A0A3Q0KT97_SCHMA Loading...

O-acyltransferase (Membrane bound) domain containing protein, putative

AlphaFold DB , UniProt , Accession A0A3Q0KT97, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 604 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M39.2Very low57Low232 Ų232101.6 Ų101.6100%1.14352%0.524SS*.  034.70-117.7174.5175.300114
2K40.1Very low57.7Low177 Ų17799.5 Ų99.577%0.7752%0.518SS*.  trans-92.9-9.5176.8-78.8-176.4177.2177.90114T4 N8K2-T4 PolarHBondContact O-N 3.28Å; K2-T4 VanDerWaalsContact O-N 3.13Å; K2-N8 PolarHBondContact O-ND2 2.99Å
3F44.7Very low58.8Low193 Ų19396.2 Ų96.285%0.84650%0.498SS*.THydrogen-bonded Turntrans-71.3-6.2-172.3-94.4-85.1000116.3
4T48.8Very low60.2Low131 Ų13189.4 Ų89.480%0.80446%0.462SS*.THydrogen-bonded Turntrans-100.3-4.9-169.849.80000115.3K2K2-T4 PolarHBondContact O-N 3.28Å; K2-T4 VanDerWaalsContact O-N 3.13Å
5S60.6Low60.9Low54 Ų5484.8 Ų84.838%0.37845%0.446SS..  trans-84.1132.6177.279.50000111.1A7 N8 F9S5-A7 PolarHBondContact O-N 3.42Å; S5-N8 WeakPolarHBondContact O-CB 3.43Å; S5-N8 PolarHBondContact O-N 3.24Å; S5-N8 PolarHBondContact OG-N 3.46Å; S5-F9 PolarHBondContact O-N 3.16Å
6L62.8Low61.7Low46 Ų4680.7 Ų80.724%0.24142%0.424CS..Hα-helixtrans-56.7-23173-174.257.1000112.3F9 N10 V142 K146L6-F9 HydrophobicContact CD1-CB 4.2Å; L6-F9 HydrophobicContact CD1-CD1 4.41Å; L6-F9 PolarHBondContact O-N 3.27Å; L6-N10 PolarHBondContact O-N 3.44Å; L6-V142 HydrophobicContact CD2-CG1 3.68Å; L6-K146 HydrophobicContact CD2-CD 3.77Å; L6-K146 HydrophobicContact CG-CD 4.43Å
7A60.7Low61.8Low66 Ų6681.9 Ų81.955%0.54543%0.431SS..Hα-helixtrans-62.4-40.6171.400000112.4S5 F9 N10 K11S5-A7 PolarHBondContact O-N 3.42Å; A7-F9 VanDerWaalsContact C-N 3.34Å; A7-N10 PolarHBondContact O-N 3.43Å; A7-K11 PolarHBondContact O-N 2.87Å; A7-K11 VanDerWaalsContact O-N 3.09Å
8N63.1Low61.8Low56 Ų5683.1 Ų83.130%0.29944%0.442SS..Hα-helixtrans-69.4-33.6173.7-80.9-27.2000112K2 S5 K11 V12K2-N8 PolarHBondContact O-ND2 2.99Å; S5-N8 WeakPolarHBondContact O-CB 3.43Å; S5-N8 PolarHBondContact O-N 3.24Å; S5-N8 PolarHBondContact OG-N 3.46Å; N8-K11 PolarHBondContact O-N 3.5Å; N8-V12 VanDerWaalsContact O-CB 3.22Å; N8-V12 WeakPolarHBondContact O-CB 3.41Å; N8-V12 VanDerWaalsContact O-CG2 3.3Å; N8-V12 WeakPolarHBondContact O-CG2 3.29Å; N8-V12 PolarHBondContact O-N 3.33Å
9F67.9Low62.3Low28 Ų2881 Ų8112%0.12343%0.431CS..Hα-helixtrans-63-46172.8-173-86.2000111.8S5 L6 A7 K11 F13 M14 L139 C143S5-F9 PolarHBondContact O-N 3.16Å; L6-F9 HydrophobicContact CD1-CB 4.2Å; L6-F9 HydrophobicContact CD1-CD1 4.41Å; L6-F9 PolarHBondContact O-N 3.27Å; A7-F9 VanDerWaalsContact C-N 3.34Å; F9-K11 VanDerWaalsContact C-N 3.33Å; F9-K11 PolarHBondContact O-N 3.49Å; F9-F13 HydrophobicContact CB-CD2 4.43Å; F9-F13 HydrophobicContact CD1-CB 4.27Å; F9-F13 HydrophobicContact CD2-CB 4.04Å; F9-F13 AromaticContact CD2-CD2 3.46Å; F9-F13 HydrophobicContact CD2-CD2 3.46Å; F9-F13 VanDerWaalsContact CD2-CD2 3.46Å; F9-F13 AromaticContact CD2-CE2 3.97Å; F9-F13 HydrophobicContact CD2-CE2 3.97Å; F9-F13 AromaticContact CD2-CG 3.75Å; F9-F13 HydrophobicContact CD2-CG 3.75Å; F9-F13 HydrophobicContact CE1-CB 4.12Å; F9-F13 HydrophobicContact CE2-CB 3.86Å; F9-F13 HydrophobicContact CE2-CD1 4.08Å; F9-F13 AromaticContact CE2-CD2 3.86Å; F9-F13 HydrophobicContact CE2-CD2 3.86Å; F9-F13 HydrophobicContact CE2-CE2 4.41Å; F9-F13 AromaticContact CE2-CG 3.66Å; F9-F13 HydrophobicContact CE2-CG 3.66Å; F9-F13 HydrophobicContact CG-CB 4.26Å; F9-F13 HydrophobicContact CG-CD2 4.03Å; F9-F13 HydrophobicContact CG-CG 4.36Å; F9-F13 HydrophobicContact CZ-CB 3.91Å; F9-F13 HydrophobicContact CZ-CG 4.22Å; F9-F13 WeakPolarHBondContact O-CA 3.26Å; F9-F13 VanDerWaalsContact O-CB 3.28Å; F9-F13 WeakPolarHBondContact O-CB 3.34Å; F9-F13 PolarHBondContact O-N 3.41Å; F9-M14 HydrophobicContact CE1-CG 4.24Å; F9-M14 PolarHBondContact O-N 3.28Å; F9-L139 HydrophobicContact CD2-CD1 4.41Å; F9-L139 HydrophobicContact CE1-CB 3.96Å; F9-L139 HydrophobicContact CE2-CB 4.22Å; F9-L139 HydrophobicContact CE2-CD1 3.73Å; F9-L139 HydrophobicContact CZ-CB 3.65Å; F9-L139 HydrophobicContact CZ-CD1 4Å; F9-L139 HydrophobicContact CZ-CG 4.46Å; F9-C143 WeakPolarHBondContact CD1-SG 3.49Å; F9-C143 VanDerWaalsContact CE1-SG 3.51Å
10N70.3Confident62.5Low23 Ų2379.2 Ų79.212%0.12342%0.423CS..Iπ-helixtrans-57.1-45.5175.8-77.2-13.4000112.5L6 A7 M14 G15 L16 C143L6-N10 PolarHBondContact O-N 3.44Å; A7-N10 PolarHBondContact O-N 3.43Å; N10-M14 CarbonylContact O-C 3.46Å; N10-M14 WeakPolarHBondContact O-CA 3.47Å; N10-M14 WeakPolarHBondContact O-CB 3.44Å; N10-M14 PolarHBondContact O-N 3.3Å; N10-G15 PolarHBondContact O-N 3.39Å; N10-L16 PolarHBondContact O-N 2.95Å; N10-L16 VanDerWaalsContact O-N 3.17Å; N10-C143 VanDerWaalsContact OD1-CB 3.31Å; N10-C143 WeakPolarHBondContact OD1-CB 3.44Å; N10-C143 PolarHBondContact OD1-SG 3.36Å
11K68.7Low63.1Low112 Ų11280.6 Ų80.649%0.48743%0.43SS..Iπ-helixtrans-68.7-54.6-178.9-162.3179.2-179174.30111.9A7 N8 F9 G15 D17 R103A7-K11 PolarHBondContact O-N 2.87Å; A7-K11 VanDerWaalsContact O-N 3.09Å; N8-K11 PolarHBondContact O-N 3.5Å; F9-K11 VanDerWaalsContact C-N 3.33Å; F9-K11 PolarHBondContact O-N 3.49Å; K11-G15 WeakPolarHBondContact O-CA 3.3Å; K11-G15 PolarHBondContact O-N 2.93Å; K11-D17 WeakPolarHBondContact CE-OD1 3.37Å; K11-D17 WeakPolarHBondContact CG-OD1 3.49Å; K11-R103 PolarHBondContact O-NH2 3.14Å
12V65.7Low64.6Low76 Ų7675.4 Ų75.446%0.46140%0.403SS..Iπ-helixtrans-80.6-33.6-1701790000112.9N8 R103N8-V12 VanDerWaalsContact O-CB 3.22Å; N8-V12 WeakPolarHBondContact O-CB 3.41Å; N8-V12 VanDerWaalsContact O-CG2 3.3Å; N8-V12 WeakPolarHBondContact O-CG2 3.29Å; N8-V12 PolarHBondContact O-N 3.33Å; V12-R103 PolarHBondContact O-NE 3.05Å; V12-R103 PolarHBondContact O-NH1 3.49Å; V12-R103 PolarHBondContact O-NH2 3.33Å
13F72.5Confident66.1Low57 Ų5774.6 Ų74.625%0.2541%0.408CS..Iπ-helixtrans-102-49.9-177.1-67-95.4000111.6F9 R103 V104 I107F9-F13 HydrophobicContact CB-CD2 4.43Å; F9-F13 HydrophobicContact CD1-CB 4.27Å; F9-F13 HydrophobicContact CD2-CB 4.04Å; F9-F13 AromaticContact CD2-CD2 3.46Å; F9-F13 HydrophobicContact CD2-CD2 3.46Å; F9-F13 VanDerWaalsContact CD2-CD2 3.46Å; F9-F13 AromaticContact CD2-CE2 3.97Å; F9-F13 HydrophobicContact CD2-CE2 3.97Å; F9-F13 AromaticContact CD2-CG 3.75Å; F9-F13 HydrophobicContact CD2-CG 3.75Å; F9-F13 HydrophobicContact CE1-CB 4.12Å; F9-F13 HydrophobicContact CE2-CB 3.86Å; F9-F13 HydrophobicContact CE2-CD1 4.08Å; F9-F13 AromaticContact CE2-CD2 3.86Å; F9-F13 HydrophobicContact CE2-CD2 3.86Å; F9-F13 HydrophobicContact CE2-CE2 4.41Å; F9-F13 AromaticContact CE2-CG 3.66Å; F9-F13 HydrophobicContact CE2-CG 3.66Å; F9-F13 HydrophobicContact CG-CB 4.26Å; F9-F13 HydrophobicContact CG-CD2 4.03Å; F9-F13 HydrophobicContact CG-CG 4.36Å; F9-F13 HydrophobicContact CZ-CB 3.91Å; F9-F13 HydrophobicContact CZ-CG 4.22Å; F9-F13 WeakPolarHBondContact O-CA 3.26Å; F9-F13 VanDerWaalsContact O-CB 3.28Å; F9-F13 WeakPolarHBondContact O-CB 3.34Å; F9-F13 PolarHBondContact O-N 3.41Å; F13-R103 PolarHBondContact O-NE 3.18Å; F13-R103 PolarHBondContact O-NH2 3.03Å; F13-V104 WeakPolarHBondContact O-CG2 3.18Å; F13-I107 HydrophobicContact CD1-CD1 3.74Å; F13-I107 HydrophobicContact CE1-CD1 3.99Å; F13-I107 HydrophobicContact CE1-CG2 4.46Å
14M77.4Confident67.4Low0 Ų068.1 Ų68.10%040%0.395CS..Iπ-helixtrans-80.5-20.7-179.3-62.9-65.4-69.700113.8F9 N10 L16 Q101 V104 V140 C143 Y147 I156F9-M14 HydrophobicContact CE1-CG 4.24Å; F9-M14 PolarHBondContact O-N 3.28Å; N10-M14 CarbonylContact O-C 3.46Å; N10-M14 WeakPolarHBondContact O-CA 3.47Å; N10-M14 WeakPolarHBondContact O-CB 3.44Å; N10-M14 PolarHBondContact O-N 3.3Å; M14-L16 VanDerWaalsContact C-N 3.32Å; M14-L16 HydrophobicContact CB-CD1 3.92Å; M14-L16 HydrophobicContact CB-CG 3.94Å; M14-Q101 WeakPolarHBondContact O-CG 3.45Å; M14-V104 HydrophobicContact SD-CG2 3.85Å; M14-V140 HydrophobicContact CE-CG1 4.19Å; M14-V140 HydrophobicContact SD-CG1 4.31Å; M14-V140 HydrophobicContact SD-CG2 4.28Å; M14-C143 HydrophobicContact CG-CB 4.15Å; M14-Y147 HydrophobicContact CE-CE1 4.03Å; M14-Y147 WeakPolarHBondContact CE-OH 3.46Å; M14-I156 HydrophobicContact CE-CG2 3.82Å; M14-I156 HydrophobicContact SD-CG2 4.4Å
15G71.6Confident68.2Low21 Ų2168.5 Ų68.522%0.21639%0.387CS..  trans7824.6176.300000112.7N10 K11 D17N10-G15 PolarHBondContact O-N 3.39Å; K11-G15 WeakPolarHBondContact O-CA 3.3Å; K11-G15 PolarHBondContact O-N 2.93Å; G15-D17 PolarHBondContact O-N 3.17Å
16L73Confident68.7Low19 Ų1967.6 Ų67.610%0.09938%0.381CS..  trans-98.977.4-178.5-59.4177.1000107.8N10 M14 F31 Y147N10-L16 PolarHBondContact O-N 2.95Å; N10-L16 VanDerWaalsContact O-N 3.17Å; M14-L16 VanDerWaalsContact C-N 3.32Å; M14-L16 HydrophobicContact CB-CD1 3.92Å; M14-L16 HydrophobicContact CB-CG 3.94Å; L16-F31 HydrophobicContact CD2-CB 3.91Å; L16-Y147 HydrophobicContact CD1-CD1 3.39Å; L16-Y147 HydrophobicContact CD1-CD2 4.37Å; L16-Y147 HydrophobicContact CD1-CE1 3.53Å; L16-Y147 HydrophobicContact CD1-CG 3.87Å
17D63.2Low69.4Low102 Ų10268.5 Ų68.555%0.54539%0.385SS..SBendtrans-72.2-34.7-177.8-69.4-48.5000112.7K11 G15K11-D17 WeakPolarHBondContact CE-OD1 3.37Å; K11-D17 WeakPolarHBondContact CG-OD1 3.49Å; G15-D17 PolarHBondContact O-N 3.17Å
18V62.8Low69.9Low103 Ų10372.5 Ų72.562%0.62439%0.386SS*.  trans-147.7112.4179.4-175.30000108.3K33V18-K33 PolarHBondContact O-NZ 2.75Å
19L70.8Confident70.5Confident43 Ų4370.6 Ų70.623%0.22538%0.38CS..  trans-82.8128.4167.6-69.5165.1000107.6L21 P26 F31 Y147L19-L21 PolarHBondContact O-N 3.36Å; L19-P26 HydrophobicContact CD1-CG 4.4Å; L19-F31 HydrophobicContact CD2-CB 3.6Å; L19-Y147 VanDerWaalsContact CD1-CB 3.44Å
20P66.8Low70.8Confident44 Ų4470.4 Ų70.429%0.28639%0.385SS..  trans-63.5130.917129.7-33.6000108P26 I27 G30P20-P26 WeakPolarHBondContact O-CA 3.46Å; P20-I27 HydrophobicContact CB-CD1 3.85Å; P20-I27 HydrophobicContact CB-CG1 4.22Å; P20-I27 HydrophobicContact CG-CB 4.18Å; P20-I27 HydrophobicContact CG-CD1 4.38Å; P20-I27 HydrophobicContact CG-CG1 4.44Å; P20-I27 PolarHBondContact O-N 3.09Å; P20-G30 VanDerWaalsContact CD-O 3.3Å; P20-G30 WeakPolarHBondContact CD-O 3.34Å; P20-G30 WeakPolarHBondContact CG-O 3.5Å
21L73.7Confident71.3Confident109 Ų10969.5 Ų69.557%0.57138%0.38SS*.EExtended strand (participates in β ladder)trans-109.7135179.9-62.4174.6000109L19 Q25 P26L19-L21 PolarHBondContact O-N 3.36Å; L21-Q25 CarbonylContact C-O 3.45Å; L21-Q25 VanDerWaalsContact CA-O 3.25Å; L21-Q25 WeakPolarHBondContact CA-O 3.21Å; L21-P26 HydrophobicContact CD2-CB 4.47Å; L21-P26 HydrophobicContact CD2-CG 4.09Å
22E70.5Confident72Confident123 Ų12365.6 Ų65.658%0.57536%0.363SS*.EExtended strand (participates in β ladder)trans-120.1122.3167.5-177.5173.9-163.300107.2G24 Q25 I27E22-G24 PolarHBondContact O-N 3.08Å; E22-G24 VanDerWaalsContact O-N 3.17Å; E22-Q25 PolarHBondContact N-O 3.49Å; E22-Q25 PolarHBondContact O-N 2.85Å; E22-Q25 VanDerWaalsContact O-O 3.12Å; E22-I27 HydrophobicContact CB-CD1 4.03Å; E22-I27 HydrophobicContact CB-CG1 3.61Å
23N72.3Confident72.6Confident161 Ų16168.4 Ų68.486%0.86137%0.368SS*.THydrogen-bonded Turntrans52.935.2-174.6-58-29.9000114.3Q25N23-Q25 PolarHBondContact O-N 3.04Å
24G71.7Confident73.3Confident56 Ų5666.2 Ų66.258%0.57736%0.36SS*.THydrogen-bonded Turntrans77.90.2-179.600000115E22E22-G24 PolarHBondContact O-N 3.08Å; E22-G24 VanDerWaalsContact O-N 3.17Å
25Q67Low74Confident139 Ų13967.1 Ų67.165%0.6537%0.367SS*.EExtended strand (participates in β ladder)trans-106.8144.1174.5-65.3-62.2-37.200110.6L21 E22 N23 I27L21-Q25 CarbonylContact C-O 3.45Å; L21-Q25 VanDerWaalsContact CA-O 3.25Å; L21-Q25 WeakPolarHBondContact CA-O 3.21Å; E22-Q25 PolarHBondContact N-O 3.49Å; E22-Q25 PolarHBondContact O-N 2.85Å; E22-Q25 VanDerWaalsContact O-O 3.12Å; N23-Q25 PolarHBondContact O-N 3.04Å; Q25-I27 PolarHBondContact O-N 3.06Å
26P71.1Confident75Confident36 Ų3670.3 Ų70.323%0.23438%0.376CS..EExtended strand (participates in β ladder)trans-54.7131172.4-24.333.8000112L19 P20 L21 R28 Y147L19-P26 HydrophobicContact CD1-CG 4.4Å; P20-P26 WeakPolarHBondContact O-CA 3.46Å; L21-P26 HydrophobicContact CD2-CB 4.47Å; L21-P26 HydrophobicContact CD2-CG 4.09Å; P26-R28 PolarHBondContact O-N 3.03Å; P26-Y147 VanDerWaalsContact CB-O 3.3Å; P26-Y147 WeakPolarHBondContact CB-O 3.48Å
27I76.2Confident76Confident65 Ų6575.2 Ų75.233%0.33340%0.401SS..PPolyproline II helixtrans-65.2127.8173.2-58.1-177.7000108.3P20 E22 Q25 G29 G30P20-I27 HydrophobicContact CB-CD1 3.85Å; P20-I27 HydrophobicContact CB-CG1 4.22Å; P20-I27 HydrophobicContact CG-CB 4.18Å; P20-I27 HydrophobicContact CG-CD1 4.38Å; P20-I27 HydrophobicContact CG-CG1 4.44Å; P20-I27 PolarHBondContact O-N 3.09Å; E22-I27 HydrophobicContact CB-CD1 4.03Å; E22-I27 HydrophobicContact CB-CG1 3.61Å; Q25-I27 PolarHBondContact O-N 3.06Å; I27-G29 PolarHBondContact O-N 3.35Å; I27-G30 PolarHBondContact O-N 3.49Å
28R71.9Confident77.5Confident150 Ų15073.2 Ų73.257%0.56639%0.388SS*.THydrogen-bonded Turntrans-55.4123.9179.2-160.1-179.7-160.8-176.11.6110.2P26 G30 D148 G150P26-R28 PolarHBondContact O-N 3.03Å; R28-G30 PolarHBondContact O-N 3.4Å; R28-D148 WeakPolarHBondContact CG-OD1 3.32Å; R28-G150 PolarHBondContact NH2-O 3.42Å
29G75Confident79Confident16 Ų1671.1 Ų71.117%0.16537%0.372CS..THydrogen-bonded Turntrans70.8-3.7-175.800000116.2I27 F31 Y32 T153I27-G29 PolarHBondContact O-N 3.35Å; G29-F31 PolarHBondContact O-N 3.02Å; G29-Y32 WeakPolarHBondContact O-CB 3.39Å; G29-Y32 PolarHBondContact O-N 3.01Å; G29-T153 VanDerWaalsContact CA-OG1 3.23Å; G29-T153 WeakPolarHBondContact CA-OG1 3.3Å
30G74.9Confident80.1Confident23 Ų2373.6 Ų73.624%0.23739%0.391CS..THydrogen-bonded Turntrans-65.8-10.3-179.900000114.6P20 I27 R28 Y32P20-G30 VanDerWaalsContact CD-O 3.3Å; P20-G30 WeakPolarHBondContact CD-O 3.34Å; P20-G30 WeakPolarHBondContact CG-O 3.5Å; I27-G30 PolarHBondContact O-N 3.49Å; R28-G30 PolarHBondContact O-N 3.4Å; G30-Y32 VanDerWaalsContact C-N 3.33Å
31F80.2Confident81.4Confident5 Ų574.6 Ų74.62%0.02239%0.394CS..THydrogen-bonded Turntrans-76.1-18.8171.472.8-92.9000113.2L16 L19 G29 K33 Y147 D148 T153 D155L16-F31 HydrophobicContact CD2-CB 3.91Å; L19-F31 HydrophobicContact CD2-CB 3.6Å; G29-F31 PolarHBondContact O-N 3.02Å; F31-K33 PolarHBondContact O-N 3.34Å; F31-Y147 HydrophobicContact CB-CD2 4.22Å; F31-Y147 AromaticContact CD1-CD2 3.7Å; F31-Y147 HydrophobicContact CD1-CD2 3.7Å; F31-Y147 AromaticContact CD1-CE2 3.84Å; F31-Y147 HydrophobicContact CD1-CE2 3.84Å; F31-Y147 HydrophobicContact CD2-CD2 4.4Å; F31-Y147 AromaticContact CD2-CE2 3.98Å; F31-Y147 HydrophobicContact CD2-CE2 3.98Å; F31-Y147 HydrophobicContact CE1-CD2 4.15Å; F31-Y147 AromaticContact CE1-CE2 3.91Å; F31-Y147 HydrophobicContact CE1-CE2 3.91Å; F31-Y147 HydrophobicContact CE2-CE2 4.06Å; F31-Y147 AromaticContact CG-CD2 3.85Å; F31-Y147 HydrophobicContact CG-CD2 3.85Å; F31-Y147 AromaticContact CG-CE2 3.87Å; F31-Y147 HydrophobicContact CG-CE2 3.87Å; F31-Y147 HydrophobicContact CZ-CE2 4.02Å; F31-D148 HydrophobicContact CD1-CB 4.08Å; F31-D148 HydrophobicContact CE1-CB 3.73Å; F31-D148 WeakPolarHBondContact CE1-OD2 3.41Å; F31-T153 HydrophobicContact CE1-CG2 3.88Å; F31-T153 HydrophobicContact CE2-CG2 4.31Å; F31-T153 HydrophobicContact CZ-CG2 3.54Å; F31-D155 HydrophobicContact CE2-CB 3.68Å; F31-D155 HydrophobicContact CZ-CB 3.94Å
32Y82.7Confident82.4Confident30 Ų3069.9 Ų69.912%0.11837%0.37CS..  trans-77.492.9-174.4-173.3-93.9000111G29 G30 L49 D50 N53 C97 T153G29-Y32 WeakPolarHBondContact O-CB 3.39Å; G29-Y32 PolarHBondContact O-N 3.01Å; G30-Y32 VanDerWaalsContact C-N 3.33Å; Y32-L49 HydrophobicContact CE1-CD2 4.35Å; Y32-L49 HydrophobicContact CE1-CG 4.29Å; Y32-D50 HydrophobicContact CD1-CB 4.02Å; Y32-D50 HydrophobicContact CD2-CB 3.8Å; Y32-D50 HydrophobicContact CE1-CB 3.77Å; Y32-D50 HydrophobicContact CE2-CB 3.55Å; Y32-D50 HydrophobicContact CG-CB 4.03Å; Y32-D50 WeakPolarHBondContact OH-CA 3.31Å; Y32-N53 WeakPolarHBondContact OH-CB 3.41Å; Y32-N53 PolarHBondContact OH-ND2 3.46Å; Y32-C97 WeakPolarHBondContact CE2-O 3.4Å; Y32-C97 VanDerWaalsContact CZ-O 3.32Å; Y32-C97 PolarHBondContact OH-O 3.43Å; Y32-T153 HydrophobicContact CD2-CG2 4.47Å; Y32-T153 HydrophobicContact CG-CG2 4.45Å
33K80Confident83.5Confident134 Ų13471.8 Ų71.858%0.58338%0.377SS*.  trans-106.727.5-177.8-61.7-176.5-175.2178.10113.4V18 F31V18-K33 PolarHBondContact O-NZ 2.75Å; F31-K33 PolarHBondContact O-N 3.34Å
34S86.5Confident84.5Confident11 Ų1172.5 Ų72.58%0.07737%0.372CS..SBendtrans-76.5-159.4-178.9-154.60000112.1Q36 S95 F96 C97 F98 G99S34-Q36 WeakPolarHBondContact O-CG 3.28Å; S34-Q36 PolarHBondContact O-N 3.47Å; S34-Q36 PolarHBondContact O-NE2 2.86Å; S34-S95 PolarHBondContact OG-O 3.06Å; S34-F96 VanDerWaalsContact OG-C 3.28Å; S34-F96 PolarHBondContact OG-O 3.27Å; S34-C97 WeakPolarHBondContact CB-O 3.39Å; S34-C97 PolarHBondContact OG-O 2.92Å; S34-C97 VanDerWaalsContact OG-O 3.12Å; S34-F98 PolarHBondContact OG-N 3.32Å; S34-F98 VanDerWaalsContact OG-N 3.15Å; S34-G99 PolarHBondContact OG-N 2.89Å
35S91.8Very high85.5Confident20 Ų2072.8 Ų72.814%0.1436%0.359CS..  trans-49.7124177.9-179.70000112.6I37 N53 F96S35-I37 WeakPolarHBondContact OG-CG1 3.44Å; S35-N53 PolarHBondContact O-ND2 2.74Å; S35-F96 VanDerWaalsContact CB-CE2 3.46Å; S35-F96 VanDerWaalsContact CB-O 3.31Å; S35-F96 WeakPolarHBondContact CB-O 3.15Å; S35-F96 PolarHBondContact N-O 2.83Å; S35-F96 WeakPolarHBondContact OG-CE2 3.2Å
36Q93Very high86.7Confident87 Ų8773.3 Ų73.341%0.40737%0.366SS..  trans-98.23.6179.5-58.5-57.8-50.900112.6S34 F38 I39 L49S34-Q36 WeakPolarHBondContact O-CG 3.28Å; S34-Q36 PolarHBondContact O-N 3.47Å; S34-Q36 PolarHBondContact O-NE2 2.86Å; Q36-F38 PolarHBondContact O-N 2.89Å; Q36-I39 HydrophobicContact CB-CD1 3.78Å; Q36-I39 HydrophobicContact CB-CG1 4.32Å; Q36-I39 HydrophobicContact CG-CD1 4.41Å; Q36-I39 VanDerWaalsContact O-CG1 3.3Å; Q36-I39 WeakPolarHBondContact O-CG1 3.28Å; Q36-I39 PolarHBondContact O-N 3.06Å; Q36-L49 VanDerWaalsContact OE1-CD2 3.29Å
37I94Very high87.6Confident123 Ų12372.6 Ų72.663%0.63136%0.361SS*.THydrogen-bonded Turntrans-56.6-38.2-173.3-64.8172.4000111.8S35S35-I37 WeakPolarHBondContact OG-CG1 3.44Å
38F94.6Very high88.2Confident60 Ų6072.7 Ų72.726%0.26337%0.366SS..THydrogen-bonded Turntrans-97.918.5-174.2-64.3-75.8000114.6Q36 P40 L41 A42 L49 I52 V56 F96Q36-F38 PolarHBondContact O-N 2.89Å; F38-P40 VanDerWaalsContact C-CD 3.45Å; F38-P40 VanDerWaalsContact C-N 3.33Å; F38-L41 HydrophobicContact CB-CB 4.45Å; F38-L41 HydrophobicContact CD1-CD2 4.14Å; F38-L41 PolarHBondContact O-N 3.02Å; F38-A42 WeakPolarHBondContact O-CB 3.14Å; F38-A42 PolarHBondContact O-N 2.72Å; F38-L49 HydrophobicContact CB-CD1 4.18Å; F38-I52 HydrophobicContact CB-CG2 3.78Å; F38-I52 HydrophobicContact CG-CG2 4.38Å; F38-V56 HydrophobicContact CD1-CG2 4.46Å; F38-V56 HydrophobicContact CD2-CG1 4.45Å; F38-V56 HydrophobicContact CD2-CG2 4.28Å; F38-V56 HydrophobicContact CE1-CG2 4.36Å; F38-V56 HydrophobicContact CE2-CB 4.36Å; F38-V56 HydrophobicContact CE2-CG1 3.7Å; F38-V56 HydrophobicContact CE2-CG2 4.19Å; F38-V56 HydrophobicContact CG-CG2 4.42Å; F38-V56 HydrophobicContact CZ-CG1 3.84Å; F38-V56 HydrophobicContact CZ-CG2 4.23Å; F38-F96 HydrophobicContact CD2-CE2 4.32Å; F38-F96 AromaticContact CD2-CZ 3.76Å; F38-F96 HydrophobicContact CD2-CZ 3.76Å; F38-F96 HydrophobicContact CE2-CE2 4.01Å; F38-F96 AromaticContact CE2-CZ 3.63Å; F38-F96 HydrophobicContact CE2-CZ 3.63Å
39I93.5Very high89.3Confident59 Ų5966.8 Ų66.830%0.30335%0.346SS..Hα-helixtrans-51.1-46.3171.7-72.1169.2000112.2Q36 L41 A42 K43 L49Q36-I39 HydrophobicContact CB-CD1 3.78Å; Q36-I39 HydrophobicContact CB-CG1 4.32Å; Q36-I39 HydrophobicContact CG-CD1 4.41Å; Q36-I39 VanDerWaalsContact O-CG1 3.3Å; Q36-I39 WeakPolarHBondContact O-CG1 3.28Å; Q36-I39 PolarHBondContact O-N 3.06Å; I39-L41 VanDerWaalsContact C-N 3.29Å; I39-L41 PolarHBondContact O-N 3.04Å; I39-A42 PolarHBondContact O-N 3.37Å; I39-K43 HydrophobicContact CG2-CD 4.01Å; I39-K43 HydrophobicContact CG2-CG 4.31Å; I39-K43 WeakPolarHBondContact O-CG 3.45Å; I39-K43 PolarHBondContact O-N 3.43Å; I39-L49 HydrophobicContact CG1-CD1 4.3Å; I39-L49 HydrophobicContact CG1-CD2 3.88Å
40P95.1Very high90.1Very high95 Ų9566.5 Ų66.562%0.61734%0.34SS*.Hα-helixtrans-59.9-40.7-179.1-24.835.5000112.4F38 F44F38-P40 VanDerWaalsContact C-CD 3.45Å; F38-P40 VanDerWaalsContact C-N 3.33Å; P40-F44 WeakPolarHBondContact O-CB 3.49Å; P40-F44 PolarHBondContact O-N 3.39Å
41L94.4Very high90.9Very high65 Ų6568.8 Ų68.834%0.3435%0.345SS..Hα-helixtrans-68.7-42.8178.1-177.861.7000111.8F38 I39 K43 F44 M45 I52F38-L41 HydrophobicContact CB-CB 4.45Å; F38-L41 HydrophobicContact CD1-CD2 4.14Å; F38-L41 PolarHBondContact O-N 3.02Å; I39-L41 VanDerWaalsContact C-N 3.29Å; I39-L41 PolarHBondContact O-N 3.04Å; L41-K43 PolarHBondContact O-N 3.49Å; L41-F44 HydrophobicContact CD1-CD1 4.48Å; L41-F44 PolarHBondContact O-N 3.3Å; L41-M45 HydrophobicContact CD1-CG 4.01Å; L41-M45 HydrophobicContact CD1-SD 3.86Å; L41-M45 HydrophobicContact CG-CG 4.48Å; L41-M45 HydrophobicContact CG-SD 4.11Å; L41-M45 WeakPolarHBondContact O-CB 3.43Å; L41-M45 WeakPolarHBondContact O-CG 3.36Å; L41-M45 PolarHBondContact O-N 3.35Å; L41-I52 HydrophobicContact CD2-CG2 3.94Å; L41-I52 HydrophobicContact CG-CG2 4.32Å
42A93.4Very high91.6Very high9 Ų969 Ų697%0.07435%0.346CS..Hα-helixtrans-59.4-44.6176.400000112.1F38 I39 N46 V47 L49 I52F38-A42 WeakPolarHBondContact O-CB 3.14Å; F38-A42 PolarHBondContact O-N 2.72Å; I39-A42 PolarHBondContact O-N 3.37Å; A42-N46 PolarHBondContact O-N 3.09Å; A42-V47 WeakPolarHBondContact CA-O 3.35Å; A42-V47 WeakPolarHBondContact CB-O 3.48Å; A42-V47 PolarHBondContact O-N 3.26Å; A42-V47 VanDerWaalsContact O-N 3.1Å; A42-L49 HydrophobicContact CB-CB 4.2Å; A42-L49 HydrophobicContact CB-CD1 4.18Å; A42-I52 HydrophobicContact CB-CG1 3.97Å
43K93.9Very high92.2Very high164 Ų16467.6 Ų67.671%0.71334%0.341SS*.Hα-helixtrans-64-44.7174.5-72-178.3177.4-177.50112I39 L41 M45 N46I39-K43 HydrophobicContact CG2-CD 4.01Å; I39-K43 HydrophobicContact CG2-CG 4.31Å; I39-K43 WeakPolarHBondContact O-CG 3.45Å; I39-K43 PolarHBondContact O-N 3.43Å; L41-K43 PolarHBondContact O-N 3.49Å; K43-M45 PolarHBondContact O-N 3.39Å; K43-N46 PolarHBondContact O-N 2.99Å
44F94.4Very high92.8Very high176 Ų17661.9 Ų61.977%0.77232%0.316SS*.Hα-helixtrans-61.3-43.5178.8174.5-102.3000112.5P40 L41 N46P40-F44 WeakPolarHBondContact O-CB 3.49Å; P40-F44 PolarHBondContact O-N 3.39Å; L41-F44 HydrophobicContact CD1-CD1 4.48Å; L41-F44 PolarHBondContact O-N 3.3Å; F44-N46 VanDerWaalsContact C-N 3.31Å
45M92.1Very high93.2Very high62 Ų6263.8 Ų63.831%0.30533%0.327SS..Hα-helixtrans-81.2-10.7-179.5-65.9-172.367.200113.8L41 K43 V47 I52L41-M45 HydrophobicContact CD1-CG 4.01Å; L41-M45 HydrophobicContact CD1-SD 3.86Å; L41-M45 HydrophobicContact CG-CG 4.48Å; L41-M45 HydrophobicContact CG-SD 4.11Å; L41-M45 WeakPolarHBondContact O-CB 3.43Å; L41-M45 WeakPolarHBondContact O-CG 3.36Å; L41-M45 PolarHBondContact O-N 3.35Å; K43-M45 PolarHBondContact O-N 3.39Å; M45-V47 VanDerWaalsContact C-N 3.26Å; M45-V47 HydrophobicContact CB-CB 4.31Å; M45-V47 HydrophobicContact CB-CG2 4.08Å; M45-V47 PolarHBondContact O-N 3.15Å; M45-I52 HydrophobicContact SD-CD1 3.86Å
46N91.5Very high93.3Very high149 Ų14964 Ų6480%0.79733%0.328SS*.THydrogen-bonded Turntrans54.142-169.1-164.434.8000112.8A42 K43 F44A42-N46 PolarHBondContact O-N 3.09Å; K43-N46 PolarHBondContact O-N 2.99Å; F44-N46 VanDerWaalsContact C-N 3.31Å
47V89.6Confident93.4Very high21 Ų2159.9 Ų59.913%0.12731%0.308CS..  trans-122.4139.3180173.70000108.8A42 M45 Q51 I52 A342A42-V47 WeakPolarHBondContact CA-O 3.35Å; A42-V47 WeakPolarHBondContact CB-O 3.48Å; A42-V47 PolarHBondContact O-N 3.26Å; A42-V47 VanDerWaalsContact O-N 3.1Å; M45-V47 VanDerWaalsContact C-N 3.26Å; M45-V47 HydrophobicContact CB-CB 4.31Å; M45-V47 HydrophobicContact CB-CG2 4.08Å; M45-V47 PolarHBondContact O-N 3.15Å; V47-Q51 HydrophobicContact CG1-CB 3.91Å; V47-I52 HydrophobicContact CB-CD1 3.95Å; V47-I52 HydrophobicContact CB-CG1 4.26Å; V47-I52 HydrophobicContact CG1-CD1 3.84Å; V47-I52 HydrophobicContact CG1-CG1 4.08Å; V47-A342 HydrophobicContact CG2-CB 4.41Å
48P90.8Very high93.5Very high67 Ų6754.1 Ų54.144%0.43528%0.279SS..  trans-54139.9177.8-28.637000113.7D50 Q51 I52P48-D50 VanDerWaalsContact C-N 3.27Å; P48-D50 WeakPolarHBondContact CB-OD1 3.5Å; P48-D50 PolarHBondContact O-N 3.42Å; P48-Q51 HydrophobicContact CB-CG 4.29Å; P48-Q51 WeakPolarHBondContact O-CB 3.19Å; P48-Q51 PolarHBondContact O-N 2.84Å; P48-Q51 VanDerWaalsContact O-N 3.08Å; P48-I52 PolarHBondContact O-N 3.29Å; P48-I52 VanDerWaalsContact O-N 3.14Å
49L93.1Very high93.5Very high26 Ų2655.4 Ų55.414%0.13629%0.291CS..Hα-helixtrans-58.3-37.7-175.4175.965.4000112.9Y32 Q36 F38 I39 A42 Q51 I52 N53Y32-L49 HydrophobicContact CE1-CD2 4.35Å; Y32-L49 HydrophobicContact CE1-CG 4.29Å; Q36-L49 VanDerWaalsContact OE1-CD2 3.29Å; F38-L49 HydrophobicContact CB-CD1 4.18Å; I39-L49 HydrophobicContact CG1-CD1 4.3Å; I39-L49 HydrophobicContact CG1-CD2 3.88Å; A42-L49 HydrophobicContact CB-CB 4.2Å; A42-L49 HydrophobicContact CB-CD1 4.18Å; L49-Q51 VanDerWaalsContact C-N 3.3Å; L49-Q51 PolarHBondContact O-N 3.13Å; L49-I52 PolarHBondContact O-N 3.15Å; L49-N53 WeakPolarHBondContact O-CB 3.42Å; L49-N53 PolarHBondContact O-N 3.23Å
50D92Very high93.6Very high10 Ų1056.2 Ų56.25%0.05330%0.296CS..Hα-helixtrans-61.1-38.9177.860.3-56.4000112.3Y32 P48 Y54 T153 L154Y32-D50 HydrophobicContact CD1-CB 4.02Å; Y32-D50 HydrophobicContact CD2-CB 3.8Å; Y32-D50 HydrophobicContact CE1-CB 3.77Å; Y32-D50 HydrophobicContact CE2-CB 3.55Å; Y32-D50 HydrophobicContact CG-CB 4.03Å; Y32-D50 WeakPolarHBondContact OH-CA 3.31Å; P48-D50 VanDerWaalsContact C-N 3.27Å; P48-D50 WeakPolarHBondContact CB-OD1 3.5Å; P48-D50 PolarHBondContact O-N 3.42Å; D50-Y54 WeakPolarHBondContact O-CB 3.35Å; D50-Y54 PolarHBondContact O-N 3.09Å; D50-T153 HydrophobicContact CB-CG2 4.32Å; D50-L154 HydrophobicContact CB-CB 4.2Å; D50-L154 VanDerWaalsContact OD2-CD1 3.27Å; D50-L154 WeakPolarHBondContact OD2-CD1 3.4Å; D50-L154 PolarHBondContact OD2-N 3.33Å
51Q92.4Very high93.6Very high72 Ų7251.8 Ų51.834%0.33627%0.267SS..Hα-helixtrans-70.4-42.1175.3-61.6178.320.900111.2V47 P48 L49 Y54 V55 L154V47-Q51 HydrophobicContact CG1-CB 3.91Å; P48-Q51 HydrophobicContact CB-CG 4.29Å; P48-Q51 WeakPolarHBondContact O-CB 3.19Å; P48-Q51 PolarHBondContact O-N 2.84Å; P48-Q51 VanDerWaalsContact O-N 3.08Å; L49-Q51 VanDerWaalsContact C-N 3.3Å; L49-Q51 PolarHBondContact O-N 3.13Å; Q51-Y54 WeakPolarHBondContact O-CB 3.28Å; Q51-Y54 PolarHBondContact O-N 3.03Å; Q51-V55 VanDerWaalsContact O-CG2 3.23Å; Q51-V55 WeakPolarHBondContact O-CG2 3.48Å; Q51-V55 PolarHBondContact O-N 2.92Å; Q51-L154 HydrophobicContact CG-CD1 3.74Å
52I94.1Very high93.6Very high9 Ų950.8 Ų50.85%0.04626%0.261CS..Hα-helixtrans-60-47.4174.9-64.4-59.3000111F38 L41 A42 M45 V47 P48 L49 Y54 V55 V56F38-I52 HydrophobicContact CB-CG2 3.78Å; F38-I52 HydrophobicContact CG-CG2 4.38Å; L41-I52 HydrophobicContact CD2-CG2 3.94Å; L41-I52 HydrophobicContact CG-CG2 4.32Å; A42-I52 HydrophobicContact CB-CG1 3.97Å; M45-I52 HydrophobicContact SD-CD1 3.86Å; V47-I52 HydrophobicContact CB-CD1 3.95Å; V47-I52 HydrophobicContact CB-CG1 4.26Å; V47-I52 HydrophobicContact CG1-CD1 3.84Å; V47-I52 HydrophobicContact CG1-CG1 4.08Å; P48-I52 PolarHBondContact O-N 3.29Å; P48-I52 VanDerWaalsContact O-N 3.14Å; L49-I52 PolarHBondContact O-N 3.15Å; I52-Y54 VanDerWaalsContact C-N 3.27Å; I52-Y54 PolarHBondContact O-N 3.29Å; I52-V55 PolarHBondContact O-N 3.34Å; I52-V56 HydrophobicContact CG2-CG2 4.26Å; I52-V56 WeakPolarHBondContact O-CG2 3.37Å; I52-V56 PolarHBondContact O-N 3.5Å
53N95.1Very high93.7Very high0 Ų052.5 Ų52.50%028%0.28CS..Hα-helixtrans-60-39.3176.8-75.3-1.7000111.7Y32 S35 L49 S57 F96Y32-N53 WeakPolarHBondContact OH-CB 3.41Å; Y32-N53 PolarHBondContact OH-ND2 3.46Å; S35-N53 PolarHBondContact O-ND2 2.74Å; L49-N53 WeakPolarHBondContact O-CB 3.42Å; L49-N53 PolarHBondContact O-N 3.23Å; N53-S57 VanDerWaalsContact O-CB 3.32Å; N53-S57 WeakPolarHBondContact O-CB 3.35Å; N53-S57 PolarHBondContact O-N 2.98Å; N53-S57 PolarHBondContact O-OG 3.08Å; N53-F96 HydrophobicContact CB-CD1 4.47Å; N53-F96 HydrophobicContact CB-CE1 3.7Å; N53-F96 HydrophobicContact CB-CZ 4.27Å
54Y93.6Very high93.9Very high14 Ų1446.2 Ų46.26%0.05525%0.254CS..Hα-helixtrans-62.6-45.4174.6175.1-104000112.3D50 Q51 I52 S57 G58 L154 F297 V298 F383 A384 L387D50-Y54 WeakPolarHBondContact O-CB 3.35Å; D50-Y54 PolarHBondContact O-N 3.09Å; Q51-Y54 WeakPolarHBondContact O-CB 3.28Å; Q51-Y54 PolarHBondContact O-N 3.03Å; I52-Y54 VanDerWaalsContact C-N 3.27Å; I52-Y54 PolarHBondContact O-N 3.29Å; Y54-S57 PolarHBondContact O-N 3.46Å; Y54-G58 PolarHBondContact O-N 3.14Å; Y54-L154 HydrophobicContact CD2-CD2 3.89Å; Y54-L154 HydrophobicContact CG-CD2 3.84Å; Y54-F297 HydrophobicContact CD2-CB 4.09Å; Y54-F297 HydrophobicContact CD2-CD2 4.05Å; Y54-F297 AromaticContact CD2-CG 3.99Å; Y54-F297 HydrophobicContact CD2-CG 3.99Å; Y54-F297 HydrophobicContact CE2-CB 3.55Å; Y54-F297 AromaticContact CE2-CD2 3.87Å; Y54-F297 HydrophobicContact CE2-CD2 3.87Å; Y54-F297 AromaticContact CE2-CG 3.84Å; Y54-F297 HydrophobicContact CE2-CG 3.84Å; Y54-V298 HydrophobicContact CE2-CG2 4.29Å; Y54-V298 WeakPolarHBondContact OH-CG2 3.41Å; Y54-F383 HydrophobicContact CD1-CE1 4.25Å; Y54-F383 HydrophobicContact CE1-CE1 4.1Å; Y54-A384 HydrophobicContact CE1-CB 4.44Å; Y54-A384 PolarHBondContact OH-O 3.36Å; Y54-L387 HydrophobicContact CD1-CD2 4.25Å; Y54-L387 HydrophobicContact CE1-CD2 3.72Å
55V94.3Very high93.9Very high52 Ų5237.9 Ų37.932%0.31522%0.217SC..Hα-helixtrans-62.6-48.5176.5-1790000111.2Q51 I52 S57 G58 V59 F383Q51-V55 VanDerWaalsContact O-CG2 3.23Å; Q51-V55 WeakPolarHBondContact O-CG2 3.48Å; Q51-V55 PolarHBondContact O-N 2.92Å; I52-V55 PolarHBondContact O-N 3.34Å; V55-S57 VanDerWaalsContact C-N 3.28Å; V55-S57 PolarHBondContact O-N 3.35Å; V55-G58 WeakPolarHBondContact O-CA 3.36Å; V55-G58 PolarHBondContact O-N 3.48Å; V55-V59 PolarHBondContact O-N 3.23Å; V55-F383 HydrophobicContact CG2-CE1 3.89Å; V55-F383 HydrophobicContact CG2-CZ 3.55Å
56V95.1Very high94Very high25 Ų2537.1 Ų37.115%0.15221%0.213CC..Hα-helixtrans-57.9-43.8178.21700000110.6F38 I52 G58 V59 I60 F96F38-V56 HydrophobicContact CD1-CG2 4.46Å; F38-V56 HydrophobicContact CD2-CG1 4.45Å; F38-V56 HydrophobicContact CD2-CG2 4.28Å; F38-V56 HydrophobicContact CE1-CG2 4.36Å; F38-V56 HydrophobicContact CE2-CB 4.36Å; F38-V56 HydrophobicContact CE2-CG1 3.7Å; F38-V56 HydrophobicContact CE2-CG2 4.19Å; F38-V56 HydrophobicContact CG-CG2 4.42Å; F38-V56 HydrophobicContact CZ-CG1 3.84Å; F38-V56 HydrophobicContact CZ-CG2 4.23Å; I52-V56 HydrophobicContact CG2-CG2 4.26Å; I52-V56 WeakPolarHBondContact O-CG2 3.37Å; I52-V56 PolarHBondContact O-N 3.5Å; V56-G58 VanDerWaalsContact C-N 3.28Å; V56-G58 PolarHBondContact O-N 3.28Å; V56-V59 PolarHBondContact O-N 2.97Å; V56-V59 VanDerWaalsContact O-N 3.14Å; V56-I60 HydrophobicContact CG1-CD1 3.74Å; V56-I60 HydrophobicContact CG1-CG1 4.32Å; V56-I60 WeakPolarHBondContact O-CG1 3.36Å; V56-I60 PolarHBondContact O-N 3.47Å; V56-F96 HydrophobicContact CG1-CZ 4.35Å
57S95.5Very high94.2Very high0 Ų033.5 Ų33.50%019%0.193CC..Hα-helixtrans-63.1-35.8176.4-60.70000112.5N53 Y54 V55 S61 F96 C97 F297N53-S57 VanDerWaalsContact O-CB 3.32Å; N53-S57 WeakPolarHBondContact O-CB 3.35Å; N53-S57 PolarHBondContact O-N 2.98Å; N53-S57 PolarHBondContact O-OG 3.08Å; Y54-S57 PolarHBondContact O-N 3.46Å; V55-S57 VanDerWaalsContact C-N 3.28Å; V55-S57 PolarHBondContact O-N 3.35Å; S57-S61 WeakPolarHBondContact O-CB 3.29Å; S57-S61 PolarHBondContact O-N 3.17Å; S57-F96 WeakPolarHBondContact OG-CD1 3.4Å; S57-F96 WeakPolarHBondContact OG-CE1 3.4Å; S57-C97 PolarHBondContact OG-SG 2.96Å; S57-F297 VanDerWaalsContact CB-CE2 3.49Å; S57-F297 VanDerWaalsContact CB-CZ 3.49Å
58G94.8Very high94.5Very high1 Ų132.5 Ų32.51%0.0119%0.187CC..Hα-helixtrans-60.9-47170.800000112.4Y54 V55 V56 S61 I62 N391Y54-G58 PolarHBondContact O-N 3.14Å; V55-G58 WeakPolarHBondContact O-CA 3.36Å; V55-G58 PolarHBondContact O-N 3.48Å; V56-G58 VanDerWaalsContact C-N 3.28Å; V56-G58 PolarHBondContact O-N 3.28Å; G58-S61 WeakPolarHBondContact O-CB 3.37Å; G58-S61 PolarHBondContact O-N 3.5Å; G58-I62 WeakPolarHBondContact O-CG1 3.19Å; G58-I62 PolarHBondContact O-N 3.33Å; G58-I62 VanDerWaalsContact O-N 3.09Å; G58-N391 PolarHBondContact O-OD1 3.36Å
59V94.3Very high94.6Very high88 Ų8831.2 Ų31.253%0.53317%0.174SC..Hα-helixtrans-62.9-44.7177.5176.80000111.5V55 V56 S61 I62 G63V55-V59 PolarHBondContact O-N 3.23Å; V56-V59 PolarHBondContact O-N 2.97Å; V56-V59 VanDerWaalsContact O-N 3.14Å; V59-S61 VanDerWaalsContact C-N 3.31Å; V59-S61 PolarHBondContact O-N 3.28Å; V59-I62 WeakPolarHBondContact O-CB 3.27Å; V59-I62 PolarHBondContact O-N 3.08Å; V59-G63 PolarHBondContact O-N 3.47Å
60I96Very high94.6Very high76 Ų7639.3 Ų39.339%0.3920%0.203SC..Hα-helixtrans-60.5-43.4175.3-67169.7000110.3V56 I62 G63 L64 L93V56-I60 HydrophobicContact CG1-CD1 3.74Å; V56-I60 HydrophobicContact CG1-CG1 4.32Å; V56-I60 WeakPolarHBondContact O-CG1 3.36Å; V56-I60 PolarHBondContact O-N 3.47Å; I60-I62 VanDerWaalsContact C-N 3.3Å; I60-I62 PolarHBondContact O-N 3.4Å; I60-G63 WeakPolarHBondContact O-CA 3.24Å; I60-G63 PolarHBondContact O-N 2.93Å; I60-L64 HydrophobicContact CG2-CD1 3.86Å; I60-L64 HydrophobicContact CG2-CG 4.08Å; I60-L64 WeakPolarHBondContact O-CG 3.37Å; I60-L64 PolarHBondContact O-N 2.85Å; I60-L93 HydrophobicContact CB-CD2 4.27Å; I60-L93 HydrophobicContact CG2-CD2 3.89Å
61S96.1Very high94.7Very high2 Ų247.8 Ų47.81%0.01423%0.234CC..Hα-helixtrans-56.6-40.1176.21700000112.1S57 G58 V59 G63 L64 G65 F293 N391S57-S61 WeakPolarHBondContact O-CB 3.29Å; S57-S61 PolarHBondContact O-N 3.17Å; G58-S61 WeakPolarHBondContact O-CB 3.37Å; G58-S61 PolarHBondContact O-N 3.5Å; V59-S61 VanDerWaalsContact C-N 3.31Å; V59-S61 PolarHBondContact O-N 3.28Å; S61-G63 VanDerWaalsContact C-N 3.33Å; S61-G63 PolarHBondContact O-N 3.4Å; S61-L64 PolarHBondContact O-N 2.93Å; S61-G65 PolarHBondContact O-N 3.47Å; S61-F293 VanDerWaalsContact O-CE2 3.28Å; S61-F293 WeakPolarHBondContact O-CE2 3.02Å; S61-F293 VanDerWaalsContact OG-CD2 3.3Å; S61-F293 WeakPolarHBondContact OG-CD2 3.21Å; S61-F293 WeakPolarHBondContact OG-CE2 3.43Å; S61-N391 VanDerWaalsContact OG-CG 3.26Å; S61-N391 PolarHBondContact OG-OD1 3.01Å
62I94.8Very high94.8Very high44 Ų4444.9 Ų44.923%0.22622%0.22CC..Hα-helixtrans-59.2-45.8173.9-61173.2000110.7G58 V59 I60 G65 Q66 V390 N391 A394G58-I62 WeakPolarHBondContact O-CG1 3.19Å; G58-I62 PolarHBondContact O-N 3.33Å; G58-I62 VanDerWaalsContact O-N 3.09Å; V59-I62 WeakPolarHBondContact O-CB 3.27Å; V59-I62 PolarHBondContact O-N 3.08Å; I60-I62 VanDerWaalsContact C-N 3.3Å; I60-I62 PolarHBondContact O-N 3.4Å; I62-G65 PolarHBondContact O-N 3.4Å; I62-Q66 PolarHBondContact O-N 3.36Å; I62-V390 HydrophobicContact CD1-CG1 3.68Å; I62-V390 HydrophobicContact CG1-CG1 4.21Å; I62-N391 WeakPolarHBondContact CG1-OD1 3.37Å; I62-A394 HydrophobicContact CG2-CB 4.24Å
63G95.2Very high94.7Very high44 Ų4445.5 Ų45.545%0.45423%0.226SC..Hα-helixtrans-61.5-46.1177.500000113V59 I60 S61 G65 Q66 L67V59-G63 PolarHBondContact O-N 3.47Å; I60-G63 WeakPolarHBondContact O-CA 3.24Å; I60-G63 PolarHBondContact O-N 2.93Å; S61-G63 VanDerWaalsContact C-N 3.33Å; S61-G63 PolarHBondContact O-N 3.4Å; G63-G65 VanDerWaalsContact C-N 3.3Å; G63-G65 PolarHBondContact O-N 3.3Å; G63-Q66 PolarHBondContact O-N 2.94Å; G63-L67 PolarHBondContact O-N 2.78Å
64L96.4Very high94.7Very high32 Ų3246 Ų4617%0.16823%0.229CC..Hα-helixtrans-63.2-36.2174.8-64.1177.6000111.8I60 S61 L67 M68 F89 L93 F293I60-L64 HydrophobicContact CG2-CD1 3.86Å; I60-L64 HydrophobicContact CG2-CG 4.08Å; I60-L64 WeakPolarHBondContact O-CG 3.37Å; I60-L64 PolarHBondContact O-N 2.85Å; S61-L64 PolarHBondContact O-N 2.93Å; L64-L67 HydrophobicContact CD2-CD2 4.49Å; L64-L67 WeakPolarHBondContact O-CB 3.5Å; L64-L67 PolarHBondContact O-N 2.95Å; L64-M68 WeakPolarHBondContact O-CG 3.37Å; L64-M68 PolarHBondContact O-N 3.3Å; L64-F89 HydrophobicContact CB-CD2 4.2Å; L64-F89 HydrophobicContact CB-CE2 4.5Å; L64-F89 HydrophobicContact CD1-CB 3.93Å; L64-F89 HydrophobicContact CD1-CD1 4.17Å; L64-F89 HydrophobicContact CD1-CD2 4.45Å; L64-F89 HydrophobicContact CD1-CG 3.93Å; L64-F89 HydrophobicContact CD2-CD1 4.01Å; L64-F89 HydrophobicContact CD2-CD2 4.42Å; L64-F89 HydrophobicContact CD2-CE1 3.95Å; L64-F89 HydrophobicContact CD2-CE2 4.35Å; L64-F89 HydrophobicContact CD2-CG 4.27Å; L64-F89 HydrophobicContact CD2-CZ 4.13Å; L64-F89 HydrophobicContact CG-CG 4.47Å; L64-L93 HydrophobicContact CD1-CD1 4.5Å; L64-F293 HydrophobicContact CB-CD2 4.25Å; L64-F293 HydrophobicContact CB-CE2 3.97Å; L64-F293 HydrophobicContact CB-CZ 4.28Å
65G95.5Very high94.7Very high1 Ų150.9 Ų50.91%0.0125%0.252CS..Hα-helixtrans-61.2-43.2172.700000112.7S61 I62 G63 L67 M68 R69S61-G65 PolarHBondContact O-N 3.47Å; I62-G65 PolarHBondContact O-N 3.4Å; G63-G65 VanDerWaalsContact C-N 3.3Å; G63-G65 PolarHBondContact O-N 3.3Å; G65-L67 VanDerWaalsContact C-N 3.33Å; G65-L67 PolarHBondContact O-N 3.45Å; G65-M68 PolarHBondContact O-N 3.16Å; G65-R69 WeakPolarHBondContact O-CG 3.35Å; G65-R69 PolarHBondContact O-N 3.22Å
66Q94.5Very high94.6Very high47 Ų4756.4 Ų56.422%0.2227%0.272CS..Hα-helixtrans-65.7-36.5174.4-64.5-50.2-50.500112.3I62 G63 R69 R70 A394I62-Q66 PolarHBondContact O-N 3.36Å; G63-Q66 PolarHBondContact O-N 2.94Å; Q66-R69 PolarHBondContact O-N 3.2Å; Q66-R70 WeakPolarHBondContact O-CB 3.5Å; Q66-R70 WeakPolarHBondContact O-CG 3.4Å; Q66-R70 PolarHBondContact O-N 2.87Å; Q66-A394 PolarHBondContact NE2-O 2.99Å
67L95.3Very high94.6Very high73 Ų7359.6 Ų59.638%0.38228%0.282SS..Hα-helixtrans-61.1-48.2173-178.367.5000111.1G63 L64 G65 R69 R70 R71 F89G63-L67 PolarHBondContact O-N 2.78Å; L64-L67 HydrophobicContact CD2-CD2 4.49Å; L64-L67 WeakPolarHBondContact O-CB 3.5Å; L64-L67 PolarHBondContact O-N 2.95Å; G65-L67 VanDerWaalsContact C-N 3.33Å; G65-L67 PolarHBondContact O-N 3.45Å; L67-R69 VanDerWaalsContact C-N 3.3Å; L67-R69 PolarHBondContact O-N 3.29Å; L67-R70 PolarHBondContact O-N 3.2Å; L67-R71 HydrophobicContact CD1-CB 4.02Å; L67-R71 HydrophobicContact CD1-CG 3.59Å; L67-R71 WeakPolarHBondContact O-CB 3.49Å; L67-R71 PolarHBondContact O-N 2.97Å; L67-F89 HydrophobicContact CD2-CE2 4.36Å; L67-F89 HydrophobicContact CD2-CZ 3.78Å
68M95Very high94.5Very high0 Ų062.2 Ų62.20%030%0.301CS..Hα-helixtrans-58.8-38.7176.9-75.7-62.4-68.100112.8L64 G65 L72 R82 F85 E86 F89 F293 V395L64-M68 WeakPolarHBondContact O-CG 3.37Å; L64-M68 PolarHBondContact O-N 3.3Å; G65-M68 PolarHBondContact O-N 3.16Å; M68-L72 HydrophobicContact CE-CD1 4.45Å; M68-L72 CarbonylContact O-C 3.52Å; M68-L72 VanDerWaalsContact O-C 3.31Å; M68-L72 PolarHBondContact O-N 3.37Å; M68-L72 HydrophobicContact SD-CB 4.27Å; M68-L72 HydrophobicContact SD-CD1 3.41Å; M68-L72 WeakPolarHBondContact SD-CD1 3.4Å; M68-L72 HydrophobicContact SD-CG 4.48Å; M68-R82 HydrophobicContact CE-CB 4.09Å; M68-R82 HydrophobicContact CE-CG 4.38Å; M68-R82 PolarHBondContact O-NH1 3.42Å; M68-F85 HydrophobicContact CE-CB 4.39Å; M68-F85 HydrophobicContact SD-CB 3.75Å; M68-E86 HydrophobicContact CE-CG 3.99Å; M68-F89 HydrophobicContact CG-CD2 4.28Å; M68-F89 HydrophobicContact CG-CE2 3.98Å; M68-F89 HydrophobicContact SD-CD2 4.27Å; M68-F89 HydrophobicContact SD-CE2 3.79Å; M68-F293 HydrophobicContact CG-CE1 3.92Å; M68-F293 HydrophobicContact CG-CZ 4.22Å; M68-V395 HydrophobicContact CB-CG2 4.13Å
69R94.4Very high94.6Very high40 Ų4064.1 Ų64.115%0.15131%0.312CS..Hα-helixtrans-70.7-49.3177.5-71.5-173.769.4124.87.3112.8G65 Q66 L67 L319 P320 I322 A394 V395G65-R69 WeakPolarHBondContact O-CG 3.35Å; G65-R69 PolarHBondContact O-N 3.22Å; Q66-R69 PolarHBondContact O-N 3.2Å; L67-R69 VanDerWaalsContact C-N 3.3Å; L67-R69 PolarHBondContact O-N 3.29Å; R69-L319 HydrophobicContact CB-CD1 4.37Å; R69-L319 HydrophobicContact CG-CD1 3.76Å; R69-P320 PolarHBondContact NH1-O 3.33Å; R69-P320 PolarHBondContact NH2-O 2.69Å; R69-I322 VanDerWaalsContact CZ-CG1 3.48Å; R69-A394 WeakPolarHBondContact CD-O 3.45Å; R69-V395 WeakPolarHBondContact CD-O 3.47Å; R69-V395 WeakPolarHBondContact CG-O 3.32Å
70R92.6Very high94.7Very high196 Ų19666.4 Ų66.474%0.7431%0.312SS*.Hα-helixtrans-82.4-42.1-169.8-66.9180-178.2-173.1-0.7113Q66 L67Q66-R70 WeakPolarHBondContact O-CB 3.5Å; Q66-R70 WeakPolarHBondContact O-CG 3.4Å; Q66-R70 PolarHBondContact O-N 2.87Å; L67-R70 PolarHBondContact O-N 3.2Å
71R93.8Very high94.7Very high187 Ų18765.9 Ų65.971%0.70631%0.309SS*.THydrogen-bonded Turntrans-96.2-34.5-174.3-63.3-63.1-171.2162.40.6112.6L67 Y77L67-R71 HydrophobicContact CD1-CB 4.02Å; L67-R71 HydrophobicContact CD1-CG 3.59Å; L67-R71 WeakPolarHBondContact O-CB 3.49Å; L67-R71 PolarHBondContact O-N 2.97Å; R71-Y77 WeakPolarHBondContact O-CE2 3.39Å
72L93.8Very high94.7Very high11 Ų1165.8 Ų65.86%0.05831%0.308CS..SBendtrans-110.435-173.2-67163.4000113.1M68 Y77 R82 F85M68-L72 HydrophobicContact CE-CD1 4.45Å; M68-L72 CarbonylContact O-C 3.52Å; M68-L72 VanDerWaalsContact O-C 3.31Å; M68-L72 PolarHBondContact O-N 3.37Å; M68-L72 HydrophobicContact SD-CB 4.27Å; M68-L72 HydrophobicContact SD-CD1 3.41Å; M68-L72 WeakPolarHBondContact SD-CD1 3.4Å; M68-L72 HydrophobicContact SD-CG 4.48Å; L72-Y77 HydrophobicContact CB-CD2 4.45Å; L72-Y77 HydrophobicContact CD2-CD1 4.21Å; L72-Y77 HydrophobicContact CD2-CD2 4.07Å; L72-Y77 HydrophobicContact CD2-CE1 4.19Å; L72-Y77 HydrophobicContact CD2-CE2 4.06Å; L72-Y77 HydrophobicContact CD2-CG 4.13Å; L72-R82 WeakPolarHBondContact O-CD 3.26Å; L72-R82 PolarHBondContact O-NH1 3.33Å; L72-F85 HydrophobicContact CD1-CB 3.85Å; L72-F85 HydrophobicContact CD1-CD1 3.77Å; L72-F85 HydrophobicContact CD1-CD2 3.57Å; L72-F85 HydrophobicContact CD1-CE1 4.18Å; L72-F85 HydrophobicContact CD1-CE2 4.01Å; L72-F85 HydrophobicContact CD1-CG 3.44Å; L72-F85 VanDerWaalsContact CD1-CG 3.44Å; L72-F85 HydrophobicContact CD1-CZ 4.29Å; L72-F85 HydrophobicContact CD2-CD2 3.82Å; L72-F85 HydrophobicContact CD2-CE2 3.64Å; L72-F85 HydrophobicContact CD2-CZ 4.21Å; L72-F85 HydrophobicContact CG-CD2 4.36Å
73S93.2Very high94.8Very high22 Ų2263.7 Ų63.715%0.15430%0.298CS..  trans-49.4140-175.7175.40000113.5Q75 K76 Y77S73-Q75 PolarHBondContact O-N 2.98Å; S73-Q75 VanDerWaalsContact O-N 3.1Å; S73-Q75 PolarHBondContact OG-N 3.09Å; S73-K76 PolarHBondContact O-N 3.38Å; S73-Y77 PolarHBondContact O-N 2.94Å
74P94.3Very high94.9Very high12 Ų1265.8 Ų65.88%0.07830%0.298CS..THydrogen-bonded Turntrans-60.5-17.7177-1626.3000114.8K312 L319P74-K312 WeakPolarHBondContact CB-O 3.32Å; P74-L319 HydrophobicContact CG-CD1 4.26Å; P74-L319 HydrophobicContact CG-CD2 4.14Å; P74-L319 HydrophobicContact CG-CG 3.83Å
75Q92.7Very high95Very high116 Ų11667.8 Ų67.854%0.54231%0.305SS..THydrogen-bonded Turntrans-70.5-33.9172.7-62.1-179.1-17.500112.4S73 R317S73-Q75 PolarHBondContact O-N 2.98Å; S73-Q75 VanDerWaalsContact O-N 3.1Å; S73-Q75 PolarHBondContact OG-N 3.09Å; Q75-R317 HydrophobicContact CG-CB 4.44Å; Q75-R317 WeakPolarHBondContact CG-O 3.45Å; Q75-R317 PolarHBondContact N-O 3.32Å
76K93.2Very high95Very high167 Ų16767.8 Ų67.873%0.72631%0.305SS*.THydrogen-bonded Turntrans-97.2-33.5-173.1-66.1-175.9179.9-177.40112.8S73S73-K76 PolarHBondContact O-N 3.38Å
77Y94.6Very high95.1Very high92 Ų9266.6 Ų66.636%0.36130%0.301SS..SBendtrans-118.4141.7-172.3-68.3-86.6000111.4R71 L72 S73 I81R71-Y77 WeakPolarHBondContact O-CE2 3.39Å; L72-Y77 HydrophobicContact CB-CD2 4.45Å; L72-Y77 HydrophobicContact CD2-CD1 4.21Å; L72-Y77 HydrophobicContact CD2-CD2 4.07Å; L72-Y77 HydrophobicContact CD2-CE1 4.19Å; L72-Y77 HydrophobicContact CD2-CE2 4.06Å; L72-Y77 HydrophobicContact CD2-CG 4.13Å; S73-Y77 PolarHBondContact O-N 2.94Å; Y77-I81 HydrophobicContact CD1-CB 4.41Å; Y77-I81 HydrophobicContact CD1-CD1 4.1Å; Y77-I81 HydrophobicContact CD1-CG2 3.81Å; Y77-I81 HydrophobicContact CG-CG2 4.49Å
