58.7-47172.5-88.6113.6000112.7L170 M173 P174 L175 F176 V180 V181 I182L170-W178 HydrophobicContact CB-CZ2 4.18Å; L170-W178 VanDerWaalsContact O-CZ2 3.25Å; L170-W178 WeakPolarHBondContact O-CZ2 3.43Å; L170-W178 PolarHBondContact O-NE1 3.25Å; M173-W178 HydrophobicContact CE-CD2 3.81Å; M173-W178 HydrophobicContact CE-CE3 4.26Å; M173-W178 HydrophobicContact CE-CG 4.35Å; M173-W178 HydrophobicContact CE-CH2 4.02Å; M173-W178 HydrophobicContact CE-CZ2 3.53Å; M173-W178 HydrophobicContact CE-CZ3 4.36Å; P174-W178 PolarHBondContact O-N 3.27Å; P174-W178 VanDerWaalsContact O-N 3.14Å; L175-W178 WeakPolarHBondContact O-CB 3.4Å; L175-W178 PolarHBondContact O-N 2.71Å; F176-W178 VanDerWaalsContact C-N 3.32Å; W178-V180 VanDerWaalsContact C-N 3.31Å; W178-V180 PolarHBondContact O-N 3.45Å; W178-V181 PolarHBondContact O-N 3.07Å; W178-I182 WeakPolarHBondContact O-CG1 3.45Å; W178-I182 PolarHBondContact O-N 3.01Å
179S97.6Very high96.8Very high54 Ų5463.5 Ų63.538%0.37833%0.326SS..Hα-helixtrans-62.3-39.1179.164.50000112L175 F176 T183L175-S179 PolarHBondContact O-N 3.33Å; F176-S179 WeakPolarHBondContact CA-OG 3.25Å; F176-S179 PolarHBondContact O-N 3.43Å; F176-S179 PolarHBondContact O-OG 3.27Å; S179-T183 WeakPolarHBondContact O-CB 3.49Å; S179-T183 PolarHBondContact O-N 3.33Å; S179-T183 PolarHBondContact O-OG1 2.97Å
180V97.8Very high96.8Very high2 Ų261.6 Ų61.61%0.01231%0.312CS..Hα-helixtrans-65.5-42.8176.3173.70000111.4V75 F156 F176 V177 W178 T183 A184V75-V180 HydrophobicContact CG2-CB 4.15Å; V75-V180 HydrophobicContact CG2-CG1 4.06Å; V75-V180 HydrophobicContact CG2-CG2 4.05Å; F156-V180 HydrophobicContact CB-CG1 4.3Å; F156-V180 HydrophobicContact CD1-CG1 3.84Å; F156-V180 HydrophobicContact CD2-CG1 4.23Å; F156-V180 HydrophobicContact CE1-CG1 4.27Å; F156-V180 HydrophobicContact CG-CG1 3.86Å; F176-V180 HydrophobicContact CD1-CG2 4.37Å; F176-V180 HydrophobicContact CE1-CG2 3.82Å; F176-V180 HydrophobicContact CE2-CG2 4.13Å; F176-V180 HydrophobicContact CZ-CG2 3.68Å; F176-V180 WeakPolarHBondContact O-CG2 3.19Å; F176-V180 PolarHBondContact O-N 2.98Å; V177-V180 PolarHBondContact O-N 3.25Å; W178-V180 VanDerWaalsContact C-N 3.31Å; W178-V180 PolarHBondContact O-N 3.45Å; V180-T183 PolarHBondContact O-N 3.44Å; V180-A184 VanDerWaalsContact O-CB 3.31Å; V180-A184 WeakPolarHBondContact O-CB 3.49Å; V180-A184 PolarHBondContact O-N 3.16Å
181V96.9Very high96.9Very high13 Ų1357.8 Ų57.88%0.07929%0.292CS..Hα-helixtrans-65.9-44.1179.3172.90000112.2V160 V177 W178 T183 A184 L185V160-V181 HydrophobicContact CB-CG2 3.52Å; V160-V181 HydrophobicContact CG1-CG2 3.5Å; V160-V181 VanDerWaalsContact CG1-CG2 3.5Å; V160-V181 HydrophobicContact CG2-CG2 3.35Å; V177-V181 VanDerWaalsContact O-CG2 3.3Å; V177-V181 WeakPolarHBondContact O-CG2 3.47Å; V177-V181 PolarHBondContact O-N 2.93Å; W178-V181 PolarHBondContact O-N 3.07Å; V181-T183 VanDerWaalsContact C-N 3.32Å; V181-T183 PolarHBondContact O-N 3.18Å; V181-A184 PolarHBondContact O-N 3.37Å; V181-L185 HydrophobicContact CG1-CD1 4.2Å; V181-L185 WeakPolarHBondContact O-CG 3.46Å; V181-L185 PolarHBondContact O-N 3.42Å
182I97.8Very high97.1Very high90 Ų9055 Ų5546%0.46228%0.281SS..Hα-helixtrans-60.8-46.6176.4-67.3167.7000109.5W178 A184 L185 L186W178-I182 WeakPolarHBondContact O-CG1 3.45Å; W178-I182 PolarHBondContact O-N 3.01Å; I182-A184 VanDerWaalsContact C-N 3.33Å; I182-A184 PolarHBondContact O-N 3.18Å; I182-L185 PolarHBondContact O-N 2.87Å; I182-L186 HydrophobicContact CG2-CD1 4.18Å; I182-L186 WeakPolarHBondContact O-CG 3.26Å; I182-L186 PolarHBondContact O-N 3.49Å
183T97.5Very high97.2Very high44 Ų4448.3 Ų48.327%0.2726%0.26SS..Hα-helixtrans-60.9-42177-53.60000111.8I67 S179 V180 V181 L185 L186 L187I67-T183 HydrophobicContact CD1-CG2 3.64Å; I67-T183 HydrophobicContact CG1-CG2 4.11Å; S179-T183 WeakPolarHBondContact O-CB 3.49Å; S179-T183 PolarHBondContact O-N 3.33Å; S179-T183 PolarHBondContact O-OG1 2.97Å; V180-T183 PolarHBondContact O-N 3.44Å; V181-T183 VanDerWaalsContact C-N 3.32Å; V181-T183 PolarHBondContact O-N 3.18Å; T183-L185 PolarHBondContact O-N 3.08Å; T183-L186 PolarHBondContact O-N 3.35Å; T183-L187 HydrophobicContact CG2-CD1 4.03Å; T183-L187 HydrophobicContact CG2-CG 4.32Å; T183-L187 WeakPolarHBondContact O-CB 3.23Å; T183-L187 VanDerWaalsContact O-CG 3.28Å; T183-L187 WeakPolarHBondContact O-CG 3.26Å; T183-L187 PolarHBondContact O-N 2.83Å
184A97.4Very high97.2Very high1 Ų148 Ų481%0.00826%0.259CS..Hα-helixtrans-62.2-41.7177.400000112A153 F156 I157 V180 V181 I182 L187 L188A153-A184 HydrophobicContact CB-CB 3.98Å; A153-A184 WeakPolarHBondContact CB-O 3.46Å; F156-A184 HydrophobicContact CB-CB 4.16Å; I157-A184 HydrophobicContact CD1-CB 4.15Å; I157-A184 HydrophobicContact CG1-CB 3.85Å; V180-A184 VanDerWaalsContact O-CB 3.31Å; V180-A184 WeakPolarHBondContact O-CB 3.49Å; V180-A184 PolarHBondContact O-N 3.16Å; V181-A184 PolarHBondContact O-N 3.37Å; I182-A184 VanDerWaalsContact C-N 3.33Å; I182-A184 PolarHBondContact O-N 3.18Å; A184-L187 PolarHBondContact O-N 2.6Å; A184-L188 WeakPolarHBondContact O-CB 3.26Å; A184-L188 PolarHBondContact O-N 3.29Å