78S94.7Very high95.2Very high56 Ų5667.2 Ų67.239%0.39230%0.304SS..  trans-64.5153.2174.771.60000111R80 I81 R82S78-R80 PolarHBondContact O-N 3.43Å; S78-R80 VanDerWaalsContact O-N 3.14Å; S78-I81 PolarHBondContact O-N 3.18Å; S78-I81 VanDerWaalsContact O-N 3.1Å; S78-I81 PolarHBondContact OG-N 3.43Å; S78-R82 PolarHBondContact O-N 2.98Å; S78-R82 VanDerWaalsContact O-N 3.15Å
79P95.4Very high95.3Very high40 Ų4068.1 Ų68.126%0.2631%0.308SS..Hα-helixtrans-52.5-36.3174.1-28.836.1000112.6I81 R82 A83 L311 K312P79-I81 PolarHBondContact O-N 3.31Å; P79-R82 PolarHBondContact O-N 3.26Å; P79-A83 WeakPolarHBondContact O-CB 3.49Å; P79-A83 PolarHBondContact O-N 3.12Å; P79-L311 HydrophobicContact CB-CD2 3.8Å; P79-L311 HydrophobicContact CB-CG 3.87Å; P79-L311 WeakPolarHBondContact O-CD2 3.28Å; P79-K312 HydrophobicContact CB-CG 4.4Å; P79-K312 HydrophobicContact CG-CG 3.72Å
80R96.3Very high95.4Very high136 Ų13666.2 Ų66.251%0.51330%0.301SS..Hα-helixtrans-64.4-40.7179.9-156.5178.6-168.3-175.9-2.6112.8S78 A83 L84 D282 I284S78-R80 PolarHBondContact O-N 3.43Å; S78-R80 VanDerWaalsContact O-N 3.14Å; R80-A83 WeakPolarHBondContact O-CB 3.34Å; R80-A83 PolarHBondContact O-N 2.98Å; R80-L84 WeakPolarHBondContact O-CG 3.3Å; R80-L84 PolarHBondContact O-N 3.32Å; R80-L84 VanDerWaalsContact O-N 3.14Å; R80-D282 IonicContact NE-OD1 3.81Å; R80-I284 HydrophobicContact CG-CB 4.43Å; R80-I284 HydrophobicContact CG-CD1 4.39Å; R80-I284 HydrophobicContact CG-CG2 4.09Å
81I96.5Very high95.5Very high66 Ų6659.7 Ų59.734%0.33828%0.281SS..Hα-helixtrans-67.8-45.1175.7-65.6171.3000110Y77 S78 P79 A83 L84 F85Y77-I81 HydrophobicContact CD1-CB 4.41Å; Y77-I81 HydrophobicContact CD1-CD1 4.1Å; Y77-I81 HydrophobicContact CD1-CG2 3.81Å; Y77-I81 HydrophobicContact CG-CG2 4.49Å; S78-I81 PolarHBondContact O-N 3.18Å; S78-I81 VanDerWaalsContact O-N 3.1Å; S78-I81 PolarHBondContact OG-N 3.43Å; P79-I81 PolarHBondContact O-N 3.31Å; I81-A83 VanDerWaalsContact C-N 3.25Å; I81-A83 PolarHBondContact O-N 3.36Å; I81-L84 WeakPolarHBondContact O-CB 3.36Å; I81-L84 PolarHBondContact O-N 3.07Å; I81-L84 VanDerWaalsContact O-N 3.13Å; I81-F85 HydrophobicContact CG2-CD2 4.07Å; I81-F85 HydrophobicContact CG2-CE2 3.92Å; I81-F85 WeakPolarHBondContact O-CD2 3.39Å; I81-F85 PolarHBondContact O-N 2.89Å
82R97Very high95.6Very high0 Ų055.7 Ų55.70%027%0.273CS..Hα-helixtrans-57.9-40.5175.6-71173.354.774.84111.2M68 L72 S78 P79 L84 F85 E86 Y310 L311M68-R82 HydrophobicContact CE-CB 4.09Å; M68-R82 HydrophobicContact CE-CG 4.38Å; M68-R82 PolarHBondContact O-NH1 3.42Å; L72-R82 WeakPolarHBondContact O-CD 3.26Å; L72-R82 PolarHBondContact O-NH1 3.33Å; S78-R82 PolarHBondContact O-N 2.98Å; S78-R82 VanDerWaalsContact O-N 3.15Å; P79-R82 PolarHBondContact O-N 3.26Å; R82-L84 VanDerWaalsContact C-N 3.35Å; R82-L84 PolarHBondContact O-N 2.85Å; R82-F85 PolarHBondContact O-N 3.36Å; R82-E86 WeakPolarHBondContact O-CG 3.42Å; R82-E86 PolarHBondContact O-N 3.08Å; R82-Y310 PolarHBondContact NH2-OH 2.92Å; R82-L311 HydrophobicContact CB-CD1 3.5Å; R82-L311 HydrophobicContact CB-CG 4.34Å; R82-L311 WeakPolarHBondContact CD-O 3.11Å; R82-L311 PolarHBondContact NE-O 3.46Å
83A97.4Very high95.8Very high0 Ų055.5 Ų55.50%027%0.272CS..Hα-helixtrans-62.2-37.4176.500000113P79 R80 I81 E86 T87 I284 I285 A288 L311P79-A83 WeakPolarHBondContact O-CB 3.49Å; P79-A83 PolarHBondContact O-N 3.12Å; R80-A83 WeakPolarHBondContact O-CB 3.34Å; R80-A83 PolarHBondContact O-N 2.98Å; I81-A83 VanDerWaalsContact C-N 3.25Å; I81-A83 PolarHBondContact O-N 3.36Å; A83-E86 PolarHBondContact O-N 2.93Å; A83-T87 WeakPolarHBondContact O-CB 3.41Å; A83-T87 PolarHBondContact O-N 3.49Å; A83-T87 PolarHBondContact O-OG1 3.44Å; A83-I284 HydrophobicContact CB-CG2 4.06Å; A83-I285 HydrophobicContact CB-CG1 4.35Å; A83-A288 HydrophobicContact CB-CB 3.5Å; A83-A288 VanDerWaalsContact CB-CB 3.5Å; A83-A288 VanDerWaalsContact O-CB 3.26Å; A83-A288 WeakPolarHBondContact O-CB 3.31Å; A83-L311 HydrophobicContact CB-CD1 4.41Å; A83-L311 HydrophobicContact CB-CD2 4.03Å
84L97.3Very high95.8Very high88 Ų8854.5 Ų54.546%0.46127%0.265SS..Hα-helixtrans-61.8-44.8174.2-70.8170.3000111.6R80 I81 R82 T87 L88 I284R80-L84 WeakPolarHBondContact O-CG 3.3Å; R80-L84 PolarHBondContact O-N 3.32Å; R80-L84 VanDerWaalsContact O-N 3.14Å; I81-L84 WeakPolarHBondContact O-CB 3.36Å; I81-L84 PolarHBondContact O-N 3.07Å; I81-L84 VanDerWaalsContact O-N 3.13Å; R82-L84 VanDerWaalsContact C-N 3.35Å; R82-L84 PolarHBondContact O-N 2.85Å; L84-T87 PolarHBondContact O-N 3.33Å; L84-L88 WeakPolarHBondContact O-CB 3.16Å; L84-L88 PolarHBondContact O-N 2.96Å; L84-I284 HydrophobicContact CD2-CD1 4.14Å; L84-I284 HydrophobicContact CD2-CG1 4.18Å; L84-I284 HydrophobicContact CD2-CG2 3.63Å; L84-I284 HydrophobicContact CG-CG2 3.82Å
85F97Very high95.8Very high74 Ų7456.9 Ų56.933%0.32528%0.282SS..Hα-helixtrans-67.2-41176.5-78.6-82.1000112.5M68 L72 I81 R82 T87 L88 F89M68-F85 HydrophobicContact CE-CB 4.39Å; M68-F85 HydrophobicContact SD-CB 3.75Å; L72-F85 HydrophobicContact CD1-CB 3.85Å; L72-F85 HydrophobicContact CD1-CD1 3.77Å; L72-F85 HydrophobicContact CD1-CD2 3.57Å; L72-F85 HydrophobicContact CD1-CE1 4.18Å; L72-F85 HydrophobicContact CD1-CE2 4.01Å; L72-F85 HydrophobicContact CD1-CG 3.44Å; L72-F85 VanDerWaalsContact CD1-CG 3.44Å; L72-F85 HydrophobicContact CD1-CZ 4.29Å; L72-F85 HydrophobicContact CD2-CD2 3.82Å; L72-F85 HydrophobicContact CD2-CE2 3.64Å; L72-F85 HydrophobicContact CD2-CZ 4.21Å; L72-F85 HydrophobicContact CG-CD2 4.36Å; I81-F85 HydrophobicContact CG2-CD2 4.07Å; I81-F85 HydrophobicContact CG2-CE2 3.92Å; I81-F85 WeakPolarHBondContact O-CD2 3.39Å; I81-F85 PolarHBondContact O-N 2.89Å; R82-F85 PolarHBondContact O-N 3.36Å; F85-T87 VanDerWaalsContact C-N 3.3Å; F85-T87 PolarHBondContact O-N 2.94Å; F85-L88 PolarHBondContact O-N 2.66Å; F85-F89 HydrophobicContact CB-CE2 4.17Å; F85-F89 HydrophobicContact CD1-CE1 4.43Å; F85-F89 HydrophobicContact CD1-CE2 4.33Å; F85-F89 AromaticContact CD1-CZ 3.88Å; F85-F89 HydrophobicContact CD1-CZ 3.88Å; F85-F89 WeakPolarHBondContact O-CB 3.33Å; F85-F89 VanDerWaalsContact O-CD2 3.29Å; F85-F89 WeakPolarHBondContact O-CD2 3.43Å; F85-F89 VanDerWaalsContact O-CG 3.22Å; F85-F89 WeakPolarHBondContact O-CG 3.26Å; F85-F89 PolarHBondContact O-N 3.35Å
86E96.6Very high95.9Very high0 Ų053.2 Ų53.20%026%0.264CS..Hα-helixtrans-55.7-45.9172.5-74.7-68.2165.100111.7M68 R82 A83 G90 A288 Y292 F293 H294 Y310 L311M68-E86 HydrophobicContact CE-CG 3.99Å; R82-E86 WeakPolarHBondContact O-CG 3.42Å; R82-E86 PolarHBondContact O-N 3.08Å; A83-E86 PolarHBondContact O-N 2.93Å; E86-G90 PolarHBondContact O-N 2.92Å; E86-A288 HydrophobicContact CB-CB 4.38Å; E86-Y292 WeakPolarHBondContact OE2-CB 3.39Å; E86-F293 WeakPolarHBondContact OE1-CE1 3.09Å; E86-F293 WeakPolarHBondContact OE2-CD1 3.36Å; E86-F293 WeakPolarHBondContact OE2-CE1 3.41Å; E86-H294 IonicContact OE1-CD2 3.84Å; E86-H294 IonicContact OE2-CD2 3.01Å; E86-H294 IonicContact OE2-NE2 2.83Å; E86-Y310 VanDerWaalsContact OE1-CE1 3.29Å; E86-Y310 WeakPolarHBondContact OE1-CE1 3.41Å; E86-Y310 VanDerWaalsContact OE1-CZ 3.31Å; E86-Y310 PolarHBondContact OE1-OH 3.25Å; E86-L311 HydrophobicContact CG-CD1 4.44Å
87T96Very high95.9Very high22 Ų2245.4 Ų45.414%0.13523%0.23CC..Hα-helixtrans-64.9-47.5178-530000111.1A83 L84 F85 F89 G90 L91 A288 L291A83-T87 WeakPolarHBondContact O-CB 3.41Å; A83-T87 PolarHBondContact O-N 3.49Å; A83-T87 PolarHBondContact O-OG1 3.44Å; L84-T87 PolarHBondContact O-N 3.33Å; F85-T87 VanDerWaalsContact C-N 3.3Å; F85-T87 PolarHBondContact O-N 2.94Å; T87-F89 PolarHBondContact O-N 2.89Å; T87-G90 PolarHBondContact O-N 3.48Å; T87-L91 HydrophobicContact CG2-CD1 3.96Å; T87-L91 HydrophobicContact CG2-CG 4.32Å; T87-L91 WeakPolarHBondContact O-CB 3.13Å; T87-L91 VanDerWaalsContact O-CG 3.25Å; T87-L91 WeakPolarHBondContact O-CG 3.44Å; T87-L91 PolarHBondContact O-N 3.21Å; T87-A288 WeakPolarHBondContact OG1-CA 3.37Å; T87-A288 VanDerWaalsContact OG1-CB 3.26Å; T87-A288 WeakPolarHBondContact OG1-CB 3.33Å; T87-A288 PolarHBondContact OG1-N 3.27Å; T87-L291 HydrophobicContact CG2-CD1 4.25Å
88L96.9Very high95.7Very high87 Ų8741.7 Ų41.746%0.45522%0.216SC..Hα-helixtrans-58.5-50.2179.5176.863.4000111.4L84 F85 G90 L91 L92L84-L88 WeakPolarHBondContact O-CB 3.16Å; L84-L88 PolarHBondContact O-N 2.96Å; F85-L88 PolarHBondContact O-N 2.66Å; L88-G90 VanDerWaalsContact C-N 3.33Å; L88-G90 PolarHBondContact O-N 2.76Å; L88-L91 PolarHBondContact O-N 3.38Å; L88-L92 HydrophobicContact CD1-CD1 4.37Å; L88-L92 HydrophobicContact CG-CD1 4.27Å; L88-L92 VanDerWaalsContact O-CG 3.31Å; L88-L92 WeakPolarHBondContact O-CG 3.42Å; L88-L92 PolarHBondContact O-N 3.04Å
89F97.1Very high95.5Very high18 Ų1839.9 Ų39.98%0.07921%0.206CC..Hα-helixtrans-63.7-39.9178.2-65.3-23.1000112L64 L67 M68 F85 T87 L92 L93 F293L64-F89 HydrophobicContact CB-CD2 4.2Å; L64-F89 HydrophobicContact CB-CE2 4.5Å; L64-F89 HydrophobicContact CD1-CB 3.93Å; L64-F89 HydrophobicContact CD1-CD1 4.17Å; L64-F89 HydrophobicContact CD1-CD2 4.45Å; L64-F89 HydrophobicContact CD1-CG 3.93Å; L64-F89 HydrophobicContact CD2-CD1 4.01Å; L64-F89 HydrophobicContact CD2-CD2 4.42Å; L64-F89 HydrophobicContact CD2-CE1 3.95Å; L64-F89 HydrophobicContact CD2-CE2 4.35Å; L64-F89 HydrophobicContact CD2-CG 4.27Å; L64-F89 HydrophobicContact CD2-CZ 4.13Å; L64-F89 HydrophobicContact CG-CG 4.47Å; L67-F89 HydrophobicContact CD2-CE2 4.36Å; L67-F89 HydrophobicContact CD2-CZ 3.78Å; M68-F89 HydrophobicContact CG-CD2 4.28Å; M68-F89 HydrophobicContact CG-CE2 3.98Å; M68-F89 HydrophobicContact SD-CD2 4.27Å; M68-F89 HydrophobicContact SD-CE2 3.79Å; F85-F89 HydrophobicContact CB-CE2 4.17Å; F85-F89 HydrophobicContact CD1-CE1 4.43Å; F85-F89 HydrophobicContact CD1-CE2 4.33Å; F85-F89 AromaticContact CD1-CZ 3.88Å; F85-F89 HydrophobicContact CD1-CZ 3.88Å; F85-F89 WeakPolarHBondContact O-CB 3.33Å; F85-F89 VanDerWaalsContact O-CD2 3.29Å; F85-F89 WeakPolarHBondContact O-CD2 3.43Å; F85-F89 VanDerWaalsContact O-CG 3.22Å; F85-F89 WeakPolarHBondContact O-CG 3.26Å; F85-F89 PolarHBondContact O-N 3.35Å; T87-F89 PolarHBondContact O-N 2.89Å; F89-L92 PolarHBondContact O-N 3.47Å; F89-L93 WeakPolarHBondContact O-CG 3.33Å; F89-L93 PolarHBondContact O-N 2.83Å; F89-F293 HydrophobicContact CB-CB 3.8Å; F89-F293 HydrophobicContact CB-CD1 3.78Å; F89-F293 HydrophobicContact CB-CG 3.89Å; F89-F293 HydrophobicContact CD2-CD1 4.04Å; F89-F293 HydrophobicContact CD2-CE1 4.16Å; F89-F293 HydrophobicContact CG-CD1 4.44Å
90G96.9Very high95.1Very high0 Ų044.1 Ų44.10%023%0.227CC..Hα-helixtrans-59.2-49174.700000113.3E86 T87 L88 L92 L93 L94 L291E86-G90 PolarHBondContact O-N 2.92Å; T87-G90 PolarHBondContact O-N 3.48Å; L88-G90 VanDerWaalsContact C-N 3.33Å; L88-G90 PolarHBondContact O-N 2.76Å; G90-L92 VanDerWaalsContact C-N 3.35Å; G90-L92 PolarHBondContact O-N 3.36Å; G90-L93 PolarHBondContact O-N 3.15Å; G90-L94 WeakPolarHBondContact O-CB 3.48Å; G90-L94 WeakPolarHBondContact O-CG 3.42Å; G90-L94 PolarHBondContact O-N 3.14Å; G90-L291 WeakPolarHBondContact CA-O 3.4Å
91L96.1Very high94.8Very high59 Ų5938.4 Ų38.431%0.30921%0.206SC..Hα-helixtrans-61.3-42.2177.7-70.9170.8000111.7T87 L88 S95 L102 L106 L291T87-L91 HydrophobicContact CG2-CD1 3.96Å; T87-L91 HydrophobicContact CG2-CG 4.32Å; T87-L91 WeakPolarHBondContact O-CB 3.13Å; T87-L91 VanDerWaalsContact O-CG 3.25Å; T87-L91 WeakPolarHBondContact O-CG 3.44Å; T87-L91 PolarHBondContact O-N 3.21Å; L88-L91 PolarHBondContact O-N 3.38Å; L91-S95 WeakPolarHBondContact O-CB 3.4Å; L91-S95 PolarHBondContact O-N 2.76Å; L91-L102 HydrophobicContact CD2-CD1 4.11Å; L91-L102 HydrophobicContact CD2-CD2 3.82Å; L91-L102 HydrophobicContact CD2-CG 4.43Å; L91-L106 HydrophobicContact CD2-CD2 4.36Å; L91-L291 HydrophobicContact CD2-CD1 3.82Å; L91-L291 HydrophobicContact CG-CD1 4.28Å
92L95.8Very high94.6Very high104 Ų10436.3 Ų36.355%0.54520%0.195SC..Hα-helixtrans-62.6-48.7177.3-71.8171.1000111.8L88 F89 G90 S95 F96L88-L92 HydrophobicContact CD1-CD1 4.37Å; L88-L92 HydrophobicContact CG-CD1 4.27Å; L88-L92 VanDerWaalsContact O-CG 3.31Å; L88-L92 WeakPolarHBondContact O-CG 3.42Å; L88-L92 PolarHBondContact O-N 3.04Å; F89-L92 PolarHBondContact O-N 3.47Å; G90-L92 VanDerWaalsContact C-N 3.35Å; G90-L92 PolarHBondContact O-N 3.36Å; L92-S95 PolarHBondContact O-N 3.21Å; L92-F96 WeakPolarHBondContact O-CB 3.3Å; L92-F96 PolarHBondContact O-N 3.4Å
93L96.1Very high94.3Very high7 Ų740.2 Ų40.24%0.03721%0.21CC..Hα-helixtrans-66.1-42.8179.6-70.7-171000112.4I60 L64 F89 G90 F96 C97 F293 F297I60-L93 HydrophobicContact CB-CD2 4.27Å; I60-L93 HydrophobicContact CG2-CD2 3.89Å; L64-L93 HydrophobicContact CD1-CD1 4.5Å; F89-L93 WeakPolarHBondContact O-CG 3.33Å; F89-L93 PolarHBondContact O-N 2.83Å; G90-L93 PolarHBondContact O-N 3.15Å; L93-F96 PolarHBondContact O-N 2.82Å; L93-C97 PolarHBondContact O-N 3.44Å; L93-F293 HydrophobicContact CD1-CB 3.9Å; L93-F293 HydrophobicContact CD1-CD2 4.38Å; L93-F297 HydrophobicContact CB-CE2 4.47Å; L93-F297 HydrophobicContact CB-CZ 3.86Å; L93-F297 HydrophobicContact CD1-CE2 4.47Å
94L94.8Very high94.1Very high0 Ų040.2 Ų40.20%021%0.21CC..Hα-helixtrans-65.6-41.2176.4-75.5172.6000112.2G90 F96 C97 F98 L102 L105 L291 V296 F297G90-L94 WeakPolarHBondContact O-CB 3.48Å; G90-L94 WeakPolarHBondContact O-CG 3.42Å; G90-L94 PolarHBondContact O-N 3.14Å; L94-F96 VanDerWaalsContact C-N 3.3Å; L94-F96 PolarHBondContact O-N 3.4Å; L94-C97 PolarHBondContact O-N 3.07Å; L94-F98 HydrophobicContact CD2-CD2 3.72Å; L94-F98 HydrophobicContact CD2-CE2 3.74Å; L94-F98 PolarHBondContact O-N 3Å; L94-L102 HydrophobicContact CB-CD1 3.8Å; L94-L102 HydrophobicContact CD1-CD1 3.49Å; L94-L102 VanDerWaalsContact CD1-CD1 3.49Å; L94-L102 HydrophobicContact CG-CD1 4.31Å; L94-L105 HydrophobicContact CD1-CD1 3.73Å; L94-L105 HydrophobicContact CD2-CD1 4.02Å; L94-L291 HydrophobicContact CD1-CD2 3.67Å; L94-V296 HydrophobicContact CD1-CG2 3.37Å; L94-V296 HydrophobicContact CD2-CB 4.39Å; L94-V296 HydrophobicContact CD2-CG1 3.92Å; L94-V296 HydrophobicContact CD2-CG2 3.77Å; L94-V296 HydrophobicContact CG-CB 4.34Å; L94-V296 HydrophobicContact CG-CG1 3.94Å; L94-V296 HydrophobicContact CG-CG2 3.5Å; L94-V296 VanDerWaalsContact CG-CG2 3.5Å; L94-F297 HydrophobicContact CD2-CD1 4.27Å; L94-F297 HydrophobicContact CD2-CE1 4.22Å
95S93.9Very high94Very high63 Ų6336.2 Ų36.244%0.44119%0.189SC..Hα-helixtrans-62-40.8175.4-176.90000110.9S34 L91 L92 G99S34-S95 PolarHBondContact OG-O 3.06Å; L91-S95 WeakPolarHBondContact O-CB 3.4Å; L91-S95 PolarHBondContact O-N 2.76Å; L92-S95 PolarHBondContact O-N 3.21Å; S95-G99 WeakPolarHBondContact O-CA 3.47Å; S95-G99 PolarHBondContact O-N 3.33Å
96F94.7Very high94Very high39 Ų3935.5 Ų35.517%0.17119%0.189CC..Hα-helixtrans-64.6-40176173.7-92.1000113.3S34 S35 F38 N53 V56 S57 L92 L93 L94S34-F96 VanDerWaalsContact OG-C 3.28Å; S34-F96 PolarHBondContact OG-O 3.27Å; S35-F96 VanDerWaalsContact CB-CE2 3.46Å; S35-F96 VanDerWaalsContact CB-O 3.31Å; S35-F96 WeakPolarHBondContact CB-O 3.15Å; S35-F96 PolarHBondContact N-O 2.83Å; S35-F96 WeakPolarHBondContact OG-CE2 3.2Å; F38-F96 HydrophobicContact CD2-CE2 4.32Å; F38-F96 AromaticContact CD2-CZ 3.76Å; F38-F96 HydrophobicContact CD2-CZ 3.76Å; F38-F96 HydrophobicContact CE2-CE2 4.01Å; F38-F96 AromaticContact CE2-CZ 3.63Å; F38-F96 HydrophobicContact CE2-CZ 3.63Å; N53-F96 HydrophobicContact CB-CD1 4.47Å; N53-F96 HydrophobicContact CB-CE1 3.7Å; N53-F96 HydrophobicContact CB-CZ 4.27Å; V56-F96 HydrophobicContact CG1-CZ 4.35Å; S57-F96 WeakPolarHBondContact OG-CD1 3.4Å; S57-F96 WeakPolarHBondContact OG-CE1 3.4Å; L92-F96 WeakPolarHBondContact O-CB 3.3Å; L92-F96 PolarHBondContact O-N 3.4Å; L93-F96 PolarHBondContact O-N 2.82Å; L94-F96 VanDerWaalsContact C-N 3.3Å; L94-F96 PolarHBondContact O-N 3.4Å
97C92.8Very high93.9Very high3 Ų337.9 Ų37.92%0.0220%0.2CC..Hα-helixtrans-85.6-34-178.6-83.40000115Y32 S34 S57 L93 L94 F297Y32-C97 WeakPolarHBondContact CE2-O 3.4Å; Y32-C97 VanDerWaalsContact CZ-O 3.32Å; Y32-C97 PolarHBondContact OH-O 3.43Å; S34-C97 WeakPolarHBondContact CB-O 3.39Å; S34-C97 PolarHBondContact OG-O 2.92Å; S34-C97 VanDerWaalsContact OG-O 3.12Å; S57-C97 PolarHBondContact OG-SG 2.96Å; L93-C97 PolarHBondContact O-N 3.44Å; L94-C97 PolarHBondContact O-N 3.07Å; C97-F297 HydrophobicContact CB-CD1 4.42Å; C97-F297 HydrophobicContact CB-CE1 3.58Å; C97-F297 HydrophobicContact CB-CZ 4.19Å; C97-F297 VanDerWaalsContact SG-CE1 3.54Å; C97-F297 VanDerWaalsContact SG-CZ 3.58Å
98F91.7Very high94Very high13 Ų1336.8 Ų36.86%0.05719%0.194CC..Hα-helixtrans-126.6-3.7-172-53.6-66.9000114.4S34 L94 N100 Q101 D155 I156 P159 F297S34-F98 PolarHBondContact OG-N 3.32Å; S34-F98 VanDerWaalsContact OG-N 3.15Å; L94-F98 HydrophobicContact CD2-CD2 3.72Å; L94-F98 HydrophobicContact CD2-CE2 3.74Å; L94-F98 PolarHBondContact O-N 3Å; F98-N100 PolarHBondContact O-N 2.7Å; F98-Q101 HydrophobicContact CB-CB 4.17Å; F98-Q101 WeakPolarHBondContact O-CB 3.47Å; F98-Q101 PolarHBondContact O-N 3.3Å; F98-Q101 VanDerWaalsContact O-N 3.12Å; F98-D155 VanDerWaalsContact CE1-C 3.45Å; F98-D155 WeakPolarHBondContact CE1-O 3.38Å; F98-I156 HydrophobicContact CB-CD1 3.98Å; F98-I156 HydrophobicContact CD2-CD1 3.73Å; F98-I156 HydrophobicContact CE2-CD1 4.29Å; F98-I156 HydrophobicContact CG-CD1 3.87Å; F98-P159 HydrophobicContact CD2-CG 4.34Å; F98-P159 HydrophobicContact CE2-CG 3.43Å; F98-P159 VanDerWaalsContact CE2-CG 3.43Å; F98-P159 HydrophobicContact CZ-CG 3.61Å; F98-F297 AromaticContact CE2-CD1 3.61Å; F98-F297 HydrophobicContact CE2-CD1 3.61Å; F98-F297 AromaticContact CE2-CE1 3.96Å; F98-F297 HydrophobicContact CE2-CE1 3.96Å; F98-F297 HydrophobicContact CZ-CD1 4.07Å
99G90Very high94Very high18 Ų1832.7 Ų32.719%0.18617%0.172CC..G310 helixtrans52.5-128.6179.600000112.6S34 S95 Q101 L102S34-G99 PolarHBondContact OG-N 2.89Å; S95-G99 WeakPolarHBondContact O-CA 3.47Å; S95-G99 PolarHBondContact O-N 3.33Å; G99-Q101 PolarHBondContact O-N 2.88Å; G99-Q101 VanDerWaalsContact O-N 3.1Å; G99-L102 WeakPolarHBondContact O-CB 3.28Å; G99-L102 PolarHBondContact O-N 3.43Å; G99-L102 VanDerWaalsContact O-N 3.14Å
100N86.7Confident94Very high129 Ų12933.9 Ų33.969%0.6918%0.183SC*.G310 helixtrans-62.7-17.3-177.4-70.7-16.5000114.2F98 L102 R103F98-N100 PolarHBondContact O-N 2.7Å; N100-L102 PolarHBondContact O-N 3.43Å; N100-R103 WeakPolarHBondContact O-CD 3.34Å; N100-R103 VanDerWaalsContact O-CG 3.25Å; N100-R103 WeakPolarHBondContact O-CG 3.49Å; N100-R103 PolarHBondContact O-N 2.87Å
101Q89.9Confident94Very high16 Ų1636.4 Ų36.48%0.07520%0.196CC..G310 helixtrans-66.9-15.7176.5-62.4-171.4-5.400112.6M14 F98 G99 R103 V104 I156M14-Q101 WeakPolarHBondContact O-CG 3.45Å; F98-Q101 HydrophobicContact CB-CB 4.17Å; F98-Q101 WeakPolarHBondContact O-CB 3.47Å; F98-Q101 PolarHBondContact O-N 3.3Å; F98-Q101 VanDerWaalsContact O-N 3.12Å; G99-Q101 PolarHBondContact O-N 2.88Å; G99-Q101 VanDerWaalsContact O-N 3.1Å; Q101-R103 PolarHBondContact O-N 3.33Å; Q101-R103 VanDerWaalsContact O-N 3.07Å; Q101-V104 WeakPolarHBondContact O-CB 3.07Å; Q101-V104 VanDerWaalsContact O-CG2 3.28Å; Q101-V104 WeakPolarHBondContact O-CG2 3.43Å; Q101-V104 PolarHBondContact O-N 2.93Å; Q101-I156 HydrophobicContact CB-CB 3.86Å; Q101-I156 HydrophobicContact CB-CD1 4.41Å; Q101-I156 HydrophobicContact CB-CG1 4.13Å; Q101-I156 HydrophobicContact CB-CG2 4.09Å
102L91.5Very high94.1Very high22 Ų2233.6 Ų33.612%0.11518%0.181CC..Hα-helixtrans-49.7-34.6172.7170.160.2000113.1L91 L94 G99 N100 V104 L105 L106L91-L102 HydrophobicContact CD2-CD1 4.11Å; L91-L102 HydrophobicContact CD2-CD2 3.82Å; L91-L102 HydrophobicContact CD2-CG 4.43Å; L94-L102 HydrophobicContact CB-CD1 3.8Å; L94-L102 HydrophobicContact CD1-CD1 3.49Å; L94-L102 VanDerWaalsContact CD1-CD1 3.49Å; L94-L102 HydrophobicContact CG-CD1 4.31Å; G99-L102 WeakPolarHBondContact O-CB 3.28Å; G99-L102 PolarHBondContact O-N 3.43Å; G99-L102 VanDerWaalsContact O-N 3.14Å; N100-L102 PolarHBondContact O-N 3.43Å; L102-V104 PolarHBondContact O-N 3.03Å; L102-V104 VanDerWaalsContact O-N 3.11Å; L102-L105 HydrophobicContact CD1-CD1 4.47Å; L102-L105 PolarHBondContact O-N 3.16Å; L102-L105 VanDerWaalsContact O-N 3.07Å; L102-L106 HydrophobicContact CG-CD1 4.35Å; L102-L106 PolarHBondContact O-N 3.44Å
103R91.9Very high94.2Very high82 Ų8229.7 Ų29.731%0.30916%0.159SC..Hα-helixtrans-57.9-26.9177.973.3-164.2179174.11.7113.3K11 V12 F13 N100 Q101 L105 L106 I107K11-R103 PolarHBondContact O-NH2 3.14Å; V12-R103 PolarHBondContact O-NE 3.05Å; V12-R103 PolarHBondContact O-NH1 3.49Å; V12-R103 PolarHBondContact O-NH2 3.33Å; F13-R103 PolarHBondContact O-NE 3.18Å; F13-R103 PolarHBondContact O-NH2 3.03Å; N100-R103 WeakPolarHBondContact O-CD 3.34Å; N100-R103 VanDerWaalsContact O-CG 3.25Å; N100-R103 WeakPolarHBondContact O-CG 3.49Å; N100-R103 PolarHBondContact O-N 2.87Å; Q101-R103 PolarHBondContact O-N 3.33Å; Q101-R103 VanDerWaalsContact O-N 3.07Å; R103-L105 VanDerWaalsContact C-N 3.3Å; R103-L105 PolarHBondContact O-N 3.17Å; R103-L106 PolarHBondContact O-N 3.13Å; R103-I107 VanDerWaalsContact O-CG1 3.27Å; R103-I107 WeakPolarHBondContact O-CG1 3.47Å; R103-I107 PolarHBondContact O-N 3.46Å
104V93.5Very high94.3Very high1 Ų134.1 Ų34.11%0.00618%0.183CC..Hα-helixtrans-60.7-41.8178177.70000110.5F13 M14 Q101 L102 Q108 Y136 V140 I156 V160F13-V104 WeakPolarHBondContact O-CG2 3.18Å; M14-V104 HydrophobicContact SD-CG2 3.85Å; Q101-V104 WeakPolarHBondContact O-CB 3.07Å; Q101-V104 VanDerWaalsContact O-CG2 3.28Å; Q101-V104 WeakPolarHBondContact O-CG2 3.43Å; Q101-V104 PolarHBondContact O-N 2.93Å; L102-V104 PolarHBondContact O-N 3.03Å; L102-V104 VanDerWaalsContact O-N 3.11Å; V104-Q108 PolarHBondContact O-N 2.96Å; V104-Y136 WeakPolarHBondContact CA-OH 3.42Å; V104-Y136 HydrophobicContact CG1-CE1 3.59Å; V104-Y136 VanDerWaalsContact O-CE1 3.29Å; V104-Y136 WeakPolarHBondContact O-CE1 3.39Å; V104-Y136 PolarHBondContact O-OH 3.42Å; V104-V140 HydrophobicContact CG1-CG2 3.76Å; V104-I156 HydrophobicContact CB-CG1 4.2Å; V104-I156 HydrophobicContact CB-CG2 4.38Å; V104-I156 HydrophobicContact CG1-CG2 4.31Å; V104-I156 HydrophobicContact CG2-CG2 4.37Å; V104-V160 HydrophobicContact CG1-CG2 3.73Å
105L95.3Very high94.5Very high3 Ų337 Ų372%0.01620%0.195CC..Hα-helixtrans-71.4-38.8176.1-66.7170.9000112.2L94 L102 R103 S109 I156 P159 V160 Q163L94-L105 HydrophobicContact CD1-CD1 3.73Å; L94-L105 HydrophobicContact CD2-CD1 4.02Å; L102-L105 HydrophobicContact CD1-CD1 4.47Å; L102-L105 PolarHBondContact O-N 3.16Å; L102-L105 VanDerWaalsContact O-N 3.07Å; R103-L105 VanDerWaalsContact C-N 3.3Å; R103-L105 PolarHBondContact O-N 3.17Å; L105-S109 WeakPolarHBondContact O-CB 3.4Å; L105-S109 PolarHBondContact O-N 3.13Å; L105-S109 VanDerWaalsContact O-N 3.15Å; L105-S109 PolarHBondContact O-OG 2.65Å; L105-I156 HydrophobicContact CD1-CD1 3.7Å; L105-I156 HydrophobicContact CD1-CG1 4.48Å; L105-I156 HydrophobicContact CG-CD1 3.96Å; L105-I156 HydrophobicContact CG-CG1 4.21Å; L105-P159 HydrophobicContact CD1-CB 3.83Å; L105-P159 HydrophobicContact CD2-CB 3.91Å; L105-P159 HydrophobicContact CG-CB 4.38Å; L105-V160 HydrophobicContact CD2-CB 4.33Å; L105-V160 HydrophobicContact CD2-CG2 3.63Å; L105-V160 HydrophobicContact CG-CG2 4.35Å; L105-Q163 HydrophobicContact CD2-CB 4.11Å; L105-Q163 PolarHBondContact O-NE2 2.93Å; L105-Q163 PolarHBondContact O-OE1 3.24Å
106L95.4Very high94.6Very high60 Ų6034.1 Ų34.131%0.31418%0.175SC..Hα-helixtrans-66-41.8180-62.2179.2000111.5L91 L102 R103 S109 S110 L291L91-L106 HydrophobicContact CD2-CD2 4.36Å; L102-L106 HydrophobicContact CG-CD1 4.35Å; L102-L106 PolarHBondContact O-N 3.44Å; R103-L106 PolarHBondContact O-N 3.13Å; L106-S109 PolarHBondContact O-OG 3.41Å; L106-S110 WeakPolarHBondContact O-CB 3.46Å; L106-S110 PolarHBondContact O-N 3.01Å; L106-S110 PolarHBondContact O-OG 2.88Å; L106-L291 HydrophobicContact CD2-CD1 3.88Å
107I95.5Very high94.7Very high49 Ų4937.2 Ų37.225%0.25119%0.191SC..Hα-helixtrans-66.4-48.2179.1-68.1166.5000111.1F13 R103 S109 S110 I111 Y136F13-I107 HydrophobicContact CD1-CD1 3.74Å; F13-I107 HydrophobicContact CE1-CD1 3.99Å; F13-I107 HydrophobicContact CE1-CG2 4.46Å; R103-I107 VanDerWaalsContact O-CG1 3.27Å; R103-I107 WeakPolarHBondContact O-CG1 3.47Å; R103-I107 PolarHBondContact O-N 3.46Å; I107-S109 PolarHBondContact O-N 3.41Å; I107-S110 PolarHBondContact O-N 2.65Å; I107-I111 HydrophobicContact CG2-CD1 3.94Å; I107-I111 PolarHBondContact O-N 3.32Å; I107-I111 VanDerWaalsContact O-N 3.13Å; I107-Y136 HydrophobicContact CG2-CE2 3.95Å
108Q97Very high94.9Very high0 Ų041.9 Ų41.90%022%0.223CC..Hα-helixtrans-58.5-50.3-179.2-169.2-174.326.400111.4V104 A112 W132 S133 Y136 T164 L167V104-Q108 PolarHBondContact O-N 2.96Å; Q108-A112 WeakPolarHBondContact O-CB 3.21Å; Q108-A112 PolarHBondContact O-N 2.87Å; Q108-A112 VanDerWaalsContact O-N 3.16Å; Q108-W132 PolarHBondContact O-NE1 2.88Å; Q108-S133 PolarHBondContact NE2-O 3.46Å; Q108-Y136 HydrophobicContact CB-CD1 3.59Å; Q108-Y136 HydrophobicContact CB-CE1 3.61Å; Q108-Y136 HydrophobicContact CB-CG 4.15Å; Q108-Y136 HydrophobicContact CG-CD1 3.58Å; Q108-Y136 HydrophobicContact CG-CE1 4.15Å; Q108-Y136 HydrophobicContact CG-CG 3.94Å; Q108-T164 PolarHBondContact NE2-OG1 3.37Å; Q108-T164 VanDerWaalsContact NE2-OG1 3.08Å; Q108-L167 HydrophobicContact CG-CD1 3.91Å
109S97.2Very high95.1Very high0 Ų043.8 Ų43.80%023%0.233CC..Hα-helixtrans-67.9-38.8-178.955.90000113L105 L106 I107 A112 Y113 F286L105-S109 WeakPolarHBondContact O-CB 3.4Å; L105-S109 PolarHBondContact O-N 3.13Å; L105-S109 VanDerWaalsContact O-N 3.15Å; L105-S109 PolarHBondContact O-OG 2.65Å; L106-S109 PolarHBondContact O-OG 3.41Å; I107-S109 PolarHBondContact O-N 3.41Å; S109-A112 PolarHBondContact O-N 3.24Å; S109-Y113 VanDerWaalsContact O-CB 3.3Å; S109-Y113 WeakPolarHBondContact O-CB 3.48Å; S109-Y113 PolarHBondContact O-N 2.98Å; S109-F286 WeakPolarHBondContact O-CZ 3.4Å
110S97.7Very high95.3Very high44 Ų4447.1 Ų47.131%0.30825%0.252SS..Hα-helixtrans-63.6-45.6178.5-61.20000112.1L106 I107 Y113 L114L106-S110 WeakPolarHBondContact O-CB 3.46Å; L106-S110 PolarHBondContact O-N 3.01Å; L106-S110 PolarHBondContact O-OG 2.88Å; I107-S110 PolarHBondContact O-N 2.65Å; S110-Y113 PolarHBondContact O-N 3.24Å; S110-L114 WeakPolarHBondContact O-CG 3.31Å; S110-L114 PolarHBondContact O-N 3.49Å
111I97.4Very high95.7Very high52 Ų5242.5 Ų42.527%0.26723%0.23SC..Hα-helixtrans-66.6-42179.2-67.9170.3000110.8I107 Y113 L114 F115 W132I107-I111 HydrophobicContact CG2-CD1 3.94Å; I107-I111 PolarHBondContact O-N 3.32Å; I107-I111 VanDerWaalsContact O-N 3.13Å; I111-Y113 VanDerWaalsContact C-N 3.31Å; I111-Y113 PolarHBondContact O-N 2.86Å; I111-L114 PolarHBondContact O-N 3.37Å; I111-F115 HydrophobicContact CG2-CD2 4.43Å; I111-F115 HydrophobicContact CG2-CE2 3.78Å; I111-F115 HydrophobicContact CG2-CZ 3.9Å; I111-F115 PolarHBondContact O-N 3.35Å; I111-F115 VanDerWaalsContact O-N 3.12Å; I111-W132 HydrophobicContact CB-CD2 4.48Å; I111-W132 HydrophobicContact CB-CH2 4.38Å; I111-W132 HydrophobicContact CB-CZ2 3.61Å; I111-W132 HydrophobicContact CD1-CH2 3.44Å; I111-W132 VanDerWaalsContact CD1-CH2 3.44Å; I111-W132 HydrophobicContact CD1-CZ2 3.35Å; I111-W132 HydrophobicContact CD1-CZ3 4.43Å; I111-W132 HydrophobicContact CG1-CH2 4.48Å; I111-W132 HydrophobicContact CG1-CZ2 4.02Å; I111-W132 HydrophobicContact CG2-CD2 3.77Å; I111-W132 VanDerWaalsContact CG2-CE2 3.43Å; I111-W132 HydrophobicContact CG2-CE3 4.24Å; I111-W132 HydrophobicContact CG2-CG 4.28Å; I111-W132 HydrophobicContact CG2-CH2 4.14Å; I111-W132 HydrophobicContact CG2-CZ2 3.66Å; I111-W132 HydrophobicContact CG2-CZ3 4.4Å
112A98.1Very high95.9Very high0 Ų044.9 Ų44.90%024%0.243CC..Hα-helixtrans-61.9-39.7175.100000112.3Q108 S109 F115 M116 V129 L167Q108-A112 WeakPolarHBondContact O-CB 3.21Å; Q108-A112 PolarHBondContact O-N 2.87Å; Q108-A112 VanDerWaalsContact O-N 3.16Å; S109-A112 PolarHBondContact O-N 3.24Å; A112-F115 PolarHBondContact O-N 2.93Å; A112-M116 HydrophobicContact CB-CE 4.34Å; A112-M116 WeakPolarHBondContact O-CE 3.29Å; A112-M116 PolarHBondContact O-N 3.02Å; A112-M116 VanDerWaalsContact O-N 3.09Å; A112-V129 HydrophobicContact CB-CG1 4.12Å; A112-L167 HydrophobicContact CB-CD1 3.84Å; A112-L167 HydrophobicContact CB-CD2 3.67Å; A112-L167 HydrophobicContact CB-CG 4.22Å
113Y98.1Very high96Very high22 Ų2249.1 Ų49.19%0.08626%0.262CS..Hα-helixtrans-63.7-41.4175.6-172.1-107.3000112.3S109 S110 I111 F115 M116 M117 V280 P281 P283 F286S109-Y113 VanDerWaalsContact O-CB 3.3Å; S109-Y113 WeakPolarHBondContact O-CB 3.48Å; S109-Y113 PolarHBondContact O-N 2.98Å; S110-Y113 PolarHBondContact O-N 3.24Å; I111-Y113 VanDerWaalsContact C-N 3.31Å; I111-Y113 PolarHBondContact O-N 2.86Å; Y113-F115 VanDerWaalsContact C-N 3.32Å; Y113-F115 PolarHBondContact O-N 2.73Å; Y113-M116 PolarHBondContact O-N 3.06Å; Y113-M117 HydrophobicContact CD1-CG 3.93Å; Y113-M117 HydrophobicContact CD2-CG 4.5Å; Y113-M117 HydrophobicContact CE1-CG 3.5Å; Y113-M117 VanDerWaalsContact CE1-CG 3.5Å; Y113-M117 HydrophobicContact CE1-SD 4.16Å; Y113-M117 HydrophobicContact CE2-CG 4.14Å; Y113-M117 HydrophobicContact CE2-SD 4.32Å; Y113-M117 HydrophobicContact CG-CG 4.4Å; Y113-M117 WeakPolarHBondContact O-CB 3.45Å; Y113-M117 WeakPolarHBondContact O-CG 3.43Å; Y113-M117 PolarHBondContact O-N 2.67Å; Y113-M117 PolarHBondContact OH-SD 3.31Å; Y113-V280 HydrophobicContact CE2-CG1 4.01Å; Y113-P281 WeakPolarHBondContact CE2-O 3.22Å; Y113-P281 PolarHBondContact OH-O 3.23Å; Y113-P283 HydrophobicContact CE1-CB 4.34Å; Y113-P283 HydrophobicContact CE1-CG 4Å; Y113-P283 VanDerWaalsContact OH-CD 3.24Å; Y113-P283 WeakPolarHBondContact OH-CD 3.5Å; Y113-P283 WeakPolarHBondContact OH-CG 3.43Å; Y113-F286 HydrophobicContact CD2-CB 3.97Å; Y113-F286 AromaticContact CD2-CD1 3.48Å; Y113-F286 HydrophobicContact CD2-CD1 3.48Å; Y113-F286 VanDerWaalsContact CD2-CD1 3.48Å; Y113-F286 AromaticContact CD2-CD2 3.57Å; Y113-F286 HydrophobicContact CD2-CD2 3.57Å; Y113-F286 AromaticContact CD2-CE1 3.81Å; Y113-F286 HydrophobicContact CD2-CE1 3.81Å; Y113-F286 AromaticContact CD2-CE2 3.87Å; Y113-F286 HydrophobicContact CD2-CE2 3.87Å; Y113-F286 AromaticContact CD2-CG 3.36Å; Y113-F286 HydrophobicContact CD2-CG 3.36Å; Y113-F286 AromaticContact CD2-CZ 3.98Å; Y113-F286 HydrophobicContact CD2-CZ 3.98Å; Y113-F286 HydrophobicContact CE2-CB 3.76Å; Y113-F286 HydrophobicContact CE2-CD1 4.1Å; Y113-F286 HydrophobicContact CE2-CD2 4.09Å; Y113-F286 AromaticContact CE2-CG 3.7Å; Y113-F286 HydrophobicContact CE2-CG 3.7Å; Y113-F286 AromaticContact CG-CD1 3.85Å; Y113-F286 HydrophobicContact CG-CD1 3.85Å; Y113-F286 AromaticContact CG-CE1 3.89Å; Y113-F286 HydrophobicContact CG-CE1 3.89Å; Y113-F286 HydrophobicContact CG-CG 4.2Å; Y113-F286 HydrophobicContact CG-CZ 4.26Å
114L97.7Very high96.3Very high101 Ų10151.6 Ų51.653%0.52928%0.275SS..Hα-helixtrans-59.4-42.2174.3-70.1172.3000111.7S110 I111 M116 M117 C118S110-L114 WeakPolarHBondContact O-CG 3.31Å; S110-L114 PolarHBondContact O-N 3.49Å; I111-L114 PolarHBondContact O-N 3.37Å; L114-M116 PolarHBondContact O-N 3.33Å; L114-M117 PolarHBondContact O-N 3.29Å; L114-C118 VanDerWaalsContact O-CB 3.28Å; L114-C118 WeakPolarHBondContact O-CB 3.45Å; L114-C118 PolarHBondContact O-N 3.17Å; L114-C118 PolarHBondContact O-SG 2.86Å
115F97.8Very high96.5Very high60 Ų6051.5 Ų51.526%0.26328%0.275SS..Hα-helixtrans-61.2-44.7173.8-65.2-33.9000112.5I111 A112 Y113 M117 L119 L128 V129 W132I111-F115 HydrophobicContact CG2-CD2 4.43Å; I111-F115 HydrophobicContact CG2-CE2 3.78Å; I111-F115 HydrophobicContact CG2-CZ 3.9Å; I111-F115 PolarHBondContact O-N 3.35Å; I111-F115 VanDerWaalsContact O-N 3.12Å; A112-F115 PolarHBondContact O-N 2.93Å; Y113-F115 VanDerWaalsContact C-N 3.32Å; Y113-F115 PolarHBondContact O-N 2.73Å; F115-M117 VanDerWaalsContact C-N 3.31Å; F115-M117 PolarHBondContact O-N 3.28Å; F115-L119 HydrophobicContact CB-CD1 4.35Å; F115-L119 VanDerWaalsContact O-CB 3.28Å; F115-L119 WeakPolarHBondContact O-CB 3.19Å; F115-L119 WeakPolarHBondContact O-CG 3.13Å; F115-L119 PolarHBondContact O-N 3.38Å; F115-L119 VanDerWaalsContact O-N 3.09Å; F115-L128 HydrophobicContact CD1-CD2 4.02Å; F115-L128 HydrophobicContact CD2-CD2 4.33Å; F115-L128 HydrophobicContact CD2-CG 4.28Å; F115-L128 HydrophobicContact CE1-CD2 4.25Å; F115-L128 HydrophobicContact CE2-CG 4.37Å; F115-L128 HydrophobicContact CG-CD2 4.07Å; F115-V129 HydrophobicContact CB-CG2 3.86Å; F115-V129 HydrophobicContact CD2-CG2 4.41Å; F115-W132 HydrophobicContact CD2-CB 4.35Å; F115-W132 HydrophobicContact CD2-CG 4.46Å; F115-W132 HydrophobicContact CE2-CB 3.79Å; F115-W132 HydrophobicContact CE2-CD2 4.33Å; F115-W132 AromaticContact CE2-CG 3.85Å; F115-W132 HydrophobicContact CE2-CG 3.85Å
116M97.8Very high96.6Very high2 Ų251.4 Ų51.41%0.0127%0.274CS..Hα-helixtrans-65-33.5178.5-70.9-176.4-86.600112.8A112 Y113 L114 M125 V129 L167 L170 A171 L174 V280 F286A112-M116 HydrophobicContact CB-CE 4.34Å; A112-M116 WeakPolarHBondContact O-CE 3.29Å; A112-M116 PolarHBondContact O-N 3.02Å; A112-M116 VanDerWaalsContact O-N 3.09Å; Y113-M116 PolarHBondContact O-N 3.06Å; L114-M116 PolarHBondContact O-N 3.33Å; M116-M125 HydrophobicContact CB-SD 4.3Å; M116-M125 HydrophobicContact CG-CE 4.49Å; M116-M125 HydrophobicContact CG-SD 3.87Å; M116-V129 HydrophobicContact CG-CG2 3.93Å; M116-L167 HydrophobicContact CE-CD2 4.23Å; M116-L170 HydrophobicContact CE-CD2 4.26Å; M116-L170 HydrophobicContact SD-CD2 4.06Å; M116-L170 HydrophobicContact SD-CG 4.06Å; M116-A171 HydrophobicContact SD-CB 4.47Å; M116-L174 HydrophobicContact CG-CD1 4.27Å; M116-L174 HydrophobicContact SD-CD1 3.89Å; M116-V280 HydrophobicContact CB-CG1 4.19Å; M116-V280 WeakPolarHBondContact O-CG2 3.48Å; M116-F286 HydrophobicContact CE-CE2 3.65Å; M116-F286 HydrophobicContact CE-CZ 4.16Å
117M96.2Very high96.7Very high104 Ų10451.8 Ų51.851%0.51228%0.279SS..Hα-helixtrans-77.7-39.1178.7-75.5-62.1-5800113.3Y113 L114 F115 V280Y113-M117 HydrophobicContact CD1-CG 3.93Å; Y113-M117 HydrophobicContact CD2-CG 4.5Å; Y113-M117 HydrophobicContact CE1-CG 3.5Å; Y113-M117 VanDerWaalsContact CE1-CG 3.5Å; Y113-M117 HydrophobicContact CE1-SD 4.16Å; Y113-M117 HydrophobicContact CE2-CG 4.14Å; Y113-M117 HydrophobicContact CE2-SD 4.32Å; Y113-M117 HydrophobicContact CG-CG 4.4Å; Y113-M117 WeakPolarHBondContact O-CB 3.45Å; Y113-M117 WeakPolarHBondContact O-CG 3.43Å; Y113-M117 PolarHBondContact O-N 2.67Å; Y113-M117 PolarHBondContact OH-SD 3.31Å; L114-M117 PolarHBondContact O-N 3.29Å; F115-M117 VanDerWaalsContact C-N 3.31Å; F115-M117 PolarHBondContact O-N 3.28Å; M117-V280 HydrophobicContact CG-CG1 4.27Å; M117-V280 HydrophobicContact SD-CB 4.15Å; M117-V280 HydrophobicContact SD-CG1 3.57Å; M117-V280 VanDerWaalsContact SD-CG1 3.57Å
118C96.3Very high96.8Very high102 Ų10251.8 Ų51.869%0.68928%0.279SS*.Hα-helixtrans-89.8-19.6-172.4-64.40000113.8L114L114-C118 VanDerWaalsContact O-CB 3.28Å; L114-C118 WeakPolarHBondContact O-CB 3.45Å; L114-C118 PolarHBondContact O-N 3.17Å; L114-C118 PolarHBondContact O-SG 2.86Å
119L96.4Very high96.8Very high52 Ų5251.8 Ų51.827%0.27228%0.279SS..SBendtrans-109.8149.2-176.8-59.1173.9000111.3F115 F124 M125 L128F115-L119 HydrophobicContact CB-CD1 4.35Å; F115-L119 VanDerWaalsContact O-CB 3.28Å; F115-L119 WeakPolarHBondContact O-CB 3.19Å; F115-L119 WeakPolarHBondContact O-CG 3.13Å; F115-L119 PolarHBondContact O-N 3.38Å; F115-L119 VanDerWaalsContact O-N 3.09Å; L119-F124 HydrophobicContact CD1-CE1 4.24Å; L119-M125 HydrophobicContact CB-CB 4.1Å; L119-M125 HydrophobicContact CB-CG 4.02Å; L119-M125 HydrophobicContact CD1-CB 4.46Å; L119-M125 HydrophobicContact CD1-CG 4.43Å; L119-L128 HydrophobicContact CD1-CD2 3.5Å; L119-L128 VanDerWaalsContact CD1-CD2 3.5Å
120P94.8Very high96.9Very high89 Ų8952.1 Ų52.158%0.57828%0.281SS*.  trans-63.9142173.327.1-34.2000110.8N122 M125P120-N122 PolarHBondContact O-N 3.5Å; P120-N122 PolarHBondContact O-OD1 3.42Å; P120-M125 WeakPolarHBondContact O-CB 3.4Å
121S93.9Very high96.9Very high32 Ų3254.8 Ų54.822%0.22429%0.291CS..SBendtrans-68.574.1178.7-560000112.4
122N94.5Very high96.9Very high65 Ų6554.4 Ų54.435%0.34829%0.286SS..SBendtrans-125.6175.1178.368.214.7000110.9P120 F124 M125 A126 V175P120-N122 PolarHBondContact O-N 3.5Å; P120-N122 PolarHBondContact O-OD1 3.42Å; N122-F124 PolarHBondContact O-N 3.15Å; N122-F124 WeakPolarHBondContact OD1-CB 3.49Å; N122-F124 PolarHBondContact OD1-N 3.04Å; N122-F124 VanDerWaalsContact OD1-N 3.13Å; N122-M125 PolarHBondContact O-N 3.04Å; N122-M125 PolarHBondContact OD1-N 3.19Å; N122-A126 PolarHBondContact O-N 2.86Å; N122-V175 WeakPolarHBondContact O-CG2 3.23Å
123H94.5Very high96.9Very high112 Ų11254.4 Ų54.452%0.51929%0.286SS..Hα-helixtrans-57-33.4-180-77.9-75.5000113.6A126 V127H123-A126 PolarHBondContact O-N 3.19Å; H123-V127 WeakPolarHBondContact O-CB 3.38Å; H123-V127 VanDerWaalsContact O-CG2 3.31Å; H123-V127 WeakPolarHBondContact O-CG2 3.28Å; H123-V127 PolarHBondContact O-N 3.02Å
124F96.8Very high96.8Very high133 Ų13354.6 Ų54.658%0.58329%0.288SS*.Hα-helixtrans-62.6-47.8177.9173.1-97.6000111.6L119 N122 A126 V127 L128L119-F124 HydrophobicContact CD1-CE1 4.24Å; N122-F124 PolarHBondContact O-N 3.15Å; N122-F124 WeakPolarHBondContact OD1-CB 3.49Å; N122-F124 PolarHBondContact OD1-N 3.04Å; N122-F124 VanDerWaalsContact OD1-N 3.13Å; F124-A126 VanDerWaalsContact C-N 3.29Å; F124-A126 PolarHBondContact O-N 3.41Å; F124-V127 PolarHBondContact O-N 3.37Å; F124-L128 HydrophobicContact CE1-CD2 4.29Å; F124-L128 WeakPolarHBondContact O-CB 3.49Å; F124-L128 PolarHBondContact O-N 3.41Å
125M97.7Very high96.7Very high0 Ų054.9 Ų54.90%029%0.286CS..Hα-helixtrans-58.4-43175.5178.9-123.263.100111.2M116 L119 P120 N122 L128 V129 A171M116-M125 HydrophobicContact CB-SD 4.3Å; M116-M125 HydrophobicContact CG-CE 4.49Å; M116-M125 HydrophobicContact CG-SD 3.87Å; L119-M125 HydrophobicContact CB-CB 4.1Å; L119-M125 HydrophobicContact CB-CG 4.02Å; L119-M125 HydrophobicContact CD1-CB 4.46Å; L119-M125 HydrophobicContact CD1-CG 4.43Å; P120-M125 WeakPolarHBondContact O-CB 3.4Å; N122-M125 PolarHBondContact O-N 3.04Å; N122-M125 PolarHBondContact OD1-N 3.19Å; M125-L128 PolarHBondContact O-N 2.92Å; M125-V129 HydrophobicContact CG-CG2 4.49Å; M125-V129 WeakPolarHBondContact O-CG2 3.44Å; M125-V129 PolarHBondContact O-N 3.03Å; M125-A171 HydrophobicContact CE-CB 3.63Å; M125-A171 VanDerWaalsContact CE-O 3.26Å; M125-A171 WeakPolarHBondContact CE-O 3.48Å
126A97.7Very high96.6Very high0 Ų052.2 Ų52.20%027%0.274CS..Hα-helixtrans-65.5-42.6-17800000112.4N122 H123 F124 T130 A171 F172 V175N122-A126 PolarHBondContact O-N 2.86Å; H123-A126 PolarHBondContact O-N 3.19Å; F124-A126 VanDerWaalsContact C-N 3.29Å; F124-A126 PolarHBondContact O-N 3.41Å; A126-T130 WeakPolarHBondContact O-CB 3.42Å; A126-T130 PolarHBondContact O-N 3.02Å; A126-T130 PolarHBondContact O-OG1 3.13Å; A126-A171 HydrophobicContact CB-CB 4.26Å; A126-F172 HydrophobicContact CB-CD1 3.67Å; A126-F172 HydrophobicContact CB-CD2 4.1Å; A126-F172 HydrophobicContact CB-CE1 3.76Å; A126-F172 HydrophobicContact CB-CE2 4.19Å; A126-F172 HydrophobicContact CB-CG 3.87Å; A126-F172 HydrophobicContact CB-CZ 4.03Å; A126-V175 HydrophobicContact CB-CG2 3.8Å
127V97.2Very high96.5Very high68 Ų6852.2 Ų52.241%0.41227%0.274SS..Hα-helixtrans-64.7-43.8174.3171.40000110.7H123 F124 T130 I131 F172H123-V127 WeakPolarHBondContact O-CB 3.38Å; H123-V127 VanDerWaalsContact O-CG2 3.31Å; H123-V127 WeakPolarHBondContact O-CG2 3.28Å; H123-V127 PolarHBondContact O-N 3.02Å; F124-V127 PolarHBondContact O-N 3.37Å; V127-T130 PolarHBondContact O-N 3.3Å; V127-I131 HydrophobicContact CG1-CD1 3.63Å; V127-I131 HydrophobicContact CG1-CG1 4.22Å; V127-I131 VanDerWaalsContact O-CG1 3.3Å; V127-I131 WeakPolarHBondContact O-CG1 3.47Å; V127-I131 PolarHBondContact O-N 3.22Å; V127-F172 HydrophobicContact CG2-CZ 4.31Å
128L97.8Very high96.4Very high49 Ų4948.3 Ų48.326%0.25726%0.256SS..Hα-helixtrans-61.8-47179.7-175.666.8000112.3F115 L119 F124 M125 T130 I131 W132F115-L128 HydrophobicContact CD1-CD2 4.02Å; F115-L128 HydrophobicContact CD2-CD2 4.33Å; F115-L128 HydrophobicContact CD2-CG 4.28Å; F115-L128 HydrophobicContact CE1-CD2 4.25Å; F115-L128 HydrophobicContact CE2-CG 4.37Å; F115-L128 HydrophobicContact CG-CD2 4.07Å; L119-L128 HydrophobicContact CD1-CD2 3.5Å; L119-L128 VanDerWaalsContact CD1-CD2 3.5Å; F124-L128 HydrophobicContact CE1-CD2 4.29Å; F124-L128 WeakPolarHBondContact O-CB 3.49Å; F124-L128 PolarHBondContact O-N 3.41Å; M125-L128 PolarHBondContact O-N 2.92Å; L128-T130 VanDerWaalsContact C-N 3.27Å; L128-T130 PolarHBondContact O-N 3Å; L128-I131 PolarHBondContact O-N 2.89Å; L128-W132 WeakPolarHBondContact O-CB 3.33Å; L128-W132 PolarHBondContact O-N 2.83Å
129V98.3Very high96.2Very high0 Ų045.4 Ų45.40%023%0.233CC..Hα-helixtrans-61-39.5176171.30000110.9A112 F115 M116 M125 S133 L167 A171A112-V129 HydrophobicContact CB-CG1 4.12Å; F115-V129 HydrophobicContact CB-CG2 3.86Å; F115-V129 HydrophobicContact CD2-CG2 4.41Å; M116-V129 HydrophobicContact CG-CG2 3.93Å; M125-V129 HydrophobicContact CG-CG2 4.49Å; M125-V129 WeakPolarHBondContact O-CG2 3.44Å; M125-V129 PolarHBondContact O-N 3.03Å; V129-S133 WeakPolarHBondContact O-CB 3.34Å; V129-S133 PolarHBondContact O-N 3.01Å; V129-S133 PolarHBondContact O-OG 3.26Å; V129-L167 HydrophobicContact CG1-CB 4.26Å; V129-A171 HydrophobicContact CB-CB 3.8Å; V129-A171 HydrophobicContact CG1-CB 3.78Å; V129-A171 HydrophobicContact CG2-CB 4.23Å
130T97.8Very high96Very high8 Ų843 Ų435%0.04922%0.22CC..Hα-helixtrans-66.6-45.5177.8-58.90000111.6A126 V127 L128 S133 L134 S168 F172 F447A126-T130 WeakPolarHBondContact O-CB 3.42Å; A126-T130 PolarHBondContact O-N 3.02Å; A126-T130 PolarHBondContact O-OG1 3.13Å; V127-T130 PolarHBondContact O-N 3.3Å; L128-T130 VanDerWaalsContact C-N 3.27Å; L128-T130 PolarHBondContact O-N 3Å; T130-S133 PolarHBondContact O-N 2.85Å; T130-L134 HydrophobicContact CG2-CD1 3.94Å; T130-L134 HydrophobicContact CG2-CG 4.5Å; T130-L134 WeakPolarHBondContact O-CB 3.41Å; T130-L134 WeakPolarHBondContact O-CG 3.41Å; T130-L134 PolarHBondContact O-N 3.14Å; T130-S168 WeakPolarHBondContact OG1-CB 3.49Å; T130-F172 WeakPolarHBondContact OG1-CE2 3.39Å; T130-F447 HydrophobicContact CG2-CE1 3.97Å; T130-F447 HydrophobicContact CG2-CZ 3.71Å
131I97.4Very high95.9Very high100 Ų10039.3 Ų39.351%0.51320%0.196SC..Hα-helixtrans-59.8-49.1175.6-71.5170000110.2V127 L128 S133 L134 F135V127-I131 HydrophobicContact CG1-CD1 3.63Å; V127-I131 HydrophobicContact CG1-CG1 4.22Å; V127-I131 VanDerWaalsContact O-CG1 3.3Å; V127-I131 WeakPolarHBondContact O-CG1 3.47Å; V127-I131 PolarHBondContact O-N 3.22Å; L128-I131 PolarHBondContact O-N 2.89Å; I131-S133 VanDerWaalsContact C-N 3.35Å; I131-S133 PolarHBondContact O-N 2.58Å; I131-L134 PolarHBondContact O-N 2.91Å; I131-F135 WeakPolarHBondContact O-CB 3.36Å; I131-F135 PolarHBondContact O-N 3.1Å
132W97.7Very high95.7Very high44 Ų4440 Ų4017%0.16720%0.198CC..Hα-helixtrans-56.5-48.6176.4165.1-107.7000111.9Q108 I111 F115 L128 L134 F135 Y136Q108-W132 PolarHBondContact O-NE1 2.88Å; I111-W132 HydrophobicContact CB-CD2 4.48Å; I111-W132 HydrophobicContact CB-CH2 4.38Å; I111-W132 HydrophobicContact CB-CZ2 3.61Å; I111-W132 HydrophobicContact CD1-CH2 3.44Å; I111-W132 VanDerWaalsContact CD1-CH2 3.44Å; I111-W132 HydrophobicContact CD1-CZ2 3.35Å; I111-W132 HydrophobicContact CD1-CZ3 4.43Å; I111-W132 HydrophobicContact CG1-CH2 4.48Å; I111-W132 HydrophobicContact CG1-CZ2 4.02Å; I111-W132 HydrophobicContact CG2-CD2 3.77Å; I111-W132 VanDerWaalsContact CG2-CE2 3.43Å; I111-W132 HydrophobicContact CG2-CE3 4.24Å; I111-W132 HydrophobicContact CG2-CG 4.28Å; I111-W132 HydrophobicContact CG2-CH2 4.14Å; I111-W132 HydrophobicContact CG2-CZ2 3.66Å; I111-W132 HydrophobicContact CG2-CZ3 4.4Å; F115-W132 HydrophobicContact CD2-CB 4.35Å; F115-W132 HydrophobicContact CD2-CG 4.46Å; F115-W132 HydrophobicContact CE2-CB 3.79Å; F115-W132 HydrophobicContact CE2-CD2 4.33Å; F115-W132 AromaticContact CE2-CG 3.85Å; F115-W132 HydrophobicContact CE2-CG 3.85Å; L128-W132 WeakPolarHBondContact O-CB 3.33Å; L128-W132 PolarHBondContact O-N 2.83Å; W132-L134 PolarHBondContact O-N 3.45Å; W132-F135 HydrophobicContact CE3-CD1 4.36Å; W132-F135 HydrophobicContact CZ3-CD1 4.32Å; W132-F135 PolarHBondContact O-N 2.94Å; W132-Y136 AromaticContact CH2-CD2 3.66Å; W132-Y136 HydrophobicContact CH2-CD2 3.66Å; W132-Y136 HydrophobicContact CH2-CE2 4.33Å; W132-Y136 AromaticContact CZ2-CD2 3.65Å; W132-Y136 HydrophobicContact CZ2-CD2 3.65Å; W132-Y136 HydrophobicContact CZ2-CE2 4.29Å; W132-Y136 HydrophobicContact CZ2-CG 4.2Å; W132-Y136 VanDerWaalsContact O-CB 3.32Å; W132-Y136 WeakPolarHBondContact O-CB 3.33Å; W132-Y136 PolarHBondContact O-N 3.33Å