185L97.9Very high97.2Very high79 Ų7947.1 Ų47.141%0.41426%0.255SS..Hα-helixtrans-62.3-46.2174.9-74.1167.9000111.6I157 V181 I182 T183 L187 L188 L189I157-L185 HydrophobicContact CD1-CD2 3.77Å; I157-L185 HydrophobicContact CD1-CG 4.14Å; I157-L185 HydrophobicContact CG1-CD2 4.31Å; I157-L185 HydrophobicContact CG1-CG 4.38Å; V181-L185 HydrophobicContact CG1-CD1 4.2Å; V181-L185 WeakPolarHBondContact O-CG 3.46Å; V181-L185 PolarHBondContact O-N 3.42Å; I182-L185 PolarHBondContact O-N 2.87Å; T183-L185 PolarHBondContact O-N 3.08Å; L185-L187 PolarHBondContact O-N 3.21Å; L185-L188 PolarHBondContact O-N 3.28Å; L185-L189 WeakPolarHBondContact O-CG 3.47Å; L185-L189 PolarHBondContact O-N 2.93Å; L185-L189 VanDerWaalsContact O-N 3.12Å
186L97.3Very high97.2Very high72 Ų7241.2 Ų41.238%0.37723%0.231SC..Hα-helixtrans-60.6-45.5177.3-65.8175000111.2I182 T183 L188 L189 S190 P233I182-L186 HydrophobicContact CG2-CD1 4.18Å; I182-L186 WeakPolarHBondContact O-CG 3.26Å; I182-L186 PolarHBondContact O-N 3.49Å; T183-L186 PolarHBondContact O-N 3.35Å; L186-L188 PolarHBondContact O-N 3.41Å; L186-L189 PolarHBondContact O-N 3.15Å; L186-S190 WeakPolarHBondContact O-CB 3.43Å; L186-S190 PolarHBondContact O-N 3.43Å; L186-S190 PolarHBondContact O-OG 3.11Å; L186-P233 HydrophobicContact CD2-CB 4.42Å
187L94.9Very high97.3Very high5 Ų538.6 Ų38.63%0.02622%0.22CC..Hα-helixtrans-61.2-43.5177.6-72.5171.4000112.5M63 A153 T183 A184 L185 L189 S190 L191 K234M63-L187 HydrophobicContact SD-CD2 4.36Å; A153-L187 HydrophobicContact CB-CB 4.31Å; T183-L187 HydrophobicContact CG2-CD1 4.03Å; T183-L187 HydrophobicContact CG2-CG 4.32Å; T183-L187 WeakPolarHBondContact O-CB 3.23Å; T183-L187 VanDerWaalsContact O-CG 3.28Å; T183-L187 WeakPolarHBondContact O-CG 3.26Å; T183-L187 PolarHBondContact O-N 2.83Å; A184-L187 PolarHBondContact O-N 2.6Å; L185-L187 PolarHBondContact O-N 3.21Å; L187-L189 VanDerWaalsContact C-N 3.29Å; L187-L189 PolarHBondContact O-N 3.43Å; L187-S190 PolarHBondContact O-N 2.94Å; L187-L191 HydrophobicContact CB-CD1 4.02Å; L187-L191 HydrophobicContact CD2-CD1 3.94Å; L187-L191 HydrophobicContact CD2-CG 4.28Å; L187-L191 VanDerWaalsContact O-CB 3.27Å; L187-L191 WeakPolarHBondContact O-CB 3.47Å; L187-L191 WeakPolarHBondContact O-CG 3.4Å; L187-L191 PolarHBondContact O-N 2.94Å; L187-K234 HydrophobicContact CD2-CD 3.79Å; L187-K234 VanDerWaalsContact CD2-NZ 3.33Å
188L96.4Very high97.3Very high59 Ų5938.7 Ų38.731%0.30922%0.22SC..Hα-helixtrans-63.4-36.8-179.6-176.961.3000112I150 A153 V154 I157 A184 L185 L186 P192I150-L188 HydrophobicContact CG2-CD1 3.98Å; A153-L188 HydrophobicContact CB-CB 4.37Å; V154-L188 HydrophobicContact CG2-CD1 3.78Å; V154-L188 HydrophobicContact CG2-CD2 4.42Å; I157-L188 HydrophobicContact CD1-CD2 3.89Å; A184-L188 WeakPolarHBondContact O-CB 3.26Å; A184-L188 PolarHBondContact O-N 3.29Å; L185-L188 PolarHBondContact O-N 3.28Å; L186-L188 PolarHBondContact O-N 3.41Å; L188-P192 VanDerWaalsContact O-CD 3.23Å; L188-P192 WeakPolarHBondContact O-CD 3.33Å; L188-P192 WeakPolarHBondContact O-CG 3.39Å
189L96.6Very high97.3Very high125 Ų12537.4 Ų37.465%0.65422%0.222SC*.Hα-helixtrans-82.4-32.6-179.8-65.6174.3000113L185 L186 L187L185-L189 WeakPolarHBondContact O-CG 3.47Å; L185-L189 PolarHBondContact O-N 2.93Å; L185-L189 VanDerWaalsContact O-N 3.12Å; L186-L189 PolarHBondContact O-N 3.15Å; L187-L189 VanDerWaalsContact C-N 3.29Å; L187-L189 PolarHBondContact O-N 3.43Å
190S95.5Very high97.3Very high3 Ų336.8 Ų36.82%0.02121%0.214CC..Hα-helixtrans-93.8-37.6-170.474.60000113.9L186 L187 V193 L194L186-S190 WeakPolarHBondContact O-CB 3.43Å; L186-S190 PolarHBondContact O-N 3.43Å; L186-S190 PolarHBondContact O-OG 3.11Å; L187-S190 PolarHBondContact O-N 2.94Å; S190-V193 PolarHBondContact O-N 2.61Å; S190-V193 VanDerWaalsContact O-N 3.15Å; S190-L194 PolarHBondContact O-N 2.87Å
191L95.8Very high97.4Very high4 Ų436.7 Ų36.72%0.02121%0.213CC..Hα-helixtrans-62.9-35.8-177-74.9168.1000114.6S149 I150 L187 V193 L194 A195 F230S149-L191 VanDerWaalsContact CB-CD1 3.43Å; I150-L191 HydrophobicContact CD1-CB 3.93Å; I150-L191 HydrophobicContact CG1-CB 3.88Å; I150-L191 HydrophobicContact CG1-CD1 3.85Å; L187-L191 HydrophobicContact CB-CD1 4.02Å; L187-L191 HydrophobicContact CD2-CD1 3.94Å; L187-L191 HydrophobicContact CD2-CG 4.28Å; L187-L191 VanDerWaalsContact O-CB 3.27Å; L187-L191 WeakPolarHBondContact O-CB 3.47Å; L187-L191 WeakPolarHBondContact O-CG 3.4Å; L187-L191 PolarHBondContact O-N 2.94Å; L191-V193 PolarHBondContact O-N 2.84Å; L191-L194 HydrophobicContact CD2-CD2 4.48Å; L191-L194 PolarHBondContact O-N 3.33Å; L191-A195 WeakPolarHBondContact O-CB 3.36Å; L191-A195 PolarHBondContact O-N 3.17Å; L191-F230 HydrophobicContact CD2-CD2 4.06Å; L191-F230 HydrophobicContact CD2-CE2 3.39Å; L191-F230 HydrophobicContact CD2-CZ 4.1Å; L191-F230 HydrophobicContact CG-CD2 4.49Å; L191-F230 HydrophobicContact CG-CE2 4.08Å
192P97.8Very high97.4Very high68 Ų6837.4 Ų37.444%0.44222%0.217SC..Hα-helixtrans-59.1-33.1174.4-26.736.6000113.2I150 L188 A195 G196I150-P192 HydrophobicContact CD1-CG 4.42Å; L188-P192 VanDerWaalsContact O-CD 3.23Å; L188-P192 WeakPolarHBondContact O-CD 3.33Å; L188-P192 WeakPolarHBondContact O-CG 3.39Å; P192-A195 PolarHBondContact O-N 2.71Å; P192-G196 PolarHBondContact O-N 3.37Å