133S97.8Very high95.3Very high0 Ų036.9 Ų36.90%018%0.182CC..Hα-helixtrans-64.1-44.3-176.3-55.70000111.4Q108 V129 T130 I131 L137Q108-S133 PolarHBondContact NE2-O 3.46Å; V129-S133 WeakPolarHBondContact O-CB 3.34Å; V129-S133 PolarHBondContact O-N 3.01Å; V129-S133 PolarHBondContact O-OG 3.26Å; T130-S133 PolarHBondContact O-N 2.85Å; I131-S133 VanDerWaalsContact C-N 3.35Å; I131-S133 PolarHBondContact O-N 2.58Å; S133-L137 WeakPolarHBondContact O-CB 3.2Å; S133-L137 PolarHBondContact O-N 2.89Å
134L96.8Very high95Very high25 Ų2533.1 Ų33.113%0.13116%0.163CC..Hα-helixtrans-69.3-37.5177.1-73173.9000112.8T130 I131 W132 T138 T164 F447 F466T130-L134 HydrophobicContact CG2-CD1 3.94Å; T130-L134 HydrophobicContact CG2-CG 4.5Å; T130-L134 WeakPolarHBondContact O-CB 3.41Å; T130-L134 WeakPolarHBondContact O-CG 3.41Å; T130-L134 PolarHBondContact O-N 3.14Å; I131-L134 PolarHBondContact O-N 2.91Å; W132-L134 PolarHBondContact O-N 3.45Å; L134-T138 WeakPolarHBondContact O-CB 3.4Å; L134-T138 PolarHBondContact O-N 3.15Å; L134-T138 PolarHBondContact O-OG1 3.49Å; L134-T164 HydrophobicContact CD2-CG2 3.91Å; L134-T164 HydrophobicContact CG-CG2 4.35Å; L134-F447 HydrophobicContact CD1-CZ 4.36Å; L134-F466 HydrophobicContact CB-CE1 4.13Å; L134-F466 HydrophobicContact CD2-CD1 4.32Å
135F95.3Very high94.5Very high108 Ų10828.5 Ų28.547%0.47414%0.144SC..Hα-helixtrans-64.4-46174.3171-104.7000111.3I131 W132 L137 T138 L139I131-F135 WeakPolarHBondContact O-CB 3.36Å; I131-F135 PolarHBondContact O-N 3.1Å; W132-F135 HydrophobicContact CE3-CD1 4.36Å; W132-F135 HydrophobicContact CZ3-CD1 4.32Å; W132-F135 PolarHBondContact O-N 2.94Å; F135-L137 PolarHBondContact O-N 2.65Å; F135-T138 WeakPolarHBondContact O-CA 3.36Å; F135-T138 VanDerWaalsContact O-CB 3.23Å; F135-T138 WeakPolarHBondContact O-CB 3.23Å; F135-T138 PolarHBondContact O-N 2.98Å; F135-T138 VanDerWaalsContact O-N 3.13Å; F135-L139 HydrophobicContact CD1-CD1 4.35Å; F135-L139 HydrophobicContact CE1-CD1 3.7Å; F135-L139 HydrophobicContact CE1-CG 4.29Å; F135-L139 HydrophobicContact CE2-CD2 4.33Å; F135-L139 HydrophobicContact CE2-CG 4.46Å; F135-L139 HydrophobicContact CZ-CD1 3.87Å; F135-L139 HydrophobicContact CZ-CD2 4.14Å; F135-L139 HydrophobicContact CZ-CG 4.15Å; F135-L139 PolarHBondContact O-N 3.4Å
136Y95.5Very high93.7Very high4 Ų434.4 Ų34.42%0.01617%0.17CC..Hα-helixtrans-64.3-43178.2-169.4-91.4000111.7V104 I107 Q108 W132 T138 L139 V140 V160V104-Y136 WeakPolarHBondContact CA-OH 3.42Å; V104-Y136 HydrophobicContact CG1-CE1 3.59Å; V104-Y136 VanDerWaalsContact O-CE1 3.29Å; V104-Y136 WeakPolarHBondContact O-CE1 3.39Å; V104-Y136 PolarHBondContact O-OH 3.42Å; I107-Y136 HydrophobicContact CG2-CE2 3.95Å; Q108-Y136 HydrophobicContact CB-CD1 3.59Å; Q108-Y136 HydrophobicContact CB-CE1 3.61Å; Q108-Y136 HydrophobicContact CB-CG 4.15Å; Q108-Y136 HydrophobicContact CG-CD1 3.58Å; Q108-Y136 HydrophobicContact CG-CE1 4.15Å; Q108-Y136 HydrophobicContact CG-CG 3.94Å; W132-Y136 AromaticContact CH2-CD2 3.66Å; W132-Y136 HydrophobicContact CH2-CD2 3.66Å; W132-Y136 HydrophobicContact CH2-CE2 4.33Å; W132-Y136 AromaticContact CZ2-CD2 3.65Å; W132-Y136 HydrophobicContact CZ2-CD2 3.65Å; W132-Y136 HydrophobicContact CZ2-CE2 4.29Å; W132-Y136 HydrophobicContact CZ2-CG 4.2Å; W132-Y136 VanDerWaalsContact O-CB 3.32Å; W132-Y136 WeakPolarHBondContact O-CB 3.33Å; W132-Y136 PolarHBondContact O-N 3.33Å; Y136-T138 VanDerWaalsContact C-N 3.26Å; Y136-T138 PolarHBondContact O-N 3.33Å; Y136-L139 WeakPolarHBondContact O-CB 3.49Å; Y136-L139 PolarHBondContact O-N 2.9Å; Y136-V140 HydrophobicContact CD1-CG2 4.37Å; Y136-V140 HydrophobicContact CE1-CG2 4.18Å; Y136-V140 PolarHBondContact O-N 3.49Å; Y136-V140 VanDerWaalsContact O-N 3.15Å; Y136-V160 HydrophobicContact CD1-CG1 4.42Å
137L96.1Very high93Very high2 Ų234.6 Ų34.61%0.0117%0.17CC..Hα-helixtrans-59-39.1172.1176.962.6000111.8S133 F135 L139 V140 H141 V160 M161 T164 W467S133-L137 WeakPolarHBondContact O-CB 3.2Å; S133-L137 PolarHBondContact O-N 2.89Å; F135-L137 PolarHBondContact O-N 2.65Å; L137-L139 VanDerWaalsContact C-N 3.35Å; L137-L139 PolarHBondContact O-N 2.94Å; L137-V140 PolarHBondContact O-N 3.28Å; L137-H141 WeakPolarHBondContact CD1-NE2 3.32Å; L137-H141 PolarHBondContact O-CD2 3.29Å; L137-H141 PolarHBondContact O-N 2.92Å; L137-V160 HydrophobicContact CB-CG1 4.27Å; L137-V160 HydrophobicContact CD1-CB 4.26Å; L137-V160 HydrophobicContact CD1-CG1 3.69Å; L137-M161 HydrophobicContact CD1-CG 3.64Å; L137-M161 HydrophobicContact CD2-CG 4.16Å; L137-T164 HydrophobicContact CD2-CG2 4.2Å; L137-W467 HydrophobicContact CD2-CG 4.37Å
138T93.8Very high92.3Very high22 Ų2231.7 Ų31.714%0.13515%0.153CC..Hα-helixtrans-59-45.1174.7-66.50000111.7L134 F135 Y136 V140 H141 V142 F466 F470L134-T138 WeakPolarHBondContact O-CB 3.4Å; L134-T138 PolarHBondContact O-N 3.15Å; L134-T138 PolarHBondContact O-OG1 3.49Å; F135-T138 WeakPolarHBondContact O-CA 3.36Å; F135-T138 VanDerWaalsContact O-CB 3.23Å; F135-T138 WeakPolarHBondContact O-CB 3.23Å; F135-T138 PolarHBondContact O-N 2.98Å; F135-T138 VanDerWaalsContact O-N 3.13Å; Y136-T138 VanDerWaalsContact C-N 3.26Å; Y136-T138 PolarHBondContact O-N 3.33Å; T138-V140 VanDerWaalsContact C-N 3.33Å; T138-V140 PolarHBondContact O-N 2.68Å; T138-H141 PolarHBondContact O-N 3.12Å; T138-V142 HydrophobicContact CG2-CG2 4.28Å; T138-V142 WeakPolarHBondContact O-CB 3.26Å; T138-V142 VanDerWaalsContact O-CG2 3.29Å; T138-V142 WeakPolarHBondContact O-CG2 3.26Å; T138-V142 PolarHBondContact O-N 2.86Å; T138-F466 VanDerWaalsContact OG1-CE1 3.3Å; T138-F466 WeakPolarHBondContact OG1-CE1 3.42Å; T138-F466 WeakPolarHBondContact OG1-CZ 3.16Å; T138-F470 HydrophobicContact CG2-CD2 4.41Å; T138-F470 HydrophobicContact CG2-CE1 4.49Å; T138-F470 HydrophobicContact CG2-CE2 3.36Å; T138-F470 HydrophobicContact CG2-CZ 3.38Å
139L92.4Very high91.6Very high41 Ų4135.2 Ų35.222%0.21516%0.163CC..Hα-helixtrans-58.9-45.9176.3-63.5177.1000111.1F9 F135 Y136 L137 H141 V142 C143F9-L139 HydrophobicContact CD2-CD1 4.41Å; F9-L139 HydrophobicContact CE1-CB 3.96Å; F9-L139 HydrophobicContact CE2-CB 4.22Å; F9-L139 HydrophobicContact CE2-CD1 3.73Å; F9-L139 HydrophobicContact CZ-CB 3.65Å; F9-L139 HydrophobicContact CZ-CD1 4Å; F9-L139 HydrophobicContact CZ-CG 4.46Å; F135-L139 HydrophobicContact CD1-CD1 4.35Å; F135-L139 HydrophobicContact CE1-CD1 3.7Å; F135-L139 HydrophobicContact CE1-CG 4.29Å; F135-L139 HydrophobicContact CE2-CD2 4.33Å; F135-L139 HydrophobicContact CE2-CG 4.46Å; F135-L139 HydrophobicContact CZ-CD1 3.87Å; F135-L139 HydrophobicContact CZ-CD2 4.14Å; F135-L139 HydrophobicContact CZ-CG 4.15Å; F135-L139 PolarHBondContact O-N 3.4Å; Y136-L139 WeakPolarHBondContact O-CB 3.49Å; Y136-L139 PolarHBondContact O-N 2.9Å; L137-L139 VanDerWaalsContact C-N 3.35Å; L137-L139 PolarHBondContact O-N 2.94Å; L139-H141 PolarHBondContact O-N 3.33Å; L139-V142 PolarHBondContact O-N 3.15Å; L139-C143 PolarHBondContact O-N 2.84Å; L139-C143 PolarHBondContact O-SG 3.43Å
140V92.3Very high90.7Very high0 Ų035.9 Ų35.90%017%0.17CC..Hα-helixtrans-60.6-44.8177.3176.90000111.6M14 V104 Y136 L137 T138 C143 R144 I156 V160M14-V140 HydrophobicContact CE-CG1 4.19Å; M14-V140 HydrophobicContact SD-CG1 4.31Å; M14-V140 HydrophobicContact SD-CG2 4.28Å; V104-V140 HydrophobicContact CG1-CG2 3.76Å; Y136-V140 HydrophobicContact CD1-CG2 4.37Å; Y136-V140 HydrophobicContact CE1-CG2 4.18Å; Y136-V140 PolarHBondContact O-N 3.49Å; Y136-V140 VanDerWaalsContact O-N 3.15Å; L137-V140 PolarHBondContact O-N 3.28Å; T138-V140 VanDerWaalsContact C-N 3.33Å; T138-V140 PolarHBondContact O-N 2.68Å; V140-C143 WeakPolarHBondContact O-CB 3.17Å; V140-C143 PolarHBondContact O-N 3.5Å; V140-R144 PolarHBondContact O-N 2.82Å; V140-I156 HydrophobicContact CG1-CG2 4.48Å; V140-V160 HydrophobicContact CG2-CG1 4.43Å
141H92Very high89.9Confident13 Ų1335.9 Ų35.96%0.0617%0.171CC..Hα-helixtrans-63.3-42.8177-76.7-41.9000112.7L137 T138 L139 C143 R144 L145 W467 H468 G469 F470L137-H141 WeakPolarHBondContact CD1-NE2 3.32Å; L137-H141 PolarHBondContact O-CD2 3.29Å; L137-H141 PolarHBondContact O-N 2.92Å; T138-H141 PolarHBondContact O-N 3.12Å; L139-H141 PolarHBondContact O-N 3.33Å; H141-C143 VanDerWaalsContact C-N 3.3Å; H141-C143 PolarHBondContact O-N 3.1Å; H141-R144 PolarHBondContact O-N 2.9Å; H141-L145 WeakPolarHBondContact O-CG 3.39Å; H141-L145 PolarHBondContact O-N 3.44Å; H141-W467 PolarHBondContact NE2-O 2.86Å; H141-H468 PolarHBondContact CE1-O 2.98Å; H141-H468 PolarHBondContact NE2-O 2.72Å; H141-G469 VanDerWaalsContact CD2-CA 3.49Å; H141-G469 WeakPolarHBondContact CD2-CA 3.4Å; H141-F470 HydrophobicContact CB-CD2 4.22Å
142V89.7Confident89Confident45 Ų4535.1 Ų35.127%0.27316%0.163SC..Hα-helixtrans-64.1-36.7176171.30000111.1L6 T138 L139 K146 F470L6-V142 HydrophobicContact CD2-CG1 3.68Å; T138-V142 HydrophobicContact CG2-CG2 4.28Å; T138-V142 WeakPolarHBondContact O-CB 3.26Å; T138-V142 VanDerWaalsContact O-CG2 3.29Å; T138-V142 WeakPolarHBondContact O-CG2 3.26Å; T138-V142 PolarHBondContact O-N 2.86Å; L139-V142 PolarHBondContact O-N 3.15Å; V142-K146 PolarHBondContact O-N 3.14Å; V142-F470 HydrophobicContact CG2-CD2 4.4Å
143C87.4Confident88.4Confident0 Ų034 Ų340%016%0.161CC..Hα-helixtrans-62.9-49172.1-66.70000111.3F9 N10 M14 L139 V140 H141 L145 K146 Y147F9-C143 WeakPolarHBondContact CD1-SG 3.49Å; F9-C143 VanDerWaalsContact CE1-SG 3.51Å; N10-C143 VanDerWaalsContact OD1-CB 3.31Å; N10-C143 WeakPolarHBondContact OD1-CB 3.44Å; N10-C143 PolarHBondContact OD1-SG 3.36Å; M14-C143 HydrophobicContact CG-CB 4.15Å; L139-C143 PolarHBondContact O-N 2.84Å; L139-C143 PolarHBondContact O-SG 3.43Å; V140-C143 WeakPolarHBondContact O-CB 3.17Å; V140-C143 PolarHBondContact O-N 3.5Å; H141-C143 VanDerWaalsContact C-N 3.3Å; H141-C143 PolarHBondContact O-N 3.1Å; C143-L145 VanDerWaalsContact C-N 3.31Å; C143-L145 PolarHBondContact O-N 3.17Å; C143-K146 WeakPolarHBondContact O-CB 3.23Å; C143-K146 PolarHBondContact O-N 2.94Å; C143-Y147 VanDerWaalsContact C-CD1 3.44Å; C143-Y147 VanDerWaalsContact C-CE1 3.4Å; C143-Y147 HydrophobicContact CB-CD1 4.41Å; C143-Y147 HydrophobicContact CB-CE1 4.04Å; C143-Y147 WeakPolarHBondContact O-CD1 3.48Å; C143-Y147 WeakPolarHBondContact O-CE1 3.5Å; C143-Y147 PolarHBondContact O-N 3.4Å
144R86.7Confident87.9Confident34 Ų3436 Ų3613%0.12817%0.171CC..Hα-helixtrans-58.1-42.2178.9-170.9-175.6178.2132.61.1112.4V140 H141 K146 Y147 D148 G151 T153 D155 S157V140-R144 PolarHBondContact O-N 2.82Å; H141-R144 PolarHBondContact O-N 2.9Å; R144-K146 PolarHBondContact O-N 2.96Å; R144-K146 VanDerWaalsContact O-N 3.12Å; R144-Y147 VanDerWaalsContact CA-CZ 3.45Å; R144-Y147 HydrophobicContact CB-CE1 4.18Å; R144-Y147 HydrophobicContact CB-CE2 4.39Å; R144-Y147 HydrophobicContact CG-CE2 4.06Å; R144-Y147 PolarHBondContact O-N 3.48Å; R144-D148 IonicContact NH2-OD2 3.77Å; R144-D148 CarbonylContact O-C 3.55Å; R144-D148 PolarHBondContact O-N 3Å; R144-G151 PolarHBondContact NH2-O 2.98Å; R144-T153 PolarHBondContact NH2-O 3.14Å; R144-D155 WeakPolarHBondContact CD-OD2 3.48Å; R144-D155 WeakPolarHBondContact CG-OD2 3.43Å; R144-D155 IonicContact CZ-OD1 2.9Å; R144-D155 IonicContact CZ-OD2 3.59Å; R144-D155 IonicContact NE-OD2 3.28Å; R144-D155 IonicContact NH1-OD1 3.51Å; R144-D155 PolarHBondContact NH1-OD1 3.03Å; R144-D155 IonicContact NH1-OD2 2.64Å; R144-D155 PolarHBondContact NH1-OD2 3.24Å; R144-S157 PolarHBondContact NH1-OG 3.03Å
145L86.2Confident87.5Confident35 Ų3535 Ų3518%0.18317%0.166CC..Hα-helixtrans-55.2-29.5174.3-77.1170000113.2H141 C143 Y149 F470 Y471H141-L145 WeakPolarHBondContact O-CG 3.39Å; H141-L145 PolarHBondContact O-N 3.44Å; C143-L145 VanDerWaalsContact C-N 3.31Å; C143-L145 PolarHBondContact O-N 3.17Å; L145-Y149 HydrophobicContact CD2-CD2 3.63Å; L145-Y149 HydrophobicContact CD2-CE2 3.64Å; L145-Y149 WeakPolarHBondContact O-CB 3.29Å; L145-F470 HydrophobicContact CD1-CB 3.88Å; L145-Y471 HydrophobicContact CD2-CD1 3.58Å; L145-Y471 HydrophobicContact CD2-CD2 3.97Å; L145-Y471 HydrophobicContact CD2-CE1 3.21Å; L145-Y471 HydrophobicContact CD2-CE2 3.62Å; L145-Y471 HydrophobicContact CD2-CG 3.97Å; L145-Y471 HydrophobicContact CG-CE2 4.38Å
146K82.9Confident87.3Confident125 Ų12529.9 Ų29.954%0.54314%0.144SC..Hα-helixtrans-84.6-36.8179.9-69.2-169.6171.5-162.90114L6 V142 C143 R144L6-K146 HydrophobicContact CD2-CD 3.77Å; L6-K146 HydrophobicContact CG-CD 4.43Å; V142-K146 PolarHBondContact O-N 3.14Å; C143-K146 WeakPolarHBondContact O-CB 3.23Å; C143-K146 PolarHBondContact O-N 2.94Å; R144-K146 PolarHBondContact O-N 2.96Å; R144-K146 VanDerWaalsContact O-N 3.12Å
147Y81.6Confident87.1Confident3 Ų330 Ų301%0.01215%0.145CC..Hα-helixtrans-100.5-18.5-172.967.5-111000114.6M14 L16 L19 P26 F31 C143 R144 D155M14-Y147 HydrophobicContact CE-CE1 4.03Å; M14-Y147 WeakPolarHBondContact CE-OH 3.46Å; L16-Y147 HydrophobicContact CD1-CD1 3.39Å; L16-Y147 HydrophobicContact CD1-CD2 4.37Å; L16-Y147 HydrophobicContact CD1-CE1 3.53Å; L16-Y147 HydrophobicContact CD1-CG 3.87Å; L19-Y147 VanDerWaalsContact CD1-CB 3.44Å; P26-Y147 VanDerWaalsContact CB-O 3.3Å; P26-Y147 WeakPolarHBondContact CB-O 3.48Å; F31-Y147 HydrophobicContact CB-CD2 4.22Å; F31-Y147 AromaticContact CD1-CD2 3.7Å; F31-Y147 HydrophobicContact CD1-CD2 3.7Å; F31-Y147 AromaticContact CD1-CE2 3.84Å; F31-Y147 HydrophobicContact CD1-CE2 3.84Å; F31-Y147 HydrophobicContact CD2-CD2 4.4Å; F31-Y147 AromaticContact CD2-CE2 3.98Å; F31-Y147 HydrophobicContact CD2-CE2 3.98Å; F31-Y147 HydrophobicContact CE1-CD2 4.15Å; F31-Y147 AromaticContact CE1-CE2 3.91Å; F31-Y147 HydrophobicContact CE1-CE2 3.91Å; F31-Y147 HydrophobicContact CE2-CE2 4.06Å; F31-Y147 AromaticContact CG-CD2 3.85Å; F31-Y147 HydrophobicContact CG-CD2 3.85Å; F31-Y147 AromaticContact CG-CE2 3.87Å; F31-Y147 HydrophobicContact CG-CE2 3.87Å; F31-Y147 HydrophobicContact CZ-CE2 4.02Å; C143-Y147 VanDerWaalsContact C-CD1 3.44Å; C143-Y147 VanDerWaalsContact C-CE1 3.4Å; C143-Y147 HydrophobicContact CB-CD1 4.41Å; C143-Y147 HydrophobicContact CB-CE1 4.04Å; C143-Y147 WeakPolarHBondContact O-CD1 3.48Å; C143-Y147 WeakPolarHBondContact O-CE1 3.5Å; C143-Y147 PolarHBondContact O-N 3.4Å; R144-Y147 VanDerWaalsContact CA-CZ 3.45Å; R144-Y147 HydrophobicContact CB-CE1 4.18Å; R144-Y147 HydrophobicContact CB-CE2 4.39Å; R144-Y147 HydrophobicContact CG-CE2 4.06Å; R144-Y147 PolarHBondContact O-N 3.48Å; Y147-D155 PolarHBondContact OH-OD2 3.01Å
148D82.1Confident87Confident7 Ų730.9 Ų30.94%0.03716%0.155CC..SBendtrans-152.958-178.6-168.541.7000110.7R28 F31 R144 G150 G151R28-D148 WeakPolarHBondContact CG-OD1 3.32Å; F31-D148 HydrophobicContact CD1-CB 4.08Å; F31-D148 HydrophobicContact CE1-CB 3.73Å; F31-D148 WeakPolarHBondContact CE1-OD2 3.41Å; R144-D148 IonicContact NH2-OD2 3.77Å; R144-D148 CarbonylContact O-C 3.55Å; R144-D148 PolarHBondContact O-N 3Å; D148-G150 PolarHBondContact O-N 3.38Å; D148-G151 PolarHBondContact O-N 2.77Å; D148-G151 VanDerWaalsContact O-N 3.08Å; D148-G151 WeakPolarHBondContact OD1-CA 3.27Å; D148-G151 VanDerWaalsContact OD2-CA 3.27Å; D148-G151 WeakPolarHBondContact OD2-CA 3.28Å
149Y83.1Confident87.1Confident124 Ų12430.1 Ų30.149%0.48615%0.15SC..THydrogen-bonded Turntrans-60.6121.9178.6-169.7-85.5000110.5L145 G151 Y471L145-Y149 HydrophobicContact CD2-CD2 3.63Å; L145-Y149 HydrophobicContact CD2-CE2 3.64Å; L145-Y149 WeakPolarHBondContact O-CB 3.29Å; Y149-G151 PolarHBondContact O-N 2.92Å; Y149-Y471 WeakPolarHBondContact CA-OH 3.36Å; Y149-Y471 HydrophobicContact CD1-CE1 4.23Å; Y149-Y471 HydrophobicContact CD2-CD1 4.46Å; Y149-Y471 AromaticContact CD2-CE1 3.65Å; Y149-Y471 HydrophobicContact CD2-CE1 3.65Å; Y149-Y471 HydrophobicContact CE1-CD1 4.5Å; Y149-Y471 HydrophobicContact CE1-CE1 4.06Å; Y149-Y471 AromaticContact CE2-CD1 3.82Å; Y149-Y471 HydrophobicContact CE2-CD1 3.82Å; Y149-Y471 AromaticContact CE2-CE1 3.45Å; Y149-Y471 HydrophobicContact CE2-CE1 3.45Å; Y149-Y471 VanDerWaalsContact CE2-CE1 3.45Å; Y149-Y471 HydrophobicContact CG-CE1 4.04Å; Y149-Y471 AromaticContact CZ-CD1 3.84Å; Y149-Y471 AromaticContact CZ-CE1 3.68Å
150G80.1Confident87.2Confident14 Ų1428.2 Ų28.214%0.14414%0.14CC..THydrogen-bonded Turntrans71.36.1-178.300000115R28 D148 Y471R28-G150 PolarHBondContact NH2-O 3.42Å; D148-G150 PolarHBondContact O-N 3.38Å; G150-Y471 PolarHBondContact N-OH 3.48Å
151G80.3Confident87.4Confident7 Ų729.2 Ų29.27%0.07215%0.145CC..  trans-79.7145.2179.500000114.2R144 D148 Y149R144-G151 PolarHBondContact NH2-O 2.98Å; D148-G151 PolarHBondContact O-N 2.77Å; D148-G151 VanDerWaalsContact O-N 3.08Å; D148-G151 WeakPolarHBondContact OD1-CA 3.27Å; D148-G151 VanDerWaalsContact OD2-CA 3.27Å; D148-G151 WeakPolarHBondContact OD2-CA 3.28Å; Y149-G151 PolarHBondContact O-N 2.92Å
152Y79.5Confident87.6Confident84 Ų8429.1 Ų29.133%0.32915%0.145SC..  trans-103.59.8179.1-76.3-89.5000112.8L154 H529Y152-L154 PolarHBondContact O-N 3.13Å; Y152-H529 PolarHBondContact OH-O 3.46Å
153T85.1Confident88Confident20 Ų2027.1 Ų27.112%0.12313%0.133CC..  trans-62.2135.5174.4-57.30000109.3G29 F31 Y32 D50 R144 D155G29-T153 VanDerWaalsContact CA-OG1 3.23Å; G29-T153 WeakPolarHBondContact CA-OG1 3.3Å; F31-T153 HydrophobicContact CE1-CG2 3.88Å; F31-T153 HydrophobicContact CE2-CG2 4.31Å; F31-T153 HydrophobicContact CZ-CG2 3.54Å; Y32-T153 HydrophobicContact CD2-CG2 4.47Å; Y32-T153 HydrophobicContact CG-CG2 4.45Å; D50-T153 HydrophobicContact CB-CG2 4.32Å; R144-T153 PolarHBondContact NH2-O 3.14Å; T153-D155 PolarHBondContact O-N 3.44Å
154L86.1Confident88.5Confident43 Ų4327.1 Ų27.123%0.22513%0.133CC..  trans-62.5131.4174.5-82.790.6000109.5D50 Q51 Y54 Y152D50-L154 HydrophobicContact CB-CB 4.2Å; D50-L154 VanDerWaalsContact OD2-CD1 3.27Å; D50-L154 WeakPolarHBondContact OD2-CD1 3.4Å; D50-L154 PolarHBondContact OD2-N 3.33Å; Q51-L154 HydrophobicContact CG-CD1 3.74Å; Y54-L154 HydrophobicContact CD2-CD2 3.89Å; Y54-L154 HydrophobicContact CG-CD2 3.84Å; Y152-L154 PolarHBondContact O-N 3.13Å
155D88.4Confident89Confident5 Ų525.6 Ų25.63%0.02713%0.127CC..  trans-137.3176.2172.178.50.9000110.7F31 F98 R144 Y147 T153 S157F31-D155 HydrophobicContact CE2-CB 3.68Å; F31-D155 HydrophobicContact CZ-CB 3.94Å; F98-D155 VanDerWaalsContact CE1-C 3.45Å; F98-D155 WeakPolarHBondContact CE1-O 3.38Å; R144-D155 WeakPolarHBondContact CD-OD2 3.48Å; R144-D155 WeakPolarHBondContact CG-OD2 3.43Å; R144-D155 IonicContact CZ-OD1 2.9Å; R144-D155 IonicContact CZ-OD2 3.59Å; R144-D155 IonicContact NE-OD2 3.28Å; R144-D155 IonicContact NH1-OD1 3.51Å; R144-D155 PolarHBondContact NH1-OD1 3.03Å; R144-D155 IonicContact NH1-OD2 2.64Å; R144-D155 PolarHBondContact NH1-OD2 3.24Å; Y147-D155 PolarHBondContact OH-OD2 3.01Å; T153-D155 PolarHBondContact O-N 3.44Å; D155-S157 PolarHBondContact O-N 3.4Å; D155-S157 VanDerWaalsContact O-N 3.09Å; D155-S157 WeakPolarHBondContact OD1-CA 3.3Å; D155-S157 WeakPolarHBondContact OD1-CB 3.22Å; D155-S157 PolarHBondContact OD1-N 3.26Å; D155-S157 PolarHBondContact OD1-OG 3.13Å
156I91.6Very high89.5Confident0 Ų024.1 Ų24.10%012%0.119CC..THydrogen-bonded Turntrans-62.9-13.5-179.4-159.565.7000114M14 F98 Q101 V104 L105 V140 G158 P159 V160M14-I156 HydrophobicContact CE-CG2 3.82Å; M14-I156 HydrophobicContact SD-CG2 4.4Å; F98-I156 HydrophobicContact CB-CD1 3.98Å; F98-I156 HydrophobicContact CD2-CD1 3.73Å; F98-I156 HydrophobicContact CE2-CD1 4.29Å; F98-I156 HydrophobicContact CG-CD1 3.87Å; Q101-I156 HydrophobicContact CB-CB 3.86Å; Q101-I156 HydrophobicContact CB-CD1 4.41Å; Q101-I156 HydrophobicContact CB-CG1 4.13Å; Q101-I156 HydrophobicContact CB-CG2 4.09Å; V104-I156 HydrophobicContact CB-CG1 4.2Å; V104-I156 HydrophobicContact CB-CG2 4.38Å; V104-I156 HydrophobicContact CG1-CG2 4.31Å; V104-I156 HydrophobicContact CG2-CG2 4.37Å; L105-I156 HydrophobicContact CD1-CD1 3.7Å; L105-I156 HydrophobicContact CD1-CG1 4.48Å; L105-I156 HydrophobicContact CG-CD1 3.96Å; L105-I156 HydrophobicContact CG-CG1 4.21Å; V140-I156 HydrophobicContact CG1-CG2 4.48Å; I156-G158 VanDerWaalsContact C-N 3.31Å; I156-G158 PolarHBondContact O-N 3.49Å; I156-P159 HydrophobicContact CD1-CB 4.28Å; I156-P159 HydrophobicContact CD1-CG 4.23Å; I156-P159 VanDerWaalsContact O-CD 3.24Å; I156-P159 WeakPolarHBondContact O-CD 3.41Å; I156-V160 HydrophobicContact CG1-CG2 4.21Å; I156-V160 WeakPolarHBondContact O-CG2 3.47Å; I156-V160 PolarHBondContact O-N 3.39Å
157S92.6Very high90.3Very high7 Ų718.1 Ų18.15%0.0499%0.093CC..Hα-helixtrans-63.3-36.2-177.9760000111.9R144 D155 V160 M161R144-S157 PolarHBondContact NH1-OG 3.03Å; D155-S157 PolarHBondContact O-N 3.4Å; D155-S157 VanDerWaalsContact O-N 3.09Å; D155-S157 WeakPolarHBondContact OD1-CA 3.3Å; D155-S157 WeakPolarHBondContact OD1-CB 3.22Å; D155-S157 PolarHBondContact OD1-N 3.26Å; D155-S157 PolarHBondContact OD1-OG 3.13Å; S157-V160 PolarHBondContact O-N 2.86Å; S157-M161 WeakPolarHBondContact O-CB 3.4Å; S157-M161 VanDerWaalsContact O-CG 3.24Å; S157-M161 WeakPolarHBondContact O-CG 3.48Å; S157-M161 PolarHBondContact O-N 2.92Å
158G93Very high91.1Very high20 Ų2018 Ų1821%0.2069%0.093CC..Hα-helixtrans-57.2-54.617400000112.9I156 V160 M161 V162 F297I156-G158 VanDerWaalsContact C-N 3.31Å; I156-G158 PolarHBondContact O-N 3.49Å; G158-V160 VanDerWaalsContact C-N 3.35Å; G158-V160 PolarHBondContact O-N 3.15Å; G158-M161 WeakPolarHBondContact O-CB 3.41Å; G158-M161 PolarHBondContact O-N 3.3Å; G158-V162 PolarHBondContact O-N 3.21Å; G158-F297 CarbonylContact C-O 3.49Å
159P95.2Very high91.8Very high6 Ų617.7 Ų17.74%0.0399%0.091CC..Hα-helixtrans-55.6-42.5171.4-28.531.6000114.4F98 L105 I156 M161 V162 Q163 F297F98-P159 HydrophobicContact CD2-CG 4.34Å; F98-P159 HydrophobicContact CE2-CG 3.43Å; F98-P159 VanDerWaalsContact CE2-CG 3.43Å; F98-P159 HydrophobicContact CZ-CG 3.61Å; L105-P159 HydrophobicContact CD1-CB 3.83Å; L105-P159 HydrophobicContact CD2-CB 3.91Å; L105-P159 HydrophobicContact CG-CB 4.38Å; I156-P159 HydrophobicContact CD1-CB 4.28Å; I156-P159 HydrophobicContact CD1-CG 4.23Å; I156-P159 VanDerWaalsContact O-CD 3.24Å; I156-P159 WeakPolarHBondContact O-CD 3.41Å; P159-M161 VanDerWaalsContact C-N 3.31Å; P159-M161 PolarHBondContact O-N 3.42Å; P159-V162 PolarHBondContact O-N 3.18Å; P159-Q163 WeakPolarHBondContact O-CB 3.26Å; P159-Q163 PolarHBondContact O-N 3.15Å; P159-F297 VanDerWaalsContact CA-O 3.28Å; P159-F297 WeakPolarHBondContact CA-O 3.48Å; P159-F297 WeakPolarHBondContact CD-O 3.44Å; P159-F297 VanDerWaalsContact CG-O 3.27Å; P159-F297 WeakPolarHBondContact CG-O 3.1Å; P159-F297 VanDerWaalsContact N-O 3.13Å
160V95.9Very high92.6Very high0 Ų011.8 Ų11.80%07%0.068CC..Hα-helixtrans-65.3-36.2179.2175.50000110.9V104 L105 Y136 L137 V140 I156 S157 G158 Q163 T164V104-V160 HydrophobicContact CG1-CG2 3.73Å; L105-V160 HydrophobicContact CD2-CB 4.33Å; L105-V160 HydrophobicContact CD2-CG2 3.63Å; L105-V160 HydrophobicContact CG-CG2 4.35Å; Y136-V160 HydrophobicContact CD1-CG1 4.42Å; L137-V160 HydrophobicContact CB-CG1 4.27Å; L137-V160 HydrophobicContact CD1-CB 4.26Å; L137-V160 HydrophobicContact CD1-CG1 3.69Å; V140-V160 HydrophobicContact CG2-CG1 4.43Å; I156-V160 HydrophobicContact CG1-CG2 4.21Å; I156-V160 WeakPolarHBondContact O-CG2 3.47Å; I156-V160 PolarHBondContact O-N 3.39Å; S157-V160 PolarHBondContact O-N 2.86Å; G158-V160 VanDerWaalsContact C-N 3.35Å; G158-V160 PolarHBondContact O-N 3.15Å; V160-Q163 PolarHBondContact O-N 2.88Å; V160-T164 WeakPolarHBondContact O-CB 3.39Å; V160-T164 PolarHBondContact O-N 3.34Å; V160-T164 PolarHBondContact O-OG1 3.29Å
161M96.5Very high93.4Very high22 Ų2211.1 Ų11.111%0.1086%0.061CC..Hα-helixtrans-60.7-45.7174.3-76.217771.800111.2L137 S157 G158 P159 T164 Q165 W467L137-M161 HydrophobicContact CD1-CG 3.64Å; L137-M161 HydrophobicContact CD2-CG 4.16Å; S157-M161 WeakPolarHBondContact O-CB 3.4Å; S157-M161 VanDerWaalsContact O-CG 3.24Å; S157-M161 WeakPolarHBondContact O-CG 3.48Å; S157-M161 PolarHBondContact O-N 2.92Å; G158-M161 WeakPolarHBondContact O-CB 3.41Å; G158-M161 PolarHBondContact O-N 3.3Å; P159-M161 VanDerWaalsContact C-N 3.31Å; P159-M161 PolarHBondContact O-N 3.42Å; M161-T164 WeakPolarHBondContact O-CB 3.24Å; M161-T164 PolarHBondContact O-N 3.42Å; M161-Q165 WeakPolarHBondContact O-CG 3.48Å; M161-Q165 PolarHBondContact O-N 2.83Å; M161-W467 HydrophobicContact CB-CZ2 3.66Å; M161-W467 HydrophobicContact CE-CD2 3.55Å; M161-W467 HydrophobicContact CE-CE3 3.48Å; M161-W467 VanDerWaalsContact CE-CE3 3.48Å; M161-W467 HydrophobicContact CE-CG 4.39Å; M161-W467 HydrophobicContact CE-CH2 3.47Å; M161-W467 VanDerWaalsContact CE-CH2 3.47Å; M161-W467 HydrophobicContact CE-CZ2 3.52Å; M161-W467 HydrophobicContact CE-CZ3 3.44Å; M161-W467 VanDerWaalsContact CE-CZ3 3.44Å; M161-W467 WeakPolarHBondContact CE-O 3.49Å; M161-W467 HydrophobicContact CG-CZ2 4.41Å; M161-W467 PolarHBondContact O-NE1 3.05Å
162V95.9Very high94.3Very high11 Ų1111.5 Ų11.57%0.0676%0.061CC..Hα-helixtrans-69.2-40.4177178.80000111.4G158 P159 T164 Q165 R166 F301G158-V162 PolarHBondContact O-N 3.21Å; P159-V162 PolarHBondContact O-N 3.18Å; V162-T164 VanDerWaalsContact C-N 3.29Å; V162-T164 PolarHBondContact O-N 2.68Å; V162-Q165 WeakPolarHBondContact O-CB 3.36Å; V162-Q165 PolarHBondContact O-N 3.42Å; V162-Q165 VanDerWaalsContact O-N 3.09Å; V162-R166 PolarHBondContact O-N 3.29Å; V162-F301 HydrophobicContact CG1-CB 4.47Å
163Q97.1Very high95.1Very high2 Ų27.6 Ų7.61%0.0095%0.046CC..Hα-helixtrans-62.1-38.2176.7-173.2170.283.400111.6L105 P159 V160 Q165 R166 L167 M290L105-Q163 HydrophobicContact CD2-CB 4.11Å; L105-Q163 PolarHBondContact O-NE2 2.93Å; L105-Q163 PolarHBondContact O-OE1 3.24Å; P159-Q163 WeakPolarHBondContact O-CB 3.26Å; P159-Q163 PolarHBondContact O-N 3.15Å; V160-Q163 PolarHBondContact O-N 2.88Å; Q163-Q165 VanDerWaalsContact C-N 3.25Å; Q163-Q165 PolarHBondContact O-N 2.81Å; Q163-R166 PolarHBondContact O-N 3.34Å; Q163-R166 VanDerWaalsContact O-N 3.12Å; Q163-L167 HydrophobicContact CG-CD1 3.95Å; Q163-L167 HydrophobicContact CG-CG 4.16Å; Q163-L167 WeakPolarHBondContact O-CB 3.41Å; Q163-L167 WeakPolarHBondContact O-CG 3.34Å; Q163-L167 PolarHBondContact O-N 2.9Å; Q163-M290 HydrophobicContact CG-SD 3.77Å
164T97.7Very high95.7Very high0 Ų06.7 Ų6.70%04%0.04CC..Hα-helixtrans-57.9-39.1173.5-610000111.6Q108 L134 L137 V160 M161 V162 S168Q108-T164 PolarHBondContact NE2-OG1 3.37Å; Q108-T164 VanDerWaalsContact NE2-OG1 3.08Å; L134-T164 HydrophobicContact CD2-CG2 3.91Å; L134-T164 HydrophobicContact CG-CG2 4.35Å; L137-T164 HydrophobicContact CD2-CG2 4.2Å; V160-T164 WeakPolarHBondContact O-CB 3.39Å; V160-T164 PolarHBondContact O-N 3.34Å; V160-T164 PolarHBondContact O-OG1 3.29Å; M161-T164 WeakPolarHBondContact O-CB 3.24Å; M161-T164 PolarHBondContact O-N 3.42Å; V162-T164 VanDerWaalsContact C-N 3.29Å; V162-T164 PolarHBondContact O-N 2.68Å; T164-S168 WeakPolarHBondContact O-CB 3.48Å; T164-S168 PolarHBondContact O-N 3.07Å; T164-S168 VanDerWaalsContact O-N 3.12Å; T164-S168 PolarHBondContact O-OG 2.85Å
165Q98Very high96.2Very high2 Ų24.9 Ų4.91%0.0093%0.031CC..Hα-helixtrans-66.4-44.8174.9-57.3177-35.300111.3M161 V162 Q163 S168 S169 F301 T439 W442 W467M161-Q165 WeakPolarHBondContact O-CG 3.48Å; M161-Q165 PolarHBondContact O-N 2.83Å; V162-Q165 WeakPolarHBondContact O-CB 3.36Å; V162-Q165 PolarHBondContact O-N 3.42Å; V162-Q165 VanDerWaalsContact O-N 3.09Å; Q163-Q165 VanDerWaalsContact C-N 3.25Å; Q163-Q165 PolarHBondContact O-N 2.81Å; Q165-S168 PolarHBondContact O-OG 3.43Å; Q165-S169 VanDerWaalsContact O-CB 3.23Å; Q165-S169 WeakPolarHBondContact O-CB 3.33Å; Q165-S169 PolarHBondContact O-N 2.84Å; Q165-S169 PolarHBondContact O-OG 3.48Å; Q165-F301 HydrophobicContact CB-CB 4.4Å; Q165-F301 HydrophobicContact CB-CD2 3.58Å; Q165-F301 HydrophobicContact CB-CE2 4.05Å; Q165-F301 HydrophobicContact CB-CG 4.02Å; Q165-T439 PolarHBondContact NE2-OG1 2.9Å; Q165-W442 HydrophobicContact CB-CB 4.38Å; Q165-W442 HydrophobicContact CB-CD2 4Å; Q165-W442 HydrophobicContact CB-CG 3.86Å; Q165-W442 HydrophobicContact CG-CD2 3.56Å; Q165-W442 HydrophobicContact CG-CE3 3.7Å; Q165-W442 HydrophobicContact CG-CG 3.92Å; Q165-W442 HydrophobicContact CG-CH2 4.35Å; Q165-W442 HydrophobicContact CG-CZ2 4.22Å; Q165-W442 HydrophobicContact CG-CZ3 4.1Å; Q165-W442 VanDerWaalsContact NE2-CE3 3.35Å; Q165-W467 HydrophobicContact CG-CZ2 4.24Å
166R97.9Very high96.6Very high4 Ų45.1 Ų5.12%0.0153%0.032CC..Hα-helixtrans-61-47.8177.7-66.4-175-176.5146.69.5112.5V162 Q163 L170 Y289 M290 Y292 G295 F301V162-R166 PolarHBondContact O-N 3.29Å; Q163-R166 PolarHBondContact O-N 3.34Å; Q163-R166 VanDerWaalsContact O-N 3.12Å; R166-L170 VanDerWaalsContact O-CB 3.26Å; R166-L170 WeakPolarHBondContact O-CB 3.24Å; R166-L170 PolarHBondContact O-N 3.5Å; R166-Y289 HydrophobicContact CB-CE1 3.73Å; R166-Y289 WeakPolarHBondContact CD-O 3.38Å; R166-Y289 HydrophobicContact CG-CE1 4.13Å; R166-Y289 HydrophobicContact CG-CE2 4.31Å; R166-Y289 PolarHBondContact NH1-O 3.09Å; R166-M290 HydrophobicContact CB-CE 3.69Å; R166-M290 HydrophobicContact CB-SD 4.17Å; R166-M290 PolarHBondContact NH1-O 3.38Å; R166-Y292 PolarHBondContact NH2-OH 3.25Å; R166-G295 PolarHBondContact NH2-O 3.37Å; R166-F301 HydrophobicContact CG-CD2 3.92Å; R166-F301 HydrophobicContact CG-CE2 4.29Å
167L98.3Very high96.7Very high0 Ų05.2 Ų5.20%03%0.033CC..Hα-helixtrans-65.1-51-178.1-69.4173.8000111.8Q108 A112 M116 V129 Q163 L170 A171 F286 M290Q108-L167 HydrophobicContact CG-CD1 3.91Å; A112-L167 HydrophobicContact CB-CD1 3.84Å; A112-L167 HydrophobicContact CB-CD2 3.67Å; A112-L167 HydrophobicContact CB-CG 4.22Å; M116-L167 HydrophobicContact CE-CD2 4.23Å; V129-L167 HydrophobicContact CG1-CB 4.26Å; Q163-L167 HydrophobicContact CG-CD1 3.95Å; Q163-L167 HydrophobicContact CG-CG 4.16Å; Q163-L167 WeakPolarHBondContact O-CB 3.41Å; Q163-L167 WeakPolarHBondContact O-CG 3.34Å; Q163-L167 PolarHBondContact O-N 2.9Å; L167-L170 PolarHBondContact O-N 2.88Å; L167-A171 WeakPolarHBondContact O-CB 3.34Å; L167-A171 PolarHBondContact O-N 2.81Å; L167-A171 VanDerWaalsContact O-N 3.07Å; L167-F286 HydrophobicContact CD2-CE2 4Å; L167-F286 HydrophobicContact CD2-CZ 3.69Å; L167-M290 HydrophobicContact CD2-CE 3.71Å; L167-M290 HydrophobicContact CD2-SD 3.53Å; L167-M290 VanDerWaalsContact CD2-SD 3.53Å; L167-M290 HydrophobicContact CG-CE 4.27Å; L167-M290 HydrophobicContact CG-SD 3.87Å
168S98.2Very high96.7Very high1 Ų16.8 Ų6.81%0.0074%0.043CC..Hα-helixtrans-63.9-42.1179.153.80000112.2T130 T164 Q165 A171 F172 W442T130-S168 WeakPolarHBondContact OG1-CB 3.49Å; T164-S168 WeakPolarHBondContact O-CB 3.48Å; T164-S168 PolarHBondContact O-N 3.07Å; T164-S168 VanDerWaalsContact O-N 3.12Å; T164-S168 PolarHBondContact O-OG 2.85Å; Q165-S168 PolarHBondContact O-OG 3.43Å; S168-A171 WeakPolarHBondContact O-CB 3.29Å; S168-A171 PolarHBondContact O-N 3.43Å; S168-F172 WeakPolarHBondContact O-CD2 3.04Å; S168-F172 PolarHBondContact O-N 2.91Å; S168-F172 VanDerWaalsContact O-N 3.14Å; S168-W442 PolarHBondContact OG-NE1 3.49Å
169S98.2Very high96.5Very high0 Ų07.5 Ų7.50%04%0.044CC..Hα-helixtrans-63.1-50.6176.4-54.20000111.7Q165 A171 F172 N173 F301 W442Q165-S169 VanDerWaalsContact O-CB 3.23Å; Q165-S169 WeakPolarHBondContact O-CB 3.33Å; Q165-S169 PolarHBondContact O-N 2.84Å; Q165-S169 PolarHBondContact O-OG 3.48Å; S169-A171 PolarHBondContact O-N 3.19Å; S169-F172 PolarHBondContact O-N 2.92Å; S169-F172 VanDerWaalsContact O-N 3.15Å; S169-N173 WeakPolarHBondContact O-CB 3.24Å; S169-N173 PolarHBondContact O-N 3.31Å; S169-N173 PolarHBondContact O-OD1 3.13Å; S169-F301 WeakPolarHBondContact OG-CE2 3.33Å; S169-F301 WeakPolarHBondContact OG-CZ 3.5Å; S169-W442 VanDerWaalsContact OG-CD1 3.24Å
170L98.3Very high96.2Very high0 Ų08.9 Ų8.90%05%0.053CC..Hα-helixtrans-56.1-40.4179.3176.759000111.3M116 R166 L167 N173 L174 V277 P281 F286 F304M116-L170 HydrophobicContact CE-CD2 4.26Å; M116-L170 HydrophobicContact SD-CD2 4.06Å; M116-L170 HydrophobicContact SD-CG 4.06Å; R166-L170 VanDerWaalsContact O-CB 3.26Å; R166-L170 WeakPolarHBondContact O-CB 3.24Å; R166-L170 PolarHBondContact O-N 3.5Å; L167-L170 PolarHBondContact O-N 2.88Å; L170-N173 PolarHBondContact O-N 3.22Å; L170-L174 HydrophobicContact CD1-CG 4.45Å; L170-L174 HydrophobicContact CG-CD1 4.44Å; L170-L174 WeakPolarHBondContact O-CG 3.49Å; L170-L174 PolarHBondContact O-N 3Å; L170-V277 HydrophobicContact CD1-CB 4.49Å; L170-V277 HydrophobicContact CD1-CG1 4.34Å; L170-V277 HydrophobicContact CD1-CG2 4.12Å; L170-P281 HydrophobicContact CD2-CG 4.12Å; L170-F286 HydrophobicContact CD2-CD2 3.88Å; L170-F286 HydrophobicContact CD2-CE2 3.92Å; L170-F304 HydrophobicContact CD1-CB 3.83Å; L170-F304 HydrophobicContact CD1-CD1 4.03Å; L170-F304 HydrophobicContact CD1-CD2 4.35Å; L170-F304 HydrophobicContact CD1-CG 3.79Å
171A98.3Very high95.7Very high0 Ų014.7 Ų14.70%08%0.075CC..Hα-helixtrans-62.3-46.6178.700000112.4M116 M125 A126 V129 L167 S168 S169M116-A171 HydrophobicContact SD-CB 4.47Å; M125-A171 HydrophobicContact CE-CB 3.63Å; M125-A171 VanDerWaalsContact CE-O 3.26Å; M125-A171 WeakPolarHBondContact CE-O 3.48Å; A126-A171 HydrophobicContact CB-CB 4.26Å; V129-A171 HydrophobicContact CB-CB 3.8Å; V129-A171 HydrophobicContact CG1-CB 3.78Å; V129-A171 HydrophobicContact CG2-CB 4.23Å; L167-A171 WeakPolarHBondContact O-CB 3.34Å; L167-A171 PolarHBondContact O-N 2.81Å; L167-A171 VanDerWaalsContact O-N 3.07Å; S168-A171 WeakPolarHBondContact O-CB 3.29Å; S168-A171 PolarHBondContact O-N 3.43Å; S169-A171 PolarHBondContact O-N 3.19Å
172F97.9Very high95.1Very high15 Ų1520.8 Ų20.87%0.06610%0.1CC..Hα-helixtrans-70.4-35.4175-82.4-74.2000113.1A126 V127 T130 S168 S169 L174 V175 D176 T446A126-F172 HydrophobicContact CB-CD1 3.67Å; A126-F172 HydrophobicContact CB-CD2 4.1Å; A126-F172 HydrophobicContact CB-CE1 3.76Å; A126-F172 HydrophobicContact CB-CE2 4.19Å; A126-F172 HydrophobicContact CB-CG 3.87Å; A126-F172 HydrophobicContact CB-CZ 4.03Å; V127-F172 HydrophobicContact CG2-CZ 4.31Å; T130-F172 WeakPolarHBondContact OG1-CE2 3.39Å; S168-F172 WeakPolarHBondContact O-CD2 3.04Å; S168-F172 PolarHBondContact O-N 2.91Å; S168-F172 VanDerWaalsContact O-N 3.14Å; S169-F172 PolarHBondContact O-N 2.92Å; S169-F172 VanDerWaalsContact O-N 3.15Å; F172-L174 VanDerWaalsContact C-N 3.26Å; F172-L174 PolarHBondContact O-N 3.45Å; F172-V175 WeakPolarHBondContact O-CA 3.4Å; F172-V175 WeakPolarHBondContact O-CB 3.47Å; F172-V175 PolarHBondContact O-N 3.26Å; F172-D176 PolarHBondContact O-N 3.04Å; F172-T446 HydrophobicContact CD2-CG2 3.67Å; F172-T446 HydrophobicContact CE2-CG2 3.71Å
173N97.7Very high94.4Very high2 Ų222.8 Ų22.81%0.01111%0.11CC..Hα-helixtrans-64.2-32.3177.4-68.718.3000112.2S169 L170 V175 D176 G177 H275 V277S169-N173 WeakPolarHBondContact O-CB 3.24Å; S169-N173 PolarHBondContact O-N 3.31Å; S169-N173 PolarHBondContact O-OD1 3.13Å; L170-N173 PolarHBondContact O-N 3.22Å; N173-V175 VanDerWaalsContact C-N 3.34Å; N173-D176 PolarHBondContact O-N 2.98Å; N173-G177 PolarHBondContact O-N 3.34Å; N173-H275 VanDerWaalsContact CB-O 3.31Å; N173-H275 WeakPolarHBondContact CB-O 3.37Å; N173-H275 VanDerWaalsContact CG-O 3.31Å; N173-H275 VanDerWaalsContact ND2-CB 3.29Å; N173-H275 WeakPolarHBondContact ND2-CB 3.15Å; N173-H275 PolarHBondContact ND2-O 3.28Å; N173-V277 HydrophobicContact CB-CB 4.38Å; N173-V277 HydrophobicContact CB-CG2 3.91Å; N173-V277 PolarHBondContact O-N 3.45Å
174L97.4Very high93.4Very high1 Ų127.4 Ų27.41%0.00514%0.143CC..Hα-helixtrans-63.1-40171.1-74.9165000111.8M116 L170 F172 G177 V178 V277 K279 V280M116-L174 HydrophobicContact CG-CD1 4.27Å; M116-L174 HydrophobicContact SD-CD1 3.89Å; L170-L174 HydrophobicContact CD1-CG 4.45Å; L170-L174 HydrophobicContact CG-CD1 4.44Å; L170-L174 WeakPolarHBondContact O-CG 3.49Å; L170-L174 PolarHBondContact O-N 3Å; F172-L174 VanDerWaalsContact C-N 3.26Å; F172-L174 PolarHBondContact O-N 3.45Å; L174-G177 PolarHBondContact O-N 3.28Å; L174-V178 PolarHBondContact O-N 3.2Å; L174-V178 VanDerWaalsContact O-N 3.16Å; L174-V277 WeakPolarHBondContact CA-O 3.29Å; L174-V277 HydrophobicContact CD2-CB 4.07Å; L174-V277 HydrophobicContact CD2-CG1 3.71Å; L174-V277 HydrophobicContact CG-CB 4.39Å; L174-V277 HydrophobicContact CG-CG1 4.41Å; L174-K279 VanDerWaalsContact CD2-C 3.41Å; L174-K279 WeakPolarHBondContact CD2-O 3.3Å; L174-V280 HydrophobicContact CD1-CG2 4.1Å; L174-V280 HydrophobicContact CD2-CG2 4.25Å
175V96.4Very high91.7Very high4 Ų428.2 Ų28.22%0.02415%0.151CC..Hα-helixtrans-66.1-41.6175.4-177.60000111.1N122 A126 F172 N173 G177 V178 S179N122-V175 WeakPolarHBondContact O-CG2 3.23Å; A126-V175 HydrophobicContact CB-CG2 3.8Å; F172-V175 WeakPolarHBondContact O-CA 3.4Å; F172-V175 WeakPolarHBondContact O-CB 3.47Å; F172-V175 PolarHBondContact O-N 3.26Å; N173-V175 VanDerWaalsContact C-N 3.34Å; V175-G177 VanDerWaalsContact C-N 3.3Å; V175-G177 PolarHBondContact O-N 3.01Å; V175-V178 PolarHBondContact O-N 3.48Å; V175-S179 PolarHBondContact O-N 2.64Å; V175-S179 PolarHBondContact O-OG 2.89Å
176D95.6Very high89.4Confident10 Ų1033.3 Ų33.35%0.05318%0.184CC..Hα-helixtrans-65.1-34.9176.8-65.2-13.1000111.6F172 N173 S179 T180 H272 A276 R450F172-D176 PolarHBondContact O-N 3.04Å; N173-D176 PolarHBondContact O-N 2.98Å; D176-S179 PolarHBondContact O-N 3.27Å; D176-T180 WeakPolarHBondContact O-CB 3.34Å; D176-T180 PolarHBondContact O-N 3.03Å; D176-T180 PolarHBondContact O-OG1 3.06Å; D176-H272 WeakPolarHBondContact OD2-CB 3.38Å; D176-H272 IonicContact OD2-CG 3.99Å; D176-H272 IonicContact OD2-ND1 3.7Å; D176-A276 HydrophobicContact CB-CB 4.2Å; D176-R450 IonicContact OD1-CZ 3.94Å; D176-R450 IonicContact OD1-NH2 2.76Å; D176-R450 PolarHBondContact OD1-NH2 2.61Å; D176-R450 IonicContact OD2-CZ 3.87Å; D176-R450 IonicContact OD2-NH2 2.66Å; D176-R450 PolarHBondContact OD2-NH2 2.9Å
177G94.6Very high86.9Confident3 Ų342.2 Ų42.23%0.03122%0.219CC..Hα-helixtrans-63.4-42.9173.300000113.2N173 L174 V175 S179 R181N173-G177 PolarHBondContact O-N 3.34Å; L174-G177 PolarHBondContact O-N 3.28Å; V175-G177 VanDerWaalsContact C-N 3.3Å; V175-G177 PolarHBondContact O-N 3.01Å; G177-S179 VanDerWaalsContact C-N 3.34Å; G177-R181 WeakPolarHBondContact O-CB 3.4Å; G177-R181 PolarHBondContact O-N 3.19Å; G177-R181 VanDerWaalsContact O-N 3.08Å
178V92.6Very high84.2Confident40 Ų4047 Ų4724%0.24224%0.238CC..Hα-helixtrans-63.2-43.1173.4176.30000110.9L174 V175 R181 K182L174-V178 PolarHBondContact O-N 3.2Å; L174-V178 VanDerWaalsContact O-N 3.16Å; V175-V178 PolarHBondContact O-N 3.48Å; V178-R181 PolarHBondContact O-N 3.05Å; V178-K182 WeakPolarHBondContact O-CG 3.44Å; V178-K182 PolarHBondContact O-N 3.42Å; V178-K182 VanDerWaalsContact O-N 3.15Å
179S89.5Confident81.1Confident34 Ų3451.3 Ų51.324%0.23827%0.267CS..Hα-helixtrans-65.5-43.5-179.2-56.80000111.8V175 D176 G177 R181 K182 I183V175-S179 PolarHBondContact O-N 2.64Å; V175-S179 PolarHBondContact O-OG 2.89Å; D176-S179 PolarHBondContact O-N 3.27Å; G177-S179 VanDerWaalsContact C-N 3.34Å; S179-R181 PolarHBondContact O-N 3.39Å; S179-K182 PolarHBondContact O-N 2.97Å; S179-I183 WeakPolarHBondContact O-CG1 3.42Å; S179-I183 PolarHBondContact O-N 3.34Å; S179-I183 VanDerWaalsContact O-N 3.15Å
180T87.7Confident78Confident36 Ų3658.1 Ų58.122%0.22130%0.297CS..Hα-helixtrans-63-41.7177.1-56.70000111.4D176 K182 I183 S184D176-T180 WeakPolarHBondContact O-CB 3.34Å; D176-T180 PolarHBondContact O-N 3.03Å; D176-T180 PolarHBondContact O-OG1 3.06Å; T180-K182 VanDerWaalsContact C-N 3.32Å; T180-K182 PolarHBondContact O-N 3.28Å; T180-I183 PolarHBondContact O-N 2.78Å; T180-S184 PolarHBondContact O-N 3.32Å; T180-S184 PolarHBondContact O-OG 2.84Å
181R86.6Confident75Confident122 Ų12261.4 Ų61.446%0.4632%0.319SS..Hα-helixtrans-62.1-37.6175.9-170.4-175.4-60.2150.88.1112.7G177 V178 S179 G185 E278G177-R181 WeakPolarHBondContact O-CB 3.4Å; G177-R181 PolarHBondContact O-N 3.19Å; G177-R181 VanDerWaalsContact O-N 3.08Å; V178-R181 PolarHBondContact O-N 3.05Å; S179-R181 PolarHBondContact O-N 3.39Å; R181-G185 PolarHBondContact O-N 3.05Å; R181-G185 VanDerWaalsContact O-N 3.09Å; R181-E278 PolarHBondContact NH2-O 3.5Å; R181-E278 IonicContact NH2-OE2 3.99Å
182K84.2Confident72.1Confident149 Ų14967.8 Ų67.865%0.64835%0.349SS*.Hα-helixtrans-66-40.5176.8-73178.7179.4-177.60111.8V178 S179 T180 G185V178-K182 WeakPolarHBondContact O-CG 3.44Å; V178-K182 PolarHBondContact O-N 3.42Å; V178-K182 VanDerWaalsContact O-N 3.15Å; S179-K182 PolarHBondContact O-N 2.97Å; T180-K182 VanDerWaalsContact C-N 3.32Å; T180-K182 PolarHBondContact O-N 3.28Å; K182-G185 PolarHBondContact O-N 3.13Å
183I80.8Confident69.2Low54 Ų5474.1 Ų74.128%0.27738%0.379SS..Hα-helixtrans-67.8-43178.2-64.4167000110.9S179 T180 G185 Y188 I268S179-I183 WeakPolarHBondContact O-CG1 3.42Å; S179-I183 PolarHBondContact O-N 3.34Å; S179-I183 VanDerWaalsContact O-N 3.15Å; T180-I183 PolarHBondContact O-N 2.78Å; I183-G185 PolarHBondContact O-N 3.29Å; I183-Y188 WeakPolarHBondContact O-CB 3.44Å; I183-I268 HydrophobicContact CD1-CD1 3.58Å; I183-I268 HydrophobicContact CD1-CG1 4.22Å
184S75.5Confident66.2Low98 Ų9882 Ų8269%0.68542%0.416SS*.THydrogen-bonded Turntrans-79.3-1178.4-54.90000114.1T180T180-S184 PolarHBondContact O-N 3.32Å; T180-S184 PolarHBondContact O-OG 2.84Å
185G63.1Low63.1Low18 Ų1888.6 Ų88.619%0.18645%0.451CS..SBendtrans-71.2165.4-17800000113.3R181 K182 I183 Y187 Y188R181-G185 PolarHBondContact O-N 3.05Å; R181-G185 VanDerWaalsContact O-N 3.09Å; K182-G185 PolarHBondContact O-N 3.13Å; I183-G185 PolarHBondContact O-N 3.29Å; G185-Y187 PolarHBondContact O-N 3.23Å; G185-Y188 PolarHBondContact O-N 2.98Å; G185-Y188 VanDerWaalsContact O-N 3.08Å
186P48.5Very low60Low108 Ų10895.7 Ų95.770%0.70149%0.489SS*.THydrogen-bonded Turntrans-60.9-6.6-174.322-32.4000115.5
187Y45.1Very low56.7Low192 Ų192100.7 Ų100.775%0.75352%0.524SS*.THydrogen-bonded Turntrans-75.9-24.4174.5-76.1-83.5000113.5G185 K190G185-Y187 PolarHBondContact O-N 3.23Å; Y187-K190 PolarHBondContact O-N 3.45Å
188Y41.5Very low53.5Low101 Ų101106.4 Ų106.440%0.39656%0.56SS.*Hα-helixtrans-75.6-27.1179.4-158.9-93.7000112.9I183 G185 K190 S191 M266I183-Y188 WeakPolarHBondContact O-CB 3.44Å; G185-Y188 PolarHBondContact O-N 2.98Å; G185-Y188 VanDerWaalsContact O-N 3.08Å; Y188-K190 VanDerWaalsContact C-N 3.31Å; Y188-K190 PolarHBondContact O-N 3.47Å; Y188-S191 PolarHBondContact O-OG 2.87Å; Y188-M266 HydrophobicContact CE2-SD 4.42Å
189C33.5Very low50.6Low90 Ų90110.6 Ų110.661%0.60858%0.58SS**Hα-helixtrans-71.4-22.3173.9-79.60000113.6
190K33.5Very low47.7Very low144 Ų144116.9 Ų116.963%0.62661%0.611SS**Hα-helixtrans-80.4-27.5-178.5-76.1-173.8176-177.80113.6Y187 Y188Y187-K190 PolarHBondContact O-N 3.45Å; Y188-K190 VanDerWaalsContact C-N 3.31Å; Y188-K190 PolarHBondContact O-N 3.47Å
191S35.9Very low44.9Very low68 Ų68123.1 Ų123.148%0.47664%0.637SS.*Hα-helixtrans-83.4-24.2-179.2540000113.8Y188Y188-S191 PolarHBondContact O-OG 2.87Å
192Q37.3Very low42.3Very low135 Ų135124.8 Ų124.863%0.63165%0.654SS**Hα-helixtrans-81.7-20.3172-75.8-169.5-26.200113.5Q194Q192-Q194 VanDerWaalsContact C-N 3.29Å; Q192-Q194 PolarHBondContact O-N 3.23Å
193Q35.4Very low39.9Very low147 Ų147125.6 Ų125.669%0.68766%0.663SS**THydrogen-bonded Turntrans-77.6-7.6176.3-81179.8-2300114.5
194Q36.1Very low37.4Very low167 Ų167130.5 Ų130.578%0.7869%0.69SS**THydrogen-bonded Turntrans-102.8-7.8179.2-82.8178.8-25.800114.8Q192Q192-Q194 VanDerWaalsContact C-N 3.29Å; Q192-Q194 PolarHBondContact O-N 3.23Å
195N31.6Very low35.1Very low140 Ų140137.1 Ų137.175%0.74970%0.7SS**  trans-110.872.5173-76.4-13.7000110.1C197N195-C197 PolarHBondContact O-N 2.85Å
196N31.5Very low33.5Very low154 Ų154143.7 Ų143.782%0.82473%0.731SS**  trans-70.190.7166.7-85.2-14.6000109.6
197C26.4Very low32.5Very low115 Ų115147.8 Ų147.878%0.77774%0.741SS**  trans-115.1120.3153.5-109.30000107.5N195 I199N195-C197 PolarHBondContact O-N 2.85Å; C197-I199 PolarHBondContact O-N 3.42Å
198P28.3Very low31.8Very low122 Ų122144.6 Ų144.679%0.79274%0.741SS**  trans-82.3115.6-173.331.7-29.7000109.4
199I29.8Very low31.1Very low128 Ų128147.3 Ų147.366%0.65677%0.768SS**  trans-133.577.7163.6-57.8-178.8000107.8C197 E201 I202C197-I199 PolarHBondContact O-N 3.42Å; I199-E201 VanDerWaalsContact C-N 3.27Å; I199-E201 HydrophobicContact CG2-CB 4.46Å; I199-E201 WeakPolarHBondContact CG2-O 3.46Å; I199-E201 PolarHBondContact O-N 2.86Å; I199-I202 HydrophobicContact CG2-CD1 4.22Å
200N28.5Very low30.8Very low166 Ų166146.3 Ų146.389%0.88877%0.773SS**  trans-76.286148.1-85.9-19.2000106.4
201E30.9Very low30.4Very low168 Ų168148.9 Ų148.979%0.78579%0.787SS**  trans177.4143.1165.5-103.8165.6-16600105.6I199I199-E201 VanDerWaalsContact C-N 3.27Å; I199-E201 HydrophobicContact CG2-CB 4.46Å; I199-E201 WeakPolarHBondContact CG2-O 3.46Å; I199-E201 PolarHBondContact O-N 2.86Å
202I31.7Very low29.9Very low157 Ų157151.4 Ų151.481%0.80580%0.804SS**SBendtrans104.711.6-175.8-48.9155.3000115.4I199I199-I202 HydrophobicContact CG2-CD1 4.22Å
203I32.3Very low29.3Very low165 Ų165149.9 Ų149.985%0.84681%0.805SS**SBendtrans-130.764.9160.6-48177.7000109.1
204N28.9Very low28.9Very low157 Ų157148.1 Ų148.184%0.8481%0.806SS**SBendtrans-175.576163.1-95.9-18.9000108.8
205R27.6Very low28.4Very low238 Ų238143.5 Ų143.590%0.89879%0.792SS**  trans-17692.8161-105.1173.8-165.8-164.34.9107.7
206D29Very low28Very low155 Ų155148 Ų14883%0.82980%0.799SS**  trans171.860.3138-83.8-9.9000109.3
207E26.7Very low27.8Very low195 Ų195149.5 Ų149.591%0.91179%0.793SS**  trans-94.790.6151.3-79.7-170.1154.600107.7
208T31Very low27.7Very low124 Ų124153.5 Ų153.576%0.76179%0.792SS**  trans-154103.815644.90000110.5
209V27.1Very low27.6Very low158 Ų158152.8 Ų152.896%0.95878%0.781SS**  trans15.4110.3137.8-173.60000116
210G28.1Very low27.4Very low69 Ų69150 Ų15071%0.71177%0.77SS**  trans-164.4111171.300000112.3
211Q24.5Very low27.4Very low198 Ų198149 Ų14993%0.92576%0.758SS**  trans-41.6132179.3-67.6153.4-26.200114.3
212C24.4Very low27.3Very low122 Ų122144.8 Ų144.882%0.82474%0.744SS**  trans-150.9147.3165.3-104.90000115
213P25.8Very low27.1Very low102 Ų102142.5 Ų142.566%0.66273%0.729SS**  trans-98.3-157.7-144.943.7-38.7000113.7R405P213-R405 PolarHBondContact O-NH2 2.85Å
214P26.2Very low26.8Very low110 Ų110141.6 Ų141.671%0.71473%0.726SS**  trans-69.8157.1-148.131.2-37000116R216 R405P214-R216 VanDerWaalsContact C-N 3.33Å; P214-R216 PolarHBondContact O-N 2.99Å; P214-R405 VanDerWaalsContact CA-NH1 3.26Å
215C25.4Very low26.7Very low71 Ų71141.2 Ų141.248%0.4872%0.724SS.*  trans-65.683.9-173.2-128.50000110.7R405C215-R405 VanDerWaalsContact CA-CZ 3.46Å; C215-R405 HydrophobicContact CB-CG 4.42Å; C215-R405 VanDerWaalsContact CB-NE 3.32Å; C215-R405 VanDerWaalsContact N-NH2 3.18Å; C215-R405 WeakPolarHBondContact SG-CD 3.3Å; C215-R405 VanDerWaalsContact SG-CZ 3.51Å; C215-R405 PolarHBondContact SG-NE 3.21Å
216R24.8Very low26.8Very low234 Ų234133.6 Ų133.688%0.88370%0.704SS**  trans-103.591.8146.2-80.4-175.6-177177.81.5106P214 R218P214-R216 VanDerWaalsContact C-N 3.33Å; P214-R216 PolarHBondContact O-N 2.99Å; R216-R218 PolarHBondContact O-N 3.29Å
217R26Very low26.6Very low185 Ų185132.5 Ų132.570%0.69870%0.703SS**  trans-60.797.2155.6-140.3-178-158.1-179.35104.4D219R217-D219 PolarHBondContact O-N 2.61Å; R217-D219 VanDerWaalsContact O-N 3.1Å
218R24.1Very low26.6Very low200 Ų200127.1 Ų127.176%0.75569%0.685SS**  trans-55.2111.5164-98.5174.5-176.4169.69.5104.7R216 T220R216-R218 PolarHBondContact O-N 3.29Å; R218-T220 HydrophobicContact CB-CG2 3.71Å; R218-T220 WeakPolarHBondContact CB-OG1 3.45Å; R218-T220 HydrophobicContact CG-CG2 3.78Å; R218-T220 PolarHBondContact O-N 3.13Å
219D26.8Very low26.4Very low107 Ų107129.3 Ų129.357%0.57269%0.689SS**  trans-67.365.1151.6-58.5-41.3000106.6R217 F221 K421R217-D219 PolarHBondContact O-N 2.61Å; R217-D219 VanDerWaalsContact O-N 3.1Å; D219-F221 PolarHBondContact O-N 3.23Å; D219-K421 IonicContact OD2-NZ 2.82Å; D219-K421 PolarHBondContact OD2-NZ 3.03Å
220T25.5Very low26.4Very low68 Ų68127.5 Ų127.542%0.41767%0.672SS.*  trans-86.690.7169.337.60000107R218 T222R218-T220 HydrophobicContact CB-CG2 3.71Å; R218-T220 WeakPolarHBondContact CB-OG1 3.45Å; R218-T220 HydrophobicContact CG-CG2 3.78Å; R218-T220 PolarHBondContact O-N 3.13Å; T220-T222 HydrophobicContact CG2-CG2 3.5Å; T220-T222 VanDerWaalsContact CG2-CG2 3.5Å; T220-T222 PolarHBondContact O-N 2.92Å; T220-T222 VanDerWaalsContact O-N 3.11Å
221F29.3Very low26.3Very low146 Ų146132.5 Ų132.564%0.6468%0.679SS**  trans-71.475.8130.1-79.3-80.8000106.4D219 R444D219-F221 PolarHBondContact O-N 3.23Å; F221-R444 VanDerWaalsContact CG-NH1 3.31Å
222T27.8Very low26.5Very low79 Ų79128.7 Ų128.749%0.48567%0.669SS.*  trans-59.5148.1178.39.10000110.3T220 L224T220-T222 HydrophobicContact CG2-CG2 3.5Å; T220-T222 VanDerWaalsContact CG2-CG2 3.5Å; T220-T222 PolarHBondContact O-N 2.92Å; T220-T222 VanDerWaalsContact O-N 3.11Å; T222-L224 VanDerWaalsContact C-N 3.28Å; T222-L224 PolarHBondContact O-N 3.32Å
223E28Very low26.6Very low109 Ų109128.1 Ų128.151%0.50967%0.667SS.*SBendtrans-42.187.2158.6-71.8168.3123.300111.5H492E223-H492 IonicContact OE1-CD2 3.42Å
224L26.8Very low26.7Very low147 Ų147132.1 Ų132.177%0.7768%0.677SS**  trans-162.671.5169.5-98.8139.1000106.3T222T222-L224 VanDerWaalsContact C-N 3.28Å; T222-L224 PolarHBondContact O-N 3.32Å
225D26.2Very low26.9Very low149 Ų149135.1 Ų135.180%0.79769%0.686SS**  trans178.860.7156-91.1-17.2000108.1
226T29.5Very low27.2Very low77 Ų77138.6 Ų138.647%0.47270%0.7SS.*  trans-135.686.1146.432.30000104.5P228 R493T226-P228 VanDerWaalsContact O-CD 3.26Å; T226-P228 WeakPolarHBondContact O-CD 3.44Å; T226-R493 PolarHBondContact OG1-NH2 3.39Å
227T24.5Very low27.3Very low133 Ų133132.3 Ų132.382%0.81669%0.689SS**  trans-46115.4160.6-6.70000106.6
228P27.3Very low27.6Very low82 Ų82130.4 Ų130.453%0.53269%0.693SS.*  trans-63152.6161.4-2.419.7000106.1T226 I230T226-P228 VanDerWaalsContact O-CD 3.26Å; T226-P228 WeakPolarHBondContact O-CD 3.44Å; P228-I230 HydrophobicContact CB-CG1 3.95Å; P228-I230 HydrophobicContact CG-CD1 4.07Å; P228-I230 HydrophobicContact CG-CG1 3.91Å; P228-I230 PolarHBondContact O-N 3.14Å
229M26.6Very low28Very low170 Ų170127.6 Ų127.684%0.83770%0.698SS**  trans-55.290.7151.4-83-179157.300107.2
230I26.5Very low28.1Very low119 Ų119128.9 Ų128.961%0.6170%0.704SS**  trans-92.891.4164.4-63-177.8000104.3P228 T232P228-I230 HydrophobicContact CB-CG1 3.95Å; P228-I230 HydrophobicContact CG-CD1 4.07Å; P228-I230 HydrophobicContact CG-CG1 3.91Å; P228-I230 PolarHBondContact O-N 3.14Å; I230-T232 VanDerWaalsContact C-N 3.29Å; I230-T232 HydrophobicContact CG2-CG2 3.39Å; I230-T232 PolarHBondContact O-N 3.34Å
231M26.5Very low28.3Very low175 Ų175134.3 Ų134.386%0.86272%0.724SS**  trans-77.489.2154.5-72.8-171.675.600106.3S233M231-S233 PolarHBondContact O-N 2.93Å
232T28.1Very low28.1Very low117 Ų117137.6 Ų137.672%0.71873%0.733SS**  trans-79.799.2162.736.40000107.7I230 E234I230-T232 VanDerWaalsContact C-N 3.29Å; I230-T232 HydrophobicContact CG2-CG2 3.39Å; I230-T232 PolarHBondContact O-N 3.34Å; T232-E234 PolarHBondContact O-N 3.1Å
233S26.1Very low28.3Very low111 Ų111142.8 Ų142.878%0.77675%0.752SS**  trans-85.194.2159.571.90000108.2M231M231-S233 PolarHBondContact O-N 2.93Å
234E29.4Very low28.5Very low186 Ų186142.1 Ų142.187%0.86977%0.765SS**  trans-124.987.8158.2-75.5-171.8172.300106.7T232T232-E234 PolarHBondContact O-N 3.1Å
235L30.6Very low28.8Very low173 Ų173140.9 Ų140.991%0.90677%0.766SS**  trans-120.6109.3162.6-113.3132.5000107.1
236N30Very low29.1Very low143 Ų143141.4 Ų141.477%0.76577%0.769SS**  trans-58.1121.5177.2-158.3-0.6000109.3N238N236-N238 PolarHBondContact O-N 3.4Å
237P28.4Very low29.2Very low103 Ų103149.6 Ų149.667%0.66979%0.791SS**  trans-9089-176.233.6-28.2000108.9
238N32.1Very low29.6Very low144 Ų144154.5 Ų154.577%0.7780%0.795SS**  trans-168.892.3163.6-86.4-31.8000108N236N236-N238 PolarHBondContact O-N 3.4Å
239T33Very low29.9Very low142 Ų142157.9 Ų157.987%0.87180%0.801SS**  trans175.7112.1138.4-61.80000107.8
240I27.2Very low30.3Very low134 Ų134154.9 Ų154.969%0.68780%0.796SS**  trans-77.3139.7174.3-67.4159.5000108.2
241H30.5Very low30.7Very low181 Ų181157.7 Ų157.784%0.83880%0.804SS**  trans-166.4119.3134.6-98.3-65000110.8
242Y26.1Very low31Very low215 Ų215155.4 Ų155.484%0.84379%0.792SS**  trans-78.5131.5172.5-84-101.5000110.6
243H31.6Very low31.4Very low189 Ų189155 Ų15588%0.87578%0.784SS**  trans-140.3130.2150.4-89.1-70.8000109.8
244A30.9Very low31.9Very low95 Ų95152.4 Ų152.479%0.78577%0.769SS**  trans-69.6168.9-179.400000112.6
245P33.5Very low32.1Very low121 Ų121147.4 Ų147.479%0.78675%0.752SS**  trans-89.7148.4-142.935.2-35.1000114.3
246N32.5Very low32.3Very low160 Ų160141.6 Ų141.686%0.85673%0.728SS**  trans-124.9122.5165.8-100-28.3000111.9R248N246-R248 PolarHBondContact O-N 3.06Å
247R31.3Very low32.6Very low249 Ų249140 Ų14094%0.9472%0.719SS**SBendtrans-57.694.5171.9-77.5176.7170-179.7-2.8110.4
248R34.2Very low32.9Very low236 Ų236141 Ų14189%0.89171%0.714SS**  trans-161.18.1163.9-114.6172.2-169.5-170.13.4117N246N246-R248 PolarHBondContact O-N 3.06Å
249K33.4Very low32.9Very low152 Ų152137.5 Ų137.566%0.66170%0.701SS**THydrogen-bonded Turntrans-89.56.7-170.3-85.8-172.5174.8-178.60117.8K251 Q252K249-K251 VanDerWaalsContact C-N 3.28Å; K249-K251 PolarHBondContact O-N 2.97Å; K249-Q252 PolarHBondContact O-N 2.93Å
250S33.6Very low32.9Very low107 Ų107136 Ų13675%0.74869%0.688SS**Hα-helixtrans-68.9-19.3179.452.80000114.8
251K36.2Very low33.3Very low178 Ų178132.7 Ų132.777%0.77468%0.677SS**Hα-helixtrans-87.7-23.1176.1-85.7-178171.8-1790115.1K249K249-K251 VanDerWaalsContact C-N 3.28Å; K249-K251 PolarHBondContact O-N 2.97Å
252Q33.3Very low33.5Very low128 Ų128130.3 Ų130.360%0.59867%0.666SS**Hα-helixtrans-80.9-22.3180-80.1-179.5-20.300113.3K249 T255 A256K249-Q252 PolarHBondContact O-N 2.93Å; Q252-T255 WeakPolarHBondContact CA-OG1 3.24Å; Q252-T255 PolarHBondContact O-OG1 2.9Å; Q252-A256 PolarHBondContact O-N 3.19Å
253I36.5Very low33.9Very low107 Ų107123.1 Ų123.155%0.54965%0.647SS.*Hα-helixtrans-72.8-33.7176.2-61.6173.4000110.5A256 I257I253-A256 PolarHBondContact O-N 3.36Å; I253-I257 HydrophobicContact CG2-CD1 3.85Å; I253-I257 HydrophobicContact CG2-CG1 4.47Å; I253-I257 WeakPolarHBondContact O-CD1 3.34Å; I253-I257 VanDerWaalsContact O-CG1 3.26Å; I253-I257 WeakPolarHBondContact O-CG1 3.29Å; I253-I257 PolarHBondContact O-N 3.12Å
254A35Very low34.4Very low57 Ų57120 Ų12047%0.47164%0.641SS.*Hα-helixtrans-65-40.8175.500000112.4A256 I257 E258A254-A256 VanDerWaalsContact C-N 3.35Å; A254-A256 PolarHBondContact O-N 2.95Å; A254-I257 PolarHBondContact O-N 3.09Å; A254-E258 PolarHBondContact O-N 3.4Å
255T35.2Very low34.9Very low82 Ų82121.1 Ų121.150%0.50363%0.631SS.*Hα-helixtrans-69.6-30175.942.20000113.2Q252 S259Q252-T255 WeakPolarHBondContact CA-OG1 3.24Å; Q252-T255 PolarHBondContact O-OG1 2.9Å; T255-S259 WeakPolarHBondContact O-CB 3.48Å; T255-S259 PolarHBondContact O-N 3.41Å
256A33.1Very low35.7Very low50 Ų50120.4 Ų120.441%0.41362%0.619SS.*Hα-helixtrans-71-38.6173.500000111.5Q252 I253 A254 S259 D260Q252-A256 PolarHBondContact O-N 3.19Å; I253-A256 PolarHBondContact O-N 3.36Å; A254-A256 VanDerWaalsContact C-N 3.35Å; A254-A256 PolarHBondContact O-N 2.95Å; A256-S259 PolarHBondContact O-N 3.39Å; A256-S259 PolarHBondContact O-OG 3.24Å; A256-D260 PolarHBondContact O-N 3.06Å
257I37.2Very low37.4Very low111 Ų111120.1 Ų120.157%0.56962%0.617SS**Hα-helixtrans-68.6-36.6175.5-65.6165.6000111.3I253 A254 D260 S261I253-I257 HydrophobicContact CG2-CD1 3.85Å; I253-I257 HydrophobicContact CG2-CG1 4.47Å; I253-I257 WeakPolarHBondContact O-CD1 3.34Å; I253-I257 VanDerWaalsContact O-CG1 3.26Å; I253-I257 WeakPolarHBondContact O-CG1 3.29Å; I253-I257 PolarHBondContact O-N 3.12Å; A254-I257 PolarHBondContact O-N 3.09Å; I257-D260 PolarHBondContact O-N 3.42Å; I257-S261 PolarHBondContact O-N 3.38Å; I257-S261 PolarHBondContact O-OG 3.33Å
258E34Very low39.7Very low123 Ų123109.7 Ų109.758%0.57558%0.58SS**Hα-helixtrans-65.8-39.5171.8-96.4177.7163.600112A254 D260 S261 H262A254-E258 PolarHBondContact O-N 3.4Å; E258-D260 VanDerWaalsContact C-N 3.29Å; E258-D260 PolarHBondContact O-N 3.5Å; E258-S261 WeakPolarHBondContact CA-OG 3.24Å; E258-S261 PolarHBondContact O-N 3.39Å; E258-S261 VanDerWaalsContact O-N 3.17Å; E258-S261 PolarHBondContact O-OG 3.39Å; E258-H262 PolarHBondContact O-CD2 2.65Å; E258-H262 PolarHBondContact O-N 3.23Å
259S31.8Very low42.3Very low70 Ų70100.8 Ų100.849%0.4955%0.552SS.*Hα-helixtrans-64.6-32.6175.775.10000113T255 A256 H262 S263T255-S259 WeakPolarHBondContact O-CB 3.48Å; T255-S259 PolarHBondContact O-N 3.41Å; A256-S259 PolarHBondContact O-N 3.39Å; A256-S259 PolarHBondContact O-OG 3.24Å; S259-H262 PolarHBondContact O-N 3.43Å; S259-S263 PolarHBondContact O-N 2.88Å
260D34.2Very low44.9Very low112 Ų11299 Ų9960%0.59955%0.554SS**Hα-helixtrans-73.3-32.6173.3-101.6-12.4000112.4A256 I257 E258 S263 V264A256-D260 PolarHBondContact O-N 3.06Å; I257-D260 PolarHBondContact O-N 3.42Å; E258-D260 VanDerWaalsContact C-N 3.29Å; E258-D260 PolarHBondContact O-N 3.5Å; D260-S263 PolarHBondContact O-OG 2.87Å; D260-V264 WeakPolarHBondContact O-CG2 3.39Å; D260-V264 PolarHBondContact O-N 3.08Å
261S35.9Very low47.7Very low64 Ų6495 Ų9545%0.44853%0.526SS..Hα-helixtrans-72.8-29.2172.264.20000113.1I257 E258 M265I257-S261 PolarHBondContact O-N 3.38Å; I257-S261 PolarHBondContact O-OG 3.33Å; E258-S261 WeakPolarHBondContact CA-OG 3.24Å; E258-S261 PolarHBondContact O-N 3.39Å; E258-S261 VanDerWaalsContact O-N 3.17Å; E258-S261 PolarHBondContact O-OG 3.39Å; S261-M265 PolarHBondContact O-N 2.75Å
262H34.1Very low50.4Low131 Ų13187 Ų8761%0.60649%0.491SS*.Hα-helixtrans-74.2-31.9173.9-92-77.8000113.3E258 S259 M265 M266E258-H262 PolarHBondContact O-CD2 2.65Å; E258-H262 PolarHBondContact O-N 3.23Å; S259-H262 PolarHBondContact O-N 3.43Å; H262-M265 PolarHBondContact O-N 3.46Å; H262-M266 VanDerWaalsContact O-CG 3.3Å; H262-M266 WeakPolarHBondContact O-CG 3.19Å
263S34.5Very low53.2Low64 Ų6486.2 Ų86.245%0.44849%0.486SS..Hα-helixtrans-72.2-29.8174.3710000112.1S259 D260 M266S259-S263 PolarHBondContact O-N 2.88Å; D260-S263 PolarHBondContact O-OG 2.87Å; S263-M266 PolarHBondContact O-N 3.39Å; S263-M266 VanDerWaalsContact O-N 3.17Å
264V42.4Very low55.9Low124 Ų12487 Ų8775%0.75249%0.491SS*.Hα-helixtrans-74.9-24176.2176.50000112.7D260 M266D260-V264 WeakPolarHBondContact O-CG2 3.39Å; D260-V264 PolarHBondContact O-N 3.08Å; V264-M266 VanDerWaalsContact C-N 3.27Å; V264-M266 PolarHBondContact O-N 3.45Å
265M41.4Very low58.8Low118 Ų11884.5 Ų84.558%0.58147%0.469SS*.THydrogen-bonded Turntrans-79-5168.9-82.8-174.367.500113.7S261 H262S261-M265 PolarHBondContact O-N 2.75Å; H262-M265 PolarHBondContact O-N 3.46Å
266M49.7Very low61.7Low106 Ų10681.8 Ų81.852%0.52246%0.456SS..SBendtrans-110.678.6-173.4-74.9-94.5-92.900112Y188 H262 S263 V264Y188-M266 HydrophobicContact CE2-SD 4.42Å; H262-M266 VanDerWaalsContact O-CG 3.3Å; H262-M266 WeakPolarHBondContact O-CG 3.19Å; S263-M266 PolarHBondContact O-N 3.39Å; S263-M266 VanDerWaalsContact O-N 3.17Å; V264-M266 VanDerWaalsContact C-N 3.27Å; V264-M266 PolarHBondContact O-N 3.45Å
267N67.9Low64.7Low153 Ų15380 Ų8082%0.81844%0.439SS*.  trans166.872.2141.9-87.5-25.1000109.7P269N267-P269 WeakPolarHBondContact O-CD 3.3Å
268I80.1Confident67.3Low31 Ų3181.1 Ų81.116%0.15944%0.442CS..  trans-59.2123.8169.8-61178.3000108.1I183 H272 K273I183-I268 HydrophobicContact CD1-CD1 3.58Å; I183-I268 HydrophobicContact CD1-CG1 4.22Å; I268-H272 HydrophobicContact CG2-CB 3.54Å; I268-K273 HydrophobicContact CB-CG 4.23Å; I268-K273 HydrophobicContact CG2-CG 3.82Å; I268-K273 WeakPolarHBondContact O-CE 3.44Å
269P88.2Confident70.2Confident48 Ų4882.5 Ų82.531%0.31245%0.446SS..  trans-50.3143.8176.3-2935.5000112.1N267 S271 H272 K273N267-P269 WeakPolarHBondContact O-CD 3.3Å; P269-S271 PolarHBondContact O-N 2.82Å; P269-H272 WeakPolarHBondContact O-CB 3.42Å; P269-H272 PolarHBondContact O-N 2.89Å; P269-K273 PolarHBondContact O-N 3.25Å
270T89.7Confident73.3Confident115 Ų11581 Ų8171%0.70643%0.434SS*.Hα-helixtrans-57.6-34.4-177.950.30000112.6K273 L274T270-K273 PolarHBondContact O-N 2.93Å; T270-L274 PolarHBondContact O-N 3.23Å
271S91.2Very high76.3Confident23 Ų2376.2 Ų76.216%0.16141%0.409CS..Hα-helixtrans-62.5-44174.751.60000112.7P269 K273 L274 H275 E445P269-S271 PolarHBondContact O-N 2.82Å; S271-K273 VanDerWaalsContact C-N 3.31Å; S271-K273 PolarHBondContact O-N 2.91Å; S271-L274 WeakPolarHBondContact O-CB 3.42Å; S271-L274 PolarHBondContact O-N 3.47Å; S271-L274 VanDerWaalsContact O-N 3.15Å; S271-H275 PolarHBondContact O-N 2.88Å; S271-H275 PolarHBondContact O-ND1 3.26Å; S271-E445 WeakPolarHBondContact CB-OE1 3.44Å
272H93.6Very high79.1Confident9 Ų975.6 Ų75.64%0.04240%0.401CS..Hα-helixtrans-64-38.5177.7-65.5-177000111.3D176 I268 P269 H275 A276 E445 D449 R450D176-H272 WeakPolarHBondContact OD2-CB 3.38Å; D176-H272 IonicContact OD2-CG 3.99Å; D176-H272 IonicContact OD2-ND1 3.7Å; I268-H272 HydrophobicContact CG2-CB 3.54Å; P269-H272 WeakPolarHBondContact O-CB 3.42Å; P269-H272 PolarHBondContact O-N 2.89Å; H272-H275 PolarHBondContact O-N 2.8Å; H272-A276 WeakPolarHBondContact O-CB 3.36Å; H272-A276 PolarHBondContact O-N 3.27Å; H272-E445 IonicContact CD2-OE2 3.5Å; H272-D449 IonicContact CE1-OD2 3.43Å; H272-D449 IonicContact NE2-OD2 2.67Å; H272-D449 PolarHBondContact NE2-OD2 2.97Å; H272-R450 PolarHBondContact CE1-NH1 3.41Å; H272-R450 PolarHBondContact ND1-NH1 3.23Å; H272-R450 PolarHBondContact NE2-NH1 3.38Å
273K92.5Very high82.1Confident113 Ų11372.3 Ų72.349%0.49139%0.391SS..Hα-helixtrans-63.6-40.8173.9-64.9-175.9-177.9178.60111.9I268 P269 T270 S271 H275I268-K273 HydrophobicContact CB-CG 4.23Å; I268-K273 HydrophobicContact CG2-CG 3.82Å; I268-K273 WeakPolarHBondContact O-CE 3.44Å; P269-K273 PolarHBondContact O-N 3.25Å; T270-K273 PolarHBondContact O-N 2.93Å; S271-K273 VanDerWaalsContact C-N 3.31Å; S271-K273 PolarHBondContact O-N 2.91Å; K273-H275 VanDerWaalsContact C-N 3.34Å
274L92.4Very high85Confident124 Ų12471.6 Ų71.665%0.64938%0.382SS*.Hα-helixtrans-65.9-36.1179.4-178.565.1000112.4T270 S271T270-L274 PolarHBondContact O-N 3.23Å; S271-L274 WeakPolarHBondContact O-CB 3.42Å; S271-L274 PolarHBondContact O-N 3.47Å; S271-L274 VanDerWaalsContact O-N 3.15Å
275H96Very high87.7Confident3 Ų366.6 Ų66.61%0.01435%0.35CS..Hα-helixtrans-98.30.3-177.7-47.7137.7000114.5N173 S271 H272 K273 V277 F303 S305 E306 R441 E445N173-H275 VanDerWaalsContact CB-O 3.31Å; N173-H275 WeakPolarHBondContact CB-O 3.37Å; N173-H275 VanDerWaalsContact CG-O 3.31Å; N173-H275 VanDerWaalsContact ND2-CB 3.29Å; N173-H275 WeakPolarHBondContact ND2-CB 3.15Å; N173-H275 PolarHBondContact ND2-O 3.28Å; S271-H275 PolarHBondContact O-N 2.88Å; S271-H275 PolarHBondContact O-ND1 3.26Å; H272-H275 PolarHBondContact O-N 2.8Å; K273-H275 VanDerWaalsContact C-N 3.34Å; H275-V277 PolarHBondContact O-N 2.91Å; H275-F303 HydrophobicContact CB-CB 4.23Å; H275-F303 HydrophobicContact CB-CD1 4.09Å; H275-F303 HydrophobicContact CB-CG 4.13Å; H275-F303 AromaticContact CD2-CD2 3.88Å; H275-F303 AromaticContact CD2-CG 3.92Å; H275-F303 AromaticContact CE1-CD2 3.33Å; H275-F303 WeakPolarHBondContact CE1-CD2 3.4Å; H275-F303 AromaticContact CE1-CE2 3.33Å; H275-F303 WeakPolarHBondContact CE1-CE2 3.43Å; H275-F303 AromaticContact CE1-CG 3.94Å; H275-F303 AromaticContact CE1-CZ 3.95Å; H275-F303 AromaticContact CG-CD1 3.98Å; H275-F303 AromaticContact CG-CD2 3.85Å; H275-F303 AromaticContact CG-CG 3.66Å; H275-F303 AromaticContact ND1-CD1 3.86Å; H275-F303 AromaticContact ND1-CD2 3.5Å; H275-F303 WeakPolarHBondContact ND1-CD2 3.41Å; H275-F303 AromaticContact ND1-CE1 3.88Å; H275-F303 AromaticContact ND1-CE2 3.51Å; H275-F303 AromaticContact ND1-CG 3.67Å; H275-F303 AromaticContact ND1-CZ 3.7Å; H275-F303 AromaticContact NE2-CD2 3.56Å; H275-S305 WeakPolarHBondContact CA-OG 3.39Å; H275-E306 IonicContact NE2-OE1 3.84Å; H275-R441 PolarHBondContact CE1-NH2 3.26Å; H275-R441 PolarHBondContact NE2-NH2 3.21Å; H275-E445 IonicContact CE1-OE1 3.46Å; H275-E445 PolarHBondContact CE1-OE1 3.46Å; H275-E445 IonicContact CE1-OE2 2.87Å; H275-E445 IonicContact CG-OE2 2.71Å; H275-E445 VanDerWaalsContact ND1-CD 3.3Å; H275-E445 IonicContact ND1-OE1 3.9Å; H275-E445 PolarHBondContact ND1-OE1 3.44Å; H275-E445 IonicContact ND1-OE2 2.98Å; H275-E445 PolarHBondContact ND1-OE2 3.34Å
276A95.8Very high90.4Very high26 Ų2661 Ų6122%0.21532%0.323CS..  trans-55133.817900000111.8D176 H272D176-A276 HydrophobicContact CB-CB 4.2Å; H272-A276 WeakPolarHBondContact O-CB 3.36Å; H272-A276 PolarHBondContact O-N 3.27Å
277V96.2Very high92.6Very high11 Ų1158.2 Ų58.27%0.06731%0.308CS..  trans-116.6123.1-179.2-179.80000109.2L170 N173 L174 H275 K279 F304L170-V277 HydrophobicContact CD1-CB 4.49Å; L170-V277 HydrophobicContact CD1-CG1 4.34Å; L170-V277 HydrophobicContact CD1-CG2 4.12Å; N173-V277 HydrophobicContact CB-CB 4.38Å; N173-V277 HydrophobicContact CB-CG2 3.91Å; N173-V277 PolarHBondContact O-N 3.45Å; L174-V277 WeakPolarHBondContact CA-O 3.29Å; L174-V277 HydrophobicContact CD2-CB 4.07Å; L174-V277 HydrophobicContact CD2-CG1 3.71Å; L174-V277 HydrophobicContact CG-CB 4.39Å; L174-V277 HydrophobicContact CG-CG1 4.41Å; H275-V277 PolarHBondContact O-N 2.91Å; V277-K279 VanDerWaalsContact CG1-O 3.28Å; V277-K279 WeakPolarHBondContact CG1-O 3.47Å; V277-F304 HydrophobicContact CG1-CD1 4.08Å; V277-F304 HydrophobicContact CG1-CE1 4.18Å; V277-F304 HydrophobicContact CG2-CB 4.39Å; V277-F304 HydrophobicContact CG2-CD1 3.66Å; V277-F304 HydrophobicContact CG2-CG 4.45Å
278E92.5Very high94Very high135 Ų13550.9 Ų50.963%0.63127%0.269SS*.SBendtrans-74.6-32.5-171.7-74.8-169.8-173.100115.3R181R181-E278 PolarHBondContact NH2-O 3.5Å; R181-E278 IonicContact NH2-OE2 3.99Å
279K94.3Very high94.9Very high152 Ų15249.4 Ų49.466%0.66126%0.261SS*.SBendtrans-147.1150-172.3-63.2-175.7-176.2178.90109.5L174 V277L174-K279 VanDerWaalsContact CD2-C 3.41Å; L174-K279 WeakPolarHBondContact CD2-O 3.3Å; V277-K279 VanDerWaalsContact CG1-O 3.28Å; V277-K279 WeakPolarHBondContact CG1-O 3.47Å
280V96.4Very high95.3Very high39 Ų3947.3 Ų47.324%0.23625%0.247CC..PPolyproline II helixtrans-57.5128.6173.4-1740000108.6Y113 M116 M117 L174Y113-V280 HydrophobicContact CE2-CG1 4.01Å; M116-V280 HydrophobicContact CB-CG1 4.19Å; M116-V280 WeakPolarHBondContact O-CG2 3.48Å; M117-V280 HydrophobicContact CG-CG1 4.27Å; M117-V280 HydrophobicContact SD-CB 4.15Å; M117-V280 HydrophobicContact SD-CG1 3.57Å; M117-V280 VanDerWaalsContact SD-CG1 3.57Å; L174-V280 HydrophobicContact CD1-CG2 4.1Å; L174-V280 HydrophobicContact CD2-CG2 4.25Å
281P96.7Very high95.6Very high11 Ų1141.9 Ų41.97%0.07121%0.214CC..PPolyproline II helixtrans-64.1152.1179.325.1-33.5000111.4Y113 L170 I285 F286 F304Y113-P281 WeakPolarHBondContact CE2-O 3.22Å; Y113-P281 PolarHBondContact OH-O 3.23Å; L170-P281 HydrophobicContact CD2-CG 4.12Å; P281-I285 HydrophobicContact CB-CG2 4.21Å; P281-F286 HydrophobicContact CB-CB 4.4Å; P281-F286 HydrophobicContact CG-CB 4.04Å; P281-F286 HydrophobicContact CG-CD2 4.15Å; P281-F304 HydrophobicContact CB-CE1 4.3Å; P281-F304 HydrophobicContact CB-CE2 3.99Å; P281-F304 HydrophobicContact CB-CZ 3.55Å; P281-F304 HydrophobicContact CG-CE2 4.16Å; P281-F304 HydrophobicContact CG-CZ 4.04Å
282D95.2Very high95.8Very high51 Ų5140.8 Ų40.827%0.27321%0.207SC..PPolyproline II helixtrans-64.9157.717272.795.8000111.1R80 I284 I285 F286R80-D282 IonicContact NE-OD1 3.81Å; D282-I284 VanDerWaalsContact C-N 3.26Å; D282-I284 PolarHBondContact O-N 2.88Å; D282-I284 VanDerWaalsContact O-N 3.14Å; D282-I284 WeakPolarHBondContact OD1-CB 3.25Å; D282-I284 PolarHBondContact OD1-N 3.49Å; D282-I285 PolarHBondContact O-N 2.91Å; D282-I285 PolarHBondContact OD1-N 3.47Å; D282-I285 WeakPolarHBondContact OD2-CB 3.46Å; D282-I285 WeakPolarHBondContact OD2-CD1 3.22Å; D282-I285 WeakPolarHBondContact OD2-CG1 3.39Å; D282-F286 WeakPolarHBondContact O-CB 3.39Å; D282-F286 PolarHBondContact O-N 2.9Å
283P96.4Very high95.8Very high62 Ų6240.5 Ų40.540%0.40321%0.205SC..Hα-helixtrans-57.4-36.6-172.6-25.132.2000113.7Y113 F286 F287Y113-P283 HydrophobicContact CE1-CB 4.34Å; Y113-P283 HydrophobicContact CE1-CG 4Å; Y113-P283 VanDerWaalsContact OH-CD 3.24Å; Y113-P283 WeakPolarHBondContact OH-CD 3.5Å; Y113-P283 WeakPolarHBondContact OH-CG 3.43Å; P283-F286 PolarHBondContact O-N 3.27Å; P283-F287 HydrophobicContact CB-CD2 4.47Å; P283-F287 WeakPolarHBondContact O-CD2 3.31Å; P283-F287 PolarHBondContact O-N 3.38Å
284I97Very high95.9Very high49 Ų4935.3 Ų35.325%0.25118%0.183SC..Hα-helixtrans-67.2-47.9-178.1-68.5166.9000109.8R80 A83 L84 D282 F286 A288R80-I284 HydrophobicContact CG-CB 4.43Å; R80-I284 HydrophobicContact CG-CD1 4.39Å; R80-I284 HydrophobicContact CG-CG2 4.09Å; A83-I284 HydrophobicContact CB-CG2 4.06Å; L84-I284 HydrophobicContact CD2-CD1 4.14Å; L84-I284 HydrophobicContact CD2-CG1 4.18Å; L84-I284 HydrophobicContact CD2-CG2 3.63Å; L84-I284 HydrophobicContact CG-CG2 3.82Å; D282-I284 VanDerWaalsContact C-N 3.26Å; D282-I284 PolarHBondContact O-N 2.88Å; D282-I284 VanDerWaalsContact O-N 3.14Å; D282-I284 WeakPolarHBondContact OD1-CB 3.25Å; D282-I284 PolarHBondContact OD1-N 3.49Å; I284-F286 VanDerWaalsContact C-N 3.34Å; I284-A288 VanDerWaalsContact O-CB 3.23Å; I284-A288 WeakPolarHBondContact O-CB 3.4Å; I284-A288 PolarHBondContact O-N 3.32Å
285I97.7Very high95.8Very high19 Ų1929.5 Ų29.510%0.09715%0.153CC..Hα-helixtrans-66.1-39.6177.6-67.8-174.8000111A83 P281 D282 A288 Y289 F304 M308A83-I285 HydrophobicContact CB-CG1 4.35Å; P281-I285 HydrophobicContact CB-CG2 4.21Å; D282-I285 PolarHBondContact O-N 2.91Å; D282-I285 PolarHBondContact OD1-N 3.47Å; D282-I285 WeakPolarHBondContact OD2-CB 3.46Å; D282-I285 WeakPolarHBondContact OD2-CD1 3.22Å; D282-I285 WeakPolarHBondContact OD2-CG1 3.39Å; I285-A288 PolarHBondContact O-N 3.04Å; I285-Y289 PolarHBondContact O-N 3.3Å; I285-F304 HydrophobicContact CG2-CE2 3.76Å; I285-F304 HydrophobicContact CG2-CZ 3.68Å; I285-M308 HydrophobicContact CD1-CE 4.21Å; I285-M308 HydrophobicContact CD1-SD 4.34Å; I285-M308 HydrophobicContact CG2-SD 3.47Å; I285-M308 WeakPolarHBondContact CG2-SD 3.23Å
286F98Very high95.5Very high0 Ų029.7 Ų29.70%015%0.154CC..Hα-helixtrans-59.6-54.4177.4173.5-98.7000111.9S109 Y113 M116 L167 L170 P281 D282 P283 I284 A288 Y289 M290S109-F286 WeakPolarHBondContact O-CZ 3.4Å; Y113-F286 HydrophobicContact CD2-CB 3.97Å; Y113-F286 AromaticContact CD2-CD1 3.48Å; Y113-F286 HydrophobicContact CD2-CD1 3.48Å; Y113-F286 VanDerWaalsContact CD2-CD1 3.48Å; Y113-F286 AromaticContact CD2-CD2 3.57Å; Y113-F286 HydrophobicContact CD2-CD2 3.57Å; Y113-F286 AromaticContact CD2-CE1 3.81Å; Y113-F286 HydrophobicContact CD2-CE1 3.81Å; Y113-F286 AromaticContact CD2-CE2 3.87Å; Y113-F286 HydrophobicContact CD2-CE2 3.87Å; Y113-F286 AromaticContact CD2-CG 3.36Å; Y113-F286 HydrophobicContact CD2-CG 3.36Å; Y113-F286 AromaticContact CD2-CZ 3.98Å; Y113-F286 HydrophobicContact CD2-CZ 3.98Å; Y113-F286 HydrophobicContact CE2-CB 3.76Å; Y113-F286 HydrophobicContact CE2-CD1 4.1Å; Y113-F286 HydrophobicContact CE2-CD2 4.09Å; Y113-F286 AromaticContact CE2-CG 3.7Å; Y113-F286 HydrophobicContact CE2-CG 3.7Å; Y113-F286 AromaticContact CG-CD1 3.85Å; Y113-F286 HydrophobicContact CG-CD1 3.85Å; Y113-F286 AromaticContact CG-CE1 3.89Å; Y113-F286 HydrophobicContact CG-CE1 3.89Å; Y113-F286 HydrophobicContact CG-CG 4.2Å; Y113-F286 HydrophobicContact CG-CZ 4.26Å; M116-F286 HydrophobicContact CE-CE2 3.65Å; M116-F286 HydrophobicContact CE-CZ 4.16Å; L167-F286 HydrophobicContact CD2-CE2 4Å; L167-F286 HydrophobicContact CD2-CZ 3.69Å; L170-F286 HydrophobicContact CD2-CD2 3.88Å; L170-F286 HydrophobicContact CD2-CE2 3.92Å; P281-F286 HydrophobicContact CB-CB 4.4Å; P281-F286 HydrophobicContact CG-CB 4.04Å; P281-F286 HydrophobicContact CG-CD2 4.15Å; D282-F286 WeakPolarHBondContact O-CB 3.39Å; D282-F286 PolarHBondContact O-N 2.9Å; P283-F286 PolarHBondContact O-N 3.27Å; I284-F286 VanDerWaalsContact C-N 3.34Å; F286-A288 VanDerWaalsContact C-N 3.29Å; F286-A288 PolarHBondContact O-N 2.92Å; F286-Y289 WeakPolarHBondContact O-CB 3.45Å; F286-Y289 PolarHBondContact O-N 3.47Å; F286-M290 HydrophobicContact CD1-CG 4.38Å; F286-M290 HydrophobicContact CD2-CE 4.4Å; F286-M290 HydrophobicContact CE1-CG 3.89Å; F286-M290 HydrophobicContact CE2-CE 3.79Å; F286-M290 HydrophobicContact CE2-CG 4.16Å; F286-M290 HydrophobicContact CE2-SD 4.44Å; F286-M290 HydrophobicContact CZ-CE 4.17Å; F286-M290 HydrophobicContact CZ-CG 3.78Å; F286-M290 HydrophobicContact CZ-SD 4.23Å; F286-M290 WeakPolarHBondContact O-CG 3.25Å; F286-M290 PolarHBondContact O-N 2.92Å
287F97.2Very high95.3Very high48 Ų4829 Ų2921%0.21115%0.146CC..Hα-helixtrans-67.1-32.1-179.2-77-66.8000111.9P283 M290 L291P283-F287 HydrophobicContact CB-CD2 4.47Å; P283-F287 WeakPolarHBondContact O-CD2 3.31Å; P283-F287 PolarHBondContact O-N 3.38Å; F287-M290 PolarHBondContact O-N 3.07Å; F287-L291 WeakPolarHBondContact O-CB 3.28Å; F287-L291 WeakPolarHBondContact O-CG 3.19Å; F287-L291 PolarHBondContact O-N 3.46Å
288A97.4Very high94.8Very high0 Ų030.3 Ų30.30%015%0.154CC..Hα-helixtrans-63-42.7171.600000112.3A83 E86 T87 I284 I285 F286 M290 L291 Y292 Y307A83-A288 HydrophobicContact CB-CB 3.5Å; A83-A288 VanDerWaalsContact CB-CB 3.5Å; A83-A288 VanDerWaalsContact O-CB 3.26Å; A83-A288 WeakPolarHBondContact O-CB 3.31Å; E86-A288 HydrophobicContact CB-CB 4.38Å; T87-A288 WeakPolarHBondContact OG1-CA 3.37Å; T87-A288 VanDerWaalsContact OG1-CB 3.26Å; T87-A288 WeakPolarHBondContact OG1-CB 3.33Å; T87-A288 PolarHBondContact OG1-N 3.27Å; I284-A288 VanDerWaalsContact O-CB 3.23Å; I284-A288 WeakPolarHBondContact O-CB 3.4Å; I284-A288 PolarHBondContact O-N 3.32Å; I285-A288 PolarHBondContact O-N 3.04Å; F286-A288 VanDerWaalsContact C-N 3.29Å; F286-A288 PolarHBondContact O-N 2.92Å; A288-M290 VanDerWaalsContact C-N 3.3Å; A288-M290 PolarHBondContact O-N 3.07Å; A288-L291 CarbonylContact O-C 3.58Å; A288-L291 PolarHBondContact O-N 3.14Å; A288-Y292 WeakPolarHBondContact O-CA 2.95Å; A288-Y292 WeakPolarHBondContact O-CB 3.3Å; A288-Y292 PolarHBondContact O-N 2.99Å; A288-Y307 VanDerWaalsContact CB-OH 3.24Å; A288-Y307 WeakPolarHBondContact CB-OH 3.35Å
289Y97.5Very high94.1Very high0 Ų024 Ų240%013%0.125CC..Hα-helixtrans-64.2-35.8173.7173.2-124.2000112.4R166 I285 F286 L291 Y292 T302 F304 Y307R166-Y289 HydrophobicContact CB-CE1 3.73Å; R166-Y289 WeakPolarHBondContact CD-O 3.38Å; R166-Y289 HydrophobicContact CG-CE1 4.13Å; R166-Y289 HydrophobicContact CG-CE2 4.31Å; R166-Y289 PolarHBondContact NH1-O 3.09Å; I285-Y289 PolarHBondContact O-N 3.3Å; F286-Y289 WeakPolarHBondContact O-CB 3.45Å; F286-Y289 PolarHBondContact O-N 3.47Å; Y289-L291 VanDerWaalsContact C-N 3.32Å; Y289-L291 PolarHBondContact O-N 3.11Å; Y289-Y292 HydrophobicContact CD2-CE1 4.4Å; Y289-Y292 VanDerWaalsContact O-CD1 3.24Å; Y289-Y292 WeakPolarHBondContact O-CD1 3.46Å; Y289-T302 WeakPolarHBondContact CE2-O 3.46Å; Y289-T302 PolarHBondContact OH-O 3.25Å; Y289-F304 HydrophobicContact CD1-CB 4.36Å; Y289-F304 AromaticContact CD1-CD2 3.56Å; Y289-F304 HydrophobicContact CD1-CD2 3.56Å; Y289-F304 HydrophobicContact CD1-CE2 4.39Å; Y289-F304 HydrophobicContact CD1-CG 4.43Å; Y289-F304 HydrophobicContact CD2-CD2 4.2Å; Y289-F304 HydrophobicContact CE1-CB 3.98Å; Y289-F304 HydrophobicContact CE1-CD2 4.06Å; Y289-F304 HydrophobicContact CE2-CB 4.45Å; Y289-F304 AromaticContact CG-CD2 3.65Å; Y289-F304 HydrophobicContact CG-CD2 3.65Å; Y289-F304 HydrophobicContact CG-CE2 4.3Å; Y289-F304 PolarHBondContact OH-N 3.09Å; Y289-Y307 AromaticContact CD2-CD1 3.72Å; Y289-Y307 HydrophobicContact CD2-CD1 3.72Å; Y289-Y307 HydrophobicContact CD2-CD2 4.22Å; Y289-Y307 HydrophobicContact CD2-CE1 4.48Å; Y289-Y307 AromaticContact CD2-CG 3.57Å; Y289-Y307 HydrophobicContact CD2-CG 3.57Å; Y289-Y307 HydrophobicContact CE2-CG 4.37Å; Y289-Y307 HydrophobicContact CG-CD1 4.08Å; Y289-Y307 HydrophobicContact CG-CG 4.38Å
290M97Very high93.8Very high3 Ų316.8 Ų16.82%0.0159%0.094CC..Hα-helixtrans-68.9-31.1175.9-68.1-63.5126.900112.6Q163 R166 L167 F286 F287 A288Q163-M290 HydrophobicContact CG-SD 3.77Å; R166-M290 HydrophobicContact CB-CE 3.69Å; R166-M290 HydrophobicContact CB-SD 4.17Å; R166-M290 PolarHBondContact NH1-O 3.38Å; L167-M290 HydrophobicContact CD2-CE 3.71Å; L167-M290 HydrophobicContact CD2-SD 3.53Å; L167-M290 VanDerWaalsContact CD2-SD 3.53Å; L167-M290 HydrophobicContact CG-CE 4.27Å; L167-M290 HydrophobicContact CG-SD 3.87Å; F286-M290 HydrophobicContact CD1-CG 4.38Å; F286-M290 HydrophobicContact CD2-CE 4.4Å; F286-M290 HydrophobicContact CE1-CG 3.89Å; F286-M290 HydrophobicContact CE2-CE 3.79Å; F286-M290 HydrophobicContact CE2-CG 4.16Å; F286-M290 HydrophobicContact CE2-SD 4.44Å; F286-M290 HydrophobicContact CZ-CE 4.17Å; F286-M290 HydrophobicContact CZ-CG 3.78Å; F286-M290 HydrophobicContact CZ-SD 4.23Å; F286-M290 WeakPolarHBondContact O-CG 3.25Å; F286-M290 PolarHBondContact O-N 2.92Å; F287-M290 PolarHBondContact O-N 3.07Å; A288-M290 VanDerWaalsContact C-N 3.3Å; A288-M290 PolarHBondContact O-N 3.07Å
291L96.2Very high93.7Very high2 Ų215 Ų151%0.018%0.083CC..Hα-helixtrans-122.87.3-166.1-59.1172.9000114.9T87 G90 L91 L94 L106 F287 A288 Y289 F293 V296T87-L291 HydrophobicContact CG2-CD1 4.25Å; G90-L291 WeakPolarHBondContact CA-O 3.4Å; L91-L291 HydrophobicContact CD2-CD1 3.82Å; L91-L291 HydrophobicContact CG-CD1 4.28Å; L94-L291 HydrophobicContact CD1-CD2 3.67Å; L106-L291 HydrophobicContact CD2-CD1 3.88Å; F287-L291 WeakPolarHBondContact O-CB 3.28Å; F287-L291 WeakPolarHBondContact O-CG 3.19Å; F287-L291 PolarHBondContact O-N 3.46Å; A288-L291 CarbonylContact O-C 3.58Å; A288-L291 PolarHBondContact O-N 3.14Å; Y289-L291 VanDerWaalsContact C-N 3.32Å; Y289-L291 PolarHBondContact O-N 3.11Å; L291-F293 PolarHBondContact O-N 3.22Å; L291-V296 WeakPolarHBondContact O-CG2 3.03Å
292Y95Very high93.6Very high0 Ų015 Ų150%08%0.083CC..  trans-54.1130.8-175.970.1-99.3000112E86 R166 A288 Y289 H294 G295 V296 P300 T302 Y307E86-Y292 WeakPolarHBondContact OE2-CB 3.39Å; R166-Y292 PolarHBondContact NH2-OH 3.25Å; A288-Y292 WeakPolarHBondContact O-CA 2.95Å; A288-Y292 WeakPolarHBondContact O-CB 3.3Å; A288-Y292 PolarHBondContact O-N 2.99Å; Y289-Y292 HydrophobicContact CD2-CE1 4.4Å; Y289-Y292 VanDerWaalsContact O-CD1 3.24Å; Y289-Y292 WeakPolarHBondContact O-CD1 3.46Å; Y292-H294 VanDerWaalsContact C-N 3.32Å; Y292-H294 AromaticContact CD2-CD2 3.64Å; Y292-H294 AromaticContact CD2-CE1 3.11Å; Y292-H294 WeakPolarHBondContact CD2-CE1 3.42Å; Y292-H294 AromaticContact CD2-CG 3.64Å; Y292-H294 AromaticContact CD2-ND1 3.32Å; Y292-H294 VanDerWaalsContact CD2-ND1 3.32Å; Y292-H294 WeakPolarHBondContact CD2-ND1 3.2Å; Y292-H294 AromaticContact CD2-NE2 3.32Å; Y292-H294 VanDerWaalsContact CD2-NE2 3.32Å; Y292-H294 WeakPolarHBondContact CD2-NE2 3.27Å; Y292-H294 AromaticContact CE2-CE1 3.24Å; Y292-H294 WeakPolarHBondContact CE2-CE1 3.41Å; Y292-H294 AromaticContact CE2-ND1 3.28Å; Y292-H294 VanDerWaalsContact CE2-ND1 3.28Å; Y292-H294 WeakPolarHBondContact CE2-ND1 3.48Å; Y292-H294 AromaticContact CE2-NE2 3.95Å; Y292-H294 AromaticContact CG-NE2 3.99Å; Y292-H294 PolarHBondContact O-N 3.41Å; Y292-G295 PolarHBondContact O-N 2.97Å; Y292-V296 WeakPolarHBondContact O-CB 3.34Å; Y292-V296 PolarHBondContact O-N 3.32Å; Y292-P300 PolarHBondContact OH-O 2.96Å; Y292-P300 VanDerWaalsContact OH-O 3.05Å; Y292-T302 PolarHBondContact OH-OG1 3.35Å; Y292-Y307 AromaticContact CD1-CD2 3.84Å; Y292-Y307 HydrophobicContact CD1-CD2 3.84Å; Y292-Y307 AromaticContact CD1-CE2 3.82Å; Y292-Y307 HydrophobicContact CD1-CE2 3.82Å; Y292-Y307 HydrophobicContact CE1-CD2 4.3Å; Y292-Y307 HydrophobicContact CG-CD2 4.23Å; Y292-Y307 AromaticContact CG-CE2 3.91Å; Y292-Y307 HydrophobicContact CG-CE2 3.91Å
293F95.1Very high93.7Very high2 Ų212.6 Ų12.61%0.0097%0.07CC..G310 helixtrans-64.9-34-161.971-89.5000113.3S61 L64 M68 E86 F89 L93 L291 G295 V395S61-F293 VanDerWaalsContact O-CE2 3.28Å; S61-F293 WeakPolarHBondContact O-CE2 3.02Å; S61-F293 VanDerWaalsContact OG-CD2 3.3Å; S61-F293 WeakPolarHBondContact OG-CD2 3.21Å; S61-F293 WeakPolarHBondContact OG-CE2 3.43Å; L64-F293 HydrophobicContact CB-CD2 4.25Å; L64-F293 HydrophobicContact CB-CE2 3.97Å; L64-F293 HydrophobicContact CB-CZ 4.28Å; M68-F293 HydrophobicContact CG-CE1 3.92Å; M68-F293 HydrophobicContact CG-CZ 4.22Å; E86-F293 WeakPolarHBondContact OE1-CE1 3.09Å; E86-F293 WeakPolarHBondContact OE2-CD1 3.36Å; E86-F293 WeakPolarHBondContact OE2-CE1 3.41Å; F89-F293 HydrophobicContact CB-CB 3.8Å; F89-F293 HydrophobicContact CB-CD1 3.78Å; F89-F293 HydrophobicContact CB-CG 3.89Å; F89-F293 HydrophobicContact CD2-CD1 4.04Å; F89-F293 HydrophobicContact CD2-CE1 4.16Å; F89-F293 HydrophobicContact CG-CD1 4.44Å; L93-F293 HydrophobicContact CD1-CB 3.9Å; L93-F293 HydrophobicContact CD1-CD2 4.38Å; L291-F293 PolarHBondContact O-N 3.22Å; F293-G295 PolarHBondContact O-N 2.81Å; F293-V395 HydrophobicContact CZ-CG2 4.15Å
294H93.4Very high93.7Very high5 Ų510.4 Ų10.42%0.0235%0.054CC..G310 helixtrans-77.2-2.4-173.859.882.7000114.6E86 Y292 Y310 N391 V395E86-H294 IonicContact OE1-CD2 3.84Å; E86-H294 IonicContact OE2-CD2 3.01Å; E86-H294 IonicContact OE2-NE2 2.83Å; Y292-H294 VanDerWaalsContact C-N 3.32Å; Y292-H294 AromaticContact CD2-CD2 3.64Å; Y292-H294 AromaticContact CD2-CE1 3.11Å; Y292-H294 WeakPolarHBondContact CD2-CE1 3.42Å; Y292-H294 AromaticContact CD2-CG 3.64Å; Y292-H294 AromaticContact CD2-ND1 3.32Å; Y292-H294 VanDerWaalsContact CD2-ND1 3.32Å; Y292-H294 WeakPolarHBondContact CD2-ND1 3.2Å; Y292-H294 AromaticContact CD2-NE2 3.32Å; Y292-H294 VanDerWaalsContact CD2-NE2 3.32Å; Y292-H294 WeakPolarHBondContact CD2-NE2 3.27Å; Y292-H294 AromaticContact CE2-CE1 3.24Å; Y292-H294 WeakPolarHBondContact CE2-CE1 3.41Å; Y292-H294 AromaticContact CE2-ND1 3.28Å; Y292-H294 VanDerWaalsContact CE2-ND1 3.28Å; Y292-H294 WeakPolarHBondContact CE2-ND1 3.48Å; Y292-H294 AromaticContact CE2-NE2 3.95Å; Y292-H294 AromaticContact CG-NE2 3.99Å; Y292-H294 PolarHBondContact O-N 3.41Å; H294-Y310 AromaticContact NE2-CE1 3.56Å; H294-Y310 AromaticContact NE2-CZ 3.98Å; H294-N391 HydrophobicContact CB-CB 4.1Å; H294-V395 HydrophobicContact CB-CG1 4.23Å
295G91.1Very high93.7Very high2 Ų29 Ų92%0.0215%0.048CC..G310 helixtrans-146.827.2172.900000112.5R166 Y292 F293 G299R166-G295 PolarHBondContact NH2-O 3.37Å; Y292-G295 PolarHBondContact O-N 2.97Å; F293-G295 PolarHBondContact O-N 2.81Å; G295-G299 WeakPolarHBondContact CA-O 3.28Å
296V90.3Very high93.6Very high7 Ų78.7 Ų8.74%0.0425%0.046CC..THydrogen-bonded Turntrans-76.8-23.9-171.3830000113.6L94 L291 Y292L94-V296 HydrophobicContact CD1-CG2 3.37Å; L94-V296 HydrophobicContact CD2-CB 4.39Å; L94-V296 HydrophobicContact CD2-CG1 3.92Å; L94-V296 HydrophobicContact CD2-CG2 3.77Å; L94-V296 HydrophobicContact CG-CB 4.34Å; L94-V296 HydrophobicContact CG-CG1 3.94Å; L94-V296 HydrophobicContact CG-CG2 3.5Å; L94-V296 VanDerWaalsContact CG-CG2 3.5Å; L291-V296 WeakPolarHBondContact O-CG2 3.03Å; Y292-V296 WeakPolarHBondContact O-CB 3.34Å; Y292-V296 PolarHBondContact O-N 3.32Å
297F90.3Very high93.6Very high11 Ų118.9 Ų8.95%0.0485%0.047CC..THydrogen-bonded Turntrans-88.4-72.2-172-62.7-58.1000113.7Y54 S57 L93 L94 C97 F98 G158 P159Y54-F297 HydrophobicContact CD2-CB 4.09Å; Y54-F297 HydrophobicContact CD2-CD2 4.05Å; Y54-F297 AromaticContact CD2-CG 3.99Å; Y54-F297 HydrophobicContact CD2-CG 3.99Å; Y54-F297 HydrophobicContact CE2-CB 3.55Å; Y54-F297 AromaticContact CE2-CD2 3.87Å; Y54-F297 HydrophobicContact CE2-CD2 3.87Å; Y54-F297 AromaticContact CE2-CG 3.84Å; Y54-F297 HydrophobicContact CE2-CG 3.84Å; S57-F297 VanDerWaalsContact CB-CE2 3.49Å; S57-F297 VanDerWaalsContact CB-CZ 3.49Å; L93-F297 HydrophobicContact CB-CE2 4.47Å; L93-F297 HydrophobicContact CB-CZ 3.86Å; L93-F297 HydrophobicContact CD1-CE2 4.47Å; L94-F297 HydrophobicContact CD2-CD1 4.27Å; L94-F297 HydrophobicContact CD2-CE1 4.22Å; C97-F297 HydrophobicContact CB-CD1 4.42Å; C97-F297 HydrophobicContact CB-CE1 3.58Å; C97-F297 HydrophobicContact CB-CZ 4.19Å; C97-F297 VanDerWaalsContact SG-CE1 3.54Å; C97-F297 VanDerWaalsContact SG-CZ 3.58Å; F98-F297 AromaticContact CE2-CD1 3.61Å; F98-F297 HydrophobicContact CE2-CD1 3.61Å; F98-F297 AromaticContact CE2-CE1 3.96Å; F98-F297 HydrophobicContact CE2-CE1 3.96Å; F98-F297 HydrophobicContact CZ-CD1 4.07Å; G158-F297 CarbonylContact C-O 3.49Å; P159-F297 VanDerWaalsContact CA-O 3.28Å; P159-F297 WeakPolarHBondContact CA-O 3.48Å; P159-F297 WeakPolarHBondContact CD-O 3.44Å; P159-F297 VanDerWaalsContact CG-O 3.27Å; P159-F297 WeakPolarHBondContact CG-O 3.1Å; P159-F297 VanDerWaalsContact N-O 3.13Å
298V85.3Confident93.5Very high38 Ų387.6 Ų7.623%0.234%0.042CC..THydrogen-bonded Turntrans-123.520.6-174.1-650000111.5Y54 A384Y54-V298 HydrophobicContact CE2-CG2 4.29Å; Y54-V298 WeakPolarHBondContact OH-CG2 3.41Å; V298-A384 HydrophobicContact CG2-CB 4.1Å
299G79.2Confident93.4Very high2 Ų211.2 Ų11.22%0.0216%0.061CC..  trans87.4-151.6-176.500000111.9G295 A388G295-G299 WeakPolarHBondContact CA-O 3.28Å; G299-A388 WeakPolarHBondContact O-CB 3.18Å
300P87.9Confident93.4Very high1 Ų111.3 Ų11.31%0.0066%0.062CC..  cis-64.7155.83.330.2-38000112.6Y292 A388 I414 N416 S438Y292-P300 PolarHBondContact OH-O 2.96Å; Y292-P300 VanDerWaalsContact OH-O 3.05Å; P300-A388 VanDerWaalsContact CD-CB 3.47Å; P300-I414 HydrophobicContact CG-CB 4.37Å; P300-I414 HydrophobicContact CG-CD1 3.38Å; P300-I414 HydrophobicContact CG-CG1 3.53Å; P300-I414 WeakPolarHBondContact CG-O 3.21Å; P300-N416 HydrophobicContact CB-CB 4.09Å; P300-S438 WeakPolarHBondContact CB-OG 3.47Å
301F93.5Very high93.3Very high3 Ų311.1 Ų11.11%0.0136%0.061CC..  trans-66.1138.6166159-97.2000110.1V162 Q165 R166 S169 F303 S438 W442V162-F301 HydrophobicContact CG1-CB 4.47Å; Q165-F301 HydrophobicContact CB-CB 4.4Å; Q165-F301 HydrophobicContact CB-CD2 3.58Å; Q165-F301 HydrophobicContact CB-CE2 4.05Å; Q165-F301 HydrophobicContact CB-CG 4.02Å; R166-F301 HydrophobicContact CG-CD2 3.92Å; R166-F301 HydrophobicContact CG-CE2 4.29Å; S169-F301 WeakPolarHBondContact OG-CE2 3.33Å; S169-F301 WeakPolarHBondContact OG-CZ 3.5Å; F301-F303 HydrophobicContact CE1-CD1 4.2Å; F301-F303 HydrophobicContact CE1-CD2 4.11Å; F301-F303 AromaticContact CE1-CE1 3.98Å; F301-F303 HydrophobicContact CE1-CE1 3.98Å; F301-F303 AromaticContact CE1-CE2 3.87Å; F301-F303 HydrophobicContact CE1-CE2 3.87Å; F301-F303 HydrophobicContact CE1-CG 4.27Å; F301-F303 AromaticContact CE1-CZ 3.81Å; F301-F303 HydrophobicContact CE1-CZ 3.81Å; F301-F303 AromaticContact CZ-CD1 3.69Å; F301-F303 HydrophobicContact CZ-CD1 3.69Å; F301-F303 HydrophobicContact CZ-CD2 4.33Å; F301-F303 AromaticContact CZ-CE1 3.7Å; F301-F303 HydrophobicContact CZ-CE1 3.7Å; F301-F303 HydrophobicContact CZ-CE2 4.33Å; F301-F303 HydrophobicContact CZ-CG 4.03Å; F301-F303 HydrophobicContact CZ-CZ 4.04Å; F301-S438 WeakPolarHBondContact CD1-O 3.32Å; F301-S438 VanDerWaalsContact O-CB 3.28Å; F301-S438 WeakPolarHBondContact O-CB 3.29Å; F301-S438 PolarHBondContact O-OG 2.86Å; F301-W442 HydrophobicContact CD1-CB 4.09Å; F301-W442 HydrophobicContact CE1-CB 3.85Å; F301-W442 HydrophobicContact CZ-CB 4.28Å
302T94.9Very high93.3Very high10 Ų1016 Ų166%0.0618%0.082CC..  trans-131.4147.2173.355.20000108.2Y289 Y292 I414Y289-T302 WeakPolarHBondContact CE2-O 3.46Å; Y289-T302 PolarHBondContact OH-O 3.25Å; Y292-T302 PolarHBondContact OH-OG1 3.35Å; T302-I414 HydrophobicContact CG2-CD1 3.9Å