193V98.1Very high97.5Very high38 Ų3834.4 Ų34.423%0.2320%0.203CC..Hα-helixtrans-70.4-43.3178.2-177.80000111S190 L191 G196 A197 L226 F229S190-V193 PolarHBondContact O-N 2.61Å; S190-V193 VanDerWaalsContact O-N 3.15Å; L191-V193 PolarHBondContact O-N 2.84Å; V193-G196 PolarHBondContact O-N 3.15Å; V193-A197 PolarHBondContact O-N 3.04Å; V193-L226 HydrophobicContact CG1-CB 4.23Å; V193-L226 HydrophobicContact CG1-CD2 3.92Å; V193-F229 HydrophobicContact CB-CD1 3.8Å; V193-F229 HydrophobicContact CB-CE1 4.28Å; V193-F229 HydrophobicContact CG1-CB 4.24Å; V193-F229 HydrophobicContact CG1-CD1 3.76Å; V193-F229 HydrophobicContact CG1-CG 4.24Å; V193-F229 HydrophobicContact CG2-CD1 3.61Å; V193-F229 HydrophobicContact CG2-CE1 3.59Å
194L96.5Very high97.5Very high6 Ų633.6 Ų33.63%0.03120%0.196CC..Hα-helixtrans-58.3-50.5171.7177.367.9000110.9F59 S190 L191 G196 A197 I198 F227 F230F59-L194 HydrophobicContact CZ-CD2 4.44Å; S190-L194 PolarHBondContact O-N 2.87Å; L191-L194 HydrophobicContact CD2-CD2 4.48Å; L191-L194 PolarHBondContact O-N 3.33Å; L194-G196 VanDerWaalsContact C-N 3.26Å; L194-G196 PolarHBondContact O-N 3.03Å; L194-A197 WeakPolarHBondContact O-CB 3.31Å; L194-A197 PolarHBondContact O-N 3.29Å; L194-I198 HydrophobicContact CD1-CG2 4.03Å; L194-I198 WeakPolarHBondContact O-CG1 3.43Å; L194-I198 PolarHBondContact O-N 3.22Å; L194-F227 HydrophobicContact CD1-CD2 3.9Å; L194-F227 HydrophobicContact CD1-CE2 4.16Å; L194-F230 HydrophobicContact CB-CB 3.84Å; L194-F230 HydrophobicContact CB-CD1 3.93Å; L194-F230 HydrophobicContact CB-CD2 3.99Å; L194-F230 HydrophobicContact CB-CG 3.61Å; L194-F230 HydrophobicContact CD1-CD1 3.91Å; L194-F230 HydrophobicContact CD1-CE1 4.35Å; L194-F230 HydrophobicContact CD1-CG 4.44Å; L194-F230 HydrophobicContact CD2-CD1 3.83Å; L194-F230 HydrophobicContact CD2-CD2 4.36Å; L194-F230 HydrophobicContact CD2-CE1 3.62Å; L194-F230 HydrophobicContact CD2-CE2 4.18Å; L194-F230 HydrophobicContact CD2-CG 4.19Å; L194-F230 HydrophobicContact CD2-CZ 3.8Å; L194-F230 HydrophobicContact CG-CD1 4.09Å; L194-F230 HydrophobicContact CG-CE1 4.38Å; L194-F230 HydrophobicContact CG-CG 4.28Å
195A97.8Very high97.5Very high31 Ų3134.9 Ų34.926%0.25620%0.201SC..Hα-helixtrans-56.4-42.2-179.500000111.5L191 P192 I198 T199L191-A195 WeakPolarHBondContact O-CB 3.36Å; L191-A195 PolarHBondContact O-N 3.17Å; P192-A195 PolarHBondContact O-N 2.71Å; A195-I198 WeakPolarHBondContact O-CG1 3.25Å; A195-T199 VanDerWaalsContact O-CB 3.25Å; A195-T199 WeakPolarHBondContact O-CB 3.47Å; A195-T199 PolarHBondContact O-N 2.97Å; A195-T199 PolarHBondContact O-OG1 3.49Å
196G98.3Very high97.5Very high28 Ų2835.2 Ų35.229%0.28920%0.203SC..Hα-helixtrans-59.2-4917200000112.6P192 V193 L194 I198 T199 M200P192-G196 PolarHBondContact O-N 3.37Å; V193-G196 PolarHBondContact O-N 3.15Å; L194-G196 VanDerWaalsContact C-N 3.26Å; L194-G196 PolarHBondContact O-N 3.03Å; G196-I198 PolarHBondContact O-N 2.76Å; G196-T199 PolarHBondContact O-N 3.02Å; G196-M200 WeakPolarHBondContact O-CE 3.34Å; G196-M200 WeakPolarHBondContact O-CG 3.33Å; G196-M200 PolarHBondContact O-N 3.39Å
197A98.4Very high97.5Very high0 Ų037.6 Ų37.60%022%0.216CC..Hα-helixtrans-58.9-49.2179.800000112.8V193 L194 T199 M200 L201 Y223 L226V193-A197 PolarHBondContact O-N 3.04Å; L194-A197 WeakPolarHBondContact O-CB 3.31Å; L194-A197 PolarHBondContact O-N 3.29Å; A197-T199 VanDerWaalsContact C-N 3.34Å; A197-M200 PolarHBondContact O-N 2.9Å; A197-L201 PolarHBondContact O-N 3.3Å; A197-Y223 HydrophobicContact CB-CE2 4.36Å; A197-L226 HydrophobicContact CB-CB 3.71Å; A197-L226 HydrophobicContact CB-CD1 4.04Å
198I98.4Very high97.6Very high2 Ų245 Ų451%0.0126%0.255CS..Hα-helixtrans-74-25-179.364.7175.1000112.4I139 L142 H143 L194 A195 G196 L202I139-I198 HydrophobicContact CG1-CB 4.37Å; I139-I198 HydrophobicContact CG2-CB 4.07Å; I139-I198 HydrophobicContact CG2-CD1 4.26Å; I139-I198 HydrophobicContact CG2-CG1 4.21Å; L142-I198 HydrophobicContact CB-CD1 3.85Å; H143-I198 VanDerWaalsContact CE1-CG1 3.42Å; H143-I198 WeakPolarHBondContact CE1-CG1 3.42Å; L194-I198 HydrophobicContact CD1-CG2 4.03Å; L194-I198 WeakPolarHBondContact O-CG1 3.43Å; L194-I198 PolarHBondContact O-N 3.22Å; A195-I198 WeakPolarHBondContact O-CG1 3.25Å; G196-I198 PolarHBondContact O-N 2.76Å; I198-L202 WeakPolarHBondContact O-CB 3.32Å; I198-L202 PolarHBondContact O-N 2.93Å
199T98.6Very high97.6Very high62 Ų6244.6 Ų44.638%0.3826%0.255SS..Hα-helixtrans-69.7-46.4169.9-62.10000111H143 A195 G196 A197 L201 L202 T203H143-T199 PolarHBondContact NE2-OG1 2.77Å; A195-T199 VanDerWaalsContact O-CB 3.25Å; A195-T199 WeakPolarHBondContact O-CB 3.47Å; A195-T199 PolarHBondContact O-N 2.97Å; A195-T199 PolarHBondContact O-OG1 3.49Å; G196-T199 PolarHBondContact O-N 3.02Å; A197-T199 VanDerWaalsContact C-N 3.34Å; T199-L201 PolarHBondContact O-N 3.11Å; T199-L202 WeakPolarHBondContact O-CA 3.4Å; T199-L202 WeakPolarHBondContact O-CB 3.41Å; T199-L202 PolarHBondContact O-N 3.37Å; T199-T203 WeakPolarHBondContact O-CG2 3.39Å; T199-T203 PolarHBondContact O-N 3.23Å