303F97Very high93.2Very high0 Ų016 Ų160%08%0.082CC..  trans-70.7154.5174.1-71.2-81.1000110.7H275 F301 S305 E306 Y307 R441 E445H275-F303 HydrophobicContact CB-CB 4.23Å; H275-F303 HydrophobicContact CB-CD1 4.09Å; H275-F303 HydrophobicContact CB-CG 4.13Å; H275-F303 AromaticContact CD2-CD2 3.88Å; H275-F303 AromaticContact CD2-CG 3.92Å; H275-F303 AromaticContact CE1-CD2 3.33Å; H275-F303 WeakPolarHBondContact CE1-CD2 3.4Å; H275-F303 AromaticContact CE1-CE2 3.33Å; H275-F303 WeakPolarHBondContact CE1-CE2 3.43Å; H275-F303 AromaticContact CE1-CG 3.94Å; H275-F303 AromaticContact CE1-CZ 3.95Å; H275-F303 AromaticContact CG-CD1 3.98Å; H275-F303 AromaticContact CG-CD2 3.85Å; H275-F303 AromaticContact CG-CG 3.66Å; H275-F303 AromaticContact ND1-CD1 3.86Å; H275-F303 AromaticContact ND1-CD2 3.5Å; H275-F303 WeakPolarHBondContact ND1-CD2 3.41Å; H275-F303 AromaticContact ND1-CE1 3.88Å; H275-F303 AromaticContact ND1-CE2 3.51Å; H275-F303 AromaticContact ND1-CG 3.67Å; H275-F303 AromaticContact ND1-CZ 3.7Å; H275-F303 AromaticContact NE2-CD2 3.56Å; F301-F303 HydrophobicContact CE1-CD1 4.2Å; F301-F303 HydrophobicContact CE1-CD2 4.11Å; F301-F303 AromaticContact CE1-CE1 3.98Å; F301-F303 HydrophobicContact CE1-CE1 3.98Å; F301-F303 AromaticContact CE1-CE2 3.87Å; F301-F303 HydrophobicContact CE1-CE2 3.87Å; F301-F303 HydrophobicContact CE1-CG 4.27Å; F301-F303 AromaticContact CE1-CZ 3.81Å; F301-F303 HydrophobicContact CE1-CZ 3.81Å; F301-F303 AromaticContact CZ-CD1 3.69Å; F301-F303 HydrophobicContact CZ-CD1 3.69Å; F301-F303 HydrophobicContact CZ-CD2 4.33Å; F301-F303 AromaticContact CZ-CE1 3.7Å; F301-F303 HydrophobicContact CZ-CE1 3.7Å; F301-F303 HydrophobicContact CZ-CE2 4.33Å; F301-F303 HydrophobicContact CZ-CG 4.03Å; F301-F303 HydrophobicContact CZ-CZ 4.04Å; F303-S305 VanDerWaalsContact C-N 3.29Å; F303-S305 PolarHBondContact O-N 2.92Å; F303-E306 HydrophobicContact CB-CG 4.1Å; F303-E306 PolarHBondContact N-OE2 2.95Å; F303-E306 WeakPolarHBondContact O-CB 3.28Å; F303-E306 PolarHBondContact O-N 3.42Å; F303-Y307 PolarHBondContact O-N 2.79Å; F303-R441 HydrophobicContact CE2-CB 4.11Å; F303-R441 HydrophobicContact CZ-CB 4.39Å; F303-E445 HydrophobicContact CZ-CB 4.33Å; F303-E445 HydrophobicContact CZ-CG 4.12Å; F303-E445 VanDerWaalsContact CZ-OE1 3.29Å; F303-E445 WeakPolarHBondContact CZ-OE1 3.29Å; F303-E445 WeakPolarHBondContact CZ-OE2 3.37Å
304F97.6Very high93.2Very high16 Ų1617.3 Ų17.37%0.079%0.087CC..Hα-helixtrans-59.5-39-179.1178.5-101.2000112.7L170 V277 P281 I285 Y289 E306 Y307 M308L170-F304 HydrophobicContact CD1-CB 3.83Å; L170-F304 HydrophobicContact CD1-CD1 4.03Å; L170-F304 HydrophobicContact CD1-CD2 4.35Å; L170-F304 HydrophobicContact CD1-CG 3.79Å; V277-F304 HydrophobicContact CG1-CD1 4.08Å; V277-F304 HydrophobicContact CG1-CE1 4.18Å; V277-F304 HydrophobicContact CG2-CB 4.39Å; V277-F304 HydrophobicContact CG2-CD1 3.66Å; V277-F304 HydrophobicContact CG2-CG 4.45Å; P281-F304 HydrophobicContact CB-CE1 4.3Å; P281-F304 HydrophobicContact CB-CE2 3.99Å; P281-F304 HydrophobicContact CB-CZ 3.55Å; P281-F304 HydrophobicContact CG-CE2 4.16Å; P281-F304 HydrophobicContact CG-CZ 4.04Å; I285-F304 HydrophobicContact CG2-CE2 3.76Å; I285-F304 HydrophobicContact CG2-CZ 3.68Å; Y289-F304 HydrophobicContact CD1-CB 4.36Å; Y289-F304 AromaticContact CD1-CD2 3.56Å; Y289-F304 HydrophobicContact CD1-CD2 3.56Å; Y289-F304 HydrophobicContact CD1-CE2 4.39Å; Y289-F304 HydrophobicContact CD1-CG 4.43Å; Y289-F304 HydrophobicContact CD2-CD2 4.2Å; Y289-F304 HydrophobicContact CE1-CB 3.98Å; Y289-F304 HydrophobicContact CE1-CD2 4.06Å; Y289-F304 HydrophobicContact CE2-CB 4.45Å; Y289-F304 AromaticContact CG-CD2 3.65Å; Y289-F304 HydrophobicContact CG-CD2 3.65Å; Y289-F304 HydrophobicContact CG-CE2 4.3Å; Y289-F304 PolarHBondContact OH-N 3.09Å; F304-E306 PolarHBondContact O-N 3.29Å; F304-Y307 PolarHBondContact O-N 3.17Å; F304-M308 HydrophobicContact CD1-CG 4.07Å; F304-M308 HydrophobicContact CE1-CG 3.52Å; F304-M308 HydrophobicContact CE1-SD 4.34Å; F304-M308 HydrophobicContact CE2-CG 4.04Å; F304-M308 HydrophobicContact CE2-SD 4.26Å; F304-M308 HydrophobicContact CZ-CG 3.49Å; F304-M308 VanDerWaalsContact CZ-CG 3.49Å; F304-M308 HydrophobicContact CZ-SD 3.76Å; F304-M308 WeakPolarHBondContact O-CB 3.32Å; F304-M308 WeakPolarHBondContact O-CG 3.49Å; F304-M308 PolarHBondContact O-N 2.95Å
305S96.3Very high93Very high19 Ų1924.3 Ų24.313%0.13313%0.13CC..Hα-helixtrans-61.5-43.8176.656.20000111.9H275 F303 Y307 M308 D309H275-S305 WeakPolarHBondContact CA-OG 3.39Å; F303-S305 VanDerWaalsContact C-N 3.29Å; F303-S305 PolarHBondContact O-N 2.92Å; S305-Y307 VanDerWaalsContact C-N 3.35Å; S305-Y307 PolarHBondContact O-N 3.4Å; S305-M308 WeakPolarHBondContact O-CB 3.16Å; S305-M308 PolarHBondContact O-N 3.45Å; S305-M308 VanDerWaalsContact O-N 3.14Å; S305-D309 PolarHBondContact O-N 2.87Å
306E96Very high92.9Very high13 Ų1328 Ų286%0.06116%0.156CC..Hα-helixtrans-64.7-39.2177.5-56.2175.1143.600111.9H275 F303 F304 M308 D309 Y310 N413 R441H275-E306 IonicContact NE2-OE1 3.84Å; F303-E306 HydrophobicContact CB-CG 4.1Å; F303-E306 PolarHBondContact N-OE2 2.95Å; F303-E306 WeakPolarHBondContact O-CB 3.28Å; F303-E306 PolarHBondContact O-N 3.42Å; F304-E306 PolarHBondContact O-N 3.29Å; E306-M308 VanDerWaalsContact C-N 3.34Å; E306-D309 PolarHBondContact O-N 3.37Å; E306-Y310 PolarHBondContact O-N 3.49Å; E306-Y310 VanDerWaalsContact O-N 3.13Å; E306-N413 PolarHBondContact OE1-ND2 2.85Å; E306-N413 PolarHBondContact OE1-OD1 3.37Å; E306-R441 IonicContact OE1-CZ 3.96Å; E306-R441 VanDerWaalsContact OE1-CZ 3.3Å; E306-R441 IonicContact OE1-NH1 3.7Å; E306-R441 PolarHBondContact OE1-NH1 2.9Å; E306-R441 IonicContact OE1-NH2 3.59Å; E306-R441 PolarHBondContact OE1-NH2 3.05Å; E306-R441 IonicContact OE2-NH1 3.51Å; E306-R441 IonicContact OE2-NH2 3.77Å
307Y96.5Very high93Very high4 Ų436.1 Ų36.12%0.01619%0.186CC..Hα-helixtrans-63-42.4172.6172.8-102.8000111.4A288 Y289 Y292 F303 F304 S305 D309 Y310 L311A288-Y307 VanDerWaalsContact CB-OH 3.24Å; A288-Y307 WeakPolarHBondContact CB-OH 3.35Å; Y289-Y307 AromaticContact CD2-CD1 3.72Å; Y289-Y307 HydrophobicContact CD2-CD1 3.72Å; Y289-Y307 HydrophobicContact CD2-CD2 4.22Å; Y289-Y307 HydrophobicContact CD2-CE1 4.48Å; Y289-Y307 AromaticContact CD2-CG 3.57Å; Y289-Y307 HydrophobicContact CD2-CG 3.57Å; Y289-Y307 HydrophobicContact CE2-CG 4.37Å; Y289-Y307 HydrophobicContact CG-CD1 4.08Å; Y289-Y307 HydrophobicContact CG-CG 4.38Å; Y292-Y307 AromaticContact CD1-CD2 3.84Å; Y292-Y307 HydrophobicContact CD1-CD2 3.84Å; Y292-Y307 AromaticContact CD1-CE2 3.82Å; Y292-Y307 HydrophobicContact CD1-CE2 3.82Å; Y292-Y307 HydrophobicContact CE1-CD2 4.3Å; Y292-Y307 HydrophobicContact CG-CD2 4.23Å; Y292-Y307 AromaticContact CG-CE2 3.91Å; Y292-Y307 HydrophobicContact CG-CE2 3.91Å; F303-Y307 PolarHBondContact O-N 2.79Å; F304-Y307 PolarHBondContact O-N 3.17Å; S305-Y307 VanDerWaalsContact C-N 3.35Å; S305-Y307 PolarHBondContact O-N 3.4Å; Y307-D309 VanDerWaalsContact C-N 3.34Å; Y307-D309 PolarHBondContact O-N 2.8Å; Y307-Y310 HydrophobicContact CD2-CD1 4.23Å; Y307-Y310 HydrophobicContact CE2-CD1 4.21Å; Y307-Y310 HydrophobicContact CE2-CE1 4.42Å; Y307-Y310 WeakPolarHBondContact O-CB 3.14Å; Y307-Y310 PolarHBondContact O-N 3.13Å; Y307-L311 HydrophobicContact CE1-CD2 4.2Å; Y307-L311 WeakPolarHBondContact O-CB 3.46Å; Y307-L311 PolarHBondContact O-N 3.36Å
308M96.7Very high93.1Very high22 Ų2240.6 Ų40.611%0.10821%0.207CC..Hα-helixtrans-64.8-36.9176.8-77.7-58-55.800112.8I285 F304 S305 E306 L311 K312I285-M308 HydrophobicContact CD1-CE 4.21Å; I285-M308 HydrophobicContact CD1-SD 4.34Å; I285-M308 HydrophobicContact CG2-SD 3.47Å; I285-M308 WeakPolarHBondContact CG2-SD 3.23Å; F304-M308 HydrophobicContact CD1-CG 4.07Å; F304-M308 HydrophobicContact CE1-CG 3.52Å; F304-M308 HydrophobicContact CE1-SD 4.34Å; F304-M308 HydrophobicContact CE2-CG 4.04Å; F304-M308 HydrophobicContact CE2-SD 4.26Å; F304-M308 HydrophobicContact CZ-CG 3.49Å; F304-M308 VanDerWaalsContact CZ-CG 3.49Å; F304-M308 HydrophobicContact CZ-SD 3.76Å; F304-M308 WeakPolarHBondContact O-CB 3.32Å; F304-M308 WeakPolarHBondContact O-CG 3.49Å; F304-M308 PolarHBondContact O-N 2.95Å; S305-M308 WeakPolarHBondContact O-CB 3.16Å; S305-M308 PolarHBondContact O-N 3.45Å; S305-M308 VanDerWaalsContact O-N 3.14Å; E306-M308 VanDerWaalsContact C-N 3.34Å; M308-L311 HydrophobicContact CE-CD2 4.43Å; M308-L311 PolarHBondContact O-N 3.42Å; M308-L311 HydrophobicContact SD-CD2 4.04Å; M308-K312 HydrophobicContact CE-CD 4.31Å; M308-K312 HydrophobicContact CE-CG 4.39Å; M308-K312 WeakPolarHBondContact O-CB 3.32Å; M308-K312 VanDerWaalsContact O-CG 3.28Å; M308-K312 WeakPolarHBondContact O-CG 3.21Å; M308-K312 PolarHBondContact O-N 2.86Å
309D95.7Very high93.5Very high75 Ų7539.4 Ų39.440%0.40120%0.199SC..Hα-helixtrans-62.2-46.7174.3-71.5-20.8000110.8S305 E306 Y307 L311 K312 G313 Y314S305-D309 PolarHBondContact O-N 2.87Å; E306-D309 PolarHBondContact O-N 3.37Å; Y307-D309 VanDerWaalsContact C-N 3.34Å; Y307-D309 PolarHBondContact O-N 2.8Å; D309-L311 VanDerWaalsContact C-N 3.34Å; D309-L311 PolarHBondContact O-N 3.11Å; D309-K312 PolarHBondContact O-N 3.31Å; D309-G313 PolarHBondContact O-N 2.97Å; D309-Y314 HydrophobicContact CB-CD1 3.74Å; D309-Y314 HydrophobicContact CB-CE1 3.93Å; D309-Y314 PolarHBondContact O-N 2.82Å
310Y95.6Very high94.1Very high2 Ų239.8 Ų39.81%0.00820%0.201CC..Hα-helixtrans-55.8-48.4171.7156.6-108.6000111.9R82 E86 H294 E306 Y307 K312 G313 L319 V395 A397R82-Y310 PolarHBondContact NH2-OH 2.92Å; E86-Y310 VanDerWaalsContact OE1-CE1 3.29Å; E86-Y310 WeakPolarHBondContact OE1-CE1 3.41Å; E86-Y310 VanDerWaalsContact OE1-CZ 3.31Å; E86-Y310 PolarHBondContact OE1-OH 3.25Å; H294-Y310 AromaticContact NE2-CE1 3.56Å; H294-Y310 AromaticContact NE2-CZ 3.98Å; E306-Y310 PolarHBondContact O-N 3.49Å; E306-Y310 VanDerWaalsContact O-N 3.13Å; Y307-Y310 HydrophobicContact CD2-CD1 4.23Å; Y307-Y310 HydrophobicContact CE2-CD1 4.21Å; Y307-Y310 HydrophobicContact CE2-CE1 4.42Å; Y307-Y310 WeakPolarHBondContact O-CB 3.14Å; Y307-Y310 PolarHBondContact O-N 3.13Å; Y310-K312 VanDerWaalsContact C-N 3.28Å; Y310-K312 PolarHBondContact O-N 3.41Å; Y310-G313 PolarHBondContact O-N 2.91Å; Y310-G313 VanDerWaalsContact O-N 3.14Å; Y310-L319 HydrophobicContact CD2-CD2 3.81Å; Y310-L319 HydrophobicContact CE2-CD2 3.95Å; Y310-V395 HydrophobicContact CE2-CG1 4.18Å; Y310-V395 HydrophobicContact CE2-CG2 3.89Å; Y310-V395 WeakPolarHBondContact OH-CG2 3.48Å; Y310-A397 HydrophobicContact CD2-CB 4.01Å; Y310-A397 HydrophobicContact CG-CB 4.09Å
311L95.8Very high94.3Very high0 Ų043.7 Ų43.70%023%0.227CC..Hα-helixtrans-63.4-36.5-175.9-166.167.5000111.9P79 R82 A83 E86 Y307 M308 D309P79-L311 HydrophobicContact CB-CD2 3.8Å; P79-L311 HydrophobicContact CB-CG 3.87Å; P79-L311 WeakPolarHBondContact O-CD2 3.28Å; R82-L311 HydrophobicContact CB-CD1 3.5Å; R82-L311 HydrophobicContact CB-CG 4.34Å; R82-L311 WeakPolarHBondContact CD-O 3.11Å; R82-L311 PolarHBondContact NE-O 3.46Å; A83-L311 HydrophobicContact CB-CD1 4.41Å; A83-L311 HydrophobicContact CB-CD2 4.03Å; E86-L311 HydrophobicContact CG-CD1 4.44Å; Y307-L311 HydrophobicContact CE1-CD2 4.2Å; Y307-L311 WeakPolarHBondContact O-CB 3.46Å; Y307-L311 PolarHBondContact O-N 3.36Å; M308-L311 HydrophobicContact CE-CD2 4.43Å; M308-L311 PolarHBondContact O-N 3.42Å; M308-L311 HydrophobicContact SD-CD2 4.04Å; D309-L311 VanDerWaalsContact C-N 3.34Å; D309-L311 PolarHBondContact O-N 3.11Å
312K96Very high94.2Very high104 Ų10445.3 Ų45.345%0.45224%0.235SC..Hα-helixtrans-81.7-13177.2-71.3170.7176.6172.60114.3P74 P79 M308 D309 Y310 R317P74-K312 WeakPolarHBondContact CB-O 3.32Å; P79-K312 HydrophobicContact CB-CG 4.4Å; P79-K312 HydrophobicContact CG-CG 3.72Å; M308-K312 HydrophobicContact CE-CD 4.31Å; M308-K312 HydrophobicContact CE-CG 4.39Å; M308-K312 WeakPolarHBondContact O-CB 3.32Å; M308-K312 VanDerWaalsContact O-CG 3.28Å; M308-K312 WeakPolarHBondContact O-CG 3.21Å; M308-K312 PolarHBondContact O-N 2.86Å; D309-K312 PolarHBondContact O-N 3.31Å; Y310-K312 VanDerWaalsContact C-N 3.28Å; Y310-K312 PolarHBondContact O-N 3.41Å; K312-R317 WeakPolarHBondContact O-CA 3.24Å
313G94Very high94.1Very high0 Ų047.1 Ų47.10%024%0.244CC..THydrogen-bonded Turntrans77.333-173.700000113.6D309 Y310 R317 E318D309-G313 PolarHBondContact O-N 2.97Å; Y310-G313 PolarHBondContact O-N 2.91Å; Y310-G313 VanDerWaalsContact O-N 3.14Å; G313-R317 CarbonylContact O-C 3.53Å; G313-R317 VanDerWaalsContact O-CA 3.24Å; G313-R317 WeakPolarHBondContact O-CA 3.32Å; G313-R317 PolarHBondContact O-N 3.3Å; G313-E318 CarbonylContact O-C 3.54Å; G313-E318 PolarHBondContact O-N 3.45Å
314Y93.9Very high93.9Very high30 Ų3052.2 Ų52.212%0.11827%0.27CS..THydrogen-bonded Turntrans55.3-159.3179.1-50.5-85000111.9D309 S316 R317 L319 P320 G396 G398 Y399D309-Y314 HydrophobicContact CB-CD1 3.74Å; D309-Y314 HydrophobicContact CB-CE1 3.93Å; D309-Y314 PolarHBondContact O-N 2.82Å; Y314-S316 VanDerWaalsContact C-N 3.28Å; Y314-S316 PolarHBondContact O-N 3.42Å; Y314-R317 PolarHBondContact O-N 3.48Å; Y314-L319 HydrophobicContact CE2-CD2 4.16Å; Y314-P320 VanDerWaalsContact CE2-CD 3.46Å; Y314-P320 HydrophobicContact CE2-CG 4.1Å; Y314-G396 WeakPolarHBondContact CE2-O 3.11Å; Y314-G396 PolarHBondContact OH-O 3.21Å; Y314-G398 PolarHBondContact OH-N 3.16Å; Y314-Y399 AromaticContact CD1-CD1 3.84Å; Y314-Y399 HydrophobicContact CD1-CD1 3.84Å; Y314-Y399 HydrophobicContact CD2-CD1 4.19Å; Y314-Y399 HydrophobicContact CE1-CD1 4.03Å; Y314-Y399 HydrophobicContact CE1-CG 4.4Å; Y314-Y399 HydrophobicContact CE2-CD1 4.37Å; Y314-Y399 AromaticContact CG-CD1 3.94Å; Y314-Y399 HydrophobicContact CG-CD1 3.94Å; Y314-Y399 VanDerWaalsContact CZ-CB 3.48Å; Y314-Y399 WeakPolarHBondContact OH-CB 3.12Å; Y314-Y399 PolarHBondContact OH-N 2.92Å
315T90.1Very high93.7Very high151 Ų15161.5 Ų61.593%0.92630%0.304SS*.THydrogen-bonded Turntrans-61.4-34-176-43.50000113.2
316S88.8Confident93.6Very high80 Ų8064 Ų6456%0.55931%0.311SS*.THydrogen-bonded Turntrans-87.60.8-176.254.10000114.4Y314 E318Y314-S316 VanDerWaalsContact C-N 3.28Å; Y314-S316 PolarHBondContact O-N 3.42Å; S316-E318 PolarHBondContact O-N 3.24Å; S316-E318 VanDerWaalsContact O-N 3.13Å
317R91.4Very high93.6Very high177 Ų17764.4 Ų64.467%0.66831%0.314SS*.THydrogen-bonded Turntrans53.123.7-167-64.8-172.9169.2179.3-1.5113.6Q75 K312 G313 Y314Q75-R317 HydrophobicContact CG-CB 4.44Å; Q75-R317 WeakPolarHBondContact CG-O 3.45Å; Q75-R317 PolarHBondContact N-O 3.32Å; K312-R317 WeakPolarHBondContact O-CA 3.24Å; G313-R317 CarbonylContact O-C 3.53Å; G313-R317 VanDerWaalsContact O-CA 3.24Å; G313-R317 WeakPolarHBondContact O-CA 3.32Å; G313-R317 PolarHBondContact O-N 3.3Å; Y314-R317 PolarHBondContact O-N 3.48Å
318E92.5Very high93.6Very high106 Ų10668.6 Ų68.650%0.49534%0.335SS..SBendtrans-129.2137.9-179.4-167.6178.9172.900110.3G313 S316G313-E318 CarbonylContact O-C 3.54Å; G313-E318 PolarHBondContact O-N 3.45Å; S316-E318 PolarHBondContact O-N 3.24Å; S316-E318 VanDerWaalsContact O-N 3.13Å
319L93.3Very high93.5Very high12 Ų1272 Ų726%0.06336%0.357CS..PPolyproline II helixtrans-73.7134.2175.8-65.2171.2000109.7R69 P74 Y310 Y314R69-L319 HydrophobicContact CB-CD1 4.37Å; R69-L319 HydrophobicContact CG-CD1 3.76Å; P74-L319 HydrophobicContact CG-CD1 4.26Å; P74-L319 HydrophobicContact CG-CD2 4.14Å; P74-L319 HydrophobicContact CG-CG 3.83Å; Y310-L319 HydrophobicContact CD2-CD2 3.81Å; Y310-L319 HydrophobicContact CE2-CD2 3.95Å; Y314-L319 HydrophobicContact CE2-CD2 4.16Å
320P92.8Very high93.5Very high10 Ų1068.6 Ų68.67%0.06534%0.339CS..PPolyproline II helixtrans-64.6147.7-172.427.9-36.7000111.2R69 Y314 I322 Y399 T409R69-P320 PolarHBondContact NH1-O 3.33Å; R69-P320 PolarHBondContact NH2-O 2.69Å; Y314-P320 VanDerWaalsContact CE2-CD 3.46Å; Y314-P320 HydrophobicContact CE2-CG 4.1Å; P320-I322 PolarHBondContact O-N 2.95Å; P320-Y399 HydrophobicContact CB-CD1 4.41Å; P320-Y399 HydrophobicContact CB-CD2 3.7Å; P320-Y399 HydrophobicContact CB-CE2 3.86Å; P320-Y399 HydrophobicContact CB-CG 3.97Å; P320-Y399 HydrophobicContact CG-CD1 4.3Å; P320-Y399 HydrophobicContact CG-CD2 3.82Å; P320-Y399 HydrophobicContact CG-CE2 4.46Å; P320-Y399 HydrophobicContact CG-CG 3.7Å; P320-T409 HydrophobicContact CB-CG2 3.89Å; P320-T409 HydrophobicContact CG-CG2 4.37Å
321P91.9Very high93.6Very high84 Ų8472.8 Ų72.855%0.54536%0.357SS..PPolyproline II helixtrans-58.7139.1179.225.2-33.8000110.8N323 T409P321-N323 PolarHBondContact O-N 3.4Å; P321-T409 PolarHBondContact O-OG1 3.12Å
322I92.5Very high93.7Very high37 Ų3778 Ų7819%0.1939%0.385CS..PPolyproline II helixtrans-74.8119.5176.9-56.5176.5000107.9R69 P320 M324 L327 A394R69-I322 VanDerWaalsContact CZ-CG1 3.48Å; P320-I322 PolarHBondContact O-N 2.95Å; I322-M324 VanDerWaalsContact C-N 3.35Å; I322-M324 HydrophobicContact CB-SD 4.26Å; I322-M324 HydrophobicContact CG2-SD 3.79Å; I322-M324 PolarHBondContact O-N 3.04Å; I322-L327 HydrophobicContact CG2-CB 4.13Å; I322-L327 HydrophobicContact CG2-CD2 3.75Å; I322-A394 VanDerWaalsContact CD1-O 3.26Å; I322-A394 WeakPolarHBondContact CD1-O 3.21Å
323N92Very high93.7Very high47 Ų4775.8 Ų75.825%0.25137%0.374SS..  trans-71.494.5165.7-177.4-19.1000108.8P321 R325 Y326 L327P321-N323 PolarHBondContact O-N 3.4Å; N323-R325 VanDerWaalsContact C-N 3.27Å; N323-R325 PolarHBondContact O-N 2.93Å; N323-R325 PolarHBondContact OD1-N 3.03Å; N323-Y326 WeakPolarHBondContact O-CB 3.2Å; N323-Y326 PolarHBondContact O-N 2.71Å; N323-Y326 VanDerWaalsContact O-N 3.1Å; N323-Y326 PolarHBondContact OD1-N 2.84Å; N323-Y326 VanDerWaalsContact OD1-N 3.1Å; N323-L327 PolarHBondContact O-N 2.91Å
324M93.2Very high93.8Very high108 Ų10875.9 Ų75.953%0.53237%0.374SS..Hα-helixtrans-60.5-35.3-176.1-68.9-58.9-67.500112.8I322 Y326 L327 I328I322-M324 VanDerWaalsContact C-N 3.35Å; I322-M324 HydrophobicContact CB-SD 4.26Å; I322-M324 HydrophobicContact CG2-SD 3.79Å; I322-M324 PolarHBondContact O-N 3.04Å; M324-Y326 VanDerWaalsContact C-N 3.35Å; M324-L327 PolarHBondContact O-N 3.01Å; M324-L327 HydrophobicContact SD-CD2 4.36Å; M324-I328 WeakPolarHBondContact O-CB 3.19Å; M324-I328 WeakPolarHBondContact O-CD1 3.32Å; M324-I328 VanDerWaalsContact O-CG1 3.22Å; M324-I328 WeakPolarHBondContact O-CG1 3.43Å; M324-I328 PolarHBondContact O-N 3.05Å
325R93.8Very high93.9Very high211 Ų21177 Ų7780%0.79638%0.384SS*.Hα-helixtrans-62.8-44175.5-65.2-177.2179.9178.80.1111N323 T329N323-R325 VanDerWaalsContact C-N 3.27Å; N323-R325 PolarHBondContact O-N 2.93Å; N323-R325 PolarHBondContact OD1-N 3.03Å; R325-T329 WeakPolarHBondContact O-CB 3.49Å; R325-T329 PolarHBondContact O-N 3.09Å; R325-T329 PolarHBondContact O-OG1 3.39Å
326Y93.8Very high94.3Very high72 Ų7272.2 Ų72.228%0.28236%0.36SS..Hα-helixtrans-63.3-47.4175-178.4-110.5000111.6N323 M324 I328 T329 L330 E389 V393N323-Y326 WeakPolarHBondContact O-CB 3.2Å; N323-Y326 PolarHBondContact O-N 2.71Å; N323-Y326 VanDerWaalsContact O-N 3.1Å; N323-Y326 PolarHBondContact OD1-N 2.84Å; N323-Y326 VanDerWaalsContact OD1-N 3.1Å; M324-Y326 VanDerWaalsContact C-N 3.35Å; Y326-I328 PolarHBondContact O-N 3.47Å; Y326-T329 PolarHBondContact O-N 3.24Å; Y326-L330 HydrophobicContact CE1-CD2 4.33Å; Y326-L330 VanDerWaalsContact O-CB 3.3Å; Y326-L330 WeakPolarHBondContact O-CB 3.49Å; Y326-L330 PolarHBondContact O-N 3.16Å; Y326-E389 PolarHBondContact OH-OE1 3.34Å; Y326-V393 HydrophobicContact CD1-CG1 4.18Å; Y326-V393 HydrophobicContact CD1-CG2 4.47Å; Y326-V393 HydrophobicContact CE1-CG1 4.45Å; Y326-V393 HydrophobicContact CE1-CG2 3.92Å
327L95Very high94.7Very high21 Ų2168.6 Ų68.611%0.1134%0.335CS..Hα-helixtrans-61.4-44.5-179.6-176.962.8000112.1I322 N323 M324 L330 F331 V390 V393 A394I322-L327 HydrophobicContact CG2-CB 4.13Å; I322-L327 HydrophobicContact CG2-CD2 3.75Å; N323-L327 PolarHBondContact O-N 2.91Å; M324-L327 PolarHBondContact O-N 3.01Å; M324-L327 HydrophobicContact SD-CD2 4.36Å; L327-L330 PolarHBondContact O-N 2.9Å; L327-F331 WeakPolarHBondContact O-CB 3.24Å; L327-F331 PolarHBondContact O-N 3.39Å; L327-V390 HydrophobicContact CD1-CG1 3.96Å; L327-V393 HydrophobicContact CB-CG1 4.4Å; L327-V393 HydrophobicContact CD1-CB 4.17Å; L327-V393 HydrophobicContact CD1-CG1 3.9Å; L327-A394 HydrophobicContact CD1-CB 4.42Å; L327-A394 HydrophobicContact CD2-CB 4.42Å
328I96.3Very high94.8Very high91 Ų9160.9 Ų60.947%0.46731%0.31SS..Hα-helixtrans-63.5-45.2176.9-68.9165.6000110.4M324 Y326 L330 F331 L332M324-I328 WeakPolarHBondContact O-CB 3.19Å; M324-I328 WeakPolarHBondContact O-CD1 3.32Å; M324-I328 VanDerWaalsContact O-CG1 3.22Å; M324-I328 WeakPolarHBondContact O-CG1 3.43Å; M324-I328 PolarHBondContact O-N 3.05Å; Y326-I328 PolarHBondContact O-N 3.47Å; I328-L330 VanDerWaalsContact C-N 3.31Å; I328-L330 PolarHBondContact O-N 2.53Å; I328-F331 PolarHBondContact O-N 3Å; I328-L332 HydrophobicContact CG2-CD1 3.92Å; I328-L332 HydrophobicContact CG2-CG 4.27Å; I328-L332 WeakPolarHBondContact O-CB 3.27Å; I328-L332 VanDerWaalsContact O-CG 3.31Å; I328-L332 WeakPolarHBondContact O-CG 3.21Å; I328-L332 PolarHBondContact O-N 2.8Å
329T95.9Very high95Very high93 Ų9360 Ų6057%0.57131%0.308SS*.Hα-helixtrans-60-43.6177.6-56.20000111.3R325 Y326 R333R325-T329 WeakPolarHBondContact O-CB 3.49Å; R325-T329 PolarHBondContact O-N 3.09Å; R325-T329 PolarHBondContact O-OG1 3.39Å; Y326-T329 PolarHBondContact O-N 3.24Å; T329-R333 WeakPolarHBondContact O-CB 3.28Å; T329-R333 PolarHBondContact O-N 3.39Å
330L95.7Very high95.1Very high5 Ų561 Ų613%0.02632%0.316CS..Hα-helixtrans-64.9-42.5177.9178.861.9000111.8Y326 L327 I328 T334 E389 V390 V393Y326-L330 HydrophobicContact CE1-CD2 4.33Å; Y326-L330 VanDerWaalsContact O-CB 3.3Å; Y326-L330 WeakPolarHBondContact O-CB 3.49Å; Y326-L330 PolarHBondContact O-N 3.16Å; L327-L330 PolarHBondContact O-N 2.9Å; I328-L330 VanDerWaalsContact C-N 3.31Å; I328-L330 PolarHBondContact O-N 2.53Å; L330-T334 WeakPolarHBondContact O-CB 3.46Å; L330-T334 PolarHBondContact O-N 3.42Å; L330-T334 PolarHBondContact O-OG1 3.36Å; L330-E389 HydrophobicContact CD1-CB 4.23Å; L330-E389 HydrophobicContact CD1-CG 4.14Å; L330-E389 WeakPolarHBondContact CD1-OE2 3.37Å; L330-E389 HydrophobicContact CD2-CB 3.91Å; L330-E389 HydrophobicContact CD2-CG 3.61Å; L330-V390 HydrophobicContact CB-CG2 4.39Å; L330-V390 HydrophobicContact CD2-CB 4.47Å; L330-V390 HydrophobicContact CD2-CG2 3.92Å; L330-V390 HydrophobicContact CG-CG2 3.63Å; L330-V393 HydrophobicContact CD2-CG2 4.03Å
331F96.4Very high95.1Very high89 Ų8961.2 Ų61.239%0.3932%0.319SS..Hα-helixtrans-62.8-48.9175.9-178.6-100.2000111.5L327 I328 R333 T334 V335 V390L327-F331 WeakPolarHBondContact O-CB 3.24Å; L327-F331 PolarHBondContact O-N 3.39Å; I328-F331 PolarHBondContact O-N 3Å; F331-R333 PolarHBondContact O-N 2.88Å; F331-T334 WeakPolarHBondContact O-CB 3.33Å; F331-T334 PolarHBondContact O-N 3.09Å; F331-T334 VanDerWaalsContact O-N 3.16Å; F331-V335 HydrophobicContact CD1-CG2 4.18Å; F331-V335 HydrophobicContact CE1-CG2 3.79Å; F331-V335 HydrophobicContact CE2-CG2 4.14Å; F331-V335 HydrophobicContact CZ-CG2 3.77Å; F331-V335 WeakPolarHBondContact O-CG2 3.39Å; F331-V335 PolarHBondContact O-N 3.24Å; F331-V390 HydrophobicContact CB-CG2 4.34Å; F331-V390 HydrophobicContact CD2-CG1 4.32Å
332L97.4Very high95.1Very high109 Ų10958.9 Ų58.957%0.57131%0.306SS*.Hα-helixtrans-60.7-44.3177.7-69.4175.3000112.1I328 T334 V335 A336I328-L332 HydrophobicContact CG2-CD1 3.92Å; I328-L332 HydrophobicContact CG2-CG 4.27Å; I328-L332 WeakPolarHBondContact O-CB 3.27Å; I328-L332 VanDerWaalsContact O-CG 3.31Å; I328-L332 WeakPolarHBondContact O-CG 3.21Å; I328-L332 PolarHBondContact O-N 2.8Å; L332-T334 VanDerWaalsContact C-N 3.31Å; L332-T334 PolarHBondContact O-N 3.13Å; L332-V335 PolarHBondContact O-N 3.42Å; L332-A336 VanDerWaalsContact O-CB 3.31Å; L332-A336 WeakPolarHBondContact O-CB 2.98Å; L332-A336 PolarHBondContact O-N 3.24Å
333R96.7Very high95.2Very high59 Ų5962.5 Ų62.522%0.22332%0.318CS..Hα-helixtrans-58-45.7173.8-177.1-171.973.2-178.23.3111.2T329 F331 A336 S337 E389 F417T329-R333 WeakPolarHBondContact O-CB 3.28Å; T329-R333 PolarHBondContact O-N 3.39Å; F331-R333 PolarHBondContact O-N 2.88Å; R333-A336 PolarHBondContact O-N 3.23Å; R333-S337 PolarHBondContact O-N 2.87Å; R333-S337 PolarHBondContact O-OG 2.51Å; R333-E389 IonicContact NH2-OE2 3.54Å; R333-E389 PolarHBondContact NH2-OE2 2.81Å; R333-F417 VanDerWaalsContact NH2-CZ 3.27Å
334T96.8Very high95.3Very high2 Ų264.3 Ų64.31%0.01233%0.328CS..Hα-helixtrans-61.6-52.5179.8-59.20000110.2L330 F331 L332 A336 S337 G338 F383 G386 L387L330-T334 WeakPolarHBondContact O-CB 3.46Å; L330-T334 PolarHBondContact O-N 3.42Å; L330-T334 PolarHBondContact O-OG1 3.36Å; F331-T334 WeakPolarHBondContact O-CB 3.33Å; F331-T334 PolarHBondContact O-N 3.09Å; F331-T334 VanDerWaalsContact O-N 3.16Å; L332-T334 VanDerWaalsContact C-N 3.31Å; L332-T334 PolarHBondContact O-N 3.13Å; T334-A336 VanDerWaalsContact C-N 3.31Å; T334-A336 PolarHBondContact O-N 3.3Å; T334-S337 PolarHBondContact O-N 3.2Å; T334-G338 PolarHBondContact O-N 2.98Å; T334-F383 HydrophobicContact CG2-CD2 3.72Å; T334-F383 HydrophobicContact CG2-CE2 4Å; T334-F383 WeakPolarHBondContact O-CD2 3.14Å; T334-G386 VanDerWaalsContact OG1-C 3.26Å; T334-G386 WeakPolarHBondContact OG1-CA 3.19Å; T334-G386 PolarHBondContact OG1-O 2.99Å; T334-L387 HydrophobicContact CG2-CB 3.99Å; T334-L387 VanDerWaalsContact CG2-N 3.33Å
335V96.4Very high95.3Very high53 Ų5359.8 Ų59.832%0.32131%0.307SS..Hα-helixtrans-57.1-44.3177.5172.80000111.2F331 L332 S337 G338 L339F331-V335 HydrophobicContact CD1-CG2 4.18Å; F331-V335 HydrophobicContact CE1-CG2 3.79Å; F331-V335 HydrophobicContact CE2-CG2 4.14Å; F331-V335 HydrophobicContact CZ-CG2 3.77Å; F331-V335 WeakPolarHBondContact O-CG2 3.39Å; F331-V335 PolarHBondContact O-N 3.24Å; L332-V335 PolarHBondContact O-N 3.42Å; V335-S337 PolarHBondContact O-N 3.33Å; V335-G338 PolarHBondContact O-N 3.23Å; V335-L339 HydrophobicContact CG1-CD1 3.85Å; V335-L339 HydrophobicContact CG1-CG 4.2Å; V335-L339 WeakPolarHBondContact O-CG 3.3Å; V335-L339 PolarHBondContact O-N 3.36Å
336A97.2Very high95.2Very high51 Ų5154 Ų5442%0.42130%0.297SS..Hα-helixtrans-60.4-43.9177.500000112.7L332 R333 T334 S340L332-A336 VanDerWaalsContact O-CB 3.31Å; L332-A336 WeakPolarHBondContact O-CB 2.98Å; L332-A336 PolarHBondContact O-N 3.24Å; R333-A336 PolarHBondContact O-N 3.23Å; T334-A336 VanDerWaalsContact C-N 3.31Å; T334-A336 PolarHBondContact O-N 3.3Å; A336-S340 VanDerWaalsContact O-CB 3.31Å; A336-S340 WeakPolarHBondContact O-CB 3.06Å; A336-S340 PolarHBondContact O-N 3.32Å; A336-S340 PolarHBondContact O-OG 3.24Å
337S97Very high95.2Very high4 Ų459.3 Ų59.33%0.02832%0.317CS..Hα-helixtrans-63.5-41.2173.6-710000112R333 T334 V335 S340 A341 Q379R333-S337 PolarHBondContact O-N 2.87Å; R333-S337 PolarHBondContact O-OG 2.51Å; T334-S337 PolarHBondContact O-N 3.2Å; V335-S337 PolarHBondContact O-N 3.33Å; S337-S340 PolarHBondContact O-N 2.9Å; S337-A341 WeakPolarHBondContact O-CB 3.41Å; S337-A341 PolarHBondContact O-N 3.4Å; S337-Q379 WeakPolarHBondContact O-CB 3.36Å; S337-Q379 PolarHBondContact OG-OE1 2.67Å
338G95Very high95.2Very high14 Ų1461.6 Ų61.614%0.14433%0.326CS..Hα-helixtrans-62.7-47.7177.200000112.9T334 V335 A341 A342 F383T334-G338 PolarHBondContact O-N 2.98Å; V335-G338 PolarHBondContact O-N 3.23Å; G338-A341 PolarHBondContact O-N 3.48Å; G338-A342 WeakPolarHBondContact O-CB 3.29Å; G338-A342 PolarHBondContact O-N 3.03Å; G338-F383 VanDerWaalsContact CA-CD2 3.41Å
339L95.1Very high95.1Very high87 Ų8760 Ų6046%0.45532%0.322SS..Hα-helixtrans-64-40.7176.8-67.8175.4000111.6V335 A341 A342 Y343V335-L339 HydrophobicContact CG1-CD1 3.85Å; V335-L339 HydrophobicContact CG1-CG 4.2Å; V335-L339 WeakPolarHBondContact O-CG 3.3Å; V335-L339 PolarHBondContact O-N 3.36Å; L339-A341 VanDerWaalsContact C-N 3.35Å; L339-A341 PolarHBondContact O-N 3.02Å; L339-A342 PolarHBondContact O-N 3.09Å; L339-Y343 HydrophobicContact CB-CD2 4.47Å; L339-Y343 HydrophobicContact CD2-CD2 4.12Å; L339-Y343 HydrophobicContact CD2-CE2 3.78Å; L339-Y343 WeakPolarHBondContact O-CB 3.41Å; L339-Y343 WeakPolarHBondContact O-CD2 3.47Å; L339-Y343 PolarHBondContact O-N 2.81Å
340S95.7Very high95.1Very high34 Ų3456 Ų5624%0.23830%0.297CS..Iπ-helixtrans-62.1-43.4175.1-60.10000111.3A336 S337 L344 C345A336-S340 VanDerWaalsContact O-CB 3.31Å; A336-S340 WeakPolarHBondContact O-CB 3.06Å; A336-S340 PolarHBondContact O-N 3.32Å; A336-S340 PolarHBondContact O-OG 3.24Å; S337-S340 PolarHBondContact O-N 2.9Å; S340-L344 WeakPolarHBondContact O-CA 3.35Å; S340-L344 VanDerWaalsContact O-CB 3.22Å; S340-L344 WeakPolarHBondContact O-CB 3.41Å; S340-L344 PolarHBondContact O-N 3.39Å; S340-C345 PolarHBondContact O-N 3.37Å
341A93.4Very high95Very high15 Ų1560.6 Ų60.612%0.12432%0.318CS..Iπ-helixtrans-65.1-40.7176.400000112.6S337 G338 L339 C345 Q379 K380S337-A341 WeakPolarHBondContact O-CB 3.41Å; S337-A341 PolarHBondContact O-N 3.4Å; G338-A341 PolarHBondContact O-N 3.48Å; L339-A341 VanDerWaalsContact C-N 3.35Å; L339-A341 PolarHBondContact O-N 3.02Å; A341-C345 WeakPolarHBondContact O-CB 3.39Å; A341-Q379 HydrophobicContact CB-CB 4.06Å; A341-K380 HydrophobicContact CB-CG 3.78Å
342A91.9Very high94.9Very high34 Ų3458.6 Ų58.628%0.28131%0.309SS..Iπ-helixtrans-72.3-44.2-178.600000112.7V47 G338 L339 P346V47-A342 HydrophobicContact CG2-CB 4.41Å; G338-A342 WeakPolarHBondContact O-CB 3.29Å; G338-A342 PolarHBondContact O-N 3.03Å; L339-A342 PolarHBondContact O-N 3.09Å; A342-P346 WeakPolarHBondContact O-CD 3.49Å; A342-P346 WeakPolarHBondContact O-CG 3.39Å
343Y93.7Very high94.9Very high113 Ų11353.4 Ų53.444%0.44328%0.282SS..Iπ-helixtrans-106.2-26.5-169.3-64.3-71.6000114.6L339 Y347L339-Y343 HydrophobicContact CB-CD2 4.47Å; L339-Y343 HydrophobicContact CD2-CD2 4.12Å; L339-Y343 HydrophobicContact CD2-CE2 3.78Å; L339-Y343 WeakPolarHBondContact O-CB 3.41Å; L339-Y343 WeakPolarHBondContact O-CD2 3.47Å; L339-Y343 PolarHBondContact O-N 2.81Å; Y343-Y347 WeakPolarHBondContact O-CD2 3.24Å; Y343-Y347 WeakPolarHBondContact O-CE2 3.34Å
344L95.6Very high94.8Very high85 Ų8552.4 Ų52.445%0.44528%0.281SS..Iπ-helixtrans-96.3-35.8-179.8-55.5177.9000112.7S340 P346 Y347 L376S340-L344 WeakPolarHBondContact O-CA 3.35Å; S340-L344 VanDerWaalsContact O-CB 3.22Å; S340-L344 WeakPolarHBondContact O-CB 3.41Å; S340-L344 PolarHBondContact O-N 3.39Å; L344-P346 VanDerWaalsContact C-CD 3.44Å; L344-P346 VanDerWaalsContact C-N 3.34Å; L344-Y347 PolarHBondContact O-N 2.94Å; L344-Y347 VanDerWaalsContact O-N 3.11Å; L344-L376 HydrophobicContact CB-CD1 4.25Å; L344-L376 HydrophobicContact CB-CD2 3.72Å; L344-L376 HydrophobicContact CD1-CD2 4.17Å
345C92.7Very high94.7Very high14 Ų1454.7 Ų54.710%0.09530%0.295CS..G310 helixtrans-55.8-39.1-179.5-166.20000113.9S340 A341 Y347 F348S340-C345 PolarHBondContact O-N 3.37Å; A341-C345 WeakPolarHBondContact O-CB 3.39Å; C345-Y347 PolarHBondContact O-N 3.24Å; C345-F348 CarbonylContact O-C 3.42Å; C345-F348 PolarHBondContact O-N 2.93Å; C345-F348 VanDerWaalsContact O-N 3.11Å
346P92Very high94.6Very high90 Ų9059.4 Ų59.458%0.58431%0.314SS*.G310 helixtrans-61.7-24.4177.9-25.736.5000114.8A342 L344 F348A342-P346 WeakPolarHBondContact O-CD 3.49Å; A342-P346 WeakPolarHBondContact O-CG 3.39Å; L344-P346 VanDerWaalsContact C-CD 3.44Å; L344-P346 VanDerWaalsContact C-N 3.34Å; P346-F348 VanDerWaalsContact C-N 3.32Å
347Y94.4Very high94.5Very high183 Ų18360.3 Ų60.372%0.71832%0.316SS*.G310 helixtrans-77.8-17.1177.1-68.5-84.1000113.3Y343 L344 C345 P349Y343-Y347 WeakPolarHBondContact O-CD2 3.24Å; Y343-Y347 WeakPolarHBondContact O-CE2 3.34Å; L344-Y347 PolarHBondContact O-N 2.94Å; L344-Y347 VanDerWaalsContact O-N 3.11Å; C345-Y347 PolarHBondContact O-N 3.24Å; Y347-P349 VanDerWaalsContact C-CD 3.4Å; Y347-P349 WeakPolarHBondContact O-CD 3.38Å
348F94.9Very high94.4Very high68 Ų6860.1 Ų60.130%0.29831%0.314SS..SBendtrans-12662.9-179.9-65.1-91.4000110.5C345 P346 F350 Y369 I372 L376C345-F348 CarbonylContact O-C 3.42Å; C345-F348 PolarHBondContact O-N 2.93Å; C345-F348 VanDerWaalsContact O-N 3.11Å; P346-F348 VanDerWaalsContact C-N 3.32Å; F348-F350 PolarHBondContact O-N 3.49Å; F348-F350 VanDerWaalsContact O-N 3.17Å; F348-Y369 HydrophobicContact CD1-CD2 4.27Å; F348-Y369 AromaticContact CD1-CE2 3.93Å; F348-Y369 HydrophobicContact CD1-CE2 3.93Å; F348-I372 HydrophobicContact CD1-CB 4.48Å; F348-I372 HydrophobicContact CD1-CG2 3.76Å; F348-I372 HydrophobicContact CD2-CG2 4.19Å; F348-I372 HydrophobicContact CE1-CG2 3.75Å; F348-I372 HydrophobicContact CE2-CG2 4.18Å; F348-I372 HydrophobicContact CG-CG2 3.99Å; F348-I372 HydrophobicContact CZ-CG2 3.97Å; F348-L376 HydrophobicContact CB-CD1 3.9Å; F348-L376 HydrophobicContact CD2-CD1 3.43Å; F348-L376 VanDerWaalsContact CD2-CD1 3.43Å; F348-L376 HydrophobicContact CE2-CD1 4.2Å; F348-L376 HydrophobicContact CG-CD1 3.87Å
349P94.2Very high94.3Very high59 Ų5961.9 Ų61.938%0.38332%0.322SS..  trans-61.7119.8-179.326.8-34000109.6Y347 E351 F352 Y369Y347-P349 VanDerWaalsContact C-CD 3.4Å; Y347-P349 WeakPolarHBondContact O-CD 3.38Å; P349-E351 PolarHBondContact O-N 3.48Å; P349-F352 HydrophobicContact CG-CB 4.42Å; P349-F352 WeakPolarHBondContact O-CB 3.12Å; P349-F352 PolarHBondContact O-N 3.35Å; P349-Y369 PolarHBondContact O-OH 2.83Å
350F94.7Very high94.3Very high7 Ų764.2 Ų64.23%0.03134%0.335CS..G310 helixtrans-66.1-26.2-174.1-173.6-120.6000112.3F348 F352 V353 S373 L374 I377 A526 H529 L530 F539F348-F350 PolarHBondContact O-N 3.49Å; F348-F350 VanDerWaalsContact O-N 3.17Å; F350-F352 PolarHBondContact O-N 2.77Å; F350-F352 VanDerWaalsContact O-N 3.09Å; F350-V353 HydrophobicContact CD2-CG1 4.03Å; F350-V353 HydrophobicContact CE2-CG1 3.88Å; F350-V353 HydrophobicContact CE2-CG2 4.33Å; F350-V353 HydrophobicContact CZ-CG2 4.29Å; F350-V353 WeakPolarHBondContact O-CG1 3.4Å; F350-V353 WeakPolarHBondContact O-CG2 2.94Å; F350-V353 PolarHBondContact O-N 2.97Å; F350-V353 VanDerWaalsContact O-N 3.12Å; F350-S373 WeakPolarHBondContact CD2-OG 3.48Å; F350-L374 HydrophobicContact CD1-CD2 4.32Å; F350-L374 HydrophobicContact CD2-CD2 4.01Å; F350-L374 HydrophobicContact CD2-CG 4.15Å; F350-L374 HydrophobicContact CE1-CD2 3.99Å; F350-L374 HydrophobicContact CE2-CD1 4.07Å; F350-L374 HydrophobicContact CE2-CD2 3.68Å; F350-L374 HydrophobicContact CE2-CG 3.68Å; F350-L374 HydrophobicContact CG-CD2 4.33Å; F350-L374 HydrophobicContact CZ-CD1 4.19Å; F350-L374 HydrophobicContact CZ-CD2 3.68Å; F350-L374 HydrophobicContact CZ-CG 4.06Å; F350-I377 HydrophobicContact CB-CD1 3.48Å; F350-I377 VanDerWaalsContact CB-CD1 3.48Å; F350-I377 HydrophobicContact CD1-CD1 4.23Å; F350-I377 HydrophobicContact CD2-CD1 4.49Å; F350-I377 HydrophobicContact CG-CD1 3.83Å; F350-A526 HydrophobicContact CE1-CB 4.14Å; F350-A526 HydrophobicContact CZ-CB 3.58Å; F350-H529 HydrophobicContact CD1-CB 3.78Å; F350-H529 HydrophobicContact CE1-CB 3.87Å; F350-L530 HydrophobicContact CD1-CD2 3.96Å; F350-L530 HydrophobicContact CD1-CG 4.38Å; F350-L530 HydrophobicContact CE1-CD1 4.4Å; F350-L530 HydrophobicContact CE1-CD2 3.79Å; F350-L530 HydrophobicContact CE1-CG 3.79Å; F350-F539 HydrophobicContact CZ-CE2 4.29Å
351E93.1Very high94.2Very high103 Ų10367.3 Ų67.348%0.48134%0.342SS..G310 helixtrans-58.2-21.2173.6-62.583.4174.500112.9P349 V353 L354P349-E351 PolarHBondContact O-N 3.48Å; E351-V353 PolarHBondContact O-N 2.88Å; E351-V353 VanDerWaalsContact O-N 3.13Å; E351-L354 WeakPolarHBondContact O-CB 3.4Å; E351-L354 PolarHBondContact O-N 3.45Å
352F96Very high94.3Very high46 Ų4669.6 Ų69.620%0.20236%0.358CS..G310 helixtrans-55.6-30174.3-180-115.1000112.7P349 F350 L354 T355 P357 F358 Y361 Y369P349-F352 HydrophobicContact CG-CB 4.42Å; P349-F352 WeakPolarHBondContact O-CB 3.12Å; P349-F352 PolarHBondContact O-N 3.35Å; F350-F352 PolarHBondContact O-N 2.77Å; F350-F352 VanDerWaalsContact O-N 3.09Å; F352-L354 PolarHBondContact O-N 3.33Å; F352-T355 HydrophobicContact CD2-CG2 4.28Å; F352-T355 VanDerWaalsContact CD2-OG1 3.27Å; F352-T355 WeakPolarHBondContact CD2-OG1 3.39Å; F352-T355 WeakPolarHBondContact CE2-OG1 3.19Å; F352-T355 WeakPolarHBondContact O-CB 3.17Å; F352-T355 PolarHBondContact O-N 2.8Å; F352-T355 PolarHBondContact O-OG1 2.95Å; F352-P357 HydrophobicContact CE2-CB 4.11Å; F352-P357 HydrophobicContact CZ-CB 4.24Å; F352-F358 HydrophobicContact CD1-CB 4.13Å; F352-F358 AromaticContact CD1-CD2 3.85Å; F352-F358 HydrophobicContact CD1-CD2 3.85Å; F352-F358 HydrophobicContact CD1-CG 4.4Å; F352-F358 HydrophobicContact CE1-CB 3.89Å; F352-F358 AromaticContact CE1-CD2 3.78Å; F352-F358 HydrophobicContact CE1-CD2 3.78Å; F352-F358 HydrophobicContact CE1-CG 4.34Å; F352-F358 HydrophobicContact CZ-CB 4.16Å; F352-F358 VanDerWaalsContact O-CB 3.28Å; F352-F358 WeakPolarHBondContact O-CB 3.4Å; F352-Y361 AromaticContact CE1-CE2 3.79Å; F352-Y361 HydrophobicContact CE1-CE2 3.79Å; F352-Y361 HydrophobicContact CZ-CE2 4.26Å; F352-Y369 HydrophobicContact CB-CE1 4.08Å; F352-Y369 WeakPolarHBondContact CB-OH 3.48Å; F352-Y369 HydrophobicContact CD1-CD1 4.22Å; F352-Y369 HydrophobicContact CD1-CD2 4.29Å; F352-Y369 AromaticContact CD1-CE1 3.69Å; F352-Y369 HydrophobicContact CD1-CE1 3.69Å; F352-Y369 AromaticContact CD1-CE2 3.75Å; F352-Y369 HydrophobicContact CD1-CE2 3.75Å; F352-Y369 AromaticContact CD1-CZ 3.42Å; F352-Y369 VanDerWaalsContact CD1-CZ 3.42Å; F352-Y369 HydrophobicContact CE1-CE2 4.23Å; F352-Y369 HydrophobicContact CG-CE1 4.37Å
353V95.8Very high94.5Very high0 Ų071.2 Ų71.20%036%0.36CS..G310 helixtrans-63-16.1179-53.50000113.5F350 E351 F358 Y369 V370 L530 F539F350-V353 HydrophobicContact CD2-CG1 4.03Å; F350-V353 HydrophobicContact CE2-CG1 3.88Å; F350-V353 HydrophobicContact CE2-CG2 4.33Å; F350-V353 HydrophobicContact CZ-CG2 4.29Å; F350-V353 WeakPolarHBondContact O-CG1 3.4Å; F350-V353 WeakPolarHBondContact O-CG2 2.94Å; F350-V353 PolarHBondContact O-N 2.97Å; F350-V353 VanDerWaalsContact O-N 3.12Å; E351-V353 PolarHBondContact O-N 2.88Å; E351-V353 VanDerWaalsContact O-N 3.13Å; V353-F358 HydrophobicContact CB-CD1 4.03Å; V353-F358 HydrophobicContact CB-CE1 3.83Å; V353-F358 HydrophobicContact CB-CE2 4.5Å; V353-F358 HydrophobicContact CB-CG 4.42Å; V353-F358 HydrophobicContact CB-CZ 4.1Å; V353-F358 HydrophobicContact CG1-CD2 4.44Å; V353-F358 HydrophobicContact CG1-CE1 4.16Å; V353-F358 HydrophobicContact CG1-CE2 4.04Å; V353-F358 HydrophobicContact CG1-CZ 3.89Å; V353-F358 VanDerWaalsContact O-CD1 3.26Å; V353-F358 WeakPolarHBondContact O-CD1 3.42Å; V353-Y369 HydrophobicContact CG1-CD1 4.08Å; V353-Y369 HydrophobicContact CG1-CE1 4.12Å; V353-V370 HydrophobicContact CG1-CG2 4.01Å; V353-L530 HydrophobicContact CG2-CD2 4.22Å; V353-F539 HydrophobicContact CB-CD2 4.13Å; V353-F539 HydrophobicContact CG2-CD2 3.75Å; V353-F539 HydrophobicContact CG2-CE2 4.42Å
354L95Very high94.5Very high38 Ų3871.2 Ų71.220%0.19937%0.367CS..G310 helixtrans-91-7.7177.1-56.9-179.9000112.9E351 F352 L530 S535 K538E351-L354 WeakPolarHBondContact O-CB 3.4Å; E351-L354 PolarHBondContact O-N 3.45Å; F352-L354 PolarHBondContact O-N 3.33Å; L354-L530 HydrophobicContact CD1-CD2 4.02Å; L354-L530 HydrophobicContact CD2-CD1 4.2Å; L354-L530 HydrophobicContact CD2-CD2 4.12Å; L354-L530 HydrophobicContact CG-CD2 4.07Å; L354-S535 WeakPolarHBondContact CD2-O 3.5Å; L354-K538 HydrophobicContact CD2-CB 4.49Å; L354-K538 HydrophobicContact CD2-CD 4.44Å; L354-K538 VanDerWaalsContact O-CE 3.26Å; L354-K538 WeakPolarHBondContact O-CE 3.37Å; L354-K538 PolarHBondContact O-NZ 3.36Å
355T95.9Very high94.6Very high51 Ų5172.3 Ų72.331%0.31337%0.37SS..SBendtrans-86.4154.6-176.170.60000111.6F352 F358F352-T355 HydrophobicContact CD2-CG2 4.28Å; F352-T355 VanDerWaalsContact CD2-OG1 3.27Å; F352-T355 WeakPolarHBondContact CD2-OG1 3.39Å; F352-T355 WeakPolarHBondContact CE2-OG1 3.19Å; F352-T355 WeakPolarHBondContact O-CB 3.17Å; F352-T355 PolarHBondContact O-N 2.8Å; F352-T355 PolarHBondContact O-OG1 2.95Å; T355-F358 PolarHBondContact O-N 3.24Å
356E93.5Very high94.8Very high151 Ų15173 Ų7371%0.70637%0.371SS*.Hα-helixtrans-61.3-41.2176-63.8-174.2172.600113.5F358 T359 N360E356-F358 PolarHBondContact O-N 3.1Å; E356-T359 WeakPolarHBondContact O-CA 3.46Å; E356-T359 WeakPolarHBondContact O-CB 3.34Å; E356-T359 PolarHBondContact O-N 3.21Å; E356-T359 PolarHBondContact O-OG1 3.49Å; E356-N360 PolarHBondContact O-N 3.42Å
357P95.2Very high95Very high71 Ų7171.1 Ų71.146%0.46136%0.355SS..Hα-helixtrans-55.1-36.3176.5-28.936.7000114F352 T359 N360F352-P357 HydrophobicContact CE2-CB 4.11Å; F352-P357 HydrophobicContact CZ-CB 4.24Å; P357-T359 VanDerWaalsContact C-N 3.27Å; P357-T359 PolarHBondContact O-N 2.9Å; P357-N360 WeakPolarHBondContact O-CB 3.27Å; P357-N360 PolarHBondContact O-N 2.91Å; P357-N360 VanDerWaalsContact O-N 3.09Å
358F95.5Very high95.1Very high0 Ų066.6 Ų66.60%034%0.342CS..Hα-helixtrans-63.1-35.2175.5179-103.9000112.4F352 V353 T355 E356 N360 Y361 R366 Y369 V370 V542F352-F358 HydrophobicContact CD1-CB 4.13Å; F352-F358 AromaticContact CD1-CD2 3.85Å; F352-F358 HydrophobicContact CD1-CD2 3.85Å; F352-F358 HydrophobicContact CD1-CG 4.4Å; F352-F358 HydrophobicContact CE1-CB 3.89Å; F352-F358 AromaticContact CE1-CD2 3.78Å; F352-F358 HydrophobicContact CE1-CD2 3.78Å; F352-F358 HydrophobicContact CE1-CG 4.34Å; F352-F358 HydrophobicContact CZ-CB 4.16Å; F352-F358 VanDerWaalsContact O-CB 3.28Å; F352-F358 WeakPolarHBondContact O-CB 3.4Å; V353-F358 HydrophobicContact CB-CD1 4.03Å; V353-F358 HydrophobicContact CB-CE1 3.83Å; V353-F358 HydrophobicContact CB-CE2 4.5Å; V353-F358 HydrophobicContact CB-CG 4.42Å; V353-F358 HydrophobicContact CB-CZ 4.1Å; V353-F358 HydrophobicContact CG1-CD2 4.44Å; V353-F358 HydrophobicContact CG1-CE1 4.16Å; V353-F358 HydrophobicContact CG1-CE2 4.04Å; V353-F358 HydrophobicContact CG1-CZ 3.89Å; V353-F358 VanDerWaalsContact O-CD1 3.26Å; V353-F358 WeakPolarHBondContact O-CD1 3.42Å; T355-F358 PolarHBondContact O-N 3.24Å; E356-F358 PolarHBondContact O-N 3.1Å; F358-N360 PolarHBondContact O-N 3.12Å; F358-Y361 HydrophobicContact CD2-CD2 4.23Å; F358-Y361 WeakPolarHBondContact O-CB 3.08Å; F358-Y361 PolarHBondContact O-N 3.32Å; F358-Y361 VanDerWaalsContact O-N 3.16Å; F358-R366 HydrophobicContact CE1-CB 4.36Å; F358-R366 HydrophobicContact CE1-CG 4.17Å; F358-R366 HydrophobicContact CE2-CB 4.18Å; F358-R366 HydrophobicContact CE2-CG 4.2Å; F358-R366 HydrophobicContact CZ-CB 3.72Å; F358-R366 HydrophobicContact CZ-CG 3.89Å; F358-Y369 HydrophobicContact CD2-CD1 4.34Å; F358-Y369 AromaticContact CE2-CD1 3.89Å; F358-Y369 HydrophobicContact CE2-CD1 3.89Å; F358-Y369 HydrophobicContact CE2-CG 4.16Å; F358-V370 HydrophobicContact CE2-CG2 4.47Å; F358-V370 HydrophobicContact CZ-CG2 3.86Å; F358-V542 HydrophobicContact CD1-CG1 4.21Å; F358-V542 HydrophobicContact CE1-CG1 3.75Å
359T91.9Very high95.2Very high50 Ų5064.7 Ų64.731%0.30733%0.334SS..Hα-helixtrans-69.1-17.7176.470.10000112.8E356 P357 Y361 R366 V542E356-T359 WeakPolarHBondContact O-CA 3.46Å; E356-T359 WeakPolarHBondContact O-CB 3.34Å; E356-T359 PolarHBondContact O-N 3.21Å; E356-T359 PolarHBondContact O-OG1 3.49Å; P357-T359 VanDerWaalsContact C-N 3.27Å; P357-T359 PolarHBondContact O-N 2.9Å; T359-Y361 VanDerWaalsContact C-N 3.33Å; T359-R366 PolarHBondContact O-NH2 3.5Å; T359-V542 HydrophobicContact CG2-CG2 4.12Å
360N94.4Very high95.3Very high137 Ų13762.1 Ų62.173%0.73332%0.317SS*.THydrogen-bonded Turntrans-81.5-12.7174.2-66.3-23.9000113.1E356 P357 F358E356-N360 PolarHBondContact O-N 3.42Å; P357-N360 WeakPolarHBondContact O-CB 3.27Å; P357-N360 PolarHBondContact O-N 2.91Å; P357-N360 VanDerWaalsContact O-N 3.09Å; F358-N360 PolarHBondContact O-N 3.12Å
361Y95Very high95.4Very high98 Ų9863.5 Ų63.538%0.38433%0.326SS..SBendtrans-68.5142.9175.7-73.70.3000111.6F352 F358 T359 H365 R366F352-Y361 AromaticContact CE1-CE2 3.79Å; F352-Y361 HydrophobicContact CE1-CE2 3.79Å; F352-Y361 HydrophobicContact CZ-CE2 4.26Å; F358-Y361 HydrophobicContact CD2-CD2 4.23Å; F358-Y361 WeakPolarHBondContact O-CB 3.08Å; F358-Y361 PolarHBondContact O-N 3.32Å; F358-Y361 VanDerWaalsContact O-N 3.16Å; T359-Y361 VanDerWaalsContact C-N 3.33Å; Y361-H365 HydrophobicContact CD2-CB 4.21Å; Y361-H365 HydrophobicContact CG-CB 4.23Å; Y361-R366 PolarHBondContact O-NE 2.94Å; Y361-R366 PolarHBondContact O-NH2 3.45Å
362S95.9Very high95.6Very high64 Ų6462 Ų6245%0.44832%0.321SS..  trans-58.2156.3168.866.70000111.1L364 H365 R366S362-L364 PolarHBondContact O-N 3.04Å; S362-H365 PolarHBondContact O-N 3.29Å; S362-H365 PolarHBondContact OG-ND1 3.22Å; S362-R366 WeakPolarHBondContact O-CG 3.41Å; S362-R366 PolarHBondContact O-N 3.17Å
363M94.5Very high95.7Very high68 Ų6859.9 Ų59.934%0.33531%0.311SS..Hα-helixtrans-54.4-40.7-177.5-173.563.283.500112.5R366 I367 F543 Y544M363-R366 PolarHBondContact O-N 3.26Å; M363-I367 HydrophobicContact CG-CD1 4.05Å; M363-I367 VanDerWaalsContact O-CG1 3.29Å; M363-I367 WeakPolarHBondContact O-CG1 3.33Å; M363-I367 PolarHBondContact O-N 3.2Å; M363-F543 HydrophobicContact SD-CD1 3.76Å; M363-F543 HydrophobicContact SD-CE1 4.03Å; M363-Y544 HydrophobicContact CE-CD2 3.9Å; M363-Y544 HydrophobicContact CE-CE2 3.81Å
364L95.2Very high95.7Very high112 Ų11259.9 Ų59.959%0.58631%0.311SS*.Hα-helixtrans-61.8-45.5176.9-179.961.8000111.8S362 R366 I367 L368S362-L364 PolarHBondContact O-N 3.04Å; L364-R366 VanDerWaalsContact C-N 3.34Å; L364-R366 PolarHBondContact O-N 3.37Å; L364-I367 PolarHBondContact O-N 3.18Å; L364-L368 HydrophobicContact CD1-CD1 4.3Å; L364-L368 HydrophobicContact CD1-CG 4.32Å; L364-L368 HydrophobicContact CG-CD1 4.08Å; L364-L368 HydrophobicContact CG-CG 4.5Å; L364-L368 WeakPolarHBondContact O-CG 3.34Å; L364-L368 PolarHBondContact O-N 3.5Å
365H96.1Very high95.8Very high108 Ų10861.4 Ų61.450%0.532%0.316SS..Hα-helixtrans-65.5-37.9179.1-74.876.3000111.8Y361 S362 L368 Y369Y361-H365 HydrophobicContact CD2-CB 4.21Å; Y361-H365 HydrophobicContact CG-CB 4.23Å; S362-H365 PolarHBondContact O-N 3.29Å; S362-H365 PolarHBondContact OG-ND1 3.22Å; H365-L368 PolarHBondContact O-N 2.8Å; H365-Y369 WeakPolarHBondContact O-CB 3.49Å; H365-Y369 PolarHBondContact O-N 3.41Å
366R97Very high95.8Very high30 Ų3059.5 Ų59.511%0.11330%0.304CS..Hα-helixtrans-60.8-46.5172.6-63.9-178.7-164.9169.65.9111.5F358 T359 Y361 S362 M363 L364 Y369 V370 V542 F543F358-R366 HydrophobicContact CE1-CB 4.36Å; F358-R366 HydrophobicContact CE1-CG 4.17Å; F358-R366 HydrophobicContact CE2-CB 4.18Å; F358-R366 HydrophobicContact CE2-CG 4.2Å; F358-R366 HydrophobicContact CZ-CB 3.72Å; F358-R366 HydrophobicContact CZ-CG 3.89Å; T359-R366 PolarHBondContact O-NH2 3.5Å; Y361-R366 PolarHBondContact O-NE 2.94Å; Y361-R366 PolarHBondContact O-NH2 3.45Å; S362-R366 WeakPolarHBondContact O-CG 3.41Å; S362-R366 PolarHBondContact O-N 3.17Å; M363-R366 PolarHBondContact O-N 3.26Å; L364-R366 VanDerWaalsContact C-N 3.34Å; L364-R366 PolarHBondContact O-N 3.37Å; R366-Y369 PolarHBondContact O-N 3.06Å; R366-V370 WeakPolarHBondContact O-CB 3.39Å; R366-V370 VanDerWaalsContact O-CG2 3.26Å; R366-V370 WeakPolarHBondContact O-CG2 3.36Å; R366-V370 PolarHBondContact O-N 3.49Å; R366-V542 PolarHBondContact NH1-O 2.9Å; R366-F543 HydrophobicContact CB-CE1 4.08Å; R366-F543 HydrophobicContact CB-CZ 3.97Å
367I96.3Very high95.9Very high50 Ų5052.7 Ų52.726%0.25627%0.272SS..Hα-helixtrans-61-46.4178.2-70.6169.2000111M363 L364 V370 T371 L519 F543M363-I367 HydrophobicContact CG-CD1 4.05Å; M363-I367 VanDerWaalsContact O-CG1 3.29Å; M363-I367 WeakPolarHBondContact O-CG1 3.33Å; M363-I367 PolarHBondContact O-N 3.2Å; L364-I367 PolarHBondContact O-N 3.18Å; I367-V370 PolarHBondContact O-N 3.07Å; I367-T371 VanDerWaalsContact O-CB 3.3Å; I367-T371 WeakPolarHBondContact O-CB 3.39Å; I367-T371 PolarHBondContact O-N 3.41Å; I367-T371 PolarHBondContact O-OG1 3.49Å; I367-L519 HydrophobicContact CG2-CD2 3.38Å; I367-F543 HydrophobicContact CG1-CE1 3.9Å
368L96.5Very high95.9Very high87 Ų8749.6 Ų49.646%0.45525%0.252SS..Hα-helixtrans-63.2-46.8179.9-71.5172.9000111.6L364 H365 V370 T371 I372L364-L368 HydrophobicContact CD1-CD1 4.3Å; L364-L368 HydrophobicContact CD1-CG 4.32Å; L364-L368 HydrophobicContact CG-CD1 4.08Å; L364-L368 HydrophobicContact CG-CG 4.5Å; L364-L368 WeakPolarHBondContact O-CG 3.34Å; L364-L368 PolarHBondContact O-N 3.5Å; H365-L368 PolarHBondContact O-N 2.8Å; L368-V370 PolarHBondContact O-N 3.33Å; L368-T371 PolarHBondContact O-N 3.33Å; L368-I372 WeakPolarHBondContact O-CG1 3.35Å; L368-I372 PolarHBondContact O-N 3.1Å
369Y97.4Very high95.9Very high29 Ų2950 Ų5011%0.11425%0.253CS..Hα-helixtrans-60.7-46.7178.1-173-85000111.8F348 P349 F352 V353 F358 H365 R366 T371 I372 S373F348-Y369 HydrophobicContact CD1-CD2 4.27Å; F348-Y369 AromaticContact CD1-CE2 3.93Å; F348-Y369 HydrophobicContact CD1-CE2 3.93Å; P349-Y369 PolarHBondContact O-OH 2.83Å; F352-Y369 HydrophobicContact CB-CE1 4.08Å; F352-Y369 WeakPolarHBondContact CB-OH 3.48Å; F352-Y369 HydrophobicContact CD1-CD1 4.22Å; F352-Y369 HydrophobicContact CD1-CD2 4.29Å; F352-Y369 AromaticContact CD1-CE1 3.69Å; F352-Y369 HydrophobicContact CD1-CE1 3.69Å; F352-Y369 AromaticContact CD1-CE2 3.75Å; F352-Y369 HydrophobicContact CD1-CE2 3.75Å; F352-Y369 AromaticContact CD1-CZ 3.42Å; F352-Y369 VanDerWaalsContact CD1-CZ 3.42Å; F352-Y369 HydrophobicContact CE1-CE2 4.23Å; F352-Y369 HydrophobicContact CG-CE1 4.37Å; V353-Y369 HydrophobicContact CG1-CD1 4.08Å; V353-Y369 HydrophobicContact CG1-CE1 4.12Å; F358-Y369 HydrophobicContact CD2-CD1 4.34Å; F358-Y369 AromaticContact CE2-CD1 3.89Å; F358-Y369 HydrophobicContact CE2-CD1 3.89Å; F358-Y369 HydrophobicContact CE2-CG 4.16Å; H365-Y369 WeakPolarHBondContact O-CB 3.49Å; H365-Y369 PolarHBondContact O-N 3.41Å; R366-Y369 PolarHBondContact O-N 3.06Å; Y369-T371 VanDerWaalsContact C-N 3.31Å; Y369-T371 PolarHBondContact O-N 3.02Å; Y369-I372 PolarHBondContact O-N 2.83Å; Y369-S373 VanDerWaalsContact O-CB 3.31Å; Y369-S373 WeakPolarHBondContact O-CB 3.38Å; Y369-S373 PolarHBondContact O-N 2.99Å; Y369-S373 PolarHBondContact O-OG 2.95Å
370V97.3Very high96Very high5 Ų551.4 Ų51.43%0.0326%0.255CS..Hα-helixtrans-62.3-39.7177.51700000111.3V353 F358 R366 I367 L368 S373 L374 N522 F539 F543V353-V370 HydrophobicContact CG1-CG2 4.01Å; F358-V370 HydrophobicContact CE2-CG2 4.47Å; F358-V370 HydrophobicContact CZ-CG2 3.86Å; R366-V370 WeakPolarHBondContact O-CB 3.39Å; R366-V370 VanDerWaalsContact O-CG2 3.26Å; R366-V370 WeakPolarHBondContact O-CG2 3.36Å; R366-V370 PolarHBondContact O-N 3.49Å; I367-V370 PolarHBondContact O-N 3.07Å; L368-V370 PolarHBondContact O-N 3.33Å; V370-S373 WeakPolarHBondContact CA-OG 3.39Å; V370-S373 PolarHBondContact O-OG 3.37Å; V370-L374 HydrophobicContact CG1-CD1 3.61Å; V370-L374 HydrophobicContact CG1-CG 4.39Å; V370-L374 VanDerWaalsContact O-CB 3.26Å; V370-L374 WeakPolarHBondContact O-CB 3.44Å; V370-L374 VanDerWaalsContact O-CG 3.31Å; V370-L374 WeakPolarHBondContact O-CG 3.2Å; V370-L374 PolarHBondContact O-N 3.49Å; V370-N522 HydrophobicContact CG1-CB 4.3Å; V370-F539 HydrophobicContact CG1-CE2 4.3Å; V370-F539 HydrophobicContact CG1-CZ 4.17Å; V370-F539 HydrophobicContact CG2-CE2 3.85Å; V370-F539 HydrophobicContact CG2-CZ 4.43Å; V370-F543 HydrophobicContact CG2-CE2 4.16Å; V370-F543 HydrophobicContact CG2-CZ 3.9Å
371T96.6Very high96Very high36 Ų3647.6 Ų47.622%0.22123%0.231CC..Hα-helixtrans-64.3-47.3177.9-60.70000111.4I367 L368 Y369 F375 N522I367-T371 VanDerWaalsContact O-CB 3.3Å; I367-T371 WeakPolarHBondContact O-CB 3.39Å; I367-T371 PolarHBondContact O-N 3.41Å; I367-T371 PolarHBondContact O-OG1 3.49Å; L368-T371 PolarHBondContact O-N 3.33Å; Y369-T371 VanDerWaalsContact C-N 3.31Å; Y369-T371 PolarHBondContact O-N 3.02Å; T371-F375 WeakPolarHBondContact O-CB 3.12Å; T371-F375 PolarHBondContact O-N 3.43Å; T371-N522 PolarHBondContact OG1-ND2 3.02Å
372I96.7Very high96.1Very high72 Ų7242.9 Ų42.937%0.36921%0.213SC..Hα-helixtrans-66.8-51180-66.2166.7000110.8F348 L368 Y369 L374 F375 L376F348-I372 HydrophobicContact CD1-CB 4.48Å; F348-I372 HydrophobicContact CD1-CG2 3.76Å; F348-I372 HydrophobicContact CD2-CG2 4.19Å; F348-I372 HydrophobicContact CE1-CG2 3.75Å; F348-I372 HydrophobicContact CE2-CG2 4.18Å; F348-I372 HydrophobicContact CG-CG2 3.99Å; F348-I372 HydrophobicContact CZ-CG2 3.97Å; L368-I372 WeakPolarHBondContact O-CG1 3.35Å; L368-I372 PolarHBondContact O-N 3.1Å; Y369-I372 PolarHBondContact O-N 2.83Å; I372-L374 PolarHBondContact O-N 3Å; I372-F375 PolarHBondContact O-N 3.34Å; I372-L376 HydrophobicContact CG2-CD1 3.98Å; I372-L376 HydrophobicContact CG2-CG 4.46Å; I372-L376 WeakPolarHBondContact O-CG 3.31Å; I372-L376 PolarHBondContact O-N 2.77Å
373S97Very high96.1Very high0 Ų041.8 Ų41.80%020%0.2CC..Hα-helixtrans-59.6-45.2-178.7530000112.2F350 Y369 V370 L376 I377F350-S373 WeakPolarHBondContact CD2-OG 3.48Å; Y369-S373 VanDerWaalsContact O-CB 3.31Å; Y369-S373 WeakPolarHBondContact O-CB 3.38Å; Y369-S373 PolarHBondContact O-N 2.99Å; Y369-S373 PolarHBondContact O-OG 2.95Å; V370-S373 WeakPolarHBondContact CA-OG 3.39Å; V370-S373 PolarHBondContact O-OG 3.37Å; S373-L376 PolarHBondContact O-N 2.87Å; S373-I377 WeakPolarHBondContact O-CG1 3.26Å; S373-I377 PolarHBondContact O-N 3.48Å
374L97Very high96.1Very high0 Ų039.4 Ų39.40%019%0.191CC..Hα-helixtrans-72.9-31.9178.6-68.7174.5000113F350 V370 I372 L376 I377 R378 N522 Q525 A526 H529F350-L374 HydrophobicContact CD1-CD2 4.32Å; F350-L374 HydrophobicContact CD2-CD2 4.01Å; F350-L374 HydrophobicContact CD2-CG 4.15Å; F350-L374 HydrophobicContact CE1-CD2 3.99Å; F350-L374 HydrophobicContact CE2-CD1 4.07Å; F350-L374 HydrophobicContact CE2-CD2 3.68Å; F350-L374 HydrophobicContact CE2-CG 3.68Å; F350-L374 HydrophobicContact CG-CD2 4.33Å; F350-L374 HydrophobicContact CZ-CD1 4.19Å; F350-L374 HydrophobicContact CZ-CD2 3.68Å; F350-L374 HydrophobicContact CZ-CG 4.06Å; V370-L374 HydrophobicContact CG1-CD1 3.61Å; V370-L374 HydrophobicContact CG1-CG 4.39Å; V370-L374 VanDerWaalsContact O-CB 3.26Å; V370-L374 WeakPolarHBondContact O-CB 3.44Å; V370-L374 VanDerWaalsContact O-CG 3.31Å; V370-L374 WeakPolarHBondContact O-CG 3.2Å; V370-L374 PolarHBondContact O-N 3.49Å; I372-L374 PolarHBondContact O-N 3Å; L374-L376 VanDerWaalsContact C-N 3.34Å; L374-I377 HydrophobicContact CD2-CD1 4.17Å; L374-I377 PolarHBondContact O-N 2.67Å; L374-R378 WeakPolarHBondContact O-CG 3.38Å; L374-R378 PolarHBondContact O-N 3.43Å; L374-R378 PolarHBondContact O-NH1 2.91Å; L374-N522 HydrophobicContact CD1-CB 3.91Å; L374-N522 WeakPolarHBondContact CD1-O 3.4Å; L374-Q525 HydrophobicContact CD1-CG 3.86Å; L374-Q525 HydrophobicContact CD2-CG 4.13Å; L374-A526 HydrophobicContact CD1-CB 4.43Å; L374-H529 WeakPolarHBondContact CD2-CD2 3.39Å
375F96.4Very high96.1Very high71 Ų7135 Ų3531%0.31117%0.167SC..Hα-helixtrans-61.9-42.6169.7172.7-98.6000111.7T371 I372 R378 Q379 F419 E423T371-F375 WeakPolarHBondContact O-CB 3.12Å; T371-F375 PolarHBondContact O-N 3.43Å; I372-F375 PolarHBondContact O-N 3.34Å; F375-R378 PolarHBondContact O-N 3.42Å; F375-Q379 VanDerWaalsContact CE2-NE2 3.33Å; F375-Q379 WeakPolarHBondContact O-CG 3.31Å; F375-Q379 PolarHBondContact O-N 3.28Å; F375-Q379 PolarHBondContact O-NE2 2.94Å; F375-Q379 VanDerWaalsContact O-NE2 3.08Å; F375-F419 HydrophobicContact CE2-CE2 4.48Å; F375-F419 HydrophobicContact CE2-CZ 4.12Å; F375-F419 HydrophobicContact CZ-CZ 4.26Å; F375-E423 HydrophobicContact CE2-CG 4.24Å
376L96.5Very high96.1Very high10 Ų1029.9 Ų29.95%0.05214%0.143CC..Hα-helixtrans-66.6-39.2176.6-71.1175000112.1L344 F348 I372 S373 L374 Q379L344-L376 HydrophobicContact CB-CD1 4.25Å; L344-L376 HydrophobicContact CB-CD2 3.72Å; L344-L376 HydrophobicContact CD1-CD2 4.17Å; F348-L376 HydrophobicContact CB-CD1 3.9Å; F348-L376 HydrophobicContact CD2-CD1 3.43Å; F348-L376 VanDerWaalsContact CD2-CD1 3.43Å; F348-L376 HydrophobicContact CE2-CD1 4.2Å; F348-L376 HydrophobicContact CG-CD1 3.87Å; I372-L376 HydrophobicContact CG2-CD1 3.98Å; I372-L376 HydrophobicContact CG2-CG 4.46Å; I372-L376 WeakPolarHBondContact O-CG 3.31Å; I372-L376 PolarHBondContact O-N 2.77Å; S373-L376 PolarHBondContact O-N 2.87Å; L374-L376 VanDerWaalsContact C-N 3.34Å; L376-Q379 VanDerWaalsContact O-CB 3.27Å; L376-Q379 WeakPolarHBondContact O-CB 3.11Å; L376-Q379 WeakPolarHBondContact O-CG 3.43Å; L376-Q379 PolarHBondContact O-N 3.06Å
377I94.8Very high96Very high8 Ų828.9 Ų28.94%0.04114%0.14CC..Hα-helixtrans-62.8-42.4172.9-71.8166.8000111.2F350 S373 L374 Q379 K380 Y381 H529F350-I377 HydrophobicContact CB-CD1 3.48Å; F350-I377 VanDerWaalsContact CB-CD1 3.48Å; F350-I377 HydrophobicContact CD1-CD1 4.23Å; F350-I377 HydrophobicContact CD2-CD1 4.49Å; F350-I377 HydrophobicContact CG-CD1 3.83Å; S373-I377 WeakPolarHBondContact O-CG1 3.26Å; S373-I377 PolarHBondContact O-N 3.48Å; L374-I377 HydrophobicContact CD2-CD1 4.17Å; L374-I377 PolarHBondContact O-N 2.67Å; I377-Q379 PolarHBondContact O-N 3.32Å; I377-Q379 VanDerWaalsContact O-N 3.15Å; I377-K380 WeakPolarHBondContact O-CB 3.11Å; I377-K380 PolarHBondContact O-N 3.22Å; I377-Y381 HydrophobicContact CG2-CE2 4.2Å; I377-H529 WeakPolarHBondContact CG2-CE1 3.38Å; I377-H529 WeakPolarHBondContact CG2-ND1 3.33Å
378R95.7Very high96Very high7 Ų726.7 Ų26.73%0.02613%0.129CC..Hα-helixtrans-57.1-28.7176.1-76.9-170-60.9-84.713.5112.8L374 F375 K380 Y381 Y382 E423 W435 N522L374-R378 WeakPolarHBondContact O-CG 3.38Å; L374-R378 PolarHBondContact O-N 3.43Å; L374-R378 PolarHBondContact O-NH1 2.91Å; F375-R378 PolarHBondContact O-N 3.42Å; R378-K380 PolarHBondContact O-N 2.86Å; R378-Y381 PolarHBondContact O-N 2.83Å; R378-Y382 HydrophobicContact CB-CD2 4.47Å; R378-Y382 HydrophobicContact CB-CE2 3.92Å; R378-Y382 PolarHBondContact O-N 3.41Å; R378-E423 IonicContact CZ-OE1 3.93Å; R378-E423 IonicContact CZ-OE2 3.7Å; R378-E423 IonicContact NE-OE1 3.71Å; R378-E423 PolarHBondContact NE-OE1 3.21Å; R378-E423 IonicContact NE-OE2 3.94Å; R378-E423 IonicContact NH2-OE1 2.87Å; R378-E423 IonicContact NH2-OE2 3.63Å; R378-E423 PolarHBondContact NH2-OE2 3.44Å; R378-W435 HydrophobicContact CB-CZ3 4.45Å; R378-W435 HydrophobicContact CG-CH2 4.04Å; R378-W435 HydrophobicContact CG-CZ3 4.08Å; R378-N522 PolarHBondContact NH1-OD1 2.86Å; R378-N522 PolarHBondContact NH2-OD1 3Å
379Q96.3Very high95.9Very high7 Ų722.6 Ų22.63%0.03311%0.108CC..Hα-helixtrans-58.3-30.5176.2-55.4-50.6-49.600113.2S337 A341 F375 L376 I377 Y381 Y382 F383S337-Q379 WeakPolarHBondContact O-CB 3.36Å; S337-Q379 PolarHBondContact OG-OE1 2.67Å; A341-Q379 HydrophobicContact CB-CB 4.06Å; F375-Q379 VanDerWaalsContact CE2-NE2 3.33Å; F375-Q379 WeakPolarHBondContact O-CG 3.31Å; F375-Q379 PolarHBondContact O-N 3.28Å; F375-Q379 PolarHBondContact O-NE2 2.94Å; F375-Q379 VanDerWaalsContact O-NE2 3.08Å; L376-Q379 VanDerWaalsContact O-CB 3.27Å; L376-Q379 WeakPolarHBondContact O-CB 3.11Å; L376-Q379 WeakPolarHBondContact O-CG 3.43Å; L376-Q379 PolarHBondContact O-N 3.06Å; I377-Q379 PolarHBondContact O-N 3.32Å; I377-Q379 VanDerWaalsContact O-N 3.15Å; Q379-Y381 VanDerWaalsContact C-N 3.32Å; Q379-Y381 PolarHBondContact O-N 2.82Å; Q379-Y382 PolarHBondContact O-N 3.42Å; Q379-F383 WeakPolarHBondContact O-CB 2.96Å; Q379-F383 PolarHBondContact O-N 3.21Å
380K93.6Very high95.9Very high81 Ų8121.3 Ų21.335%0.35210%0.103SC..Hα-helixtrans-60-42.7174.3-62.5175.3-177.4177.70111.4A341 I377 R378 A384A341-K380 HydrophobicContact CB-CG 3.78Å; I377-K380 WeakPolarHBondContact O-CB 3.11Å; I377-K380 PolarHBondContact O-N 3.22Å; R378-K380 PolarHBondContact O-N 2.86Å; K380-A384 WeakPolarHBondContact O-CB 3.38Å; K380-A384 PolarHBondContact O-N 3.26Å
381Y94.1Very high95.8Very high56 Ų5621.5 Ų21.522%0.2210%0.104CC..Hα-helixtrans-73.7-41.2178.2-59.8-88.1000111.7I377 R378 Q379 F383 A384 W385 W435I377-Y381 HydrophobicContact CG2-CE2 4.2Å; R378-Y381 PolarHBondContact O-N 2.83Å; Q379-Y381 VanDerWaalsContact C-N 3.32Å; Q379-Y381 PolarHBondContact O-N 2.82Å; Y381-F383 VanDerWaalsContact C-N 3.27Å; Y381-F383 PolarHBondContact O-N 3.26Å; Y381-A384 PolarHBondContact O-N 3.08Å; Y381-W385 HydrophobicContact CD1-CH2 4.17Å; Y381-W385 HydrophobicContact CD1-CZ2 4.06Å; Y381-W385 HydrophobicContact CG-CH2 4.46Å; Y381-W385 WeakPolarHBondContact O-CB 3.47Å; Y381-W385 PolarHBondContact O-N 3.46Å; Y381-W435 HydrophobicContact CD1-CZ2 4.47Å; Y381-W435 HydrophobicContact CD2-CH2 4.02Å; Y381-W435 HydrophobicContact CD2-CZ2 4.49Å; Y381-W435 AromaticContact CG-CH2 3.87Å; Y381-W435 HydrophobicContact CG-CH2 3.87Å; Y381-W435 HydrophobicContact CG-CZ2 4.19Å
382Y96.7Very high95.8Very high0 Ų019.8 Ų19.80%09%0.093CC..Hα-helixtrans-61.3-36.9174.6-62.3-29.8000112.3R378 Q379 G386 F417 F419 V422 E423 W435R378-Y382 HydrophobicContact CB-CD2 4.47Å; R378-Y382 HydrophobicContact CB-CE2 3.92Å; R378-Y382 PolarHBondContact O-N 3.41Å; Q379-Y382 PolarHBondContact O-N 3.42Å; Y382-G386 VanDerWaalsContact O-CA 3.25Å; Y382-G386 WeakPolarHBondContact O-CA 3.43Å; Y382-G386 PolarHBondContact O-N 2.82Å; Y382-F417 HydrophobicContact CD1-CD1 4.34Å; Y382-F417 AromaticContact CD1-CD2 3.4Å; Y382-F417 HydrophobicContact CD1-CD2 3.4Å; Y382-F417 HydrophobicContact CD1-CE1 4.33Å; Y382-F417 AromaticContact CD1-CE2 3.37Å; Y382-F417 HydrophobicContact CD1-CE2 3.37Å; Y382-F417 AromaticContact CD1-CG 3.91Å; Y382-F417 HydrophobicContact CD1-CG 3.91Å; Y382-F417 AromaticContact CD1-CZ 3.87Å; Y382-F417 HydrophobicContact CD1-CZ 3.87Å; Y382-F417 AromaticContact CE1-CD2 3.68Å; Y382-F417 HydrophobicContact CE1-CD2 3.68Å; Y382-F417 HydrophobicContact CE1-CE2 4.03Å; Y382-F417 HydrophobicContact CE1-CG 4.25Å; Y382-F417 HydrophobicContact CG-CD2 4.28Å; Y382-F417 AromaticContact CG-CE2 3.81Å; Y382-F417 HydrophobicContact CG-CE2 3.81Å; Y382-F417 HydrophobicContact CG-CZ 4.13Å; Y382-F417 WeakPolarHBondContact O-CZ 3Å; Y382-F419 AromaticContact CD2-CD2 3.73Å; Y382-F419 HydrophobicContact CD2-CD2 3.73Å; Y382-F419 AromaticContact CD2-CE2 3.68Å; Y382-F419 HydrophobicContact CD2-CE2 3.68Å; Y382-F419 AromaticContact CE2-CD2 3.66Å; Y382-F419 HydrophobicContact CE2-CD2 3.66Å; Y382-F419 AromaticContact CE2-CE2 3.58Å; Y382-F419 HydrophobicContact CE2-CE2 3.58Å; Y382-F419 HydrophobicContact CG-CD2 4.26Å; Y382-V422 WeakPolarHBondContact OH-CG1 3.29Å; Y382-E423 PolarHBondContact OH-OE1 2.91Å; Y382-W435 HydrophobicContact CD1-CZ3 4.38Å; Y382-W435 HydrophobicContact CE1-CE3 4.09Å; Y382-W435 AromaticContact CE1-CZ3 3.62Å; Y382-W435 HydrophobicContact CE1-CZ3 3.62Å
383F96.1Very high95.7Very high40 Ų4016.4 Ų16.418%0.1758%0.076CC..Hα-helixtrans-64.9-55.8172.2175.9-109.2000111.6Y54 V55 T334 G338 Q379 Y381 W385 G386 L387Y54-F383 HydrophobicContact CD1-CE1 4.25Å; Y54-F383 HydrophobicContact CE1-CE1 4.1Å; V55-F383 HydrophobicContact CG2-CE1 3.89Å; V55-F383 HydrophobicContact CG2-CZ 3.55Å; T334-F383 HydrophobicContact CG2-CD2 3.72Å; T334-F383 HydrophobicContact CG2-CE2 4Å; T334-F383 WeakPolarHBondContact O-CD2 3.14Å; G338-F383 VanDerWaalsContact CA-CD2 3.41Å; Q379-F383 WeakPolarHBondContact O-CB 2.96Å; Q379-F383 PolarHBondContact O-N 3.21Å; Y381-F383 VanDerWaalsContact C-N 3.27Å; Y381-F383 PolarHBondContact O-N 3.26Å; F383-W385 PolarHBondContact O-N 2.7Å; F383-G386 PolarHBondContact O-N 3.45Å; F383-L387 HydrophobicContact CZ-CD2 4.27Å; F383-L387 WeakPolarHBondContact O-CB 3.36Å; F383-L387 PolarHBondContact O-N 3.18Å
384A94.2Very high95.6Very high19 Ų1916.4 Ų16.416%0.1578%0.076CC..Hα-helixtrans-61.4-46.9-174.700000112.2Y54 V298 K380 Y381 A388Y54-A384 HydrophobicContact CE1-CB 4.44Å; Y54-A384 PolarHBondContact OH-O 3.36Å; V298-A384 HydrophobicContact CG2-CB 4.1Å; K380-A384 WeakPolarHBondContact O-CB 3.38Å; K380-A384 PolarHBondContact O-N 3.26Å; Y381-A384 PolarHBondContact O-N 3.08Å; A384-A388 PolarHBondContact O-N 3.44Å
385W95.4Very high95.5Very high20 Ų2016.4 Ų16.48%0.0768%0.076CC..Hα-helixtrans-73.3-32.4175.8-63.2-26.4000113Y381 F383 A388 E389 N416 F417 W435 N436Y381-W385 HydrophobicContact CD1-CH2 4.17Å; Y381-W385 HydrophobicContact CD1-CZ2 4.06Å; Y381-W385 HydrophobicContact CG-CH2 4.46Å; Y381-W385 WeakPolarHBondContact O-CB 3.47Å; Y381-W385 PolarHBondContact O-N 3.46Å; F383-W385 PolarHBondContact O-N 2.7Å; W385-A388 PolarHBondContact O-N 3.26Å; W385-E389 WeakPolarHBondContact O-CB 3.44Å; W385-E389 PolarHBondContact O-N 3.4Å; W385-N416 HydrophobicContact CB-CB 4.03Å; W385-N416 HydrophobicContact CD2-CB 4.45Å; W385-N416 VanDerWaalsContact CD2-ND2 3.31Å; W385-N416 VanDerWaalsContact CE2-ND2 3.32Å; W385-N416 HydrophobicContact CG-CB 4.12Å; W385-N416 PolarHBondContact NE1-ND2 2.85Å; W385-F417 HydrophobicContact CB-CD1 3.82Å; W385-F417 HydrophobicContact CB-CE1 3.92Å; W385-F417 HydrophobicContact CE3-CB 4.27Å; W385-F417 HydrophobicContact CE3-CD1 4.06Å; W385-F417 HydrophobicContact CE3-CG 4.43Å; W385-W435 HydrophobicContact CH2-CD2 4.12Å; W385-W435 AromaticContact CH2-CE2 3.55Å; W385-W435 AromaticContact CH2-CH2 4Å; W385-W435 HydrophobicContact CH2-CH2 4Å; W385-W435 AromaticContact CH2-CZ2 3.49Å; W385-W435 HydrophobicContact CH2-CZ2 3.49Å; W385-W435 VanDerWaalsContact CH2-CZ2 3.49Å; W385-W435 HydrophobicContact CH2-CZ3 4.49Å; W385-W435 AromaticContact CH2-NE1 3.89Å; W385-W435 AromaticContact CZ3-CD2 3.92Å; W385-W435 HydrophobicContact CZ3-CD2 3.92Å; W385-W435 AromaticContact CZ3-CE2 3.8Å; W385-W435 AromaticContact CZ3-CE3 3.97Å; W385-W435 HydrophobicContact CZ3-CE3 3.97Å; W385-W435 AromaticContact CZ3-CH2 3.83Å; W385-W435 HydrophobicContact CZ3-CH2 3.83Å; W385-W435 AromaticContact CZ3-CZ2 3.77Å; W385-W435 HydrophobicContact CZ3-CZ2 3.77Å; W385-W435 AromaticContact CZ3-CZ3 3.93Å; W385-W435 HydrophobicContact CZ3-CZ3 3.93Å; W385-N436 HydrophobicContact CH2-CB 3.6Å; W385-N436 HydrophobicContact CZ2-CB 3.92Å; W385-N436 HydrophobicContact CZ3-CB 4.19Å
386G96.1Very high95.4Very high0 Ų013 Ų130%06%0.061CC..Hα-helixtrans-64-43.6176.400000111.4T334 Y382 F383 A388 E389 V390T334-G386 VanDerWaalsContact OG1-C 3.26Å; T334-G386 WeakPolarHBondContact OG1-CA 3.19Å; T334-G386 PolarHBondContact OG1-O 2.99Å; Y382-G386 VanDerWaalsContact O-CA 3.25Å; Y382-G386 WeakPolarHBondContact O-CA 3.43Å; Y382-G386 PolarHBondContact O-N 2.82Å; F383-G386 PolarHBondContact O-N 3.45Å; G386-A388 VanDerWaalsContact C-N 3.32Å; G386-A388 PolarHBondContact O-N 3.01Å; G386-E389 WeakPolarHBondContact O-CB 3.28Å; G386-E389 PolarHBondContact O-N 3.06Å; G386-E389 VanDerWaalsContact O-N 3.17Å; G386-V390 WeakPolarHBondContact O-CG2 3.42Å; G386-V390 PolarHBondContact O-N 3.37Å
387L95.9Very high95.3Very high9 Ų912.8 Ų12.85%0.0476%0.061CC..Hα-helixtrans-63-40.6177.6-176.358.7000111.6Y54 T334 F383 V390 N391Y54-L387 HydrophobicContact CD1-CD2 4.25Å; Y54-L387 HydrophobicContact CE1-CD2 3.72Å; T334-L387 HydrophobicContact CG2-CB 3.99Å; T334-L387 VanDerWaalsContact CG2-N 3.33Å; F383-L387 HydrophobicContact CZ-CD2 4.27Å; F383-L387 WeakPolarHBondContact O-CB 3.36Å; F383-L387 PolarHBondContact O-N 3.18Å; L387-V390 WeakPolarHBondContact O-CB 3.44Å; L387-V390 PolarHBondContact O-N 3.01Å; L387-N391 VanDerWaalsContact O-CG 3.32Å; L387-N391 PolarHBondContact O-N 2.75Å; L387-N391 PolarHBondContact O-ND2 3.28Å
388A95.1Very high95.1Very high4 Ų412.8 Ų12.83%0.0336%0.062CC..Hα-helixtrans-66-39.3173.700000113.4G299 P300 A384 W385 G386 N391 G392G299-A388 WeakPolarHBondContact O-CB 3.18Å; P300-A388 VanDerWaalsContact CD-CB 3.47Å; A384-A388 PolarHBondContact O-N 3.44Å; W385-A388 PolarHBondContact O-N 3.26Å; G386-A388 VanDerWaalsContact C-N 3.32Å; G386-A388 PolarHBondContact O-N 3.01Å; A388-N391 PolarHBondContact O-N 3.44Å; A388-G392 PolarHBondContact O-N 2.87Å
389E95.7Very high95.1Very high0 Ų015.1 Ų15.10%07%0.072CC..Hα-helixtrans-61.8-44.3173.5-164.6-173.7165.700110.5Y326 L330 R333 W385 G386 N391 G392 V393 I414Y326-E389 PolarHBondContact OH-OE1 3.34Å; L330-E389 HydrophobicContact CD1-CB 4.23Å; L330-E389 HydrophobicContact CD1-CG 4.14Å; L330-E389 WeakPolarHBondContact CD1-OE2 3.37Å; L330-E389 HydrophobicContact CD2-CB 3.91Å; L330-E389 HydrophobicContact CD2-CG 3.61Å; R333-E389 IonicContact NH2-OE2 3.54Å; R333-E389 PolarHBondContact NH2-OE2 2.81Å; W385-E389 WeakPolarHBondContact O-CB 3.44Å; W385-E389 PolarHBondContact O-N 3.4Å; G386-E389 WeakPolarHBondContact O-CB 3.28Å; G386-E389 PolarHBondContact O-N 3.06Å; G386-E389 VanDerWaalsContact O-N 3.17Å; E389-N391 VanDerWaalsContact C-N 3.34Å; E389-N391 PolarHBondContact O-N 3.27Å; E389-G392 PolarHBondContact O-N 3.47Å; E389-V393 HydrophobicContact CG-CG2 4.38Å; E389-V393 WeakPolarHBondContact O-CB 3.36Å; E389-V393 WeakPolarHBondContact O-CG2 3.2Å; E389-V393 PolarHBondContact O-N 3.44Å; E389-I414 HydrophobicContact CG-CG2 4.18Å
390V96.4Very high94.9Very high3 Ų317.5 Ų17.52%0.0189%0.087CC..Hα-helixtrans-55.3-49.9174.1171.20000110.3I62 L327 L330 F331 G386 L387 G392 V393 A394I62-V390 HydrophobicContact CD1-CG1 3.68Å; I62-V390 HydrophobicContact CG1-CG1 4.21Å; L327-V390 HydrophobicContact CD1-CG1 3.96Å; L330-V390 HydrophobicContact CB-CG2 4.39Å; L330-V390 HydrophobicContact CD2-CB 4.47Å; L330-V390 HydrophobicContact CD2-CG2 3.92Å; L330-V390 HydrophobicContact CG-CG2 3.63Å; F331-V390 HydrophobicContact CB-CG2 4.34Å; F331-V390 HydrophobicContact CD2-CG1 4.32Å; G386-V390 WeakPolarHBondContact O-CG2 3.42Å; G386-V390 PolarHBondContact O-N 3.37Å; L387-V390 WeakPolarHBondContact O-CB 3.44Å; L387-V390 PolarHBondContact O-N 3.01Å; V390-G392 PolarHBondContact O-N 3.46Å; V390-V393 PolarHBondContact O-N 3.16Å; V390-A394 WeakPolarHBondContact O-CB 3.4Å; V390-A394 PolarHBondContact O-N 3.42Å
391N95.9Very high94.8Very high8 Ų814.5 Ų14.54%0.0438%0.079CC..Hα-helixtrans-59.7-47.7-179.4-74.8-31.6000112.3G58 S61 I62 H294 L387 A388 E389 A394 V395G58-N391 PolarHBondContact O-OD1 3.36Å; S61-N391 VanDerWaalsContact OG-CG 3.26Å; S61-N391 PolarHBondContact OG-OD1 3.01Å; I62-N391 WeakPolarHBondContact CG1-OD1 3.37Å; H294-N391 HydrophobicContact CB-CB 4.1Å; L387-N391 VanDerWaalsContact O-CG 3.32Å; L387-N391 PolarHBondContact O-N 2.75Å; L387-N391 PolarHBondContact O-ND2 3.28Å; A388-N391 PolarHBondContact O-N 3.44Å; E389-N391 VanDerWaalsContact C-N 3.34Å; E389-N391 PolarHBondContact O-N 3.27Å; N391-A394 PolarHBondContact O-N 3.02Å; N391-V395 PolarHBondContact O-N 3.23Å; N391-V395 VanDerWaalsContact O-N 3.08Å
392G95.5Very high94.7Very high0 Ų017 Ų170%09%0.093CC..Hα-helixtrans-67.1-41.9179.600000113.2A388 E389 V390 A394 V395 G396 A397A388-G392 PolarHBondContact O-N 2.87Å; E389-G392 PolarHBondContact O-N 3.47Å; V390-G392 PolarHBondContact O-N 3.46Å; G392-A394 VanDerWaalsContact C-N 3.33Å; G392-A394 PolarHBondContact O-N 3.03Å; G392-V395 VanDerWaalsContact O-CG1 3.31Å; G392-V395 WeakPolarHBondContact O-CG1 3.41Å; G392-V395 PolarHBondContact O-N 2.86Å; G392-G396 PolarHBondContact O-N 3.37Å; G392-A397 PolarHBondContact O-N 3.12Å
393V95.2Very high94.3Very high1 Ų118.1 Ų18.11%0.00610%0.1CC..Hα-helixtrans-62-42.9174173.10000110.8Y326 L327 L330 E389 V390 V395 G396 N411 I414Y326-V393 HydrophobicContact CD1-CG1 4.18Å; Y326-V393 HydrophobicContact CD1-CG2 4.47Å; Y326-V393 HydrophobicContact CE1-CG1 4.45Å; Y326-V393 HydrophobicContact CE1-CG2 3.92Å; L327-V393 HydrophobicContact CB-CG1 4.4Å; L327-V393 HydrophobicContact CD1-CB 4.17Å; L327-V393 HydrophobicContact CD1-CG1 3.9Å; L330-V393 HydrophobicContact CD2-CG2 4.03Å; E389-V393 HydrophobicContact CG-CG2 4.38Å; E389-V393 WeakPolarHBondContact O-CB 3.36Å; E389-V393 WeakPolarHBondContact O-CG2 3.2Å; E389-V393 PolarHBondContact O-N 3.44Å; V390-V393 PolarHBondContact O-N 3.16Å; V393-V395 VanDerWaalsContact C-N 3.34Å; V393-V395 PolarHBondContact O-N 3.44Å; V393-G396 PolarHBondContact O-N 2.91Å; V393-G396 VanDerWaalsContact O-N 3.16Å; V393-N411 HydrophobicContact CG2-CB 4.17Å; V393-I414 HydrophobicContact CG2-CG2 4.07Å
394A95Very high94.1Very high0 Ų021.6 Ų21.60%013%0.127CC..Hα-helixtrans-63.2-38.3-178.800000112.4I62 Q66 R69 I322 L327 V390 N391 G392I62-A394 HydrophobicContact CG2-CB 4.24Å; Q66-A394 PolarHBondContact NE2-O 2.99Å; R69-A394 WeakPolarHBondContact CD-O 3.45Å; I322-A394 VanDerWaalsContact CD1-O 3.26Å; I322-A394 WeakPolarHBondContact CD1-O 3.21Å; L327-A394 HydrophobicContact CD1-CB 4.42Å; L327-A394 HydrophobicContact CD2-CB 4.42Å; V390-A394 WeakPolarHBondContact O-CB 3.4Å; V390-A394 PolarHBondContact O-N 3.42Å; N391-A394 PolarHBondContact O-N 3.02Å; G392-A394 VanDerWaalsContact C-N 3.33Å; G392-A394 PolarHBondContact O-N 3.03Å
395V94.7Very high93.9Very high0 Ų027.4 Ų27.40%015%0.145CC..Hα-helixtrans-80.6-18.317674.90000113.1M68 R69 F293 H294 Y310 N391 G392 V393 A397M68-V395 HydrophobicContact CB-CG2 4.13Å; R69-V395 WeakPolarHBondContact CD-O 3.47Å; R69-V395 WeakPolarHBondContact CG-O 3.32Å; F293-V395 HydrophobicContact CZ-CG2 4.15Å; H294-V395 HydrophobicContact CB-CG1 4.23Å; Y310-V395 HydrophobicContact CE2-CG1 4.18Å; Y310-V395 HydrophobicContact CE2-CG2 3.89Å; Y310-V395 WeakPolarHBondContact OH-CG2 3.48Å; N391-V395 PolarHBondContact O-N 3.23Å; N391-V395 VanDerWaalsContact O-N 3.08Å; G392-V395 VanDerWaalsContact O-CG1 3.31Å; G392-V395 WeakPolarHBondContact O-CG1 3.41Å; G392-V395 PolarHBondContact O-N 2.86Å; V393-V395 VanDerWaalsContact C-N 3.34Å; V393-V395 PolarHBondContact O-N 3.44Å; V395-A397 HydrophobicContact CG1-CB 3.78Å
396G94.3Very high93.7Very high1 Ų131.5 Ų31.51%0.0117%0.172CC..THydrogen-bonded Turntrans91.319-176.900000113.8Y314 G392 V393Y314-G396 WeakPolarHBondContact CE2-O 3.11Å; Y314-G396 PolarHBondContact OH-O 3.21Å; G392-G396 PolarHBondContact O-N 3.37Å; V393-G396 PolarHBondContact O-N 2.91Å; V393-G396 VanDerWaalsContact O-N 3.16Å
397A94Very high93.3Very high4 Ų433.5 Ų33.53%0.03319%0.193CC..  trans-78.7155169.600000110.9Y310 G392 V395Y310-A397 HydrophobicContact CD2-CB 4.01Å; Y310-A397 HydrophobicContact CG-CB 4.09Å; G392-A397 PolarHBondContact O-N 3.12Å; V395-A397 HydrophobicContact CG1-CB 3.78Å
398G92.2Very high93Very high8 Ų834.3 Ų34.38%0.08220%0.201CC..SBendtrans82.910.9172.800000116Y314 N411 H412 N413Y314-G398 PolarHBondContact OH-N 3.16Å; G398-N411 CarbonylContact O-C 3.32Å; G398-N411 WeakPolarHBondContact O-CA 3.42Å; G398-H412 PolarHBondContact O-N 3.41Å; G398-N413 PolarHBondContact O-N 2.82Å; G398-N413 VanDerWaalsContact O-N 3.16Å
399Y94.1Very high92.8Very high56 Ų5634.9 Ų34.922%0.2220%0.204CC..  trans-67.2142-180173.7-109.5000112.4Y314 P320 G401 T409 L410Y314-Y399 AromaticContact CD1-CD1 3.84Å; Y314-Y399 HydrophobicContact CD1-CD1 3.84Å; Y314-Y399 HydrophobicContact CD2-CD1 4.19Å; Y314-Y399 HydrophobicContact CE1-CD1 4.03Å; Y314-Y399 HydrophobicContact CE1-CG 4.4Å; Y314-Y399 HydrophobicContact CE2-CD1 4.37Å; Y314-Y399 AromaticContact CG-CD1 3.94Å; Y314-Y399 HydrophobicContact CG-CD1 3.94Å; Y314-Y399 VanDerWaalsContact CZ-CB 3.48Å; Y314-Y399 WeakPolarHBondContact OH-CB 3.12Å; Y314-Y399 PolarHBondContact OH-N 2.92Å; P320-Y399 HydrophobicContact CB-CD1 4.41Å; P320-Y399 HydrophobicContact CB-CD2 3.7Å; P320-Y399 HydrophobicContact CB-CE2 3.86Å; P320-Y399 HydrophobicContact CB-CG 3.97Å; P320-Y399 HydrophobicContact CG-CD1 4.3Å; P320-Y399 HydrophobicContact CG-CD2 3.82Å; P320-Y399 HydrophobicContact CG-CE2 4.46Å; P320-Y399 HydrophobicContact CG-CG 3.7Å; Y399-G401 WeakPolarHBondContact CE2-O 3.11Å; Y399-G401 WeakPolarHBondContact OH-CA 3.3Å; Y399-T409 HydrophobicContact CD2-CG2 3.45Å; Y399-T409 VanDerWaalsContact CD2-CG2 3.45Å; Y399-T409 HydrophobicContact CE2-CG2 3.68Å; Y399-L410 WeakPolarHBondContact CA-O 3.32Å
400T92.4Very high92.7Very high58 Ų5836.7 Ų36.736%0.35621%0.213SC..  trans-132.84.3-175.6510000113.3L410 H412 N413T400-L410 PolarHBondContact N-O 3.34Å; T400-L410 PolarHBondContact OG1-O 3.31Å; T400-H412 HydrophobicContact CG2-CB 3.9Å; T400-H412 PolarHBondContact OG1-CD2 3.43Å; T400-H412 VanDerWaalsContact OG1-CD2 3.22Å; T400-H412 PolarHBondContact OG1-N 2.97Å; T400-N413 HydrophobicContact CG2-CB 4.19Å; T400-N413 WeakPolarHBondContact CG2-OD1 3.14Å
401G92Very high92.5Very high18 Ų1837.1 Ų37.119%0.18622%0.216CC..EExtended strand (participates in β ladder)trans123-170.5-176.300000112.9Y399 L410Y399-G401 WeakPolarHBondContact CE2-O 3.11Å; Y399-G401 WeakPolarHBondContact OH-CA 3.3Å; G401-L410 WeakPolarHBondContact O-CB 3.06Å; G401-L410 PolarHBondContact O-N 3.16Å
402Q91.6Very high92.3Very high108 Ų10840.5 Ų40.551%0.50523%0.231SC..EExtended strand (participates in β ladder)trans-109.3149.2176.1-69.8174.7-14.100110.5P404 A408Q402-P404 WeakPolarHBondContact O-CD 3.46Å; Q402-A408 CarbonylContact C-O 3.53Å; Q402-A408 WeakPolarHBondContact CA-O 3.37Å
403C89.6Confident92.2Very high24 Ų2442 Ų4216%0.16224%0.239CC..  trans-64.2121.9171.6178.90000109.3R405 T406 G407 A408 L410C403-R405 PolarHBondContact O-N 3.03Å; C403-T406 VanDerWaalsContact CB-OG1 3.24Å; C403-T406 WeakPolarHBondContact CB-OG1 3.38Å; C403-T406 PolarHBondContact O-N 3.48Å; C403-T406 PolarHBondContact SG-OG1 3.32Å; C403-T406 VanDerWaalsContact SG-OG1 3.32Å; C403-G407 WeakPolarHBondContact O-CA 3.31Å; C403-G407 PolarHBondContact O-N 3.49Å; C403-A408 HydrophobicContact CB-CB 4.47Å; C403-A408 PolarHBondContact N-O 3.08Å; C403-L410 HydrophobicContact CB-CD1 4.38Å; C403-L410 HydrophobicContact CB-CD2 4.22Å; C403-L410 HydrophobicContact CB-CG 4.36Å
404P90.9Very high92.1Very high112 Ų11242 Ų4273%0.72724%0.239SC*.THydrogen-bonded Turntrans-59-22.5-178.8-2634.7000114.1Q402Q402-P404 WeakPolarHBondContact O-CD 3.46Å
405R91Very high92Very high142 Ų14244.6 Ų44.654%0.53625%0.249SC..THydrogen-bonded Turntrans-96.4-34-176.8-61.9-158.7-170.8-175.36.1114.9P213 P214 C215 C403P213-R405 PolarHBondContact O-NH2 2.85Å; P214-R405 VanDerWaalsContact CA-NH1 3.26Å; C215-R405 VanDerWaalsContact CA-CZ 3.46Å; C215-R405 HydrophobicContact CB-CG 4.42Å; C215-R405 VanDerWaalsContact CB-NE 3.32Å; C215-R405 VanDerWaalsContact N-NH2 3.18Å; C215-R405 WeakPolarHBondContact SG-CD 3.3Å; C215-R405 VanDerWaalsContact SG-CZ 3.51Å; C215-R405 PolarHBondContact SG-NE 3.21Å; C403-R405 PolarHBondContact O-N 3.03Å
406T89.8Confident92Very high105 Ų10544.7 Ų44.764%0.64425%0.249SC*.THydrogen-bonded Turntrans-113.1-8.7-173.862.10000112.9C403 A408C403-T406 VanDerWaalsContact CB-OG1 3.24Å; C403-T406 WeakPolarHBondContact CB-OG1 3.38Å; C403-T406 PolarHBondContact O-N 3.48Å; C403-T406 PolarHBondContact SG-OG1 3.32Å; C403-T406 VanDerWaalsContact SG-OG1 3.32Å; T406-A408 PolarHBondContact O-N 2.84Å; T406-A408 VanDerWaalsContact O-N 3.07Å; T406-A408 WeakPolarHBondContact OG1-CB 3.46Å; T406-A408 PolarHBondContact OG1-N 2.95Å
407G88.4Confident92.1Very high43 Ų4344.7 Ų44.744%0.44325%0.249SC..  trans66.70.1-171.300000114.1C403C403-G407 WeakPolarHBondContact O-CA 3.31Å; C403-G407 PolarHBondContact O-N 3.49Å
408A89.1Confident92.2Very high26 Ų2645.4 Ų45.422%0.21525%0.252CS..  trans-68.6135.1-175.100000111.7Q402 C403 T406 L410Q402-A408 CarbonylContact C-O 3.53Å; Q402-A408 WeakPolarHBondContact CA-O 3.37Å; C403-A408 HydrophobicContact CB-CB 4.47Å; C403-A408 PolarHBondContact N-O 3.08Å; T406-A408 PolarHBondContact O-N 2.84Å; T406-A408 VanDerWaalsContact O-N 3.07Å; T406-A408 WeakPolarHBondContact OG1-CB 3.46Å; T406-A408 PolarHBondContact OG1-N 2.95Å; A408-L410 PolarHBondContact O-N 3.24Å
409T91.1Very high92.4Very high16 Ų1648 Ų4810%0.09826%0.262CS..EExtended strand (participates in β ladder)trans-54.3128.5171.4-50.30000111.2P320 P321 Y399 N411P320-T409 HydrophobicContact CB-CG2 3.89Å; P320-T409 HydrophobicContact CG-CG2 4.37Å; P321-T409 PolarHBondContact O-OG1 3.12Å; Y399-T409 HydrophobicContact CD2-CG2 3.45Å; Y399-T409 VanDerWaalsContact CD2-CG2 3.45Å; Y399-T409 HydrophobicContact CE2-CG2 3.68Å; T409-N411 WeakPolarHBondContact CG2-OD1 3.43Å
410L92.9Very high92.4Very high37 Ų3750.9 Ų50.919%0.19428%0.28CS..EExtended strand (participates in β ladder)trans-107.5124.9177.7-61.4176.6000110.8Y399 T400 G401 C403 A408Y399-L410 WeakPolarHBondContact CA-O 3.32Å; T400-L410 PolarHBondContact N-O 3.34Å; T400-L410 PolarHBondContact OG1-O 3.31Å; G401-L410 WeakPolarHBondContact O-CB 3.06Å; G401-L410 PolarHBondContact O-N 3.16Å; C403-L410 HydrophobicContact CB-CD1 4.38Å; C403-L410 HydrophobicContact CB-CD2 4.22Å; C403-L410 HydrophobicContact CB-CG 4.36Å; A408-L410 PolarHBondContact O-N 3.24Å
411N92.2Very high92.6Very high13 Ų1352.2 Ų52.27%0.0728%0.281CS..  trans-116.653.4-175.1-64.7-7.1000112.3V393 G398 T409 N413 I414V393-N411 HydrophobicContact CG2-CB 4.17Å; G398-N411 CarbonylContact O-C 3.32Å; G398-N411 WeakPolarHBondContact O-CA 3.42Å; T409-N411 WeakPolarHBondContact CG2-OD1 3.43Å; N411-N413 VanDerWaalsContact C-N 3.35Å; N411-N413 PolarHBondContact O-N 3.38Å; N411-I414 HydrophobicContact CB-CG2 4.21Å
412H92.3Very high92.8Very high78 Ų7851.7 Ų51.736%0.36127%0.274SS..G310 helixtrans-68.9-29.3-172.3-63.5-58000113.9G398 T400 I414 R415G398-H412 PolarHBondContact O-N 3.41Å; T400-H412 HydrophobicContact CG2-CB 3.9Å; T400-H412 PolarHBondContact OG1-CD2 3.43Å; T400-H412 VanDerWaalsContact OG1-CD2 3.22Å; T400-H412 PolarHBondContact OG1-N 2.97Å; H412-I414 PolarHBondContact O-N 3.01Å; H412-R415 PolarHBondContact O-N 3.35Å
413N92.6Very high93Very high33 Ų3348 Ų4818%0.17626%0.257CS..G310 helixtrans-72-16.7-174.3-69.1-7000113.4E306 G398 T400 N411E306-N413 PolarHBondContact OE1-ND2 2.85Å; E306-N413 PolarHBondContact OE1-OD1 3.37Å; G398-N413 PolarHBondContact O-N 2.82Å; G398-N413 VanDerWaalsContact O-N 3.16Å; T400-N413 HydrophobicContact CG2-CB 4.19Å; T400-N413 WeakPolarHBondContact CG2-OD1 3.14Å; N411-N413 VanDerWaalsContact C-N 3.35Å; N411-N413 PolarHBondContact O-N 3.38Å
414I93.8Very high93.3Very high1 Ų149.5 Ų49.51%0.00527%0.265CS..G310 helixtrans-104.9-0.8176.1-153.978.7000112.8P300 T302 E389 V393 N411 H412 N416P300-I414 HydrophobicContact CG-CB 4.37Å; P300-I414 HydrophobicContact CG-CD1 3.38Å; P300-I414 HydrophobicContact CG-CG1 3.53Å; P300-I414 WeakPolarHBondContact CG-O 3.21Å; T302-I414 HydrophobicContact CG2-CD1 3.9Å; E389-I414 HydrophobicContact CG-CG2 4.18Å; V393-I414 HydrophobicContact CG2-CG2 4.07Å; N411-I414 HydrophobicContact CB-CG2 4.21Å; H412-I414 PolarHBondContact O-N 3.01Å; I414-N416 PolarHBondContact O-N 3.24Å
415R94.2Very high93.4Very high54 Ų5444.5 Ų44.520%0.20423%0.234CC..  trans-81.6114-179.5-174.7178-177.2177.94.6109.8H412 F417 D418 I437H412-R415 PolarHBondContact O-N 3.35Å; R415-F417 WeakPolarHBondContact CG-O 3.42Å; R415-F417 PolarHBondContact NE-O 3.44Å; R415-D418 IonicContact CZ-OD2 3.71Å; R415-D418 IonicContact NH1-OD2 2.9Å; R415-D418 VanDerWaalsContact NH2-CB 3.3Å; R415-D418 IonicContact NH2-OD1 3.03Å; R415-D418 PolarHBondContact NH2-OD1 3.45Å; R415-D418 IonicContact NH2-OD2 3.67Å; R415-D418 PolarHBondContact NH2-OD2 3.26Å; R415-I437 HydrophobicContact CG-CD1 4.39Å
416N94.4Very high93.5Very high2 Ų239.8 Ų39.81%0.01122%0.219CC..  trans-94.2-16-179.4-148.535.3000114.8P300 W385 I414 N436 I437 S438P300-N416 HydrophobicContact CB-CB 4.09Å; W385-N416 HydrophobicContact CB-CB 4.03Å; W385-N416 HydrophobicContact CD2-CB 4.45Å; W385-N416 VanDerWaalsContact CD2-ND2 3.31Å; W385-N416 VanDerWaalsContact CE2-ND2 3.32Å; W385-N416 HydrophobicContact CG-CB 4.12Å; W385-N416 PolarHBondContact NE1-ND2 2.85Å; I414-N416 PolarHBondContact O-N 3.24Å; N416-N436 PolarHBondContact ND2-OD1 2.81Å; N416-N436 CarbonylContact O-C 3.45Å; N416-N436 WeakPolarHBondContact O-CA 3.23Å; N416-N436 PolarHBondContact O-N 3.22Å; N416-N436 PolarHBondContact OD1-OD1 2.98Å; N416-I437 WeakPolarHBondContact O-CG1 3.47Å; N416-I437 PolarHBondContact O-N 3.01Å; N416-I437 PolarHBondContact OD1-N 2.9Å; N416-S438 WeakPolarHBondContact OD1-CB 3.49Å; N416-S438 PolarHBondContact OD1-N 3.32Å; N416-S438 PolarHBondContact OD1-OG 3.07Å
417F96.4Very high93.7Very high1 Ų135.2 Ų35.20%0.00419%0.191CC..  trans-150.3156.1175.569.9-80.8000113R333 Y382 W385 R415 F419 A434R333-F417 VanDerWaalsContact NH2-CZ 3.27Å; Y382-F417 HydrophobicContact CD1-CD1 4.34Å; Y382-F417 AromaticContact CD1-CD2 3.4Å; Y382-F417 HydrophobicContact CD1-CD2 3.4Å; Y382-F417 HydrophobicContact CD1-CE1 4.33Å; Y382-F417 AromaticContact CD1-CE2 3.37Å; Y382-F417 HydrophobicContact CD1-CE2 3.37Å; Y382-F417 AromaticContact CD1-CG 3.91Å; Y382-F417 HydrophobicContact CD1-CG 3.91Å; Y382-F417 AromaticContact CD1-CZ 3.87Å; Y382-F417 HydrophobicContact CD1-CZ 3.87Å; Y382-F417 AromaticContact CE1-CD2 3.68Å; Y382-F417 HydrophobicContact CE1-CD2 3.68Å; Y382-F417 HydrophobicContact CE1-CE2 4.03Å; Y382-F417 HydrophobicContact CE1-CG 4.25Å; Y382-F417 HydrophobicContact CG-CD2 4.28Å; Y382-F417 AromaticContact CG-CE2 3.81Å; Y382-F417 HydrophobicContact CG-CE2 3.81Å; Y382-F417 HydrophobicContact CG-CZ 4.13Å; Y382-F417 WeakPolarHBondContact O-CZ 3Å; W385-F417 HydrophobicContact CB-CD1 3.82Å; W385-F417 HydrophobicContact CB-CE1 3.92Å; W385-F417 HydrophobicContact CE3-CB 4.27Å; W385-F417 HydrophobicContact CE3-CD1 4.06Å; W385-F417 HydrophobicContact CE3-CG 4.43Å; R415-F417 WeakPolarHBondContact CG-O 3.42Å; R415-F417 PolarHBondContact NE-O 3.44Å; F417-F419 HydrophobicContact CD2-CB 4.24Å; F417-F419 HydrophobicContact CE2-CB 4.01Å; F417-F419 HydrophobicContact CE2-CD2 4.37Å; F417-A434 CarbonylContact C-O 3.58Å; F417-A434 VanDerWaalsContact CA-O 3.23Å; F417-A434 WeakPolarHBondContact CA-O 3.17Å
418D95.8Very high93.9Very high18 Ų1833.3 Ų33.310%0.09617%0.171CC..  trans-115.898.4167.1-172.5-31000109.7R415 L420 K421 V422 A434R415-D418 IonicContact CZ-OD2 3.71Å; R415-D418 IonicContact NH1-OD2 2.9Å; R415-D418 VanDerWaalsContact NH2-CB 3.3Å; R415-D418 IonicContact NH2-OD1 3.03Å; R415-D418 PolarHBondContact NH2-OD1 3.45Å; R415-D418 IonicContact NH2-OD2 3.67Å; R415-D418 PolarHBondContact NH2-OD2 3.26Å; D418-L420 VanDerWaalsContact C-N 3.3Å; D418-L420 PolarHBondContact O-N 3.22Å; D418-L420 PolarHBondContact OD1-N 2.88Å; D418-K421 HydrophobicContact CB-CB 3.93Å; D418-K421 HydrophobicContact CB-CD 4Å; D418-K421 HydrophobicContact CB-CG 4.13Å; D418-K421 VanDerWaalsContact CG-CG 3.44Å; D418-K421 PolarHBondContact O-N 2.71Å; D418-K421 VanDerWaalsContact O-N 3.15Å; D418-K421 PolarHBondContact OD1-N 2.78Å; D418-K421 VanDerWaalsContact OD2-CD 3.23Å; D418-K421 WeakPolarHBondContact OD2-CD 3.41Å; D418-K421 WeakPolarHBondContact OD2-CE 3.28Å; D418-K421 WeakPolarHBondContact OD2-CG 3.26Å; D418-K421 IonicContact OD2-NZ 3.3Å; D418-V422 VanDerWaalsContact O-CG2 3.3Å; D418-V422 WeakPolarHBondContact O-CG2 3.24Å; D418-V422 PolarHBondContact O-N 3.14Å; D418-A434 HydrophobicContact CB-CB 4.15Å; D418-A434 PolarHBondContact N-O 3.1Å
419F95.5Very high94Very high64 Ų6434.9 Ų34.928%0.28117%0.173SC..Hα-helixtrans-48.6-49.4-176-175.4-90.8000112.9F375 Y382 F417 V422 E423F375-F419 HydrophobicContact CE2-CE2 4.48Å; F375-F419 HydrophobicContact CE2-CZ 4.12Å; F375-F419 HydrophobicContact CZ-CZ 4.26Å; Y382-F419 AromaticContact CD2-CD2 3.73Å; Y382-F419 HydrophobicContact CD2-CD2 3.73Å; Y382-F419 AromaticContact CD2-CE2 3.68Å; Y382-F419 HydrophobicContact CD2-CE2 3.68Å; Y382-F419 AromaticContact CE2-CD2 3.66Å; Y382-F419 HydrophobicContact CE2-CD2 3.66Å; Y382-F419 AromaticContact CE2-CE2 3.58Å; Y382-F419 HydrophobicContact CE2-CE2 3.58Å; Y382-F419 HydrophobicContact CG-CD2 4.26Å; F417-F419 HydrophobicContact CD2-CB 4.24Å; F417-F419 HydrophobicContact CE2-CB 4.01Å; F417-F419 HydrophobicContact CE2-CD2 4.37Å; F419-V422 PolarHBondContact O-N 2.97Å; F419-E423 HydrophobicContact CE1-CG 4.47Å; F419-E423 HydrophobicContact CZ-CG 4.41Å; F419-E423 PolarHBondContact O-N 3.08Å; F419-E423 VanDerWaalsContact O-N 3.09Å
420L95.4Very high94Very high115 Ų11538.1 Ų38.160%0.60219%0.187SC*.Hα-helixtrans-68.8-45.8-177.1-174.664.8000110.5D418 V422 E423 T424D418-L420 VanDerWaalsContact C-N 3.3Å; D418-L420 PolarHBondContact O-N 3.22Å; D418-L420 PolarHBondContact OD1-N 2.88Å; L420-V422 VanDerWaalsContact C-N 3.28Å; L420-V422 PolarHBondContact O-N 3.03Å; L420-E423 PolarHBondContact O-N 3.02Å; L420-T424 HydrophobicContact CD1-CG2 3.78Å; L420-T424 WeakPolarHBondContact O-CB 3.32Å; L420-T424 PolarHBondContact O-N 3.34Å; L420-T424 PolarHBondContact O-OG1 2.98Å
421K95.6Very high94.2Very high86 Ų8636.8 Ų36.837%0.37418%0.18SC..Hα-helixtrans-65.6-30.2179.7-66.7-179.5-170.9172.10112.9D219 D418 G425 A434D219-K421 IonicContact OD2-NZ 2.82Å; D219-K421 PolarHBondContact OD2-NZ 3.03Å; D418-K421 HydrophobicContact CB-CB 3.93Å; D418-K421 HydrophobicContact CB-CD 4Å; D418-K421 HydrophobicContact CB-CG 4.13Å; D418-K421 VanDerWaalsContact CG-CG 3.44Å; D418-K421 PolarHBondContact O-N 2.71Å; D418-K421 VanDerWaalsContact O-N 3.15Å; D418-K421 PolarHBondContact OD1-N 2.78Å; D418-K421 VanDerWaalsContact OD2-CD 3.23Å; D418-K421 WeakPolarHBondContact OD2-CD 3.41Å; D418-K421 WeakPolarHBondContact OD2-CE 3.28Å; D418-K421 WeakPolarHBondContact OD2-CG 3.26Å; D418-K421 IonicContact OD2-NZ 3.3Å; K421-G425 VanDerWaalsContact O-CA 3.22Å; K421-G425 WeakPolarHBondContact O-CA 3.37Å; K421-G425 PolarHBondContact O-N 3.25Å; K421-G425 VanDerWaalsContact O-N 3.08Å; K421-A434 HydrophobicContact CB-CB 3.59Å; K421-A434 HydrophobicContact CD-CB 4.44Å