200M98.6Very high97.7Very high41 Ų4141 Ų4120%0.20224%0.241CC..Hα-helixtrans-58-38.9174.4-74.8-177-75.600111.3G196 A197 T203 D204 F211 F212 L226G196-M200 WeakPolarHBondContact O-CE 3.34Å; G196-M200 WeakPolarHBondContact O-CG 3.33Å; G196-M200 PolarHBondContact O-N 3.39Å; A197-M200 PolarHBondContact O-N 2.9Å; M200-T203 PolarHBondContact O-N 2.96Å; M200-T203 PolarHBondContact O-OG1 2.81Å; M200-D204 PolarHBondContact O-N 2.93Å; M200-F211 HydrophobicContact CB-CB 4.18Å; M200-F211 HydrophobicContact CB-CD2 3.73Å; M200-F211 HydrophobicContact CB-CE2 4.24Å; M200-F211 HydrophobicContact CB-CG 3.91Å; M200-F211 HydrophobicContact CG-CD1 4.08Å; M200-F211 HydrophobicContact CG-CD2 3.82Å; M200-F211 HydrophobicContact CG-CE1 4.16Å; M200-F211 HydrophobicContact CG-CE2 3.91Å; M200-F211 HydrophobicContact CG-CG 3.92Å; M200-F211 HydrophobicContact CG-CZ 4.08Å; M200-F211 HydrophobicContact SD-CB 4.48Å; M200-F211 HydrophobicContact SD-CD1 3.61Å; M200-F211 HydrophobicContact SD-CD2 4.43Å; M200-F211 HydrophobicContact SD-CE1 3.85Å; M200-F211 HydrophobicContact SD-CG 3.94Å; M200-F211 HydrophobicContact SD-CZ 4.37Å; M200-F212 HydrophobicContact CB-CE2 3.62Å; M200-F212 HydrophobicContact CB-CZ 3.73Å; M200-F212 HydrophobicContact CE-CZ 4.24Å; M200-F212 HydrophobicContact SD-CZ 4.48Å; M200-L226 HydrophobicContact CE-CD1 3.31Å
201L98.5Very high97.8Very high0 Ų045.1 Ų45.10%026%0.259CS..Hα-helixtrans-66.1-41.9175.3177.963.2000111.1V120 P122 S125 I139 A197 T199 T203 D204 R205 F212 Y223V120-L201 HydrophobicContact CG1-CD2 3.8Å; P122-L201 HydrophobicContact CB-CD1 4.12Å; P122-L201 HydrophobicContact CG-CD1 4.43Å; S125-L201 WeakPolarHBondContact OG-CD2 3.27Å; I139-L201 HydrophobicContact CD1-CD2 4.03Å; I139-L201 HydrophobicContact CD1-CG 4.17Å; A197-L201 PolarHBondContact O-N 3.3Å; T199-L201 PolarHBondContact O-N 3.11Å; L201-T203 VanDerWaalsContact C-N 3.29Å; L201-T203 PolarHBondContact O-N 2.84Å; L201-D204 PolarHBondContact O-N 3.48Å; L201-R205 HydrophobicContact CD1-CG 4.42Å; L201-R205 WeakPolarHBondContact O-CB 3.47Å; L201-R205 VanDerWaalsContact O-CG 3.22Å; L201-R205 WeakPolarHBondContact O-CG 3.29Å; L201-R205 PolarHBondContact O-N 2.9Å; L201-F212 HydrophobicContact CB-CD2 4.31Å; L201-F212 HydrophobicContact CB-CE2 4.01Å; L201-F212 HydrophobicContact CD1-CD2 4.37Å; L201-Y223 HydrophobicContact CB-CE2 4.11Å; L201-Y223 HydrophobicContact CD2-CE2 3.9Å
202L98.4Very high97.9Very high28 Ų2845 Ų4515%0.14726%0.258CS..Hα-helixtrans-61-39176.4-171.169.5000111.7D136 I139 F140 I198 T199 R205 N206D136-L202 HydrophobicContact CB-CD1 3.87Å; D136-L202 VanDerWaalsContact OD1-CD1 3.23Å; D136-L202 WeakPolarHBondContact OD1-CD1 3.23Å; I139-L202 HydrophobicContact CD1-CB 4.28Å; I139-L202 HydrophobicContact CD1-CD1 4.21Å; I139-L202 HydrophobicContact CG2-CB 4.26Å; I139-L202 HydrophobicContact CG2-CD1 4.32Å; I139-L202 HydrophobicContact CG2-CD2 4.38Å; F140-L202 HydrophobicContact CE1-CD2 3.88Å; F140-L202 HydrophobicContact CZ-CD2 3.86Å; I198-L202 WeakPolarHBondContact O-CB 3.32Å; I198-L202 PolarHBondContact O-N 2.93Å; T199-L202 WeakPolarHBondContact O-CA 3.4Å; T199-L202 WeakPolarHBondContact O-CB 3.41Å; T199-L202 PolarHBondContact O-N 3.37Å; L202-R205 PolarHBondContact O-N 3.43Å; L202-N206 WeakPolarHBondContact CD1-ND2 3.42Å; L202-N206 WeakPolarHBondContact O-CB 3.32Å; L202-N206 PolarHBondContact O-N 2.89Å; L202-N206 PolarHBondContact O-ND2 3.21Å
203T98.3Very high97.9Very high27 Ų2744.7 Ų44.717%0.16625%0.252CS..Hα-helixtrans-72.9-35.6176.762.60000112.2T199 M200 L201 R205 N206 L207 N208 T209T199-T203 WeakPolarHBondContact O-CG2 3.39Å; T199-T203 PolarHBondContact O-N 3.23Å; M200-T203 PolarHBondContact O-N 2.96Å; M200-T203 PolarHBondContact O-OG1 2.81Å; L201-T203 VanDerWaalsContact C-N 3.29Å; L201-T203 PolarHBondContact O-N 2.84Å; T203-R205 PolarHBondContact O-N 3.17Å; T203-N206 PolarHBondContact O-N 2.99Å; T203-L207 HydrophobicContact CG2-CD1 3.86Å; T203-L207 CarbonylContact O-C 3.58Å; T203-L207 WeakPolarHBondContact O-CA 3.45Å; T203-L207 PolarHBondContact O-N 2.81Å; T203-N208 PolarHBondContact O-N 3.22Å; T203-T209 WeakPolarHBondContact CB-OG1 3.41Å; T203-T209 PolarHBondContact O-OG1 3.34Å; T203-T209 PolarHBondContact OG1-OG1 3.33Å
204D98Very high97.8Very high26 Ų2646.9 Ų46.914%0.13927%0.267CS..Hα-helixtrans-62.9-36.8173.4-82.511000110.8M200 L201 T209 S210 F211 F212M200-D204 PolarHBondContact O-N 2.93Å; L201-D204 PolarHBondContact O-N 3.48Å; D204-T209 WeakPolarHBondContact CA-O 3.33Å; D204-T209 WeakPolarHBondContact CA-OG1 3.25Å; D204-T209 PolarHBondContact N-OG1 3.49Å; D204-T209 WeakPolarHBondContact OD1-CB 3.09Å; D204-T209 VanDerWaalsContact OD1-O 3.13Å; D204-T209 PolarHBondContact OD1-OG1 2.99Å; D204-S210 PolarHBondContact OD1-N 2.91Å; D204-S210 VanDerWaalsContact OD1-N 3.15Å; D204-F211 VanDerWaalsContact CG-N 3.34Å; D204-F211 WeakPolarHBondContact OD1-CD2 3.34Å; D204-F211 PolarHBondContact OD1-N 3.35Å; D204-F211 PolarHBondContact OD2-N 2.93Å; D204-F212 PolarHBondContact OD2-N 2.89Å
205R97.5Very high97.7Very high28 Ų2851.2 Ų51.211%0.10630%0.304CS..Hα-helixtrans-71.8-38.3177.7-70.9170.858.266.216.1113.7S125 H130 G132 D136 L201 L202 T203S125-R205 WeakPolarHBondContact O-CD 3.18Å; S125-R205 PolarHBondContact O-NH1 2.88Å; H130-R205 PolarHBondContact O-NH1 3.39Å; H130-R205 PolarHBondContact O-NH2 3.46Å; G132-R205 PolarHBondContact O-NH2 3.04Å; D136-R205 IonicContact OD1-CZ 3.5Å; D136-R205 IonicContact OD1-NE 2.74Å; D136-R205 PolarHBondContact OD1-NE 2.86Å; D136-R205 IonicContact OD1-NH2 3.37Å; D136-R205 PolarHBondContact OD1-NH2 3.47Å; D136-R205 IonicContact OD2-CZ 3.84Å; D136-R205 IonicContact OD2-NE 3.83Å; D136-R205 IonicContact OD2-NH2 2.97Å; D136-R205 PolarHBondContact OD2-NH2 3.45Å; L201-R205 HydrophobicContact CD1-CG 4.42Å; L201-R205 WeakPolarHBondContact O-CB 3.47Å; L201-R205 VanDerWaalsContact O-CG 3.22Å; L201-R205 WeakPolarHBondContact O-CG 3.29Å; L201-R205 PolarHBondContact O-N 2.9Å; L202-R205 PolarHBondContact O-N 3.43Å; T203-R205 PolarHBondContact O-N 3.17Å