422V96.3Very high94.3Very high8 Ų838.1 Ų38.15%0.04819%0.187CC..Hα-helixtrans-70.1-51.6175.2172.90000110.6Y382 D418 F419 L420 V431 A434 W435Y382-V422 WeakPolarHBondContact OH-CG1 3.29Å; D418-V422 VanDerWaalsContact O-CG2 3.3Å; D418-V422 WeakPolarHBondContact O-CG2 3.24Å; D418-V422 PolarHBondContact O-N 3.14Å; F419-V422 PolarHBondContact O-N 2.97Å; L420-V422 VanDerWaalsContact C-N 3.28Å; L420-V422 PolarHBondContact O-N 3.03Å; V422-V431 HydrophobicContact CG1-CG1 4.26Å; V422-A434 HydrophobicContact CG2-CB 3.77Å; V422-A434 WeakPolarHBondContact CG2-O 3.35Å; V422-W435 HydrophobicContact CG1-CE3 4.08Å; V422-W435 HydrophobicContact CG2-CB 4.08Å; V422-W435 HydrophobicContact CG2-CE3 4.43Å
423E95.4Very high94.4Very high29 Ų2936.8 Ų36.814%0.13618%0.182CC..Hα-helixtrans-77-24.5-175.1-59.9-58.8153.200113.1F375 R378 Y382 F419 L420 N518F375-E423 HydrophobicContact CE2-CG 4.24Å; R378-E423 IonicContact CZ-OE1 3.93Å; R378-E423 IonicContact CZ-OE2 3.7Å; R378-E423 IonicContact NE-OE1 3.71Å; R378-E423 PolarHBondContact NE-OE1 3.21Å; R378-E423 IonicContact NE-OE2 3.94Å; R378-E423 IonicContact NH2-OE1 2.87Å; R378-E423 IonicContact NH2-OE2 3.63Å; R378-E423 PolarHBondContact NH2-OE2 3.44Å; Y382-E423 PolarHBondContact OH-OE1 2.91Å; F419-E423 HydrophobicContact CE1-CG 4.47Å; F419-E423 HydrophobicContact CZ-CG 4.41Å; F419-E423 PolarHBondContact O-N 3.08Å; F419-E423 VanDerWaalsContact O-N 3.09Å; L420-E423 PolarHBondContact O-N 3.02Å; E423-N518 PolarHBondContact O-ND2 3.27Å
424T95.5Very high94.6Very high57 Ų5735.4 Ų35.435%0.3518%0.175SC..THydrogen-bonded Turntrans-113.619.9-179.368.60000114L420 I426 M514L420-T424 HydrophobicContact CD1-CG2 3.78Å; L420-T424 WeakPolarHBondContact O-CB 3.32Å; L420-T424 PolarHBondContact O-N 3.34Å; L420-T424 PolarHBondContact O-OG1 2.98Å; T424-I426 PolarHBondContact O-N 3.12Å; T424-M514 HydrophobicContact CG2-SD 4.12Å
425G93.6Very high94.7Very high6 Ų638.6 Ų38.66%0.06219%0.187CC..  trans-62.3126.9-178.900000112.7K421 S427 T517K421-G425 VanDerWaalsContact O-CA 3.22Å; K421-G425 WeakPolarHBondContact O-CA 3.37Å; K421-G425 PolarHBondContact O-N 3.25Å; K421-G425 VanDerWaalsContact O-N 3.08Å; G425-S427 VanDerWaalsContact C-N 3.3Å; G425-S427 PolarHBondContact O-N 2.86Å; G425-T517 WeakPolarHBondContact O-CB 3.37Å; G425-T517 VanDerWaalsContact O-CG2 3.32Å; G425-T517 WeakPolarHBondContact O-CG2 3.34Å
426I93.5Very high94.8Very high44 Ų4436.7 Ų36.723%0.22618%0.181CC..SBendtrans-82.3-4.5178.362.6166.7000113.9T424 H430 T513 M514T424-I426 PolarHBondContact O-N 3.12Å; I426-H430 VanDerWaalsContact CG1-ND1 3.29Å; I426-H430 WeakPolarHBondContact CG1-ND1 3.11Å; I426-T513 WeakPolarHBondContact O-CB 3.33Å; I426-M514 HydrophobicContact CG2-CB 4.34Å
427S93.3Very high94.9Very high8 Ų838.4 Ų38.46%0.05619%0.19CC..SBendtrans-154.1154.3175.1700000109.8G425 K429 H430 V431 T517G425-S427 VanDerWaalsContact C-N 3.3Å; G425-S427 PolarHBondContact O-N 2.86Å; S427-K429 PolarHBondContact O-N 2.85Å; S427-H430 WeakPolarHBondContact O-CB 3.35Å; S427-H430 PolarHBondContact O-N 2.97Å; S427-H430 PolarHBondContact OG-CD2 3.21Å; S427-H430 PolarHBondContact OG-N 2.64Å; S427-V431 PolarHBondContact O-N 3.33Å; S427-V431 VanDerWaalsContact O-N 3.17Å; S427-T517 PolarHBondContact N-OG1 3.39Å
428L92.8Very high94.8Very high4 Ų438.4 Ų38.42%0.02119%0.19CC..Hα-helixtrans-61.9-32.8178.6-174.458.3000111.7H430 V431 I432 F481 F484 T485 S488 V521L428-H430 PolarHBondContact O-N 3.34Å; L428-V431 PolarHBondContact O-N 2.9Å; L428-I432 HydrophobicContact CD1-CD1 4.42Å; L428-I432 HydrophobicContact CD1-CG1 4.45Å; L428-I432 HydrophobicContact CG-CD1 3.92Å; L428-I432 HydrophobicContact CG-CG1 4.43Å; L428-I432 VanDerWaalsContact O-CG1 3.31Å; L428-I432 WeakPolarHBondContact O-CG1 3.31Å; L428-I432 PolarHBondContact O-N 3.04Å; L428-F481 HydrophobicContact CD2-CD1 4.41Å; L428-F481 HydrophobicContact CD2-CG 4.49Å; L428-F484 HydrophobicContact CD2-CB 3.5Å; L428-F484 VanDerWaalsContact CD2-CB 3.5Å; L428-T485 WeakPolarHBondContact CD2-OG1 3.37Å; L428-S488 PolarHBondContact N-OG 3.5Å; L428-V521 HydrophobicContact CD1-CG2 3.59Å
429K91.4Very high94.9Very high58 Ų5838 Ų3825%0.25219%0.188SC..Hα-helixtrans-59.8-44.9172.8173.9166.2168.8440112.1S427 V431 I432 D433S427-K429 PolarHBondContact O-N 2.85Å; K429-V431 VanDerWaalsContact C-N 3.3Å; K429-V431 PolarHBondContact O-N 3.15Å; K429-I432 PolarHBondContact O-N 3.01Å; K429-D433 IonicContact NZ-OD1 3.92Å; K429-D433 PolarHBondContact NZ-OD1 3.02Å; K429-D433 IonicContact NZ-OD2 3.05Å; K429-D433 PolarHBondContact NZ-OD2 3.02Å; K429-D433 PolarHBondContact O-N 3.12Å
430H92.4Very high94.9Very high84 Ų8436.3 Ų36.339%0.38918%0.183SC..Hα-helixtrans-62.9-38.1177.6-72.7-173000112I426 S427 L428 A434I426-H430 VanDerWaalsContact CG1-ND1 3.29Å; I426-H430 WeakPolarHBondContact CG1-ND1 3.11Å; S427-H430 WeakPolarHBondContact O-CB 3.35Å; S427-H430 PolarHBondContact O-N 2.97Å; S427-H430 PolarHBondContact OG-CD2 3.21Å; S427-H430 PolarHBondContact OG-N 2.64Å; L428-H430 PolarHBondContact O-N 3.34Å; H430-A434 VanDerWaalsContact O-CB 3.31Å; H430-A434 WeakPolarHBondContact O-CB 3.4Å; H430-A434 PolarHBondContact O-N 2.77Å
431V96.3Very high94.9Very high10 Ų1033.3 Ų33.36%0.06116%0.164CC..Hα-helixtrans-65.4-46.8176.31780000110.6V422 S427 L428 K429 D433 A434 W435 T517 V521V422-V431 HydrophobicContact CG1-CG1 4.26Å; S427-V431 PolarHBondContact O-N 3.33Å; S427-V431 VanDerWaalsContact O-N 3.17Å; L428-V431 PolarHBondContact O-N 2.9Å; K429-V431 VanDerWaalsContact C-N 3.3Å; K429-V431 PolarHBondContact O-N 3.15Å; V431-D433 PolarHBondContact O-N 2.9Å; V431-A434 CarbonylContact O-C 3.51Å; V431-A434 PolarHBondContact O-N 2.8Å; V431-A434 VanDerWaalsContact O-N 3.08Å; V431-W435 VanDerWaalsContact O-CB 3.28Å; V431-W435 WeakPolarHBondContact O-CB 3.48Å; V431-W435 PolarHBondContact O-N 3.49Å; V431-T517 HydrophobicContact CG2-CG2 3.7Å; V431-V521 HydrophobicContact CB-CG2 4.4Å; V431-V521 HydrophobicContact CG1-CG2 4.04Å; V431-V521 HydrophobicContact CG2-CG2 4.28Å
432I94.6Very high95Very high40 Ų4029.2 Ų29.221%0.20515%0.146CC..Hα-helixtrans-61.9-42178.5-69.1165.4000111.8L428 K429 A434 W435 T440 F461 T485L428-I432 HydrophobicContact CD1-CD1 4.42Å; L428-I432 HydrophobicContact CD1-CG1 4.45Å; L428-I432 HydrophobicContact CG-CD1 3.92Å; L428-I432 HydrophobicContact CG-CG1 4.43Å; L428-I432 VanDerWaalsContact O-CG1 3.31Å; L428-I432 WeakPolarHBondContact O-CG1 3.31Å; L428-I432 PolarHBondContact O-N 3.04Å; K429-I432 PolarHBondContact O-N 3.01Å; I432-A434 PolarHBondContact O-N 3.28Å; I432-W435 PolarHBondContact O-N 3.16Å; I432-W435 VanDerWaalsContact O-O 3.11Å; I432-T440 PolarHBondContact O-OG1 3.28Å; I432-F461 HydrophobicContact CD1-CE1 4.39Å; I432-F461 HydrophobicContact CD1-CZ 3.81Å; I432-T485 WeakPolarHBondContact CD1-OG1 3.42Å
433D93.9Very high95.1Very high51 Ų5129.5 Ų29.527%0.27315%0.147SC..Hα-helixtrans-68.4-17.4177.6-69.5-30.9000112.4K429 V431 R444K429-D433 IonicContact NZ-OD1 3.92Å; K429-D433 PolarHBondContact NZ-OD1 3.02Å; K429-D433 IonicContact NZ-OD2 3.05Å; K429-D433 PolarHBondContact NZ-OD2 3.02Å; K429-D433 PolarHBondContact O-N 3.12Å; V431-D433 PolarHBondContact O-N 2.9Å; D433-R444 IonicContact OD1-NH2 3.72Å
434A96.8Very high95.1Very high3 Ų331 Ų313%0.02515%0.152CC..Hα-helixtrans-104.3-11.2-18000000114.1F417 D418 K421 V422 H430 V431 I432F417-A434 CarbonylContact C-O 3.58Å; F417-A434 VanDerWaalsContact CA-O 3.23Å; F417-A434 WeakPolarHBondContact CA-O 3.17Å; D418-A434 HydrophobicContact CB-CB 4.15Å; D418-A434 PolarHBondContact N-O 3.1Å; K421-A434 HydrophobicContact CB-CB 3.59Å; K421-A434 HydrophobicContact CD-CB 4.44Å; V422-A434 HydrophobicContact CG2-CB 3.77Å; V422-A434 WeakPolarHBondContact CG2-O 3.35Å; H430-A434 VanDerWaalsContact O-CB 3.31Å; H430-A434 WeakPolarHBondContact O-CB 3.4Å; H430-A434 PolarHBondContact O-N 2.77Å; V431-A434 CarbonylContact O-C 3.51Å; V431-A434 PolarHBondContact O-N 2.8Å; V431-A434 VanDerWaalsContact O-N 3.08Å; I432-A434 PolarHBondContact O-N 3.28Å
435W96.3Very high95.1Very high69 Ų6928.6 Ų28.626%0.26114%0.137SC..SBendtrans-107.3128.4-178.8173.6-92000110.4R378 Y381 Y382 W385 V422 V431 I432 I437R378-W435 HydrophobicContact CB-CZ3 4.45Å; R378-W435 HydrophobicContact CG-CH2 4.04Å; R378-W435 HydrophobicContact CG-CZ3 4.08Å; Y381-W435 HydrophobicContact CD1-CZ2 4.47Å; Y381-W435 HydrophobicContact CD2-CH2 4.02Å; Y381-W435 HydrophobicContact CD2-CZ2 4.49Å; Y381-W435 AromaticContact CG-CH2 3.87Å; Y381-W435 HydrophobicContact CG-CH2 3.87Å; Y381-W435 HydrophobicContact CG-CZ2 4.19Å; Y382-W435 HydrophobicContact CD1-CZ3 4.38Å; Y382-W435 HydrophobicContact CE1-CE3 4.09Å; Y382-W435 AromaticContact CE1-CZ3 3.62Å; Y382-W435 HydrophobicContact CE1-CZ3 3.62Å; W385-W435 HydrophobicContact CH2-CD2 4.12Å; W385-W435 AromaticContact CH2-CE2 3.55Å; W385-W435 AromaticContact CH2-CH2 4Å; W385-W435 HydrophobicContact CH2-CH2 4Å; W385-W435 AromaticContact CH2-CZ2 3.49Å; W385-W435 HydrophobicContact CH2-CZ2 3.49Å; W385-W435 VanDerWaalsContact CH2-CZ2 3.49Å; W385-W435 HydrophobicContact CH2-CZ3 4.49Å; W385-W435 AromaticContact CH2-NE1 3.89Å; W385-W435 AromaticContact CZ3-CD2 3.92Å; W385-W435 HydrophobicContact CZ3-CD2 3.92Å; W385-W435 AromaticContact CZ3-CE2 3.8Å; W385-W435 AromaticContact CZ3-CE3 3.97Å; W385-W435 HydrophobicContact CZ3-CE3 3.97Å; W385-W435 AromaticContact CZ3-CH2 3.83Å; W385-W435 HydrophobicContact CZ3-CH2 3.83Å; W385-W435 AromaticContact CZ3-CZ2 3.77Å; W385-W435 HydrophobicContact CZ3-CZ2 3.77Å; W385-W435 AromaticContact CZ3-CZ3 3.93Å; W385-W435 HydrophobicContact CZ3-CZ3 3.93Å; V422-W435 HydrophobicContact CG1-CE3 4.08Å; V422-W435 HydrophobicContact CG2-CB 4.08Å; V422-W435 HydrophobicContact CG2-CE3 4.43Å; V431-W435 VanDerWaalsContact O-CB 3.28Å; V431-W435 WeakPolarHBondContact O-CB 3.48Å; V431-W435 PolarHBondContact O-N 3.49Å; I432-W435 PolarHBondContact O-N 3.16Å; I432-W435 VanDerWaalsContact O-O 3.11Å; W435-I437 VanDerWaalsContact C-N 3.25Å; W435-I437 PolarHBondContact O-N 3.38Å
436N95.6Very high95.2Very high13 Ų1328.5 Ų28.57%0.0714%0.135CC..SBendtrans47.750.2-179.1-160.7-3.9000112.3W385 N416 S438 T439 T440W385-N436 HydrophobicContact CH2-CB 3.6Å; W385-N436 HydrophobicContact CZ2-CB 3.92Å; W385-N436 HydrophobicContact CZ3-CB 4.19Å; N416-N436 PolarHBondContact ND2-OD1 2.81Å; N416-N436 CarbonylContact O-C 3.45Å; N416-N436 WeakPolarHBondContact O-CA 3.23Å; N416-N436 PolarHBondContact O-N 3.22Å; N416-N436 PolarHBondContact OD1-OD1 2.98Å; N436-S438 PolarHBondContact O-N 3.4Å; N436-S438 VanDerWaalsContact O-N 3.09Å; N436-T439 VanDerWaalsContact CG-CB 3.41Å; N436-T439 WeakPolarHBondContact ND2-CB 3.45Å; N436-T439 PolarHBondContact ND2-OG1 2.86Å; N436-T439 WeakPolarHBondContact O-CA 3.22Å; N436-T439 WeakPolarHBondContact O-CB 3.12Å; N436-T439 PolarHBondContact O-N 3.39Å; N436-T439 VanDerWaalsContact OD1-CB 3.32Å; N436-T439 WeakPolarHBondContact OD1-CB 3.28Å; N436-T439 PolarHBondContact OD1-OG1 3.36Å; N436-T440 PolarHBondContact O-N 3.47Å
437I96.7Very high95.3Very high39 Ų3927.6 Ų27.620%0.213%0.129CC..Hα-helixtrans-49.5-42.4-169.9-62.2172.5000111.1R415 N416 W435 T439 T440 R441R415-I437 HydrophobicContact CG-CD1 4.39Å; N416-I437 WeakPolarHBondContact O-CG1 3.47Å; N416-I437 PolarHBondContact O-N 3.01Å; N416-I437 PolarHBondContact OD1-N 2.9Å; W435-I437 VanDerWaalsContact C-N 3.25Å; W435-I437 PolarHBondContact O-N 3.38Å; I437-T439 PolarHBondContact O-N 2.84Å; I437-T440 WeakPolarHBondContact O-CB 3.3Å; I437-T440 PolarHBondContact O-N 3.41Å; I437-R441 WeakPolarHBondContact O-CG 3.23Å; I437-R441 PolarHBondContact O-N 2.78Å
438S94.7Very high95.4Very high1 Ų130.2 Ų30.21%0.00714%0.138CC..Hα-helixtrans-65.6-40.4-178.4-43.80000112.1P300 F301 N416 N436 T440 R441 W442P300-S438 WeakPolarHBondContact CB-OG 3.47Å; F301-S438 WeakPolarHBondContact CD1-O 3.32Å; F301-S438 VanDerWaalsContact O-CB 3.28Å; F301-S438 WeakPolarHBondContact O-CB 3.29Å; F301-S438 PolarHBondContact O-OG 2.86Å; N416-S438 WeakPolarHBondContact OD1-CB 3.49Å; N416-S438 PolarHBondContact OD1-N 3.32Å; N416-S438 PolarHBondContact OD1-OG 3.07Å; N436-S438 PolarHBondContact O-N 3.4Å; N436-S438 VanDerWaalsContact O-N 3.09Å; S438-T440 VanDerWaalsContact C-N 3.35Å; S438-R441 WeakPolarHBondContact O-CB 3.33Å; S438-R441 PolarHBondContact O-N 3.49Å; S438-W442 PolarHBondContact O-N 3.49Å
439T96.6Very high95.5Very high9 Ų932.1 Ų32.16%0.05515%0.148CC..Hα-helixtrans-66.1-39.6174.5-620000110.8Q165 N436 I437 R441 W442 L443 W467Q165-T439 PolarHBondContact NE2-OG1 2.9Å; N436-T439 VanDerWaalsContact CG-CB 3.41Å; N436-T439 WeakPolarHBondContact ND2-CB 3.45Å; N436-T439 PolarHBondContact ND2-OG1 2.86Å; N436-T439 WeakPolarHBondContact O-CA 3.22Å; N436-T439 WeakPolarHBondContact O-CB 3.12Å; N436-T439 PolarHBondContact O-N 3.39Å; N436-T439 VanDerWaalsContact OD1-CB 3.32Å; N436-T439 WeakPolarHBondContact OD1-CB 3.28Å; N436-T439 PolarHBondContact OD1-OG1 3.36Å; I437-T439 PolarHBondContact O-N 2.84Å; T439-R441 VanDerWaalsContact C-N 3.32Å; T439-R441 PolarHBondContact O-N 3.17Å; T439-W442 HydrophobicContact CG2-CE3 3.97Å; T439-W442 HydrophobicContact CG2-CZ3 4.26Å; T439-W442 PolarHBondContact O-N 3.26Å; T439-L443 HydrophobicContact CG2-CD1 4.15Å; T439-L443 HydrophobicContact CG2-CG 4.4Å; T439-L443 WeakPolarHBondContact O-CB 3.44Å; T439-L443 WeakPolarHBondContact O-CG 3.35Å; T439-L443 PolarHBondContact O-N 3.46Å; T439-W467 HydrophobicContact CG2-CE3 4.35Å; T439-W467 HydrophobicContact CG2-CH2 4.05Å; T439-W467 HydrophobicContact CG2-CZ3 3.87Å
440T96Very high95.5Very high29 Ų2932.5 Ų32.518%0.17815%0.148CC..Hα-helixtrans-63-38175-60.90000111.8I432 N436 I437 S438 R444I432-T440 PolarHBondContact O-OG1 3.28Å; N436-T440 PolarHBondContact O-N 3.47Å; I437-T440 WeakPolarHBondContact O-CB 3.3Å; I437-T440 PolarHBondContact O-N 3.41Å; S438-T440 VanDerWaalsContact C-N 3.35Å; T440-R444 WeakPolarHBondContact O-CB 3.4Å; T440-R444 PolarHBondContact O-N 2.82Å
441R96.3Very high95.6Very high52 Ų5230.2 Ų30.220%0.19614%0.139CC..Hα-helixtrans-63.7-47.1173-68172.669.5-162.93.7111.7H275 F303 E306 I437 S438 T439 R444 E445H275-R441 PolarHBondContact CE1-NH2 3.26Å; H275-R441 PolarHBondContact NE2-NH2 3.21Å; F303-R441 HydrophobicContact CE2-CB 4.11Å; F303-R441 HydrophobicContact CZ-CB 4.39Å; E306-R441 IonicContact OE1-CZ 3.96Å; E306-R441 VanDerWaalsContact OE1-CZ 3.3Å; E306-R441 IonicContact OE1-NH1 3.7Å; E306-R441 PolarHBondContact OE1-NH1 2.9Å; E306-R441 IonicContact OE1-NH2 3.59Å; E306-R441 PolarHBondContact OE1-NH2 3.05Å; E306-R441 IonicContact OE2-NH1 3.51Å; E306-R441 IonicContact OE2-NH2 3.77Å; I437-R441 WeakPolarHBondContact O-CG 3.23Å; I437-R441 PolarHBondContact O-N 2.78Å; S438-R441 WeakPolarHBondContact O-CB 3.33Å; S438-R441 PolarHBondContact O-N 3.49Å; T439-R441 VanDerWaalsContact C-N 3.32Å; T439-R441 PolarHBondContact O-N 3.17Å; R441-R444 PolarHBondContact O-N 3.28Å; R441-E445 PolarHBondContact O-N 2.91Å
442W97.4Very high95.4Very high0 Ų033.7 Ų33.70%016%0.161CC..Hα-helixtrans-58.1-50.3175162.764.2000112.3Q165 S168 S169 F301 S438 T439 R444 E445 T446 F447 W467Q165-W442 HydrophobicContact CB-CB 4.38Å; Q165-W442 HydrophobicContact CB-CD2 4Å; Q165-W442 HydrophobicContact CB-CG 3.86Å; Q165-W442 HydrophobicContact CG-CD2 3.56Å; Q165-W442 HydrophobicContact CG-CE3 3.7Å; Q165-W442 HydrophobicContact CG-CG 3.92Å; Q165-W442 HydrophobicContact CG-CH2 4.35Å; Q165-W442 HydrophobicContact CG-CZ2 4.22Å; Q165-W442 HydrophobicContact CG-CZ3 4.1Å; Q165-W442 VanDerWaalsContact NE2-CE3 3.35Å; S168-W442 PolarHBondContact OG-NE1 3.49Å; S169-W442 VanDerWaalsContact OG-CD1 3.24Å; F301-W442 HydrophobicContact CD1-CB 4.09Å; F301-W442 HydrophobicContact CE1-CB 3.85Å; F301-W442 HydrophobicContact CZ-CB 4.28Å; S438-W442 PolarHBondContact O-N 3.49Å; T439-W442 HydrophobicContact CG2-CE3 3.97Å; T439-W442 HydrophobicContact CG2-CZ3 4.26Å; T439-W442 PolarHBondContact O-N 3.26Å; W442-R444 VanDerWaalsContact C-N 3.25Å; W442-R444 PolarHBondContact O-N 2.94Å; W442-E445 PolarHBondContact O-N 3.22Å; W442-T446 PolarHBondContact NE1-OG1 2.9Å; W442-T446 WeakPolarHBondContact O-CB 3.17Å; W442-T446 PolarHBondContact O-N 2.99Å; W442-T446 PolarHBondContact O-OG1 2.93Å; W442-F447 AromaticContact CE2-CE2 3.87Å; W442-F447 HydrophobicContact CH2-CE2 4.21Å; W442-F447 AromaticContact CZ2-CE2 3.6Å; W442-F447 HydrophobicContact CZ2-CE2 3.6Å; W442-F447 HydrophobicContact CZ2-CZ 4.34Å; W442-W467 HydrophobicContact CH2-CB 4.01Å; W442-W467 AromaticContact CH2-CD1 3.53Å; W442-W467 HydrophobicContact CH2-CD2 4.28Å; W442-W467 AromaticContact CH2-CG 3.67Å; W442-W467 HydrophobicContact CH2-CG 3.67Å; W442-W467 HydrophobicContact CZ3-CB 4.33Å; W442-W467 AromaticContact CZ3-CD1 3.97Å; W442-W467 AromaticContact CZ3-CD2 3.97Å; W442-W467 HydrophobicContact CZ3-CD2 3.97Å; W442-W467 AromaticContact CZ3-CG 3.84Å; W442-W467 HydrophobicContact CZ3-CG 3.84Å
443L97.4Very high95.2Very high14 Ų1436.6 Ų36.67%0.07319%0.185CC..Hα-helixtrans-60.5-37.8178.7-75173.4000111.7T439 F447 Y448 V460 I463T439-L443 HydrophobicContact CG2-CD1 4.15Å; T439-L443 HydrophobicContact CG2-CG 4.4Å; T439-L443 WeakPolarHBondContact O-CB 3.44Å; T439-L443 WeakPolarHBondContact O-CG 3.35Å; T439-L443 PolarHBondContact O-N 3.46Å; L443-F447 HydrophobicContact CD2-CD2 4.17Å; L443-F447 WeakPolarHBondContact O-CB 3.45Å; L443-F447 PolarHBondContact O-N 3.23Å; L443-Y448 PolarHBondContact O-N 2.93Å; L443-V460 HydrophobicContact CB-CG1 4.01Å; L443-V460 HydrophobicContact CD1-CG1 4.17Å; L443-V460 HydrophobicContact CD2-CG1 4.33Å; L443-V460 HydrophobicContact CG-CG1 4.4Å; L443-I463 HydrophobicContact CD2-CG2 4.14Å
444R95.4Very high95Very high60 Ų6037.7 Ų37.723%0.22620%0.202CC..Hα-helixtrans-64.1-57.4179-177.2177.8-63.6-174.33.8111.5F221 D433 T440 R441 W442 Y448 D449F221-R444 VanDerWaalsContact CG-NH1 3.31Å; D433-R444 IonicContact OD1-NH2 3.72Å; T440-R444 WeakPolarHBondContact O-CB 3.4Å; T440-R444 PolarHBondContact O-N 2.82Å; R441-R444 PolarHBondContact O-N 3.28Å; W442-R444 VanDerWaalsContact C-N 3.25Å; W442-R444 PolarHBondContact O-N 2.94Å; R444-Y448 WeakPolarHBondContact O-CB 3.41Å; R444-Y448 PolarHBondContact O-N 3.03Å; R444-Y448 VanDerWaalsContact O-N 3.13Å; R444-D449 PolarHBondContact O-N 3.28Å
445E95.4Very high94.7Very high7 Ų744.7 Ų44.73%0.03323%0.228CC..Hα-helixtrans-69.1-60.8-175.3-64-174-148.300109.2S271 H272 H275 F303 R441 W442 F447 R450S271-E445 WeakPolarHBondContact CB-OE1 3.44Å; H272-E445 IonicContact CD2-OE2 3.5Å; H275-E445 IonicContact CE1-OE1 3.46Å; H275-E445 PolarHBondContact CE1-OE1 3.46Å; H275-E445 IonicContact CE1-OE2 2.87Å; H275-E445 IonicContact CG-OE2 2.71Å; H275-E445 VanDerWaalsContact ND1-CD 3.3Å; H275-E445 IonicContact ND1-OE1 3.9Å; H275-E445 PolarHBondContact ND1-OE1 3.44Å; H275-E445 IonicContact ND1-OE2 2.98Å; H275-E445 PolarHBondContact ND1-OE2 3.34Å; F303-E445 HydrophobicContact CZ-CB 4.33Å; F303-E445 HydrophobicContact CZ-CG 4.12Å; F303-E445 VanDerWaalsContact CZ-OE1 3.29Å; F303-E445 WeakPolarHBondContact CZ-OE1 3.29Å; F303-E445 WeakPolarHBondContact CZ-OE2 3.37Å; R441-E445 PolarHBondContact O-N 2.91Å; W442-E445 PolarHBondContact O-N 3.22Å; E445-F447 VanDerWaalsContact C-N 3.27Å; E445-F447 PolarHBondContact O-N 3.04Å; E445-F447 VanDerWaalsContact O-N 3.1Å; E445-R450 VanDerWaalsContact C-NH1 3.26Å; E445-R450 PolarHBondContact O-NH1 2.86Å
446T96.1Very high94.6Very high3 Ų344.7 Ų44.72%0.01823%0.228CC..Hα-helixtrans-58.5-33.9-174.5-55.90000114.1F172 W442 R450F172-T446 HydrophobicContact CD2-CG2 3.67Å; F172-T446 HydrophobicContact CE2-CG2 3.71Å; W442-T446 PolarHBondContact NE1-OG1 2.9Å; W442-T446 WeakPolarHBondContact O-CB 3.17Å; W442-T446 PolarHBondContact O-N 2.99Å; W442-T446 PolarHBondContact O-OG1 2.93Å; T446-R450 WeakPolarHBondContact O-CD 3.44Å
447F96.3Very high94.4Very high25 Ų2545.2 Ų45.211%0.1123%0.232CC..THydrogen-bonded Turntrans-125.7-59.7-173-57.8-77.4000114.3T130 L134 W442 L443 E445 D449 R450 L451 V460 I463T130-F447 HydrophobicContact CG2-CE1 3.97Å; T130-F447 HydrophobicContact CG2-CZ 3.71Å; L134-F447 HydrophobicContact CD1-CZ 4.36Å; W442-F447 AromaticContact CE2-CE2 3.87Å; W442-F447 HydrophobicContact CH2-CE2 4.21Å; W442-F447 AromaticContact CZ2-CE2 3.6Å; W442-F447 HydrophobicContact CZ2-CE2 3.6Å; W442-F447 HydrophobicContact CZ2-CZ 4.34Å; L443-F447 HydrophobicContact CD2-CD2 4.17Å; L443-F447 WeakPolarHBondContact O-CB 3.45Å; L443-F447 PolarHBondContact O-N 3.23Å; E445-F447 VanDerWaalsContact C-N 3.27Å; E445-F447 PolarHBondContact O-N 3.04Å; E445-F447 VanDerWaalsContact O-N 3.1Å; F447-D449 PolarHBondContact O-N 2.66Å; F447-R450 CarbonylContact O-C 3.08Å; F447-R450 PolarHBondContact O-N 3Å; F447-L451 HydrophobicContact CB-CD1 4.02Å; F447-L451 WeakPolarHBondContact O-CB 3.47Å; F447-L451 WeakPolarHBondContact O-CG 3.3Å; F447-L451 PolarHBondContact O-N 3.42Å; F447-V460 HydrophobicContact CB-CG2 4.17Å; F447-I463 HydrophobicContact CB-CD1 4.13Å; F447-I463 HydrophobicContact CD1-CD1 3.66Å; F447-I463 HydrophobicContact CD1-CG2 4.44Å; F447-I463 HydrophobicContact CD2-CG2 3.97Å; F447-I463 HydrophobicContact CE1-CD1 4.18Å; F447-I463 HydrophobicContact CE1-CG2 4.26Å; F447-I463 HydrophobicContact CE2-CG2 3.78Å; F447-I463 HydrophobicContact CG-CD1 3.9Å; F447-I463 HydrophobicContact CG-CG2 4.29Å; F447-I463 HydrophobicContact CZ-CG2 3.93Å
448Y95.1Very high94.2Very high64 Ų6446.5 Ų46.525%0.25124%0.239SC..G310 helixtrans-54-52.3-167.8-173.8-92.7000112.5L443 R444 R450 L451 R456 V460L443-Y448 PolarHBondContact O-N 2.93Å; R444-Y448 WeakPolarHBondContact O-CB 3.41Å; R444-Y448 PolarHBondContact O-N 3.03Å; R444-Y448 VanDerWaalsContact O-N 3.13Å; Y448-R450 PolarHBondContact O-N 3.44Å; Y448-L451 PolarHBondContact O-N 3.35Å; Y448-R456 HydrophobicContact CD2-CB 3.79Å; Y448-R456 HydrophobicContact CE2-CB 3.72Å; Y448-R456 HydrophobicContact CG-CB 4.38Å; Y448-R456 WeakPolarHBondContact O-CD 3.25Å; Y448-R456 WeakPolarHBondContact O-CG 3.27Å; Y448-R456 PolarHBondContact O-NE 2.93Å; Y448-V460 HydrophobicContact CD2-CG2 4.02Å; Y448-V460 HydrophobicContact CG-CG2 4.44Å
449D94Very high94.3Very high43 Ų4349.4 Ų49.423%0.2325%0.254CS..G310 helixtrans-68.5-22.5-176.4-67.7-22.4000112.4H272 R444 F447 R456H272-D449 IonicContact CE1-OD2 3.43Å; H272-D449 IonicContact NE2-OD2 2.67Å; H272-D449 PolarHBondContact NE2-OD2 2.97Å; R444-D449 PolarHBondContact O-N 3.28Å; F447-D449 PolarHBondContact O-N 2.66Å; D449-R456 PolarHBondContact O-NH2 3.44Å
450R93.3Very high94.3Very high66 Ų6649.9 Ų49.925%0.24926%0.257CS..G310 helixtrans-95.3-15.3-176.6-67.6171.5166.475.9-1.4114D176 H272 E445 T446 F447 Y448D176-R450 IonicContact OD1-CZ 3.94Å; D176-R450 IonicContact OD1-NH2 2.76Å; D176-R450 PolarHBondContact OD1-NH2 2.61Å; D176-R450 IonicContact OD2-CZ 3.87Å; D176-R450 IonicContact OD2-NH2 2.66Å; D176-R450 PolarHBondContact OD2-NH2 2.9Å; H272-R450 PolarHBondContact CE1-NH1 3.41Å; H272-R450 PolarHBondContact ND1-NH1 3.23Å; H272-R450 PolarHBondContact NE2-NH1 3.38Å; E445-R450 VanDerWaalsContact C-NH1 3.26Å; E445-R450 PolarHBondContact O-NH1 2.86Å; T446-R450 WeakPolarHBondContact O-CD 3.44Å; F447-R450 CarbonylContact O-C 3.08Å; F447-R450 PolarHBondContact O-N 3Å; Y448-R450 PolarHBondContact O-N 3.44Å
451L93.5Very high94.4Very high37 Ų3749.7 Ų49.719%0.19425%0.253CS..SBendtrans-82.6165.4179.6-76.1168000112.1F447 Y448 R456 L459 V460 I463F447-L451 HydrophobicContact CB-CD1 4.02Å; F447-L451 WeakPolarHBondContact O-CB 3.47Å; F447-L451 WeakPolarHBondContact O-CG 3.3Å; F447-L451 PolarHBondContact O-N 3.42Å; Y448-L451 PolarHBondContact O-N 3.35Å; L451-R456 HydrophobicContact CB-CB 4.48Å; L451-R456 HydrophobicContact CB-CG 3.91Å; L451-R456 PolarHBondContact O-NE 3.42Å; L451-R456 PolarHBondContact O-NH2 2.92Å; L451-L459 HydrophobicContact CD1-CB 3.83Å; L451-L459 HydrophobicContact CD1-CD1 4.38Å; L451-L459 HydrophobicContact CD2-CD1 3.99Å; L451-V460 HydrophobicContact CD1-CG2 3.97Å; L451-I463 HydrophobicContact CD1-CD1 4.18Å
452P92.6Very high94.4Very high82 Ų8250.5 Ų50.553%0.53226%0.261SS..  trans-70131.7174.1-20.833.6000112.7A454 Y455 R456P452-A454 PolarHBondContact O-N 3.33Å; P452-Y455 PolarHBondContact O-N 2.89Å; P452-R456 WeakPolarHBondContact O-CG 3.37Å; P452-R456 PolarHBondContact O-N 3.4Å; P452-R456 VanDerWaalsContact O-N 3.17Å
453S89.1Confident94.3Very high101 Ų10152 Ų5271%0.70627%0.269SS*.THydrogen-bonded Turntrans-49.9-37.5-171.759.70000114.9Y455S453-Y455 VanDerWaalsContact C-N 3.27Å; S453-Y455 PolarHBondContact O-N 2.86Å
454A89.8Confident94.3Very high75 Ų7551.9 Ų51.962%0.6227%0.269SS*.THydrogen-bonded Turntrans-59.3-33.3-179.700000113.8P452P452-A454 PolarHBondContact O-N 3.33Å
455Y90.9Very high94.4Very high150 Ų15049 Ų4959%0.58826%0.258SS*.THydrogen-bonded Turntrans-123.1-0.5-170.5-51-68.9000114.2P452 S453 T457 I458 L459P452-Y455 PolarHBondContact O-N 2.89Å; S453-Y455 VanDerWaalsContact C-N 3.27Å; S453-Y455 PolarHBondContact O-N 2.86Å; Y455-T457 VanDerWaalsContact C-N 3.29Å; Y455-T457 PolarHBondContact O-N 2.96Å; Y455-T457 VanDerWaalsContact O-N 3.13Å; Y455-I458 PolarHBondContact O-N 2.86Å; Y455-L459 WeakPolarHBondContact O-CB 3.43Å; Y455-L459 WeakPolarHBondContact O-CG 3.33Å; Y455-L459 PolarHBondContact O-N 3.21Å
456R93.6Very high94.4Very high69 Ų6951.8 Ų51.826%0.2627%0.27SS..Hα-helixtrans-47.2-47.6-175.3-63.2179.8174.1-175.7-5.9113.4Y448 D449 L451 P452 V460Y448-R456 HydrophobicContact CD2-CB 3.79Å; Y448-R456 HydrophobicContact CE2-CB 3.72Å; Y448-R456 HydrophobicContact CG-CB 4.38Å; Y448-R456 WeakPolarHBondContact O-CD 3.25Å; Y448-R456 WeakPolarHBondContact O-CG 3.27Å; Y448-R456 PolarHBondContact O-NE 2.93Å; D449-R456 PolarHBondContact O-NH2 3.44Å; L451-R456 HydrophobicContact CB-CB 4.48Å; L451-R456 HydrophobicContact CB-CG 3.91Å; L451-R456 PolarHBondContact O-NE 3.42Å; L451-R456 PolarHBondContact O-NH2 2.92Å; P452-R456 WeakPolarHBondContact O-CG 3.37Å; P452-R456 PolarHBondContact O-N 3.4Å; P452-R456 VanDerWaalsContact O-N 3.17Å; R456-V460 WeakPolarHBondContact O-CB 3.19Å; R456-V460 VanDerWaalsContact O-CG2 3.24Å; R456-V460 WeakPolarHBondContact O-CG2 3.38Å; R456-V460 PolarHBondContact O-N 2.87Å
457T91.5Very high94.5Very high23 Ų2352.2 Ų52.214%0.14127%0.271CS..Hα-helixtrans-62.9-54.5-175.8-58.40000111Y455 L459 V460 F461 M486 R489Y455-T457 VanDerWaalsContact C-N 3.29Å; Y455-T457 PolarHBondContact O-N 2.96Å; Y455-T457 VanDerWaalsContact O-N 3.13Å; T457-L459 PolarHBondContact O-N 3.34Å; T457-V460 PolarHBondContact O-N 3Å; T457-F461 HydrophobicContact CG2-CD2 3.86Å; T457-F461 HydrophobicContact CG2-CE2 3.77Å; T457-F461 WeakPolarHBondContact O-CD2 3.18Å; T457-F461 PolarHBondContact O-N 3.37Å; T457-F461 VanDerWaalsContact O-N 3.13Å; T457-M486 HydrophobicContact CG2-CG 4.42Å; T457-R489 PolarHBondContact OG1-NH2 3.44Å
458I94.3Very high94.4Very high67 Ų6752.5 Ų52.534%0.34427%0.273SS..Hα-helixtrans-63.7-44-176.6-64.6169.4000110.5Y455 V460 F461 I462 M486Y455-I458 PolarHBondContact O-N 2.86Å; I458-V460 PolarHBondContact O-N 3.47Å; I458-F461 PolarHBondContact O-N 3.17Å; I458-I462 HydrophobicContact CG2-CD1 3.88Å; I458-I462 HydrophobicContact CG2-CG1 4.5Å; I458-I462 WeakPolarHBondContact O-CG1 3.22Å; I458-I462 PolarHBondContact O-N 3Å; I458-M486 HydrophobicContact CD1-SD 4.3Å; I458-M486 HydrophobicContact CG1-SD 4.22Å
459L96.2Very high94.4Very high62 Ų6249.5 Ų49.533%0.32526%0.262SS..Hα-helixtrans-62.6-41.5179.4-68.7176.7000112.3L451 Y455 T457 F461 I462 I463L451-L459 HydrophobicContact CD1-CB 3.83Å; L451-L459 HydrophobicContact CD1-CD1 4.38Å; L451-L459 HydrophobicContact CD2-CD1 3.99Å; Y455-L459 WeakPolarHBondContact O-CB 3.43Å; Y455-L459 WeakPolarHBondContact O-CG 3.33Å; Y455-L459 PolarHBondContact O-N 3.21Å; T457-L459 PolarHBondContact O-N 3.34Å; L459-F461 VanDerWaalsContact C-N 3.34Å; L459-F461 PolarHBondContact O-N 3.44Å; L459-I462 PolarHBondContact O-N 3.44Å; L459-I463 WeakPolarHBondContact O-CB 3.38Å; L459-I463 WeakPolarHBondContact O-CD1 3.29Å; L459-I463 VanDerWaalsContact O-CG1 3.24Å; L459-I463 WeakPolarHBondContact O-CG1 3.15Å; L459-I463 PolarHBondContact O-N 3.25Å
460V96.7Very high94.3Very high19 Ų1950.7 Ų50.712%0.11527%0.265CS..Hα-helixtrans-64.5-38.3176.2166.90000111.8L443 F447 Y448 L451 R456 T457 I458 I463 S464L443-V460 HydrophobicContact CB-CG1 4.01Å; L443-V460 HydrophobicContact CD1-CG1 4.17Å; L443-V460 HydrophobicContact CD2-CG1 4.33Å; L443-V460 HydrophobicContact CG-CG1 4.4Å; F447-V460 HydrophobicContact CB-CG2 4.17Å; Y448-V460 HydrophobicContact CD2-CG2 4.02Å; Y448-V460 HydrophobicContact CG-CG2 4.44Å; L451-V460 HydrophobicContact CD1-CG2 3.97Å; R456-V460 WeakPolarHBondContact O-CB 3.19Å; R456-V460 VanDerWaalsContact O-CG2 3.24Å; R456-V460 WeakPolarHBondContact O-CG2 3.38Å; R456-V460 PolarHBondContact O-N 2.87Å; T457-V460 PolarHBondContact O-N 3Å; I458-V460 PolarHBondContact O-N 3.47Å; V460-I463 PolarHBondContact O-N 2.96Å; V460-S464 VanDerWaalsContact O-CB 3.3Å; V460-S464 WeakPolarHBondContact O-CB 3.42Å; V460-S464 PolarHBondContact O-N 3.25Å
461F96.7Very high94.3Very high24 Ų2448.2 Ų48.211%0.10526%0.256CS..Hα-helixtrans-65-38.6173.8-84.1-72.4000112.4I432 T457 I458 L459 S464 A465 F478 F481 A482I432-F461 HydrophobicContact CD1-CE1 4.39Å; I432-F461 HydrophobicContact CD1-CZ 3.81Å; T457-F461 HydrophobicContact CG2-CD2 3.86Å; T457-F461 HydrophobicContact CG2-CE2 3.77Å; T457-F461 WeakPolarHBondContact O-CD2 3.18Å; T457-F461 PolarHBondContact O-N 3.37Å; T457-F461 VanDerWaalsContact O-N 3.13Å; I458-F461 PolarHBondContact O-N 3.17Å; L459-F461 VanDerWaalsContact C-N 3.34Å; L459-F461 PolarHBondContact O-N 3.44Å; F461-S464 PolarHBondContact O-N 3.38Å; F461-A465 PolarHBondContact O-N 2.66Å; F461-F478 HydrophobicContact CB-CB 4.43Å; F461-F478 HydrophobicContact CD1-CB 4.27Å; F461-F478 AromaticContact CD1-CD1 3.92Å; F461-F478 HydrophobicContact CD1-CD1 3.92Å; F461-F478 VanDerWaalsContact CD1-O 3.32Å; F461-F478 WeakPolarHBondContact CD1-O 3.46Å; F461-F478 HydrophobicContact CE1-CD1 4.5Å; F461-F478 WeakPolarHBondContact O-CB 3.36Å; F461-F481 HydrophobicContact CD1-CB 4.28Å; F461-F481 HydrophobicContact CE1-CB 3.66Å; F461-F481 HydrophobicContact CZ-CB 4.2Å; F461-A482 HydrophobicContact CB-CB 3.94Å; F461-A482 HydrophobicContact CD2-CB 3.44Å; F461-A482 VanDerWaalsContact CD2-CB 3.44Å; F461-A482 HydrophobicContact CE2-CB 4.06Å; F461-A482 HydrophobicContact CG-CB 3.72Å
462I96.6Very high94.4Very high69 Ų6948.6 Ų48.635%0.35426%0.261SS..Hα-helixtrans-65.4-45.9174.4-67.9167.5000110.9I458 L459 S464 A465 F466 L479I458-I462 HydrophobicContact CG2-CD1 3.88Å; I458-I462 HydrophobicContact CG2-CG1 4.5Å; I458-I462 WeakPolarHBondContact O-CG1 3.22Å; I458-I462 PolarHBondContact O-N 3Å; L459-I462 PolarHBondContact O-N 3.44Å; I462-S464 VanDerWaalsContact C-N 3.28Å; I462-S464 PolarHBondContact O-N 3.37Å; I462-A465 WeakPolarHBondContact O-CB 3.46Å; I462-A465 PolarHBondContact O-N 3.11Å; I462-F466 WeakPolarHBondContact O-CB 3.46Å; I462-F466 PolarHBondContact O-N 3.38Å; I462-L479 HydrophobicContact CD1-CD2 4.5Å; I462-L479 HydrophobicContact CG1-CD2 3.98Å
463I96.8Very high94.6Very high33 Ų3344.7 Ų44.717%0.16924%0.235CC..Hα-helixtrans-61.2-40.1176.6-68.6161.7000110.5L443 F447 L451 L459 V460 F466 W467L443-I463 HydrophobicContact CD2-CG2 4.14Å; F447-I463 HydrophobicContact CB-CD1 4.13Å; F447-I463 HydrophobicContact CD1-CD1 3.66Å; F447-I463 HydrophobicContact CD1-CG2 4.44Å; F447-I463 HydrophobicContact CD2-CG2 3.97Å; F447-I463 HydrophobicContact CE1-CD1 4.18Å; F447-I463 HydrophobicContact CE1-CG2 4.26Å; F447-I463 HydrophobicContact CE2-CG2 3.78Å; F447-I463 HydrophobicContact CG-CD1 3.9Å; F447-I463 HydrophobicContact CG-CG2 4.29Å; F447-I463 HydrophobicContact CZ-CG2 3.93Å; L451-I463 HydrophobicContact CD1-CD1 4.18Å; L459-I463 WeakPolarHBondContact O-CB 3.38Å; L459-I463 WeakPolarHBondContact O-CD1 3.29Å; L459-I463 VanDerWaalsContact O-CG1 3.24Å; L459-I463 WeakPolarHBondContact O-CG1 3.15Å; L459-I463 PolarHBondContact O-N 3.25Å; V460-I463 PolarHBondContact O-N 2.96Å; I463-F466 PolarHBondContact O-N 3.03Å; I463-W467 WeakPolarHBondContact O-CB 3.49Å; I463-W467 PolarHBondContact O-N 3.14Å
464S97.1Very high95Very high10 Ų1041.3 Ų41.37%0.0721%0.207CC..Hα-helixtrans-62.3-44.7174.7-1700000111.6V460 F461 I462 F466 W467 H468 F478V460-S464 VanDerWaalsContact O-CB 3.3Å; V460-S464 WeakPolarHBondContact O-CB 3.42Å; V460-S464 PolarHBondContact O-N 3.25Å; F461-S464 PolarHBondContact O-N 3.38Å; I462-S464 VanDerWaalsContact C-N 3.28Å; I462-S464 PolarHBondContact O-N 3.37Å; S464-F466 VanDerWaalsContact C-N 3.34Å; S464-F466 PolarHBondContact O-N 3.09Å; S464-W467 PolarHBondContact O-N 2.96Å; S464-H468 PolarHBondContact O-CD2 3.28Å; S464-H468 VanDerWaalsContact O-CD2 3.24Å; S464-H468 PolarHBondContact O-N 3.05Å; S464-H468 VanDerWaalsContact O-N 3.16Å; S464-F478 WeakPolarHBondContact OG-CE1 3.5Å; S464-F478 WeakPolarHBondContact OG-CZ 3.41Å
465A96.9Very high95.3Very high1 Ų140.8 Ų40.81%0.00819%0.189CC..Hα-helixtrans-58.7-47174.800000111.9F461 I462 W467 H468 G469 Y475 F478F461-A465 PolarHBondContact O-N 2.66Å; I462-A465 WeakPolarHBondContact O-CB 3.46Å; I462-A465 PolarHBondContact O-N 3.11Å; A465-W467 VanDerWaalsContact C-N 3.34Å; A465-W467 PolarHBondContact O-N 2.98Å; A465-H468 PolarHBondContact O-N 3.04Å; A465-H468 VanDerWaalsContact O-N 3.13Å; A465-G469 PolarHBondContact O-N 3.21Å; A465-G469 VanDerWaalsContact O-N 3.09Å; A465-Y475 HydrophobicContact CB-CD1 3.97Å; A465-Y475 HydrophobicContact CB-CE1 4.1Å; A465-Y475 HydrophobicContact CB-CG 4.23Å; A465-F478 HydrophobicContact CB-CB 3.95Å; A465-F478 HydrophobicContact CB-CD2 3.43Å; A465-F478 VanDerWaalsContact CB-CD2 3.43Å; A465-F478 HydrophobicContact CB-CE2 4.27Å; A465-F478 HydrophobicContact CB-CG 3.96Å
466F95.8Very high95.7Very high65 Ų6534.9 Ų34.929%0.28517%0.168SC..Hα-helixtrans-61.1-41.1178.9-169-89.2000112.4L134 T138 I462 I463 S464 H468 G469 F470L134-F466 HydrophobicContact CB-CE1 4.13Å; L134-F466 HydrophobicContact CD2-CD1 4.32Å; T138-F466 VanDerWaalsContact OG1-CE1 3.3Å; T138-F466 WeakPolarHBondContact OG1-CE1 3.42Å; T138-F466 WeakPolarHBondContact OG1-CZ 3.16Å; I462-F466 WeakPolarHBondContact O-CB 3.46Å; I462-F466 PolarHBondContact O-N 3.38Å; I463-F466 PolarHBondContact O-N 3.03Å; S464-F466 VanDerWaalsContact C-N 3.34Å; S464-F466 PolarHBondContact O-N 3.09Å; F466-H468 VanDerWaalsContact C-N 3.29Å; F466-H468 PolarHBondContact O-N 3.32Å; F466-G469 PolarHBondContact O-N 3.14Å; F466-F470 HydrophobicContact CD2-CE1 4.02Å; F466-F470 AromaticContact CD2-CZ 3.91Å; F466-F470 HydrophobicContact CD2-CZ 3.91Å; F466-F470 HydrophobicContact CE1-CZ 4.42Å; F466-F470 AromaticContact CE2-CE1 3.58Å; F466-F470 HydrophobicContact CE2-CE1 3.58Å; F466-F470 HydrophobicContact CE2-CE2 4.43Å; F466-F470 AromaticContact CE2-CZ 3.31Å; F466-F470 HydrophobicContact CE2-CZ 3.31Å; F466-F470 HydrophobicContact CZ-CE1 4.32Å; F466-F470 AromaticContact CZ-CZ 3.61Å; F466-F470 HydrophobicContact CZ-CZ 3.61Å
467W97.3Very high95.8Very high11 Ų1132.3 Ų32.34%0.04216%0.159CC..Hα-helixtrans-62-36.3175.2174.975.4000112.4L137 H141 M161 Q165 T439 W442 I463 S464 A465L137-W467 HydrophobicContact CD2-CG 4.37Å; H141-W467 PolarHBondContact NE2-O 2.86Å; M161-W467 HydrophobicContact CB-CZ2 3.66Å; M161-W467 HydrophobicContact CE-CD2 3.55Å; M161-W467 HydrophobicContact CE-CE3 3.48Å; M161-W467 VanDerWaalsContact CE-CE3 3.48Å; M161-W467 HydrophobicContact CE-CG 4.39Å; M161-W467 HydrophobicContact CE-CH2 3.47Å; M161-W467 VanDerWaalsContact CE-CH2 3.47Å; M161-W467 HydrophobicContact CE-CZ2 3.52Å; M161-W467 HydrophobicContact CE-CZ3 3.44Å; M161-W467 VanDerWaalsContact CE-CZ3 3.44Å; M161-W467 WeakPolarHBondContact CE-O 3.49Å; M161-W467 HydrophobicContact CG-CZ2 4.41Å; M161-W467 PolarHBondContact O-NE1 3.05Å; Q165-W467 HydrophobicContact CG-CZ2 4.24Å; T439-W467 HydrophobicContact CG2-CE3 4.35Å; T439-W467 HydrophobicContact CG2-CH2 4.05Å; T439-W467 HydrophobicContact CG2-CZ3 3.87Å; W442-W467 HydrophobicContact CH2-CB 4.01Å; W442-W467 AromaticContact CH2-CD1 3.53Å; W442-W467 HydrophobicContact CH2-CD2 4.28Å; W442-W467 AromaticContact CH2-CG 3.67Å; W442-W467 HydrophobicContact CH2-CG 3.67Å; W442-W467 HydrophobicContact CZ3-CB 4.33Å; W442-W467 AromaticContact CZ3-CD1 3.97Å; W442-W467 AromaticContact CZ3-CD2 3.97Å; W442-W467 HydrophobicContact CZ3-CD2 3.97Å; W442-W467 AromaticContact CZ3-CG 3.84Å; W442-W467 HydrophobicContact CZ3-CG 3.84Å; I463-W467 WeakPolarHBondContact O-CB 3.49Å; I463-W467 PolarHBondContact O-N 3.14Å; S464-W467 PolarHBondContact O-N 2.96Å; A465-W467 VanDerWaalsContact C-N 3.34Å; A465-W467 PolarHBondContact O-N 2.98Å
468H95.3Very high96.1Very high32 Ų3231.9 Ų31.915%0.14816%0.155CC..Hα-helixtrans-71.9-30.8175.4-83.3-77000113.9H141 S464 A465 F466 Y474 F478 F528H141-H468 PolarHBondContact CE1-O 2.98Å; H141-H468 PolarHBondContact NE2-O 2.72Å; S464-H468 PolarHBondContact O-CD2 3.28Å; S464-H468 VanDerWaalsContact O-CD2 3.24Å; S464-H468 PolarHBondContact O-N 3.05Å; S464-H468 VanDerWaalsContact O-N 3.16Å; A465-H468 PolarHBondContact O-N 3.04Å; A465-H468 VanDerWaalsContact O-N 3.13Å; F466-H468 VanDerWaalsContact C-N 3.29Å; F466-H468 PolarHBondContact O-N 3.32Å; H468-Y474 HydrophobicContact CB-CD2 3.74Å; H468-Y474 HydrophobicContact CB-CE2 3.93Å; H468-Y474 HydrophobicContact CB-CG 4.12Å; H468-Y474 WeakPolarHBondContact O-CE2 3.48Å; H468-F478 HydrophobicContact CB-CE2 4.24Å; H468-F478 AromaticContact CD2-CE2 3.41Å; H468-F478 VanDerWaalsContact CD2-CE2 3.41Å; H468-F478 WeakPolarHBondContact CD2-CE2 3.27Å; H468-F478 AromaticContact CD2-CZ 3.14Å; H468-F478 WeakPolarHBondContact CD2-CZ 3.42Å; H468-F478 AromaticContact NE2-CZ 3.5Å; H468-F528 HydrophobicContact CB-CE2 4.25Å; H468-F528 AromaticContact CE1-CE2 3.81Å; H468-F528 AromaticContact CE1-CZ 3.77Å; H468-F528 AromaticContact CG-CE2 3.75Å; H468-F528 AromaticContact ND1-CE2 3.56Å; H468-F528 AromaticContact ND1-CZ 3.55Å
469G93.8Very high96.2Very high1 Ų132.8 Ų32.81%0.0116%0.16CC..  trans135.6-158.8174.100000113.7H141 A465 F466 Y475H141-G469 VanDerWaalsContact CD2-CA 3.49Å; H141-G469 WeakPolarHBondContact CD2-CA 3.4Å; A465-G469 PolarHBondContact O-N 3.21Å; A465-G469 VanDerWaalsContact O-N 3.09Å; F466-G469 PolarHBondContact O-N 3.14Å; G469-Y475 WeakPolarHBondContact O-CE2 3.46Å; G469-Y475 PolarHBondContact O-OH 2.92Å
470F93.3Very high96.3Very high67 Ų6730.1 Ų30.129%0.29415%0.147SC..SBendtrans-11110.4-170.4-65.2-92.5000114.4T138 H141 V142 L145 F466 P472T138-F470 HydrophobicContact CG2-CD2 4.41Å; T138-F470 HydrophobicContact CG2-CE1 4.49Å; T138-F470 HydrophobicContact CG2-CE2 3.36Å; T138-F470 HydrophobicContact CG2-CZ 3.38Å; H141-F470 HydrophobicContact CB-CD2 4.22Å; V142-F470 HydrophobicContact CG2-CD2 4.4Å; L145-F470 HydrophobicContact CD1-CB 3.88Å; F466-F470 HydrophobicContact CD2-CE1 4.02Å; F466-F470 AromaticContact CD2-CZ 3.91Å; F466-F470 HydrophobicContact CD2-CZ 3.91Å; F466-F470 HydrophobicContact CE1-CZ 4.42Å; F466-F470 AromaticContact CE2-CE1 3.58Å; F466-F470 HydrophobicContact CE2-CE1 3.58Å; F466-F470 HydrophobicContact CE2-CE2 4.43Å; F466-F470 AromaticContact CE2-CZ 3.31Å; F466-F470 HydrophobicContact CE2-CZ 3.31Å; F466-F470 HydrophobicContact CZ-CE1 4.32Å; F466-F470 AromaticContact CZ-CZ 3.61Å; F466-F470 HydrophobicContact CZ-CZ 3.61Å; F470-P472 WeakPolarHBondContact O-CD 3.35Å
471Y93.5Very high96.3Very high14 Ų1430.4 Ų30.46%0.05515%0.147CC..  trans-64.3126.1170.1-71.2-77.9000109.7L145 Y149 G150 G473 Y474 L531L145-Y471 HydrophobicContact CD2-CD1 3.58Å; L145-Y471 HydrophobicContact CD2-CD2 3.97Å; L145-Y471 HydrophobicContact CD2-CE1 3.21Å; L145-Y471 HydrophobicContact CD2-CE2 3.62Å; L145-Y471 HydrophobicContact CD2-CG 3.97Å; L145-Y471 HydrophobicContact CG-CE2 4.38Å; Y149-Y471 WeakPolarHBondContact CA-OH 3.36Å; Y149-Y471 HydrophobicContact CD1-CE1 4.23Å; Y149-Y471 HydrophobicContact CD2-CD1 4.46Å; Y149-Y471 AromaticContact CD2-CE1 3.65Å; Y149-Y471 HydrophobicContact CD2-CE1 3.65Å; Y149-Y471 HydrophobicContact CE1-CD1 4.5Å; Y149-Y471 HydrophobicContact CE1-CE1 4.06Å; Y149-Y471 AromaticContact CE2-CD1 3.82Å; Y149-Y471 HydrophobicContact CE2-CD1 3.82Å; Y149-Y471 AromaticContact CE2-CE1 3.45Å; Y149-Y471 HydrophobicContact CE2-CE1 3.45Å; Y149-Y471 VanDerWaalsContact CE2-CE1 3.45Å; Y149-Y471 HydrophobicContact CG-CE1 4.04Å; Y149-Y471 AromaticContact CZ-CD1 3.84Å; Y149-Y471 AromaticContact CZ-CE1 3.68Å; G150-Y471 PolarHBondContact N-OH 3.48Å; Y471-G473 PolarHBondContact O-N 3.39Å; Y471-G473 VanDerWaalsContact O-N 3.12Å; Y471-Y474 HydrophobicContact CD2-CD2 4.38Å; Y471-Y474 AromaticContact CD2-CE2 3.57Å; Y471-Y474 HydrophobicContact CD2-CE2 3.57Å; Y471-Y474 AromaticContact CD2-CZ 3.79Å; Y471-Y474 HydrophobicContact CG-CE2 4.22Å; Y471-Y474 WeakPolarHBondContact O-CB 3.27Å; Y471-Y474 PolarHBondContact O-N 3.37Å; Y471-L531 HydrophobicContact CD1-CB 3.66Å; Y471-L531 HydrophobicContact CD1-CD1 4.43Å; Y471-L531 HydrophobicContact CD1-CD2 4.27Å; Y471-L531 HydrophobicContact CD1-CG 4.35Å; Y471-L531 HydrophobicContact CD2-CD2 3.99Å; Y471-L531 HydrophobicContact CE1-CB 4.22Å; Y471-L531 HydrophobicContact CE1-CD1 4.26Å; Y471-L531 HydrophobicContact CG-CB 4Å; Y471-L531 HydrophobicContact CG-CD2 3.84Å; Y471-L531 HydrophobicContact CG-CG 4.4Å
472P95.1Very high96.2Very high46 Ų4629.4 Ų29.430%0.29914%0.143SC..Hα-helixtrans-54.5-33.8-178.7-28.735.3000113.9F470 Y474 Y475 I476 L531 F533F470-P472 WeakPolarHBondContact O-CD 3.35Å; P472-Y474 PolarHBondContact O-N 3.04Å; P472-Y475 PolarHBondContact O-N 2.99Å; P472-Y475 VanDerWaalsContact O-N 3.16Å; P472-I476 WeakPolarHBondContact O-CG1 3.02Å; P472-I476 PolarHBondContact O-N 2.88Å; P472-I476 VanDerWaalsContact O-N 3.12Å; P472-L531 WeakPolarHBondContact CD-O 3.24Å; P472-F533 HydrophobicContact CB-CB 3.67Å; P472-F533 HydrophobicContact CB-CD2 4.14Å; P472-F533 HydrophobicContact CB-CG 4.4Å; P472-F533 HydrophobicContact CG-CB 4.06Å
473G96.3Very high96.2Very high0 Ų028 Ų280%014%0.136CC..Hα-helixtrans-57.1-31.917700000114.1Y471 M477 P527 L531Y471-G473 PolarHBondContact O-N 3.39Å; Y471-G473 VanDerWaalsContact O-N 3.12Å; G473-M477 PolarHBondContact O-N 2.92Å; G473-P527 CarbonylContact C-O 3.51Å; G473-P527 WeakPolarHBondContact CA-O 3.49Å; G473-P527 CarbonylContact O-C 3.31Å; G473-P527 WeakPolarHBondContact O-CB 3.26Å; G473-L531 PolarHBondContact N-O 3.37Å
474Y96.7Very high96.2Very high29 Ų2926.7 Ų26.711%0.11413%0.129CC..Hα-helixtrans-64.2-49.1175.1-62-22.8000111.4H468 Y471 P472 I476 M477 F478 F528 L531H468-Y474 HydrophobicContact CB-CD2 3.74Å; H468-Y474 HydrophobicContact CB-CE2 3.93Å; H468-Y474 HydrophobicContact CB-CG 4.12Å; H468-Y474 WeakPolarHBondContact O-CE2 3.48Å; Y471-Y474 HydrophobicContact CD2-CD2 4.38Å; Y471-Y474 AromaticContact CD2-CE2 3.57Å; Y471-Y474 HydrophobicContact CD2-CE2 3.57Å; Y471-Y474 AromaticContact CD2-CZ 3.79Å; Y471-Y474 HydrophobicContact CG-CE2 4.22Å; Y471-Y474 WeakPolarHBondContact O-CB 3.27Å; Y471-Y474 PolarHBondContact O-N 3.37Å; P472-Y474 PolarHBondContact O-N 3.04Å; Y474-I476 VanDerWaalsContact C-N 3.31Å; Y474-I476 PolarHBondContact O-N 3.17Å; Y474-M477 PolarHBondContact O-N 2.89Å; Y474-F478 WeakPolarHBondContact O-CD2 3.49Å; Y474-F478 PolarHBondContact O-N 3.26Å; Y474-F528 HydrophobicContact CD1-CB 4.37Å; Y474-F528 HydrophobicContact CD1-CD1 4.5Å; Y474-F528 AromaticContact CD1-CD2 3.23Å; Y474-F528 HydrophobicContact CD1-CD2 3.23Å; Y474-F528 AromaticContact CD1-CE2 3.48Å; Y474-F528 HydrophobicContact CD1-CE2 3.48Å; Y474-F528 VanDerWaalsContact CD1-CE2 3.48Å; Y474-F528 AromaticContact CD1-CG 3.8Å; Y474-F528 HydrophobicContact CD1-CG 3.8Å; Y474-F528 HydrophobicContact CD1-CZ 4.21Å; Y474-F528 HydrophobicContact CE1-CD1 4.11Å; Y474-F528 AromaticContact CE1-CD2 3.55Å; Y474-F528 HydrophobicContact CE1-CD2 3.55Å; Y474-F528 HydrophobicContact CE1-CE1 4.02Å; Y474-F528 AromaticContact CE1-CE2 3.48Å; Y474-F528 HydrophobicContact CE1-CE2 3.48Å; Y474-F528 VanDerWaalsContact CE1-CE2 3.48Å; Y474-F528 AromaticContact CE1-CG 3.86Å; Y474-F528 HydrophobicContact CE1-CG 3.86Å; Y474-F528 AromaticContact CE1-CZ 3.72Å; Y474-F528 HydrophobicContact CE1-CZ 3.72Å; Y474-F528 HydrophobicContact CG-CD2 4.22Å; Y474-F528 HydrophobicContact CG-CE2 4.31Å; Y474-L531 HydrophobicContact CD1-CD2 4.24Å; Y474-L531 HydrophobicContact CE1-CD2 3.36Å; Y474-L531 WeakPolarHBondContact OH-CD2 3.23Å