206N98Very high97.5Very high86 Ų8651.7 Ų51.746%0.4631%0.312SS..Hα-helixtrans-121-20.6-163.7-63.9-79.3000115.2D136 L202 T203D136-N206 PolarHBondContact OD1-ND2 3.12Å; L202-N206 WeakPolarHBondContact CD1-ND2 3.42Å; L202-N206 WeakPolarHBondContact O-CB 3.32Å; L202-N206 PolarHBondContact O-N 2.89Å; L202-N206 PolarHBondContact O-ND2 3.21Å; T203-N206 PolarHBondContact O-N 2.99Å
207L97.5Very high97.5Very high122 Ų12253.8 Ų53.864%0.63933%0.334SS*.SBendtrans-121.515.2-172-57.9-177.2000113.1T203 T209T203-L207 HydrophobicContact CG2-CD1 3.86Å; T203-L207 CarbonylContact O-C 3.58Å; T203-L207 WeakPolarHBondContact O-CA 3.45Å; T203-L207 PolarHBondContact O-N 2.81Å; L207-T209 PolarHBondContact O-N 3Å
208N95.8Very high97.4Very high161 Ų16154.5 Ų54.586%0.86134%0.341SS*.  trans5532.7179.1-56-53.8000113.9T203T203-N208 PolarHBondContact O-N 3.22Å
209T97.8Very high97.4Very high50 Ų5057.9 Ų57.931%0.30736%0.359SS..  trans-79.7167.4165.563.50000110.3T203 D204 L207 F211T203-T209 WeakPolarHBondContact CB-OG1 3.41Å; T203-T209 PolarHBondContact O-OG1 3.34Å; T203-T209 PolarHBondContact OG1-OG1 3.33Å; D204-T209 WeakPolarHBondContact CA-O 3.33Å; D204-T209 WeakPolarHBondContact CA-OG1 3.25Å; D204-T209 PolarHBondContact N-OG1 3.49Å; D204-T209 WeakPolarHBondContact OD1-CB 3.09Å; D204-T209 VanDerWaalsContact OD1-O 3.13Å; D204-T209 PolarHBondContact OD1-OG1 2.99Å; L207-T209 PolarHBondContact O-N 3Å; T209-F211 HydrophobicContact CG2-CE2 4.2Å
210S97.4Very high97.3Very high50 Ų5056.1 Ų56.135%0.3535%0.349SS..  trans-137.148.3-177.858.90000112.5D204 F212 G216 G218D204-S210 PolarHBondContact OD1-N 2.91Å; D204-S210 VanDerWaalsContact OD1-N 3.15Å; S210-F212 VanDerWaalsContact C-N 3.34Å; S210-G216 PolarHBondContact OG-O 2.74Å; S210-G216 VanDerWaalsContact OG-O 3.05Å; S210-G218 VanDerWaalsContact O-CA 3.23Å; S210-G218 WeakPolarHBondContact O-CA 3.37Å; S210-G218 PolarHBondContact O-N 3.42Å
211F98.3Very high97.3Very high90 Ų9058.3 Ų58.340%0.39536%0.36SS..SBendtrans-63.3-40.3177-71.1-76.5000112.2M200 D204 T209 G218 D219M200-F211 HydrophobicContact CB-CB 4.18Å; M200-F211 HydrophobicContact CB-CD2 3.73Å; M200-F211 HydrophobicContact CB-CE2 4.24Å; M200-F211 HydrophobicContact CB-CG 3.91Å; M200-F211 HydrophobicContact CG-CD1 4.08Å; M200-F211 HydrophobicContact CG-CD2 3.82Å; M200-F211 HydrophobicContact CG-CE1 4.16Å; M200-F211 HydrophobicContact CG-CE2 3.91Å; M200-F211 HydrophobicContact CG-CG 3.92Å; M200-F211 HydrophobicContact CG-CZ 4.08Å; M200-F211 HydrophobicContact SD-CB 4.48Å; M200-F211 HydrophobicContact SD-CD1 3.61Å; M200-F211 HydrophobicContact SD-CD2 4.43Å; M200-F211 HydrophobicContact SD-CE1 3.85Å; M200-F211 HydrophobicContact SD-CG 3.94Å; M200-F211 HydrophobicContact SD-CZ 4.37Å; D204-F211 VanDerWaalsContact CG-N 3.34Å; D204-F211 WeakPolarHBondContact OD1-CD2 3.34Å; D204-F211 PolarHBondContact OD1-N 3.35Å; D204-F211 PolarHBondContact OD2-N 2.93Å; T209-F211 HydrophobicContact CG2-CE2 4.2Å; F211-G218 WeakPolarHBondContact O-CA 3.27Å; F211-D219 PolarHBondContact O-N 3.05Å; F211-D219 VanDerWaalsContact O-N 3.12Å
212F98.2Very high97.3Very high2 Ų261.6 Ų61.61%0.00938%0.378CS..SBendtrans-118.2-2.6-173.5-50-56.4000113.8P122 M200 L201 D204 S210 P214 P220 L222 Y223 L226P122-F212 HydrophobicContact CB-CB 3.95Å; P122-F212 HydrophobicContact CG-CB 3.57Å; P122-F212 HydrophobicContact CG-CD2 4.1Å; P122-F212 HydrophobicContact CG-CG 3.85Å; M200-F212 HydrophobicContact CB-CE2 3.62Å; M200-F212 HydrophobicContact CB-CZ 3.73Å; M200-F212 HydrophobicContact CE-CZ 4.24Å; M200-F212 HydrophobicContact SD-CZ 4.48Å; L201-F212 HydrophobicContact CB-CD2 4.31Å; L201-F212 HydrophobicContact CB-CE2 4.01Å; L201-F212 HydrophobicContact CD1-CD2 4.37Å; D204-F212 PolarHBondContact OD2-N 2.89Å; S210-F212 VanDerWaalsContact C-N 3.34Å; F212-P214 WeakPolarHBondContact O-CD 3.23Å; F212-P220 VanDerWaalsContact O-CD 3.23Å; F212-P220 WeakPolarHBondContact O-CD 3.22Å; F212-P220 VanDerWaalsContact O-CG 3.27Å; F212-P220 WeakPolarHBondContact O-CG 3.35Å; F212-L222 HydrophobicContact CD1-CB 4.38Å; F212-L222 HydrophobicContact CE1-CB 4.29Å; F212-L222 HydrophobicContact CE1-CD2 4.15Å; F212-L222 HydrophobicContact CE1-CG 4.09Å; F212-Y223 HydrophobicContact CD2-CD2 4.07Å; F212-Y223 HydrophobicContact CE1-CD2 4.19Å; F212-Y223 HydrophobicContact CE1-CG 4.44Å; F212-Y223 AromaticContact CE2-CD2 3.64Å; F212-Y223 HydrophobicContact CE2-CD2 3.64Å; F212-Y223 HydrophobicContact CE2-CE2 4.44Å; F212-Y223 AromaticContact CZ-CD2 3.7Å; F212-Y223 HydrophobicContact CZ-CD2 3.7Å; F212-Y223 HydrophobicContact CZ-CG 4.38Å; F212-L226 HydrophobicContact CE1-CD1 4.32Å; F212-L226 HydrophobicContact CZ-CD1 4.34Å
213D96.7Very high97.3Very high61 Ų6160.3 Ų60.333%0.32637%0.371SS..  trans-89.3113.1178.1-178.55.3000111.6A215 G216 G217 G218D213-A215 PolarHBondContact O-N 2.76Å; D213-A215 WeakPolarHBondContact OD1-CB 3.42Å; D213-A215 PolarHBondContact OD1-N 2.74Å; D213-G216 CarbonylContact O-C 3.5Å; D213-G216 PolarHBondContact O-N 3.13Å; D213-G217 PolarHBondContact O-N 2.98Å; D213-G218 WeakPolarHBondContact O-CA 3.35Å; D213-G218 PolarHBondContact O-N 2.91Å
214P96.2Very high97.2Very high84 Ų8462.7 Ų62.755%0.54538%0.38SS..G310 helixtrans-57.8-29.3176.7-24.435.1000114.4F212 G216 G217 G218 P220F212-P214 WeakPolarHBondContact O-CD 3.23Å; P214-G216 PolarHBondContact O-N 3.46Å; P214-G217 PolarHBondContact O-N 3.17Å; P214-G217 VanDerWaalsContact O-N 3.11Å; P214-G218 WeakPolarHBondContact CA-O 3.33Å; P214-P220 HydrophobicContact CG-CG 3.97Å
215A95.1Very high97.2Very high96 Ų9667.5 Ų67.579%0.79340%0.401SS*.G310 helixtrans-66.1-28.6178.600000112.2D213D213-A215 PolarHBondContact O-N 2.76Å; D213-A215 WeakPolarHBondContact OD1-CB 3.42Å; D213-A215 PolarHBondContact OD1-N 2.74Å
216G94.6Very high97.2Very high42 Ų4267.9 Ų67.943%0.43341%0.405SS..G310 helixtrans-9912.8173.200000114.2S210 D213 P214S210-G216 PolarHBondContact OG-O 2.74Å; S210-G216 VanDerWaalsContact OG-O 3.05Å; D213-G216 CarbonylContact O-C 3.5Å; D213-G216 PolarHBondContact O-N 3.13Å; P214-G216 PolarHBondContact O-N 3.46Å
217G96.4Very high97.2Very high72 Ų7264.1 Ų64.174%0.74239%0.385SS*.THydrogen-bonded Turntrans83.98179.900000115.8D213 P214D213-G217 PolarHBondContact O-N 2.98Å; P214-G217 PolarHBondContact O-N 3.17Å; P214-G217 VanDerWaalsContact O-N 3.11Å
218G97.5Very high97.2Very high15 Ų1563.4 Ų63.416%0.15537%0.374CS..  trans-78.4173.7174.400000113.6S210 F211 D213 P214S210-G218 VanDerWaalsContact O-CA 3.23Å; S210-G218 WeakPolarHBondContact O-CA 3.37Å; S210-G218 PolarHBondContact O-N 3.42Å; F211-G218 WeakPolarHBondContact O-CA 3.27Å; D213-G218 WeakPolarHBondContact O-CA 3.35Å; D213-G218 PolarHBondContact O-N 2.91Å; P214-G218 WeakPolarHBondContact CA-O 3.33Å
219D97.9Very high97.1Very high73 Ų7361.6 Ų61.639%0.3936%0.358SS..  trans-134.7112.9-179-1776.2000111.8F211 I221 L222F211-D219 PolarHBondContact O-N 3.05Å; F211-D219 VanDerWaalsContact O-N 3.12Å; D219-I221 PolarHBondContact O-N 2.91Å; D219-I221 VanDerWaalsContact O-N 3.15Å; D219-I221 VanDerWaalsContact OD1-CB 3.26Å; D219-I221 WeakPolarHBondContact OD1-CB 3.49Å; D219-I221 WeakPolarHBondContact OD1-CG1 3.35Å; D219-I221 PolarHBondContact OD1-N 3.07Å; D219-L222 HydrophobicContact CB-CB 4.29Å; D219-L222 VanDerWaalsContact O-CB 3.23Å; D219-L222 WeakPolarHBondContact O-CB 3.5Å; D219-L222 PolarHBondContact O-N 2.97Å
220P97Very high96.8Very high24 Ų2459.2 Ų59.216%0.15634%0.344CS..Hα-helixtrans-57.3-25.4173-23.831.8000114F212 P214 L222 Y223 Q224F212-P220 VanDerWaalsContact O-CD 3.23Å; F212-P220 WeakPolarHBondContact O-CD 3.22Å; F212-P220 VanDerWaalsContact O-CG 3.27Å; F212-P220 WeakPolarHBondContact O-CG 3.35Å; P214-P220 HydrophobicContact CG-CG 3.97Å; P220-L222 VanDerWaalsContact C-N 3.32Å; P220-Y223 WeakPolarHBondContact O-CB 3.31Å; P220-Y223 PolarHBondContact O-N 3.44Å; P220-Q224 PolarHBondContact O-N 2.93Å
221I98.1Very high96Very high88 Ų8856.9 Ų56.945%0.45133%0.327SS..Hα-helixtrans-70.7-31177.6-57.7173.8000110.6D219 Y223 Q224 H225D219-I221 PolarHBondContact O-N 2.91Å; D219-I221 VanDerWaalsContact O-N 3.15Å; D219-I221 VanDerWaalsContact OD1-CB 3.26Å; D219-I221 WeakPolarHBondContact OD1-CB 3.49Å; D219-I221 WeakPolarHBondContact OD1-CG1 3.35Å; D219-I221 PolarHBondContact OD1-N 3.07Å; I221-Y223 VanDerWaalsContact C-N 3.25Å; I221-Y223 PolarHBondContact O-N 2.83Å; I221-Q224 WeakPolarHBondContact O-CB 3.4Å; I221-Q224 PolarHBondContact O-N 3.27Å; I221-H225 PolarHBondContact O-CD2 3.06Å; I221-H225 VanDerWaalsContact O-CD2 3.28Å; I221-H225 PolarHBondContact O-N 3.42Å
222L98.1Very high95.3Very high69 Ų6959.9 Ų59.936%0.36134%0.342SS..Hα-helixtrans-56.1-43171.5177.262.4000110.9F212 D219 P220 Q224 H225 L226F212-L222 HydrophobicContact CD1-CB 4.38Å; F212-L222 HydrophobicContact CE1-CB 4.29Å; F212-L222 HydrophobicContact CE1-CD2 4.15Å; F212-L222 HydrophobicContact CE1-CG 4.09Å; D219-L222 HydrophobicContact CB-CB 4.29Å; D219-L222 VanDerWaalsContact O-CB 3.23Å; D219-L222 WeakPolarHBondContact O-CB 3.5Å; D219-L222 PolarHBondContact O-N 2.97Å; P220-L222 VanDerWaalsContact C-N 3.32Å; L222-Q224 VanDerWaalsContact C-N 3.3Å; L222-Q224 PolarHBondContact O-N 3.36Å; L222-H225 PolarHBondContact O-N 2.84Å; L222-L226 HydrophobicContact CD1-CD1 4.29Å; L222-L226 HydrophobicContact CD1-CG 4.26Å; L222-L226 HydrophobicContact CG-CD1 4.08Å; L222-L226 HydrophobicContact CG-CG 4.48Å; L222-L226 WeakPolarHBondContact O-CG 3.44Å; L222-L226 PolarHBondContact O-N 2.94Å
223Y98.3Very high94.4Very high0 Ų062.2 Ų62.20%036%0.358CS..Hα-helixtrans-57.8-45.3175.5-174.3-77.9000110.9T119 Y121 P122 A197 L201 F212 P220 I221 H225 L226 F227T119-Y223 WeakPolarHBondContact O-CE1 3.48Å; T119-Y223 PolarHBondContact O-OH 3.36Å; Y121-Y223 AromaticContact CD1-CD1 3.52Å; Y121-Y223 HydrophobicContact CD1-CD1 3.52Å; Y121-Y223 AromaticContact CD1-CE1 3.66Å; Y121-Y223 HydrophobicContact CD1-CE1 3.66Å; Y121-Y223 AromaticContact CE1-CD1 3.99Å; Y121-Y223 HydrophobicContact CE1-CD1 3.99Å; Y121-Y223 HydrophobicContact CE1-CE1 4.11Å; P122-Y223 VanDerWaalsContact CD-CG 3.42Å; P122-Y223 HydrophobicContact CG-CD2 4.02Å; P122-Y223 HydrophobicContact CG-CG 3.88Å; A197-Y223 HydrophobicContact CB-CE2 4.36Å; L201-Y223 HydrophobicContact CB-CE2 4.11Å; L201-Y223 HydrophobicContact CD2-CE2 3.9Å; F212-Y223 HydrophobicContact CD2-CD2 4.07Å; F212-Y223 HydrophobicContact CE1-CD2 4.19Å; F212-Y223 HydrophobicContact CE1-CG 4.44Å; F212-Y223 AromaticContact CE2-CD2 3.64Å; F212-Y223 HydrophobicContact CE2-CD2 3.64Å; F212-Y223 HydrophobicContact CE2-CE2 4.44Å; F212-Y223 AromaticContact CZ-CD2 3.7Å; F212-Y223 HydrophobicContact CZ-CD2 3.7Å; F212-Y223 HydrophobicContact CZ-CG 4.38Å; P220-Y223 WeakPolarHBondContact O-CB 3.31Å; P220-Y223 PolarHBondContact O-N 3.44Å; I221-Y223 VanDerWaalsContact C-N 3.25Å; I221-Y223 PolarHBondContact O-N 2.83Å; Y223-H225 VanDerWaalsContact C-N 3.33Å; Y223-H225 PolarHBondContact O-N 3.31Å; Y223-L226 PolarHBondContact O-N 3.37Å; Y223-F227 HydrophobicContact CD1-CB 4.16Å; Y223-F227 HydrophobicContact CE1-CB 3.88Å; Y223-F227 HydrophobicContact CE1-CD2 4.02Å; Y223-F227 HydrophobicContact CE1-CG 4.21Å; Y223-F227 VanDerWaalsContact O-CB 3.26Å; Y223-F227 WeakPolarHBondContact O-CB 3.23Å; Y223-F227 PolarHBondContact O-N 3.19Å
224Q97.7Very high92.6Very high77 Ų7760.9 Ų60.936%0.3635%0.349SS..Hα-helixtrans-61-42.7179.1-57.9-174.132.400111.7Y121 P220 I221 L222 F227 W228Y121-Q224 HydrophobicContact CD1-CG 4.13Å; Y121-Q224 HydrophobicContact CE1-CB 4.32Å; Y121-Q224 HydrophobicContact CE1-CG 3.77Å; Y121-Q224 HydrophobicContact CE2-CG 4.37Å; P220-Q224 PolarHBondContact O-N 2.93Å; I221-Q224 WeakPolarHBondContact O-CB 3.4Å; I221-Q224 PolarHBondContact O-N 3.27Å; L222-Q224 VanDerWaalsContact C-N 3.3Å; L222-Q224 PolarHBondContact O-N 3.36Å; Q224-F227 PolarHBondContact O-N 3.11Å; Q224-W228 WeakPolarHBondContact O-CB 3.2Å; Q224-W228 PolarHBondContact O-N 3.2Å
225H97.8Very high90.3Very high127 Ų12764.7 Ų64.759%0.58836%0.357SS*.Hα-helixtrans-60.2-47.3176.2-75.9-60.6000112.1I221 L222 Y223 F229I221-H225 PolarHBondContact O-CD2 3.06Å; I221-H225 VanDerWaalsContact O-CD2 3.28Å; I221-H225 PolarHBondContact O-N 3.42Å; L222-H225 PolarHBondContact O-N 2.84Å; Y223-H225 VanDerWaalsContact C-N 3.33Å; Y223-H225 PolarHBondContact O-N 3.31Å; H225-F229 VanDerWaalsContact O-CB 3.27Å; H225-F229 WeakPolarHBondContact O-CB 3.45Å; H225-F229 PolarHBondContact O-N 3.05Å
226L97.6Very high90.1Very high37 Ų3763.2 Ų63.219%0.19434%0.336CS..Hα-helixtrans-65.8-42.9179.3-62.4169.4000111.5V193 A197 M200 F212 L222 Y223 F230V193-L226 HydrophobicContact CG1-CB 4.23Å; V193-L226 HydrophobicContact CG1-CD2 3.92Å; A197-L226 HydrophobicContact CB-CB 3.71Å; A197-L226 HydrophobicContact CB-CD1 4.04Å; M200-L226 HydrophobicContact CE-CD1 3.31Å; F212-L226 HydrophobicContact CE1-CD1 4.32Å; F212-L226 HydrophobicContact CZ-CD1 4.34Å; L222-L226 HydrophobicContact CD1-CD1 4.29Å; L222-L226 HydrophobicContact CD1-CG 4.26Å; L222-L226 HydrophobicContact CG-CD1 4.08Å; L222-L226 HydrophobicContact CG-CG 4.48Å; L222-L226 WeakPolarHBondContact O-CG 3.44Å; L222-L226 PolarHBondContact O-N 2.94Å; Y223-L226 PolarHBondContact O-N 3.37Å; L226-F230 PolarHBondContact O-N 3.06Å
227F97.1Very high89.9Confident6 Ų664.3 Ų64.33%0.02633%0.331CS..Hα-helixtrans-62.3-46.5178.1-176-89.2000111.5W118 T119 Y121 L194 Y223 Q224 F230 G231W118-F227 HydrophobicContact CD2-CZ 4.31Å; W118-F227 AromaticContact CE3-CZ 3.75Å; W118-F227 HydrophobicContact CE3-CZ 3.75Å; W118-F227 AromaticContact CH2-CE1 3.51Å; W118-F227 HydrophobicContact CH2-CE1 3.51Å; W118-F227 AromaticContact CH2-CZ 3.53Å; W118-F227 HydrophobicContact CH2-CZ 3.53Å; W118-F227 HydrophobicContact CZ2-CE1 4.02Å; W118-F227 HydrophobicContact CZ2-CZ 4.18Å; W118-F227 AromaticContact CZ3-CE1 3.85Å; W118-F227 HydrophobicContact CZ3-CE1 3.85Å; W118-F227 HydrophobicContact CZ3-CE2 4.44Å; W118-F227 AromaticContact CZ3-CZ 3.34Å; W118-F227 HydrophobicContact CZ3-CZ 3.34Å; T119-F227 HydrophobicContact CG2-CD1 4.41Å; T119-F227 HydrophobicContact CG2-CE1 3.69Å; T119-F227 HydrophobicContact CG2-CZ 3.92Å; Y121-F227 HydrophobicContact CE1-CD1 4.44Å; Y121-F227 HydrophobicContact CE1-CG 4.46Å; L194-F227 HydrophobicContact CD1-CD2 3.9Å; L194-F227 HydrophobicContact CD1-CE2 4.16Å; Y223-F227 HydrophobicContact CD1-CB 4.16Å; Y223-F227 HydrophobicContact CE1-CB 3.88Å; Y223-F227 HydrophobicContact CE1-CD2 4.02Å; Y223-F227 HydrophobicContact CE1-CG 4.21Å; Y223-F227 VanDerWaalsContact O-CB 3.26Å; Y223-F227 WeakPolarHBondContact O-CB 3.23Å; Y223-F227 PolarHBondContact O-N 3.19Å; Q224-F227 PolarHBondContact O-N 3.11Å; F227-F230 CarbonylContact O-C 3.57Å; F227-F230 WeakPolarHBondContact O-CB 3.23Å; F227-F230 PolarHBondContact O-N 3.15Å; F227-G231 PolarHBondContact O-N 2.58Å
228W97Very high89.5Confident107 Ų10763.8 Ų63.841%0.40531%0.308SS..Hα-helixtrans-79.4-23.1-178.2-72.6121.5000114.1W118 T119 Y121 Q224 F230 G231 H232W118-W228 HydrophobicContact CH2-CH2 4.22Å; W118-W228 HydrophobicContact CH2-CZ3 4.19Å; W118-W228 AromaticContact CZ2-CH2 3.78Å; W118-W228 HydrophobicContact CZ2-CH2 3.78Å; W118-W228 HydrophobicContact CZ2-CZ3 4.18Å; T119-W228 HydrophobicContact CG2-CZ2 4.37Å; Y121-W228 AromaticContact CZ-NE1 3.99Å; Y121-W228 VanDerWaalsContact OH-CE2 3.28Å; Y121-W228 PolarHBondContact OH-NE1 2.86Å; Q224-W228 WeakPolarHBondContact O-CB 3.2Å; Q224-W228 PolarHBondContact O-N 3.2Å; W228-F230 PolarHBondContact O-N 3.23Å; W228-G231 PolarHBondContact O-N 3.28Å; W228-H232 PolarHBondContact O-N 2.95Å
229F94.7Very high89Confident123 Ų12366.7 Ų66.754%0.53932%0.317SS..Hα-helixtrans-57.8-38.9165.2-176.2-83.5000110.7V193 H225 P233V193-F229 HydrophobicContact CB-CD1 3.8Å; V193-F229 HydrophobicContact CB-CE1 4.28Å; V193-F229 HydrophobicContact CG1-CB 4.24Å; V193-F229 HydrophobicContact CG1-CD1 3.76Å; V193-F229 HydrophobicContact CG1-CG 4.24Å; V193-F229 HydrophobicContact CG2-CD1 3.61Å; V193-F229 HydrophobicContact CG2-CE1 3.59Å; H225-F229 VanDerWaalsContact O-CB 3.27Å; H225-F229 WeakPolarHBondContact O-CB 3.45Å; H225-F229 PolarHBondContact O-N 3.05Å; F229-P233 WeakPolarHBondContact O-CD 3.41Å; F229-P233 VanDerWaalsContact O-CG 3.25Å; F229-P233 WeakPolarHBondContact O-CG 3.4Å
230F91.6Very high88.5Confident1 Ų166.3 Ų66.30%0.00431%0.312CS..Hα-helixtrans-76-46.2169.7157.6-100.5000112.8F59 L191 L194 L226 F227 W228 H232 P233 K234F59-F230 HydrophobicContact CE1-CZ 4.1Å; F59-F230 HydrophobicContact CZ-CE1 4.13Å; F59-F230 AromaticContact CZ-CZ 3.95Å; F59-F230 HydrophobicContact CZ-CZ 3.95Å; L191-F230 HydrophobicContact CD2-CD2 4.06Å; L191-F230 HydrophobicContact CD2-CE2 3.39Å; L191-F230 HydrophobicContact CD2-CZ 4.1Å; L191-F230 HydrophobicContact CG-CD2 4.49Å; L191-F230 HydrophobicContact CG-CE2 4.08Å; L194-F230 HydrophobicContact CB-CB 3.84Å; L194-F230 HydrophobicContact CB-CD1 3.93Å; L194-F230 HydrophobicContact CB-CD2 3.99Å; L194-F230 HydrophobicContact CB-CG 3.61Å; L194-F230 HydrophobicContact CD1-CD1 3.91Å; L194-F230 HydrophobicContact CD1-CE1 4.35Å; L194-F230 HydrophobicContact CD1-CG 4.44Å; L194-F230 HydrophobicContact CD2-CD1 3.83Å; L194-F230 HydrophobicContact CD2-CD2 4.36Å; L194-F230 HydrophobicContact CD2-CE1 3.62Å; L194-F230 HydrophobicContact CD2-CE2 4.18Å; L194-F230 HydrophobicContact CD2-CG 4.19Å; L194-F230 HydrophobicContact CD2-CZ 3.8Å; L194-F230 HydrophobicContact CG-CD1 4.09Å; L194-F230 HydrophobicContact CG-CE1 4.38Å; L194-F230 HydrophobicContact CG-CG 4.28Å; L226-F230 PolarHBondContact O-N 3.06Å; F227-F230 CarbonylContact O-C 3.57Å; F227-F230 WeakPolarHBondContact O-CB 3.23Å; F227-F230 PolarHBondContact O-N 3.15Å; W228-F230 PolarHBondContact O-N 3.23Å; F230-H232 PolarHBondContact O-N 2.86Å; F230-P233 WeakPolarHBondContact O-CD 3.5Å; F230-K234 HydrophobicContact CE1-CB 4.42Å; F230-K234 HydrophobicContact CE1-CG 4.31Å; F230-K234 HydrophobicContact CE2-CB 3.98Å; F230-K234 HydrophobicContact CE2-CD 3.94Å; F230-K234 HydrophobicContact CE2-CG 3.98Å; F230-K234 HydrophobicContact CZ-CB 3.94Å; F230-K234 HydrophobicContact CZ-CD 3.9Å; F230-K234 HydrophobicContact CZ-CG 3.62Å; F230-K234 WeakPolarHBondContact O-CB 3.35Å; F230-K234 PolarHBondContact O-N 3.38Å
231G80.6Confident87.9Confident0 Ų069.1 Ų69.10%032%0.322CS..Hα-helixtrans-63.7-46.3-167.200000112.2F227 W228 K234 F235F227-G231 PolarHBondContact O-N 2.58Å; W228-G231 PolarHBondContact O-N 3.28Å; G231-K234 WeakPolarHBondContact O-CB 3.32Å; G231-K234 PolarHBondContact O-N 3.4Å; G231-F235 WeakPolarHBondContact O-CD2 3.27Å; G231-F235 WeakPolarHBondContact O-CE2 3.36Å; G231-F235 PolarHBondContact O-N 3.43Å
232H82.8Confident87.2Confident154 Ų15467.8 Ų67.871%0.71331%0.313SS*.Hα-helixtrans-66.9-46.8-176.1-163.470.8000113.3W228 F230 K234 F235W228-H232 PolarHBondContact O-N 2.95Å; F230-H232 PolarHBondContact O-N 2.86Å; H232-K234 PolarHBondContact O-N 3.24Å; H232-K234 VanDerWaalsContact O-N 3.14Å; H232-F235 PolarHBondContact O-N 3.29Å
233P79.1Confident86.4Confident51 Ų5167.7 Ų67.733%0.33131%0.31SS..Hα-helixtrans-63.5-15.5173-25.236.4000115.3L186 F229 F230L186-P233 HydrophobicContact CD2-CB 4.42Å; F229-P233 WeakPolarHBondContact O-CD 3.41Å; F229-P233 VanDerWaalsContact O-CG 3.25Å; F229-P233 WeakPolarHBondContact O-CG 3.4Å; F230-P233 WeakPolarHBondContact O-CD 3.5Å
234K59.1Low85.4Confident33 Ų3373.3 Ų73.314%0.14334%0.335CS..Hα-helixtrans-82.7-28.2-178.5177.865.9-141.8153.70112.9M63 L187 F230 G231 H232M63-K234 HydrophobicContact CE-CD 4.47Å; M63-K234 HydrophobicContact SD-CD 4.18Å; M63-K234 WeakPolarHBondContact SD-CE 3.32Å; M63-K234 PolarHBondContact SD-NZ 2.8Å; L187-K234 HydrophobicContact CD2-CD 3.79Å; L187-K234 VanDerWaalsContact CD2-NZ 3.33Å; F230-K234 HydrophobicContact CE1-CB 4.42Å; F230-K234 HydrophobicContact CE1-CG 4.31Å; F230-K234 HydrophobicContact CE2-CB 3.98Å; F230-K234 HydrophobicContact CE2-CD 3.94Å; F230-K234 HydrophobicContact CE2-CG 3.98Å; F230-K234 HydrophobicContact CZ-CB 3.94Å; F230-K234 HydrophobicContact CZ-CD 3.9Å; F230-K234 HydrophobicContact CZ-CG 3.62Å; F230-K234 WeakPolarHBondContact O-CB 3.35Å; F230-K234 PolarHBondContact O-N 3.38Å; G231-K234 WeakPolarHBondContact O-CB 3.32Å; G231-K234 PolarHBondContact O-N 3.4Å; H232-K234 PolarHBondContact O-N 3.24Å; H232-K234 VanDerWaalsContact O-N 3.14Å
235F49.3Very low84.2Confident164 Ų16473 Ų7372%0.71933%0.333SS*.  trans-100.50-177-62.7-67.3000113.1I58 W118 G231 H232I58-F235 HydrophobicContact CD1-CE1 3.82Å; I58-F235 HydrophobicContact CD1-CZ 3.89Å; I58-F235 HydrophobicContact CG1-CE1 4.25Å; I58-F235 HydrophobicContact CG2-CE1 4.46Å; W118-F235 AromaticContact CH2-CE2 3.42Å; W118-F235 HydrophobicContact CH2-CE2 3.42Å; W118-F235 VanDerWaalsContact CH2-CE2 3.42Å; W118-F235 AromaticContact CH2-CZ 3.45Å; W118-F235 HydrophobicContact CH2-CZ 3.45Å; W118-F235 VanDerWaalsContact CH2-CZ 3.45Å; W118-F235 HydrophobicContact CZ2-CE2 4.23Å; W118-F235 HydrophobicContact CZ2-CZ 4.21Å; W118-F235 AromaticContact CZ3-CE2 3.99Å; W118-F235 HydrophobicContact CZ3-CE2 3.99Å; W118-F235 AromaticContact CZ3-CZ 3.65Å; W118-F235 HydrophobicContact CZ3-CZ 3.65Å; G231-F235 WeakPolarHBondContact O-CD2 3.27Å; G231-F235 WeakPolarHBondContact O-CE2 3.36Å; G231-F235 PolarHBondContact O-N 3.43Å; H232-F235 PolarHBondContact O-N 3.29Å

Retrieved 235 of 235 residues in 134.3 ms (Link to these results)