475Y97.6Very high96.1Very high64 Ų6426.7 Ų26.725%0.25113%0.129SC..Hα-helixtrans-63-40.5-179.8-66.3-96.1000111.2A465 G469 P472 L479A465-Y475 HydrophobicContact CB-CD1 3.97Å; A465-Y475 HydrophobicContact CB-CE1 4.1Å; A465-Y475 HydrophobicContact CB-CG 4.23Å; G469-Y475 WeakPolarHBondContact O-CE2 3.46Å; G469-Y475 PolarHBondContact O-OH 2.92Å; P472-Y475 PolarHBondContact O-N 2.99Å; P472-Y475 VanDerWaalsContact O-N 3.16Å; Y475-L479 VanDerWaalsContact O-CB 3.28Å; Y475-L479 WeakPolarHBondContact O-CB 3.45Å; Y475-L479 VanDerWaalsContact O-CG 3.23Å; Y475-L479 WeakPolarHBondContact O-CG 3.1Å; Y475-L479 PolarHBondContact O-N 2.72Å
476I97.7Very high95.9Very high27 Ų2729.3 Ų29.314%0.13814%0.141CC..Hα-helixtrans-60.3-50.9174.5-61.9170.8000110.3P472 Y474 S480 P527 F533 L540P472-I476 WeakPolarHBondContact O-CG1 3.02Å; P472-I476 PolarHBondContact O-N 2.88Å; P472-I476 VanDerWaalsContact O-N 3.12Å; Y474-I476 VanDerWaalsContact C-N 3.31Å; Y474-I476 PolarHBondContact O-N 3.17Å; I476-S480 VanDerWaalsContact O-CB 3.29Å; I476-S480 WeakPolarHBondContact O-CB 3.44Å; I476-S480 PolarHBondContact O-N 3.35Å; I476-S480 PolarHBondContact O-OG 3.26Å; I476-P527 HydrophobicContact CB-CB 3.91Å; I476-P527 HydrophobicContact CB-CG 4.32Å; I476-P527 HydrophobicContact CG2-CB 3.81Å; I476-P527 HydrophobicContact CG2-CG 3.66Å; I476-F533 HydrophobicContact CD1-CD2 3.83Å; I476-F533 HydrophobicContact CD1-CE2 4.22Å; I476-L540 HydrophobicContact CG2-CD1 3.84Å
477M97.7Very high95.8Very high14 Ų1426.7 Ų26.77%0.06913%0.131CC..Hα-helixtrans-58.1-54.3178.5174.3-172.88200111.6G473 Y474 L479 S480 F481 G524 Q525 P527 F528G473-M477 PolarHBondContact O-N 2.92Å; Y474-M477 PolarHBondContact O-N 2.89Å; M477-L479 PolarHBondContact O-N 2.8Å; M477-S480 WeakPolarHBondContact O-CB 3.5Å; M477-S480 PolarHBondContact O-N 3.44Å; M477-F481 HydrophobicContact CG-CD2 4.2Å; M477-F481 HydrophobicContact CG-CE2 4.19Å; M477-F481 HydrophobicContact CG-CG 4.41Å; M477-F481 HydrophobicContact CG-CZ 4.42Å; M477-F481 PolarHBondContact O-N 3.27Å; M477-F481 HydrophobicContact SD-CE2 4.15Å; M477-G524 VanDerWaalsContact CG-O 3.27Å; M477-G524 WeakPolarHBondContact CG-O 3.4Å; M477-Q525 HydrophobicContact SD-CB 4.05Å; M477-P527 HydrophobicContact CB-CB 4.45Å; M477-F528 HydrophobicContact CB-CB 4.1Å; M477-F528 HydrophobicContact CE-CB 4.16Å; M477-F528 HydrophobicContact CE-CD2 3.33Å; M477-F528 HydrophobicContact CE-CE2 4.02Å; M477-F528 HydrophobicContact CE-CG 4.02Å; M477-F528 HydrophobicContact CG-CB 4.29Å; M477-F528 HydrophobicContact SD-CB 3.38Å; M477-F528 WeakPolarHBondContact SD-CB 3.38Å; M477-F528 HydrophobicContact SD-CD2 3.75Å; M477-F528 HydrophobicContact SD-CG 3.79Å
478F97.4Very high95.6Very high14 Ų1427.4 Ų27.46%0.06114%0.137CC..Hα-helixtrans-67.3-37.1-171.5-76.1-67.4000112.4F461 S464 A465 H468 Y474 F481 A482 F528F461-F478 HydrophobicContact CB-CB 4.43Å; F461-F478 HydrophobicContact CD1-CB 4.27Å; F461-F478 AromaticContact CD1-CD1 3.92Å; F461-F478 HydrophobicContact CD1-CD1 3.92Å; F461-F478 VanDerWaalsContact CD1-O 3.32Å; F461-F478 WeakPolarHBondContact CD1-O 3.46Å; F461-F478 HydrophobicContact CE1-CD1 4.5Å; F461-F478 WeakPolarHBondContact O-CB 3.36Å; S464-F478 WeakPolarHBondContact OG-CE1 3.5Å; S464-F478 WeakPolarHBondContact OG-CZ 3.41Å; A465-F478 HydrophobicContact CB-CB 3.95Å; A465-F478 HydrophobicContact CB-CD2 3.43Å; A465-F478 VanDerWaalsContact CB-CD2 3.43Å; A465-F478 HydrophobicContact CB-CE2 4.27Å; A465-F478 HydrophobicContact CB-CG 3.96Å; H468-F478 HydrophobicContact CB-CE2 4.24Å; H468-F478 AromaticContact CD2-CE2 3.41Å; H468-F478 VanDerWaalsContact CD2-CE2 3.41Å; H468-F478 WeakPolarHBondContact CD2-CE2 3.27Å; H468-F478 AromaticContact CD2-CZ 3.14Å; H468-F478 WeakPolarHBondContact CD2-CZ 3.42Å; H468-F478 AromaticContact NE2-CZ 3.5Å; Y474-F478 WeakPolarHBondContact O-CD2 3.49Å; Y474-F478 PolarHBondContact O-N 3.26Å; F478-F481 PolarHBondContact O-N 2.87Å; F478-A482 PolarHBondContact O-N 3.01Å; F478-F528 HydrophobicContact CE2-CD2 4.24Å; F478-F528 HydrophobicContact CE2-CE2 4.18Å; F478-F528 HydrophobicContact CZ-CE2 4.37Å
479L96.5Very high95.4Very high86 Ų8629.1 Ų29.145%0.4514%0.142SC..Hα-helixtrans-68.4-37.4173.1-67.1175.1000111.8I462 Y475 M477 A482 L483I462-L479 HydrophobicContact CD1-CD2 4.5Å; I462-L479 HydrophobicContact CG1-CD2 3.98Å; Y475-L479 VanDerWaalsContact O-CB 3.28Å; Y475-L479 WeakPolarHBondContact O-CB 3.45Å; Y475-L479 VanDerWaalsContact O-CG 3.23Å; Y475-L479 WeakPolarHBondContact O-CG 3.1Å; Y475-L479 PolarHBondContact O-N 2.72Å; M477-L479 PolarHBondContact O-N 2.8Å; L479-A482 WeakPolarHBondContact O-CB 3.46Å; L479-A482 PolarHBondContact O-N 3.01Å; L479-L483 PolarHBondContact O-N 3.18Å
480S97.4Very high95.3Very high7 Ų730.3 Ų30.35%0.04915%0.148CC..Hα-helixtrans-61.2-45.6172.3-550000111.1I476 M477 A482 L483 F484 H548I476-S480 VanDerWaalsContact O-CB 3.29Å; I476-S480 WeakPolarHBondContact O-CB 3.44Å; I476-S480 PolarHBondContact O-N 3.35Å; I476-S480 PolarHBondContact O-OG 3.26Å; M477-S480 WeakPolarHBondContact O-CB 3.5Å; M477-S480 PolarHBondContact O-N 3.44Å; S480-A482 VanDerWaalsContact C-N 3.33Å; S480-A482 PolarHBondContact O-N 3.08Å; S480-L483 WeakPolarHBondContact O-CB 3.25Å; S480-L483 PolarHBondContact O-N 3.05Å; S480-F484 WeakPolarHBondContact O-CB 3.3Å; S480-F484 WeakPolarHBondContact O-CD2 3.28Å; S480-F484 WeakPolarHBondContact O-CG 3.48Å; S480-F484 PolarHBondContact O-N 3.36Å; S480-H548 PolarHBondContact OG-NE2 2.96Å
481F97Very high95.3Very high24 Ų2431.7 Ų31.711%0.10515%0.152CC..Hα-helixtrans-67.2-31.3176.6-80.96.7000112.8L428 F461 M477 F478 F484 T485 Q525L428-F481 HydrophobicContact CD2-CD1 4.41Å; L428-F481 HydrophobicContact CD2-CG 4.49Å; F461-F481 HydrophobicContact CD1-CB 4.28Å; F461-F481 HydrophobicContact CE1-CB 3.66Å; F461-F481 HydrophobicContact CZ-CB 4.2Å; M477-F481 HydrophobicContact CG-CD2 4.2Å; M477-F481 HydrophobicContact CG-CE2 4.19Å; M477-F481 HydrophobicContact CG-CG 4.41Å; M477-F481 HydrophobicContact CG-CZ 4.42Å; M477-F481 PolarHBondContact O-N 3.27Å; M477-F481 HydrophobicContact SD-CE2 4.15Å; F478-F481 PolarHBondContact O-N 2.87Å; F481-F484 HydrophobicContact CD1-CD2 4.14Å; F481-T485 WeakPolarHBondContact O-CB 3.49Å; F481-T485 PolarHBondContact O-N 3.36Å; F481-T485 PolarHBondContact O-OG1 2.88Å; F481-Q525 HydrophobicContact CZ-CB 4.01Å
482A95.6Very high95Very high4 Ų431.9 Ų31.93%0.03315%0.153CC..Hα-helixtrans-61.3-50.7170.900000110.8F461 F478 L479 S480 T485 M486F461-A482 HydrophobicContact CB-CB 3.94Å; F461-A482 HydrophobicContact CD2-CB 3.44Å; F461-A482 VanDerWaalsContact CD2-CB 3.44Å; F461-A482 HydrophobicContact CE2-CB 4.06Å; F461-A482 HydrophobicContact CG-CB 3.72Å; F478-A482 PolarHBondContact O-N 3.01Å; L479-A482 WeakPolarHBondContact O-CB 3.46Å; L479-A482 PolarHBondContact O-N 3.01Å; S480-A482 VanDerWaalsContact C-N 3.33Å; S480-A482 PolarHBondContact O-N 3.08Å; A482-T485 PolarHBondContact O-N 3.22Å; A482-M486 WeakPolarHBondContact O-CG 3.38Å; A482-M486 PolarHBondContact O-N 2.82Å
483L95.9Very high94.7Very high38 Ų3834.8 Ų34.820%0.19916%0.158CC..Hα-helixtrans-57.6-50.5176.3175.868.9000111.5L479 S480 T485 M486 T487 A551 V552 L555L479-L483 PolarHBondContact O-N 3.18Å; S480-L483 WeakPolarHBondContact O-CB 3.25Å; S480-L483 PolarHBondContact O-N 3.05Å; L483-T485 VanDerWaalsContact C-N 3.33Å; L483-T485 PolarHBondContact O-N 2.83Å; L483-M486 PolarHBondContact O-N 2.87Å; L483-T487 WeakPolarHBondContact O-CB 3.33Å; L483-T487 PolarHBondContact O-N 3.34Å; L483-T487 PolarHBondContact O-OG1 3.17Å; L483-A551 HydrophobicContact CD1-CB 4.41Å; L483-A551 HydrophobicContact CD2-CB 3.96Å; L483-A551 HydrophobicContact CG-CB 3.9Å; L483-V552 HydrophobicContact CD1-CG2 4.37Å; L483-V552 HydrophobicContact CD2-CG2 4.2Å; L483-L555 HydrophobicContact CD1-CD1 3.41Å; L483-L555 VanDerWaalsContact CD1-CD1 3.41Å
484F96.3Very high94.3Very high7 Ų737.6 Ų37.63%0.03117%0.171CC..Hα-helixtrans-67.2-32.9-179.3-60.5-24.8000112.5L428 S480 F481 T487 S488 I520 Y523 P547 H548 A551L428-F484 HydrophobicContact CD2-CB 3.5Å; L428-F484 VanDerWaalsContact CD2-CB 3.5Å; S480-F484 WeakPolarHBondContact O-CB 3.3Å; S480-F484 WeakPolarHBondContact O-CD2 3.28Å; S480-F484 WeakPolarHBondContact O-CG 3.48Å; S480-F484 PolarHBondContact O-N 3.36Å; F481-F484 HydrophobicContact CD1-CD2 4.14Å; F484-T487 PolarHBondContact O-N 3.01Å; F484-S488 WeakPolarHBondContact O-CB 3.45Å; F484-S488 PolarHBondContact O-N 3.47Å; F484-I520 HydrophobicContact CB-CG2 3.96Å; F484-I520 HydrophobicContact CD2-CG2 3.43Å; F484-I520 VanDerWaalsContact CD2-CG2 3.43Å; F484-I520 HydrophobicContact CE2-CG2 4.08Å; F484-I520 HydrophobicContact CG-CG2 3.76Å; F484-Y523 HydrophobicContact CE2-CD1 4.09Å; F484-Y523 HydrophobicContact CE2-CE1 4.3Å; F484-Y523 HydrophobicContact CZ-CD1 4.13Å; F484-Y523 AromaticContact CZ-CE1 3.95Å; F484-Y523 HydrophobicContact CZ-CE1 3.95Å; F484-P547 HydrophobicContact CE1-CB 4.32Å; F484-P547 WeakPolarHBondContact CE1-O 3.45Å; F484-P547 HydrophobicContact CZ-CB 4.04Å; F484-H548 AromaticContact CZ-CD2 3.92Å; F484-H548 AromaticContact CZ-CE1 3.91Å; F484-H548 AromaticContact CZ-NE2 3.79Å; F484-A551 HydrophobicContact CD1-CB 3.73Å; F484-A551 HydrophobicContact CE1-CB 3.85Å
485T94.2Very high94Very high10 Ų1037.5 Ų37.56%0.06117%0.174CC..Hα-helixtrans-69.5-42.8176.8-64.10000110.9L428 I432 F481 A482 L483 R489L428-T485 WeakPolarHBondContact CD2-OG1 3.37Å; I432-T485 WeakPolarHBondContact CD1-OG1 3.42Å; F481-T485 WeakPolarHBondContact O-CB 3.49Å; F481-T485 PolarHBondContact O-N 3.36Å; F481-T485 PolarHBondContact O-OG1 2.88Å; A482-T485 PolarHBondContact O-N 3.22Å; L483-T485 VanDerWaalsContact C-N 3.33Å; L483-T485 PolarHBondContact O-N 2.83Å; T485-R489 WeakPolarHBondContact O-CB 3.19Å; T485-R489 WeakPolarHBondContact O-CG 3.2Å; T485-R489 PolarHBondContact O-N 3.14Å; T485-R489 VanDerWaalsContact O-N 3.07Å
486M92.7Very high93.5Very high56 Ų5638.4 Ų38.428%0.27618%0.177SC..Hα-helixtrans-61.6-46.5174.2-71.2176.163.800111T457 I458 A482 L483 R489 L490T457-M486 HydrophobicContact CG2-CG 4.42Å; I458-M486 HydrophobicContact CD1-SD 4.3Å; I458-M486 HydrophobicContact CG1-SD 4.22Å; A482-M486 WeakPolarHBondContact O-CG 3.38Å; A482-M486 PolarHBondContact O-N 2.82Å; L483-M486 PolarHBondContact O-N 2.87Å; M486-R489 PolarHBondContact O-N 3.2Å; M486-L490 PolarHBondContact O-N 3.39Å
487T94.7Very high93Very high10 Ų1042.1 Ų42.16%0.06119%0.194CC..Hα-helixtrans-61.9-49.1177.7-54.80000111.8L483 F484 R489 L490 W491 A551 I554L483-T487 WeakPolarHBondContact O-CB 3.33Å; L483-T487 PolarHBondContact O-N 3.34Å; L483-T487 PolarHBondContact O-OG1 3.17Å; F484-T487 PolarHBondContact O-N 3.01Å; T487-R489 VanDerWaalsContact C-N 3.35Å; T487-R489 PolarHBondContact O-N 3.49Å; T487-L490 PolarHBondContact O-N 3.08Å; T487-W491 WeakPolarHBondContact O-CB 3.32Å; T487-W491 PolarHBondContact O-N 3.38Å; T487-A551 HydrophobicContact CG2-CB 4.12Å; T487-I554 HydrophobicContact CG2-CB 3.93Å; T487-I554 HydrophobicContact CG2-CD1 3.89Å; T487-I554 HydrophobicContact CG2-CG2 3.86Å
488S93.9Very high92.5Very high25 Ų2549.3 Ų49.318%0.17522%0.222CC..Hα-helixtrans-61.7-40.4-178.7179.40000111.9L428 F484 H492L428-S488 PolarHBondContact N-OG 3.5Å; F484-S488 WeakPolarHBondContact O-CB 3.45Å; F484-S488 PolarHBondContact O-N 3.47Å; S488-H492 VanDerWaalsContact O-CB 3.28Å; S488-H492 WeakPolarHBondContact O-CB 3.37Å; S488-H492 PolarHBondContact O-N 2.77Å
489R91.1Very high92.1Very high68 Ų6852.7 Ų52.726%0.25724%0.236SC..Hα-helixtrans-62.6-44.6174.7-75.5-171.2-67.6-173.2-2.5112.1T457 T485 M486 T487 R493T457-R489 PolarHBondContact OG1-NH2 3.44Å; T485-R489 WeakPolarHBondContact O-CB 3.19Å; T485-R489 WeakPolarHBondContact O-CG 3.2Å; T485-R489 PolarHBondContact O-N 3.14Å; T485-R489 VanDerWaalsContact O-N 3.07Å; M486-R489 PolarHBondContact O-N 3.2Å; T487-R489 VanDerWaalsContact C-N 3.35Å; T487-R489 PolarHBondContact O-N 3.49Å; R489-R493 WeakPolarHBondContact O-CB 3.46Å; R489-R493 PolarHBondContact O-N 3.11Å
490L91.5Very high91.5Very high26 Ų2656.7 Ų56.714%0.13625%0.246CC..Hα-helixtrans-66.2-46.1178.2-75.6166.7000111.7M486 T487 H492 R493 H494 L555 Y558M486-L490 PolarHBondContact O-N 3.39Å; T487-L490 PolarHBondContact O-N 3.08Å; L490-H492 PolarHBondContact O-N 2.81Å; L490-R493 PolarHBondContact O-N 2.69Å; L490-H494 PolarHBondContact O-CD2 2.59Å; L490-H494 VanDerWaalsContact O-CD2 3.26Å; L490-H494 PolarHBondContact O-N 3.36Å; L490-H494 VanDerWaalsContact O-N 3.1Å; L490-L555 HydrophobicContact CD1-CD2 3.28Å; L490-Y558 HydrophobicContact CD1-CD1 3.95Å; L490-Y558 HydrophobicContact CD1-CE1 4.38Å; L490-Y558 HydrophobicContact CD1-CG 4.32Å; L490-Y558 HydrophobicContact CD2-CD1 3.85Å; L490-Y558 HydrophobicContact CD2-CD2 4.19Å; L490-Y558 HydrophobicContact CD2-CE1 3.6Å; L490-Y558 HydrophobicContact CD2-CE2 3.97Å; L490-Y558 HydrophobicContact CD2-CG 4.12Å
491W91.7Very high90.9Very high96 Ų9667.8 Ų67.836%0.36429%0.286SS..Hα-helixtrans-55.6-50.4174.5178.1-89.9000111.2T487 R493 H494 C495 Y509 F512 I554T487-W491 WeakPolarHBondContact O-CB 3.32Å; T487-W491 PolarHBondContact O-N 3.38Å; W491-R493 VanDerWaalsContact C-N 3.33Å; W491-R493 PolarHBondContact O-N 2.87Å; W491-H494 PolarHBondContact O-N 3.34Å; W491-C495 HydrophobicContact CD2-CB 4.09Å; W491-C495 VanDerWaalsContact CD2-SG 3.56Å; W491-C495 VanDerWaalsContact CE3-SG 3.55Å; W491-C495 HydrophobicContact CG-CB 4.39Å; W491-C495 HydrophobicContact CZ2-CB 4.13Å; W491-C495 WeakPolarHBondContact O-CB 3.22Å; W491-C495 PolarHBondContact O-N 2.87Å; W491-Y509 AromaticContact NE1-CE2 4Å; W491-Y509 PolarHBondContact NE1-OH 3Å; W491-F512 HydrophobicContact CZ2-CE1 4.49Å; W491-I554 HydrophobicContact CE3-CD1 3.99Å; W491-I554 HydrophobicContact CZ3-CD1 4.35Å
492H88.6Confident90.5Very high19 Ų1971.1 Ų71.19%0.08831%0.305CS..Hα-helixtrans-61.4-40.9-179.4-167.877.1000112.5E223 S488 L490 H494 R496E223-H492 IonicContact OE1-CD2 3.42Å; S488-H492 VanDerWaalsContact O-CB 3.28Å; S488-H492 WeakPolarHBondContact O-CB 3.37Å; S488-H492 PolarHBondContact O-N 2.77Å; L490-H492 PolarHBondContact O-N 2.81Å; H492-H494 PolarHBondContact O-N 3.08Å; H492-R496 VanDerWaalsContact CE1-CD 3.42Å; H492-R496 WeakPolarHBondContact CE1-CD 3.24Å; H492-R496 PolarHBondContact NE2-NH1 3.36Å; H492-R496 WeakPolarHBondContact O-CB 3.48Å; H492-R496 PolarHBondContact O-N 3.4Å
493R87.4Confident90.3Very high107 Ų10779.2 Ų79.240%0.40434%0.336SS..Hα-helixtrans-63.9-39.7178.7-173.7177.1-67.5171.3-5.6112.6T226 R489 L490 W491T226-R493 PolarHBondContact OG1-NH2 3.39Å; R489-R493 WeakPolarHBondContact O-CB 3.46Å; R489-R493 PolarHBondContact O-N 3.11Å; L490-R493 PolarHBondContact O-N 2.69Å; W491-R493 VanDerWaalsContact C-N 3.33Å; W491-R493 PolarHBondContact O-N 2.87Å
494H88.7Confident90.1Very high59 Ų5982.2 Ų82.227%0.27335%0.352SS..Hα-helixtrans-96.9-33.9-173-70.8-64.2000114.8L490 W491 H492 Q497 Y498 Y558L490-H494 PolarHBondContact O-CD2 2.59Å; L490-H494 VanDerWaalsContact O-CD2 3.26Å; L490-H494 PolarHBondContact O-N 3.36Å; L490-H494 VanDerWaalsContact O-N 3.1Å; W491-H494 PolarHBondContact O-N 3.34Å; H492-H494 PolarHBondContact O-N 3.08Å; H494-Q497 VanDerWaalsContact O-CG 3.32Å; H494-Q497 WeakPolarHBondContact O-CG 3.3Å; H494-Q497 PolarHBondContact O-NE2 3.15Å; H494-Y498 WeakPolarHBondContact O-CD2 3.27Å; H494-Y498 WeakPolarHBondContact O-CE2 3.41Å; H494-Y558 AromaticContact CD2-CE2 3.93Å; H494-Y558 AromaticContact CE1-CE2 3.98Å; H494-Y558 AromaticContact NE2-CD2 3.8Å; H494-Y558 AromaticContact NE2-CE2 3.19Å; H494-Y558 WeakPolarHBondContact NE2-CE2 3.26Å
495C89.7Confident89.9Confident26 Ų2683.3 Ų83.318%0.17636%0.36CS..Hα-helixtrans-90.7-38.1-173.9-62.40000112.1W491 Q497 Y498 F499W491-C495 HydrophobicContact CD2-CB 4.09Å; W491-C495 VanDerWaalsContact CD2-SG 3.56Å; W491-C495 VanDerWaalsContact CE3-SG 3.55Å; W491-C495 HydrophobicContact CG-CB 4.39Å; W491-C495 HydrophobicContact CZ2-CB 4.13Å; W491-C495 WeakPolarHBondContact O-CB 3.22Å; W491-C495 PolarHBondContact O-N 2.87Å; C495-Q497 PolarHBondContact O-N 3.18Å; C495-Q497 VanDerWaalsContact O-N 3.16Å; C495-Y498 WeakPolarHBondContact O-CD2 3.42Å; C495-Y498 PolarHBondContact O-N 2.94Å; C495-Y498 VanDerWaalsContact O-N 3.14Å; C495-F499 VanDerWaalsContact O-CD2 3.28Å; C495-F499 WeakPolarHBondContact O-CD2 3.39Å
496R87.1Confident89.8Confident84 Ų8484.6 Ų84.632%0.31737%0.369SS..Hα-helixtrans-56.4-38.3-174.5-173.9-172.5-173.9-168.3-1.4112.8H492 Y498 F499 R500 Y509H492-R496 VanDerWaalsContact CE1-CD 3.42Å; H492-R496 WeakPolarHBondContact CE1-CD 3.24Å; H492-R496 PolarHBondContact NE2-NH1 3.36Å; H492-R496 WeakPolarHBondContact O-CB 3.48Å; H492-R496 PolarHBondContact O-N 3.4Å; R496-Y498 PolarHBondContact O-N 3.31Å; R496-F499 PolarHBondContact O-N 2.87Å; R496-F499 VanDerWaalsContact O-N 3.08Å; R496-R500 HydrophobicContact CG-CG 4.39Å; R496-R500 WeakPolarHBondContact O-CG 3.42Å; R496-R500 PolarHBondContact O-N 2.93Å; R496-Y509 HydrophobicContact CB-CE1 4.07Å; R496-Y509 HydrophobicContact CG-CE1 3.96Å
497Q87.3Confident89.8Confident105 Ų10585.7 Ų85.749%0.49137%0.374SS..Hα-helixtrans-55.7-34.2-178.360.4-177.6-8.200113.3H494 C495 F499 R500H494-Q497 VanDerWaalsContact O-CG 3.32Å; H494-Q497 WeakPolarHBondContact O-CG 3.3Å; H494-Q497 PolarHBondContact O-NE2 3.15Å; C495-Q497 PolarHBondContact O-N 3.18Å; C495-Q497 VanDerWaalsContact O-N 3.16Å; Q497-F499 VanDerWaalsContact C-N 3.29Å; Q497-F499 PolarHBondContact O-N 3.48Å; Q497-R500 PolarHBondContact O-N 3.22Å
498Y87.7Confident89.7Confident165 Ų16590.4 Ų90.465%0.64740%0.398SS*.Hα-helixtrans-70.6-25.8-179.1-59.6-66.8000113H494 C495 R496H494-Y498 WeakPolarHBondContact O-CD2 3.27Å; H494-Y498 WeakPolarHBondContact O-CE2 3.41Å; C495-Y498 WeakPolarHBondContact O-CD2 3.42Å; C495-Y498 PolarHBondContact O-N 2.94Å; C495-Y498 VanDerWaalsContact O-N 3.14Å; R496-Y498 PolarHBondContact O-N 3.31Å
499F89.6Confident89.7Confident84 Ų8489.8 Ų89.837%0.36839%0.392SS..Hα-helixtrans-96.8-3.6-176.9-59.6-82.5000113.7C495 R496 Q497 R501 S505 S506 Y509C495-F499 VanDerWaalsContact O-CD2 3.28Å; C495-F499 WeakPolarHBondContact O-CD2 3.39Å; R496-F499 PolarHBondContact O-N 2.87Å; R496-F499 VanDerWaalsContact O-N 3.08Å; Q497-F499 VanDerWaalsContact C-N 3.29Å; Q497-F499 PolarHBondContact O-N 3.48Å; F499-R501 VanDerWaalsContact C-N 3.33Å; F499-R501 PolarHBondContact O-N 3.22Å; F499-S505 CarbonylContact O-C 3.53Å; F499-S505 PolarHBondContact O-OG 3.29Å; F499-S506 WeakPolarHBondContact O-CA 3.46Å; F499-S506 PolarHBondContact O-N 3.28Å; F499-S506 VanDerWaalsContact O-N 3.12Å; F499-Y509 HydrophobicContact CB-CD2 4.19Å; F499-Y509 HydrophobicContact CB-CG 3.95Å; F499-Y509 HydrophobicContact CD1-CD2 4.32Å; F499-Y509 AromaticContact CD2-CD2 3.24Å; F499-Y509 HydrophobicContact CD2-CD2 3.24Å; F499-Y509 AromaticContact CD2-CE2 3.67Å; F499-Y509 HydrophobicContact CD2-CE2 3.67Å; F499-Y509 AromaticContact CD2-CG 3.9Å; F499-Y509 HydrophobicContact CD2-CG 3.9Å; F499-Y509 AromaticContact CE2-CD2 3.6Å; F499-Y509 HydrophobicContact CE2-CD2 3.6Å; F499-Y509 AromaticContact CE2-CE2 3.87Å; F499-Y509 HydrophobicContact CE2-CE2 3.87Å; F499-Y509 AromaticContact CG-CD2 3.66Å; F499-Y509 HydrophobicContact CG-CD2 3.66Å; F499-Y509 HydrophobicContact CG-CE2 4.49Å; F499-Y509 AromaticContact CG-CG 3.91Å; F499-Y509 HydrophobicContact CG-CG 3.91Å; F499-Y509 HydrophobicContact CZ-CD2 4.27Å
500R84.1Confident89.8Confident171 Ų17188.1 Ų88.165%0.64539%0.391SS*.SBendtrans-77.1-14.5-178-73.4-175.376170.90.4114.5R496 Q497 N502R496-R500 HydrophobicContact CG-CG 4.39Å; R496-R500 WeakPolarHBondContact O-CG 3.42Å; R496-R500 PolarHBondContact O-N 2.93Å; Q497-R500 PolarHBondContact O-N 3.22Å; R500-N502 PolarHBondContact O-N 2.94Å
501R83.8Confident90Very high240 Ų24090.2 Ų90.291%0.90640%0.404SS*.SBendtrans-66.3-37.1-173.5-76.3-179.7154.5175.4-6.8113.5F499F499-R501 VanDerWaalsContact C-N 3.33Å; F499-R501 PolarHBondContact O-N 3.22Å
502N88.1Confident90.2Very high93 Ų9390.5 Ų90.550%0.49741%0.409SS..SBendtrans-118.9141.3179.8-178.8-0.5000109.9R500 L504 S505 S506R500-N502 PolarHBondContact O-N 2.94Å; N502-L504 VanDerWaalsContact C-N 3.32Å; N502-L504 PolarHBondContact O-N 3.36Å; N502-L504 PolarHBondContact OD1-N 3.09Å; N502-S505 WeakPolarHBondContact CB-OG 3.26Å; N502-S505 PolarHBondContact N-OG 3.46Å; N502-S505 PolarHBondContact O-N 2.91Å; N502-S505 PolarHBondContact O-OG 3.47Å; N502-S506 WeakPolarHBondContact O-CB 3.46Å; N502-S506 PolarHBondContact O-N 2.89Å
503Y91.2Very high90.5Very high175 Ų17590.1 Ų90.169%0.68641%0.407SS*.Hα-helixtrans-56.8-46.9175.3178.1-101.3000111.2S505 S506 Q507Y503-S505 PolarHBondContact O-N 3.35Å; Y503-S506 WeakPolarHBondContact O-CB 3.35Å; Y503-S506 PolarHBondContact O-N 3.1Å; Y503-Q507 HydrophobicContact CD1-CG 4.16Å; Y503-Q507 HydrophobicContact CD2-CG 4.48Å; Y503-Q507 HydrophobicContact CE1-CG 3.73Å; Y503-Q507 HydrophobicContact CE2-CG 4.09Å; Y503-Q507 VanDerWaalsContact CE2-NE2 3.3Å; Y503-Q507 WeakPolarHBondContact O-CG 3.23Å; Y503-Q507 PolarHBondContact O-N 3.45Å; Y503-Q507 PolarHBondContact OH-NE2 2.87Å
504L92.4Very high90.9Very high101 Ų10187.9 Ų87.953%0.52940%0.402SS..Hα-helixtrans-62.3-45.4179.7-179.261000111.5N502 S506 Q507 L508N502-L504 VanDerWaalsContact C-N 3.32Å; N502-L504 PolarHBondContact O-N 3.36Å; N502-L504 PolarHBondContact OD1-N 3.09Å; L504-S506 VanDerWaalsContact C-N 3.27Å; L504-S506 PolarHBondContact O-N 3.1Å; L504-Q507 PolarHBondContact O-N 3.29Å; L504-L508 HydrophobicContact CD1-CD1 4.21Å; L504-L508 HydrophobicContact CD1-CG 4.12Å; L504-L508 HydrophobicContact CG-CD1 4.02Å; L504-L508 HydrophobicContact CG-CG 4.35Å; L504-L508 WeakPolarHBondContact O-CB 3.26Å; L504-L508 WeakPolarHBondContact O-CG 3.15Å; L504-L508 PolarHBondContact O-N 3.23Å
505S92.3Very high91.2Very high29 Ų2989.3 Ų89.320%0.20341%0.411CS..Hα-helixtrans-61.8-37.417763.20000111.9F499 N502 Y503 Y509F499-S505 CarbonylContact O-C 3.53Å; F499-S505 PolarHBondContact O-OG 3.29Å; N502-S505 WeakPolarHBondContact CB-OG 3.26Å; N502-S505 PolarHBondContact N-OG 3.46Å; N502-S505 PolarHBondContact O-N 2.91Å; N502-S505 PolarHBondContact O-OG 3.47Å; Y503-S505 PolarHBondContact O-N 3.35Å; S505-Y509 VanDerWaalsContact O-CB 3.26Å; S505-Y509 WeakPolarHBondContact O-CB 3.41Å; S505-Y509 PolarHBondContact O-N 3.31Å
506S91.7Very high91.5Very high37 Ų3791.1 Ų91.126%0.25942%0.418SS..Hα-helixtrans-68.1-37.6176.7-174.70000112.2F499 N502 Y503 L504 S510F499-S506 WeakPolarHBondContact O-CA 3.46Å; F499-S506 PolarHBondContact O-N 3.28Å; F499-S506 VanDerWaalsContact O-N 3.12Å; N502-S506 WeakPolarHBondContact O-CB 3.46Å; N502-S506 PolarHBondContact O-N 2.89Å; Y503-S506 WeakPolarHBondContact O-CB 3.35Å; Y503-S506 PolarHBondContact O-N 3.1Å; L504-S506 VanDerWaalsContact C-N 3.27Å; L504-S506 PolarHBondContact O-N 3.1Å; S506-S510 WeakPolarHBondContact O-CB 3.35Å; S506-S510 PolarHBondContact O-N 3.08Å; S506-S510 PolarHBondContact O-OG 2.87Å
507Q92.9Very high92Very high79 Ų7987.6 Ų87.637%0.36941%0.406SS..Hα-helixtrans-69.4-47.1175.9-67.9-57-3200111.2Y503 L504 Y509 S510 V511Y503-Q507 HydrophobicContact CD1-CG 4.16Å; Y503-Q507 HydrophobicContact CD2-CG 4.48Å; Y503-Q507 HydrophobicContact CE1-CG 3.73Å; Y503-Q507 HydrophobicContact CE2-CG 4.09Å; Y503-Q507 VanDerWaalsContact CE2-NE2 3.3Å; Y503-Q507 WeakPolarHBondContact O-CG 3.23Å; Y503-Q507 PolarHBondContact O-N 3.45Å; Y503-Q507 PolarHBondContact OH-NE2 2.87Å; L504-Q507 PolarHBondContact O-N 3.29Å; Q507-Y509 VanDerWaalsContact C-N 3.33Å; Q507-Y509 PolarHBondContact O-N 3.28Å; Q507-S510 WeakPolarHBondContact O-CA 3.49Å; Q507-S510 WeakPolarHBondContact O-CB 3.22Å; Q507-S510 PolarHBondContact O-N 3.05Å; Q507-V511 WeakPolarHBondContact O-CG2 3.39Å; Q507-V511 PolarHBondContact O-N 2.75Å
508L93.9Very high92.4Very high109 Ų10984.2 Ų84.257%0.57139%0.391SS*.Hα-helixtrans-59.5-43.2176.7-69.4175.7000111.7L504 S510 V511 F512L504-L508 HydrophobicContact CD1-CD1 4.21Å; L504-L508 HydrophobicContact CD1-CG 4.12Å; L504-L508 HydrophobicContact CG-CD1 4.02Å; L504-L508 HydrophobicContact CG-CG 4.35Å; L504-L508 WeakPolarHBondContact O-CB 3.26Å; L504-L508 WeakPolarHBondContact O-CG 3.15Å; L504-L508 PolarHBondContact O-N 3.23Å; L508-S510 VanDerWaalsContact C-N 3.29Å; L508-S510 PolarHBondContact O-N 3.02Å; L508-V511 PolarHBondContact O-N 3.05Å; L508-F512 WeakPolarHBondContact O-CB 3.37Å; L508-F512 PolarHBondContact O-N 2.97Å
509Y94Very high92.8Very high13 Ų1379.3 Ų79.35%0.05138%0.376CS..Hα-helixtrans-60.3-39.2173177.6-95000112.1W491 R496 F499 S505 Q507 F512 T513W491-Y509 AromaticContact NE1-CE2 4Å; W491-Y509 PolarHBondContact NE1-OH 3Å; R496-Y509 HydrophobicContact CB-CE1 4.07Å; R496-Y509 HydrophobicContact CG-CE1 3.96Å; F499-Y509 HydrophobicContact CB-CD2 4.19Å; F499-Y509 HydrophobicContact CB-CG 3.95Å; F499-Y509 HydrophobicContact CD1-CD2 4.32Å; F499-Y509 AromaticContact CD2-CD2 3.24Å; F499-Y509 HydrophobicContact CD2-CD2 3.24Å; F499-Y509 AromaticContact CD2-CE2 3.67Å; F499-Y509 HydrophobicContact CD2-CE2 3.67Å; F499-Y509 AromaticContact CD2-CG 3.9Å; F499-Y509 HydrophobicContact CD2-CG 3.9Å; F499-Y509 AromaticContact CE2-CD2 3.6Å; F499-Y509 HydrophobicContact CE2-CD2 3.6Å; F499-Y509 AromaticContact CE2-CE2 3.87Å; F499-Y509 HydrophobicContact CE2-CE2 3.87Å; F499-Y509 AromaticContact CG-CD2 3.66Å; F499-Y509 HydrophobicContact CG-CD2 3.66Å; F499-Y509 HydrophobicContact CG-CE2 4.49Å; F499-Y509 AromaticContact CG-CG 3.91Å; F499-Y509 HydrophobicContact CG-CG 3.91Å; F499-Y509 HydrophobicContact CZ-CD2 4.27Å; S505-Y509 VanDerWaalsContact O-CB 3.26Å; S505-Y509 WeakPolarHBondContact O-CB 3.41Å; S505-Y509 PolarHBondContact O-N 3.31Å; Q507-Y509 VanDerWaalsContact C-N 3.33Å; Q507-Y509 PolarHBondContact O-N 3.28Å; Y509-F512 PolarHBondContact O-N 3.45Å; Y509-T513 HydrophobicContact CD1-CG2 4.21Å; Y509-T513 HydrophobicContact CD2-CG2 4.29Å; Y509-T513 HydrophobicContact CE1-CG2 3.73Å; Y509-T513 HydrophobicContact CE2-CG2 3.83Å; Y509-T513 HydrophobicContact CG-CG2 4.47Å; Y509-T513 WeakPolarHBondContact O-CB 3.32Å; Y509-T513 WeakPolarHBondContact O-CG2 3.43Å; Y509-T513 PolarHBondContact O-N 3.25Å; Y509-T513 PolarHBondContact O-OG1 2.57Å
510S93.3Very high93.1Very high32 Ų3277.5 Ų77.522%0.22437%0.37CS..Hα-helixtrans-66.6-42.9177.8-57.70000111.7S506 Q507 L508 T513 M514S506-S510 WeakPolarHBondContact O-CB 3.35Å; S506-S510 PolarHBondContact O-N 3.08Å; S506-S510 PolarHBondContact O-OG 2.87Å; Q507-S510 WeakPolarHBondContact O-CA 3.49Å; Q507-S510 WeakPolarHBondContact O-CB 3.22Å; Q507-S510 PolarHBondContact O-N 3.05Å; L508-S510 VanDerWaalsContact C-N 3.29Å; L508-S510 PolarHBondContact O-N 3.02Å; S510-T513 WeakPolarHBondContact CA-OG1 3.5Å; S510-T513 PolarHBondContact O-OG1 2.9Å; S510-T513 VanDerWaalsContact O-OG1 3.11Å; S510-M514 VanDerWaalsContact O-CB 3.24Å; S510-M514 WeakPolarHBondContact O-CB 2.97Å; S510-M514 PolarHBondContact O-N 2.8Å
511V95.2Very high93.7Very high70 Ų7070 Ų7042%0.42434%0.343SS..Hα-helixtrans-64.2-45.3175.1174.80000111Q507 L508 M514 I515Q507-V511 WeakPolarHBondContact O-CG2 3.39Å; Q507-V511 PolarHBondContact O-N 2.75Å; L508-V511 PolarHBondContact O-N 3.05Å; V511-M514 HydrophobicContact CG1-CE 4.5Å; V511-M514 WeakPolarHBondContact O-CB 3.31Å; V511-M514 PolarHBondContact O-N 3.42Å; V511-I515 HydrophobicContact CG1-CD1 4.02Å; V511-I515 WeakPolarHBondContact O-CG1 3.33Å; V511-I515 PolarHBondContact O-N 3.05Å
512F95Very high94.4Very high103 Ų10358.6 Ų58.645%0.45230%0.3SS..Hα-helixtrans-58.1-52.1176.6171-102.2000111.8W491 L508 Y509 M514 I515 I516W491-F512 HydrophobicContact CZ2-CE1 4.49Å; L508-F512 WeakPolarHBondContact O-CB 3.37Å; L508-F512 PolarHBondContact O-N 2.97Å; Y509-F512 PolarHBondContact O-N 3.45Å; F512-M514 VanDerWaalsContact C-N 3.3Å; F512-M514 PolarHBondContact O-N 2.86Å; F512-I515 PolarHBondContact O-N 2.87Å; F512-I516 HydrophobicContact CD2-CG1 4.21Å; F512-I516 HydrophobicContact CE1-CG1 4.11Å; F512-I516 HydrophobicContact CE2-CD1 4.11Å; F512-I516 HydrophobicContact CE2-CG1 3.78Å; F512-I516 HydrophobicContact CZ-CD1 4.26Å; F512-I516 HydrophobicContact CZ-CG1 3.73Å; F512-I516 WeakPolarHBondContact O-CG1 3.41Å; F512-I516 PolarHBondContact O-N 2.72Å
513T95.1Very high94.8Very high10 Ų1054.7 Ų54.76%0.06128%0.278CS..Hα-helixtrans-66.4-31.618050.20000113I426 Y509 S510 T517I426-T513 WeakPolarHBondContact O-CB 3.33Å; Y509-T513 HydrophobicContact CD1-CG2 4.21Å; Y509-T513 HydrophobicContact CD2-CG2 4.29Å; Y509-T513 HydrophobicContact CE1-CG2 3.73Å; Y509-T513 HydrophobicContact CE2-CG2 3.83Å; Y509-T513 HydrophobicContact CG-CG2 4.47Å; Y509-T513 WeakPolarHBondContact O-CB 3.32Å; Y509-T513 WeakPolarHBondContact O-CG2 3.43Å; Y509-T513 PolarHBondContact O-N 3.25Å; Y509-T513 PolarHBondContact O-OG1 2.57Å; S510-T513 WeakPolarHBondContact CA-OG1 3.5Å; S510-T513 PolarHBondContact O-OG1 2.9Å; S510-T513 VanDerWaalsContact O-OG1 3.11Å; T513-T517 WeakPolarHBondContact O-CB 3.4Å; T513-T517 PolarHBondContact O-N 3.4Å; T513-T517 PolarHBondContact O-OG1 3.31Å
514M95.8Very high95.1Very high60 Ų6046.4 Ų46.430%0.29625%0.246SC..Hα-helixtrans-61.4-50.2171.2179.4-174.972.800111.5T424 I426 S510 V511 F512 T517 N518T424-M514 HydrophobicContact CG2-SD 4.12Å; I426-M514 HydrophobicContact CG2-CB 4.34Å; S510-M514 VanDerWaalsContact O-CB 3.24Å; S510-M514 WeakPolarHBondContact O-CB 2.97Å; S510-M514 PolarHBondContact O-N 2.8Å; V511-M514 HydrophobicContact CG1-CE 4.5Å; V511-M514 WeakPolarHBondContact O-CB 3.31Å; V511-M514 PolarHBondContact O-N 3.42Å; F512-M514 VanDerWaalsContact C-N 3.3Å; F512-M514 PolarHBondContact O-N 2.86Å; M514-T517 PolarHBondContact O-N 3.37Å; M514-N518 WeakPolarHBondContact O-CB 3.38Å; M514-N518 PolarHBondContact O-N 3.26Å
515I96Very high95.3Very high89 Ų8942.3 Ų42.346%0.45622%0.224SC..Hα-helixtrans-60.7-50.3178.7-66.7167.1000110.3V511 F512 T517 N518 L519V511-I515 HydrophobicContact CG1-CD1 4.02Å; V511-I515 WeakPolarHBondContact O-CG1 3.33Å; V511-I515 PolarHBondContact O-N 3.05Å; F512-I515 PolarHBondContact O-N 2.87Å; I515-T517 VanDerWaalsContact C-N 3.33Å; I515-T517 PolarHBondContact O-N 2.88Å; I515-N518 PolarHBondContact O-N 2.94Å; I515-L519 HydrophobicContact CG2-CD1 4.18Å; I515-L519 WeakPolarHBondContact O-CG 3.23Å; I515-L519 PolarHBondContact O-N 3.06Å
516I95.7Very high95.5Very high65 Ų6540.9 Ų40.933%0.33321%0.214SC..Hα-helixtrans-61.1-41.8179.7-65-60.2000111.5F512 L519 I520F512-I516 HydrophobicContact CD2-CG1 4.21Å; F512-I516 HydrophobicContact CE1-CG1 4.11Å; F512-I516 HydrophobicContact CE2-CD1 4.11Å; F512-I516 HydrophobicContact CE2-CG1 3.78Å; F512-I516 HydrophobicContact CZ-CD1 4.26Å; F512-I516 HydrophobicContact CZ-CG1 3.73Å; F512-I516 WeakPolarHBondContact O-CG1 3.41Å; F512-I516 PolarHBondContact O-N 2.72Å; I516-L519 PolarHBondContact O-N 2.96Å; I516-I520 HydrophobicContact CG2-CD1 3.65Å; I516-I520 HydrophobicContact CG2-CG1 4.32Å; I516-I520 WeakPolarHBondContact O-CB 3.47Å; I516-I520 VanDerWaalsContact O-CG1 3.27Å; I516-I520 WeakPolarHBondContact O-CG1 3.34Å; I516-I520 PolarHBondContact O-N 3.44Å
517T96.7Very high95.8Very high10 Ų1039.1 Ų39.16%0.06120%0.202CC..Hα-helixtrans-62.8-44177.3-61.30000111G425 S427 V431 T513 M514 I515 L519 I520 V521G425-T517 WeakPolarHBondContact O-CB 3.37Å; G425-T517 VanDerWaalsContact O-CG2 3.32Å; G425-T517 WeakPolarHBondContact O-CG2 3.34Å; S427-T517 PolarHBondContact N-OG1 3.39Å; V431-T517 HydrophobicContact CG2-CG2 3.7Å; T513-T517 WeakPolarHBondContact O-CB 3.4Å; T513-T517 PolarHBondContact O-N 3.4Å; T513-T517 PolarHBondContact O-OG1 3.31Å; M514-T517 PolarHBondContact O-N 3.37Å; I515-T517 VanDerWaalsContact C-N 3.33Å; I515-T517 PolarHBondContact O-N 2.88Å; T517-L519 PolarHBondContact O-N 3.25Å; T517-I520 PolarHBondContact O-N 3.32Å; T517-V521 HydrophobicContact CG2-CG2 4.23Å; T517-V521 WeakPolarHBondContact O-CB 3.45Å; T517-V521 VanDerWaalsContact O-CG2 3.24Å; T517-V521 WeakPolarHBondContact O-CG2 3.41Å; T517-V521 PolarHBondContact O-N 2.96Å
518N96Very high95.9Very high34 Ų3436.3 Ų36.318%0.18219%0.188CC..Hα-helixtrans-60.3-45.1177.2-168.2-79.7000111.5E423 M514 I515 I520 V521 N522E423-N518 PolarHBondContact O-ND2 3.27Å; M514-N518 WeakPolarHBondContact O-CB 3.38Å; M514-N518 PolarHBondContact O-N 3.26Å; I515-N518 PolarHBondContact O-N 2.94Å; N518-I520 PolarHBondContact O-N 3.45Å; N518-V521 PolarHBondContact O-N 3.32Å; N518-N522 PolarHBondContact O-N 3.37Å; N518-N522 PolarHBondContact O-ND2 3.38Å; N518-N522 PolarHBondContact OD1-ND2 2.98Å
519L96.3Very high95.9Very high61 Ų6131.7 Ų31.732%0.31916%0.164SC..Hα-helixtrans-60.5-45175.6-66.8177.3000112.3I367 I515 I516 T517 N522 Y523I367-L519 HydrophobicContact CG2-CD2 3.38Å; I515-L519 HydrophobicContact CG2-CD1 4.18Å; I515-L519 WeakPolarHBondContact O-CG 3.23Å; I515-L519 PolarHBondContact O-N 3.06Å; I516-L519 PolarHBondContact O-N 2.96Å; T517-L519 PolarHBondContact O-N 3.25Å; L519-N522 PolarHBondContact O-N 3.19Å; L519-Y523 VanDerWaalsContact O-CB 3.26Å; L519-Y523 WeakPolarHBondContact O-CB 3.5Å; L519-Y523 PolarHBondContact O-N 3.31Å
520I96.7Very high95.9Very high46 Ų4632 Ų3224%0.23617%0.166CC..Hα-helixtrans-64.6-40.9178-70.3169.8000111.1F484 I516 T517 N518 G524F484-I520 HydrophobicContact CB-CG2 3.96Å; F484-I520 HydrophobicContact CD2-CG2 3.43Å; F484-I520 VanDerWaalsContact CD2-CG2 3.43Å; F484-I520 HydrophobicContact CE2-CG2 4.08Å; F484-I520 HydrophobicContact CG-CG2 3.76Å; I516-I520 HydrophobicContact CG2-CD1 3.65Å; I516-I520 HydrophobicContact CG2-CG1 4.32Å; I516-I520 WeakPolarHBondContact O-CB 3.47Å; I516-I520 VanDerWaalsContact O-CG1 3.27Å; I516-I520 WeakPolarHBondContact O-CG1 3.34Å; I516-I520 PolarHBondContact O-N 3.44Å; T517-I520 PolarHBondContact O-N 3.32Å; N518-I520 PolarHBondContact O-N 3.45Å; I520-G524 PolarHBondContact O-N 2.85Å
521V96.7Very high95.9Very high13 Ų1331.2 Ų31.28%0.07916%0.159CC..Hα-helixtrans-64.8-44.2177.9167.40000110.6L428 V431 T517 N518 Q525L428-V521 HydrophobicContact CD1-CG2 3.59Å; V431-V521 HydrophobicContact CB-CG2 4.4Å; V431-V521 HydrophobicContact CG1-CG2 4.04Å; V431-V521 HydrophobicContact CG2-CG2 4.28Å; T517-V521 HydrophobicContact CG2-CG2 4.23Å; T517-V521 WeakPolarHBondContact O-CB 3.45Å; T517-V521 VanDerWaalsContact O-CG2 3.24Å; T517-V521 WeakPolarHBondContact O-CG2 3.41Å; T517-V521 PolarHBondContact O-N 2.96Å; N518-V521 PolarHBondContact O-N 3.32Å; V521-Q525 VanDerWaalsContact O-CB 3.26Å; V521-Q525 WeakPolarHBondContact O-CB 3.49Å; V521-Q525 VanDerWaalsContact O-CG 3.23Å; V521-Q525 WeakPolarHBondContact O-CG 3.39Å; V521-Q525 PolarHBondContact O-N 3.19Å; V521-Q525 PolarHBondContact O-NE2 3.15Å
522N97Very high95.7Very high2 Ų230.3 Ų30.31%0.01115%0.152CC..Hα-helixtrans-66.1-46.8176.5-68.1-30.6000111.5V370 T371 L374 R378 N518 L519 Q525 A526V370-N522 HydrophobicContact CG1-CB 4.3Å; T371-N522 PolarHBondContact OG1-ND2 3.02Å; L374-N522 HydrophobicContact CD1-CB 3.91Å; L374-N522 WeakPolarHBondContact CD1-O 3.4Å; R378-N522 PolarHBondContact NH1-OD1 2.86Å; R378-N522 PolarHBondContact NH2-OD1 3Å; N518-N522 PolarHBondContact O-N 3.37Å; N518-N522 PolarHBondContact O-ND2 3.38Å; N518-N522 PolarHBondContact OD1-ND2 2.98Å; L519-N522 PolarHBondContact O-N 3.19Å; N522-Q525 PolarHBondContact OD1-NE2 3.44Å; N522-A526 PolarHBondContact O-N 3.19Å
523Y97.4Very high95.7Very high11 Ų1130.9 Ų30.94%0.04316%0.155CC..Hα-helixtrans-61.3-49.1177172.3-99.4000112.6F484 L519 F539 L540 F543 P547 H548F484-Y523 HydrophobicContact CE2-CD1 4.09Å; F484-Y523 HydrophobicContact CE2-CE1 4.3Å; F484-Y523 HydrophobicContact CZ-CD1 4.13Å; F484-Y523 AromaticContact CZ-CE1 3.95Å; F484-Y523 HydrophobicContact CZ-CE1 3.95Å; L519-Y523 VanDerWaalsContact O-CB 3.26Å; L519-Y523 WeakPolarHBondContact O-CB 3.5Å; L519-Y523 PolarHBondContact O-N 3.31Å; Y523-F539 AromaticContact CD2-CE1 3.95Å; Y523-F539 HydrophobicContact CD2-CE1 3.95Å; Y523-F539 HydrophobicContact CD2-CZ 4.43Å; Y523-F539 HydrophobicContact CE2-CE1 4.26Å; Y523-L540 HydrophobicContact CD2-CD2 4.48Å; Y523-L540 HydrophobicContact CE1-CD2 3.98Å; Y523-L540 HydrophobicContact CE2-CD2 3.68Å; Y523-L540 VanDerWaalsContact CZ-CD2 3.41Å; Y523-L540 WeakPolarHBondContact OH-CD2 3.46Å; Y523-F543 HydrophobicContact CD2-CB 4.15Å; Y523-F543 HydrophobicContact CD2-CD2 4.22Å; Y523-F543 HydrophobicContact CD2-CG 4.22Å; Y523-F543 HydrophobicContact CE2-CB 3.78Å; Y523-F543 HydrophobicContact CE2-CD2 4.34Å; Y523-F543 HydrophobicContact CE2-CG 4.29Å; Y523-P547 HydrophobicContact CD1-CB 3.63Å; Y523-P547 HydrophobicContact CD1-CG 3.54Å; Y523-P547 HydrophobicContact CD2-CG 4.11Å; Y523-P547 HydrophobicContact CE1-CB 3.59Å; Y523-P547 HydrophobicContact CE1-CG 3.62Å; Y523-P547 HydrophobicContact CE2-CG 4.21Å; Y523-P547 HydrophobicContact CG-CB 4.35Å; Y523-P547 HydrophobicContact CG-CG 3.77Å; Y523-H548 AromaticContact CE1-CE1 3.45Å; Y523-H548 VanDerWaalsContact CE1-CE1 3.45Å; Y523-H548 WeakPolarHBondContact CE1-CE1 3.31Å; Y523-H548 AromaticContact CE1-ND1 3.35Å; Y523-H548 WeakPolarHBondContact CE1-ND1 3.27Å; Y523-H548 AromaticContact CZ-CE1 3.84Å; Y523-H548 AromaticContact CZ-ND1 3.53Å; Y523-H548 PolarHBondContact OH-CE1 3.4Å; Y523-H548 PolarHBondContact OH-ND1 3.24Å
524G96.8Very high95.7Very high0 Ų038.4 Ų38.40%018%0.183CC..Hα-helixtrans-76-26.9-173.600000113.9M477 I520 P527M477-G524 VanDerWaalsContact CG-O 3.27Å; M477-G524 WeakPolarHBondContact CG-O 3.4Å; I520-G524 PolarHBondContact O-N 2.85Å; G524-P527 WeakPolarHBondContact O-CD 3.5Å
525Q96.3Very high95.7Very high15 Ų1536.8 Ų36.87%0.0718%0.177CC..Hα-helixtrans-78.9-20.3176.682-173.4-88.700113.8L374 M477 F481 V521 N522 F528 H529L374-Q525 HydrophobicContact CD1-CG 3.86Å; L374-Q525 HydrophobicContact CD2-CG 4.13Å; M477-Q525 HydrophobicContact SD-CB 4.05Å; F481-Q525 HydrophobicContact CZ-CB 4.01Å; V521-Q525 VanDerWaalsContact O-CB 3.26Å; V521-Q525 WeakPolarHBondContact O-CB 3.49Å; V521-Q525 VanDerWaalsContact O-CG 3.23Å; V521-Q525 WeakPolarHBondContact O-CG 3.39Å; V521-Q525 PolarHBondContact O-N 3.19Å; V521-Q525 PolarHBondContact O-NE2 3.15Å; N522-Q525 PolarHBondContact OD1-NE2 3.44Å; Q525-F528 WeakPolarHBondContact O-CB 3.46Å; Q525-F528 PolarHBondContact O-N 3.38Å; Q525-H529 PolarHBondContact OE1-NE2 3.32Å
526A97Very high95.7Very high0 Ų032.5 Ų32.50%016%0.156CC..Hα-helixtrans-51.3-45.4-17500000114.2F350 L374 N522 F528 H529 L530 F539F350-A526 HydrophobicContact CE1-CB 4.14Å; F350-A526 HydrophobicContact CZ-CB 3.58Å; L374-A526 HydrophobicContact CD1-CB 4.43Å; N522-A526 PolarHBondContact O-N 3.19Å; A526-F528 PolarHBondContact O-N 2.91Å; A526-F528 VanDerWaalsContact O-N 3.14Å; A526-H529 PolarHBondContact O-N 3.44Å; A526-L530 WeakPolarHBondContact O-CG 3.45Å; A526-L530 PolarHBondContact O-N 3.02Å; A526-L530 VanDerWaalsContact O-N 3.11Å; A526-F539 HydrophobicContact CB-CD1 3.59Å; A526-F539 HydrophobicContact CB-CD2 4.27Å; A526-F539 HydrophobicContact CB-CE1 3.17Å; A526-F539 HydrophobicContact CB-CE2 3.87Å; A526-F539 HydrophobicContact CB-CG 4.14Å; A526-F539 HydrophobicContact CB-CZ 3.31Å
527P97.3Very high95.8Very high0 Ų032.2 Ų32.20%016%0.155CC..Hα-helixtrans-53.2-32.5174-29.837.9000114.6G473 I476 M477 G524 H529 L530 L531 S536 L540G473-P527 CarbonylContact C-O 3.51Å; G473-P527 WeakPolarHBondContact CA-O 3.49Å; G473-P527 CarbonylContact O-C 3.31Å; G473-P527 WeakPolarHBondContact O-CB 3.26Å; I476-P527 HydrophobicContact CB-CB 3.91Å; I476-P527 HydrophobicContact CB-CG 4.32Å; I476-P527 HydrophobicContact CG2-CB 3.81Å; I476-P527 HydrophobicContact CG2-CG 3.66Å; M477-P527 HydrophobicContact CB-CB 4.45Å; G524-P527 WeakPolarHBondContact O-CD 3.5Å; P527-H529 VanDerWaalsContact C-N 3.28Å; P527-H529 PolarHBondContact O-N 3.16Å; P527-L530 PolarHBondContact O-N 3.49Å; P527-L531 PolarHBondContact O-N 3.35Å; P527-S536 WeakPolarHBondContact CA-OG 3.38Å; P527-L540 HydrophobicContact CG-CD2 4.25Å
528F96Very high95.8Very high20 Ų2035.3 Ų35.39%0.08817%0.167CC..Hα-helixtrans-64.6-33.5178.4-175.4-81.3000112.7H468 Y474 M477 F478 Q525 A526 L531H468-F528 HydrophobicContact CB-CE2 4.25Å; H468-F528 AromaticContact CE1-CE2 3.81Å; H468-F528 AromaticContact CE1-CZ 3.77Å; H468-F528 AromaticContact CG-CE2 3.75Å; H468-F528 AromaticContact ND1-CE2 3.56Å; H468-F528 AromaticContact ND1-CZ 3.55Å; Y474-F528 HydrophobicContact CD1-CB 4.37Å; Y474-F528 HydrophobicContact CD1-CD1 4.5Å; Y474-F528 AromaticContact CD1-CD2 3.23Å; Y474-F528 HydrophobicContact CD1-CD2 3.23Å; Y474-F528 AromaticContact CD1-CE2 3.48Å; Y474-F528 HydrophobicContact CD1-CE2 3.48Å; Y474-F528 VanDerWaalsContact CD1-CE2 3.48Å; Y474-F528 AromaticContact CD1-CG 3.8Å; Y474-F528 HydrophobicContact CD1-CG 3.8Å; Y474-F528 HydrophobicContact CD1-CZ 4.21Å; Y474-F528 HydrophobicContact CE1-CD1 4.11Å; Y474-F528 AromaticContact CE1-CD2 3.55Å; Y474-F528 HydrophobicContact CE1-CD2 3.55Å; Y474-F528 HydrophobicContact CE1-CE1 4.02Å; Y474-F528 AromaticContact CE1-CE2 3.48Å; Y474-F528 HydrophobicContact CE1-CE2 3.48Å; Y474-F528 VanDerWaalsContact CE1-CE2 3.48Å; Y474-F528 AromaticContact CE1-CG 3.86Å; Y474-F528 HydrophobicContact CE1-CG 3.86Å; Y474-F528 AromaticContact CE1-CZ 3.72Å; Y474-F528 HydrophobicContact CE1-CZ 3.72Å; Y474-F528 HydrophobicContact CG-CD2 4.22Å; Y474-F528 HydrophobicContact CG-CE2 4.31Å; M477-F528 HydrophobicContact CB-CB 4.1Å; M477-F528 HydrophobicContact CE-CB 4.16Å; M477-F528 HydrophobicContact CE-CD2 3.33Å; M477-F528 HydrophobicContact CE-CE2 4.02Å; M477-F528 HydrophobicContact CE-CG 4.02Å; M477-F528 HydrophobicContact CG-CB 4.29Å; M477-F528 HydrophobicContact SD-CB 3.38Å; M477-F528 WeakPolarHBondContact SD-CB 3.38Å; M477-F528 HydrophobicContact SD-CD2 3.75Å; M477-F528 HydrophobicContact SD-CG 3.79Å; F478-F528 HydrophobicContact CE2-CD2 4.24Å; F478-F528 HydrophobicContact CE2-CE2 4.18Å; F478-F528 HydrophobicContact CZ-CE2 4.37Å; Q525-F528 WeakPolarHBondContact O-CB 3.46Å; Q525-F528 PolarHBondContact O-N 3.38Å; A526-F528 PolarHBondContact O-N 2.91Å; A526-F528 VanDerWaalsContact O-N 3.14Å; F528-L531 WeakPolarHBondContact O-CD2 3.46Å
529H93.9Very high95.8Very high12 Ų1233.7 Ų33.76%0.05616%0.159CC..Hα-helixtrans-87.5-26.6179.1-60.3-63.2000112.6Y152 F350 L374 I377 Q525 A526 P527Y152-H529 PolarHBondContact OH-O 3.46Å; F350-H529 HydrophobicContact CD1-CB 3.78Å; F350-H529 HydrophobicContact CE1-CB 3.87Å; L374-H529 WeakPolarHBondContact CD2-CD2 3.39Å; I377-H529 WeakPolarHBondContact CG2-CE1 3.38Å; I377-H529 WeakPolarHBondContact CG2-ND1 3.33Å; Q525-H529 PolarHBondContact OE1-NE2 3.32Å; A526-H529 PolarHBondContact O-N 3.44Å; P527-H529 VanDerWaalsContact C-N 3.28Å; P527-H529 PolarHBondContact O-N 3.16Å
530L94.3Very high95.8Very high20 Ų2031 Ų3111%0.10514%0.144CC..Hα-helixtrans-78.2-26.6176.1-63.2173.6000112.7F350 V353 L354 A526 P527 D532 F539F350-L530 HydrophobicContact CD1-CD2 3.96Å; F350-L530 HydrophobicContact CD1-CG 4.38Å; F350-L530 HydrophobicContact CE1-CD1 4.4Å; F350-L530 HydrophobicContact CE1-CD2 3.79Å; F350-L530 HydrophobicContact CE1-CG 3.79Å; V353-L530 HydrophobicContact CG2-CD2 4.22Å; L354-L530 HydrophobicContact CD1-CD2 4.02Å; L354-L530 HydrophobicContact CD2-CD1 4.2Å; L354-L530 HydrophobicContact CD2-CD2 4.12Å; L354-L530 HydrophobicContact CG-CD2 4.07Å; A526-L530 WeakPolarHBondContact O-CG 3.45Å; A526-L530 PolarHBondContact O-N 3.02Å; A526-L530 VanDerWaalsContact O-N 3.11Å; P527-L530 PolarHBondContact O-N 3.49Å; L530-D532 PolarHBondContact O-N 2.81Å; L530-F539 HydrophobicContact CD1-CB 3.5Å; L530-F539 VanDerWaalsContact CD1-CB 3.5Å; L530-F539 HydrophobicContact CD1-CD2 4.46Å; L530-F539 HydrophobicContact CD1-CG 3.96Å
531L93Very high95.8Very high14 Ų1437.7 Ų37.77%0.07317%0.167CC..  trans64.1-41.4175-58.7170.5000115.7Y471 P472 G473 Y474 P527 F528Y471-L531 HydrophobicContact CD1-CB 3.66Å; Y471-L531 HydrophobicContact CD1-CD1 4.43Å; Y471-L531 HydrophobicContact CD1-CD2 4.27Å; Y471-L531 HydrophobicContact CD1-CG 4.35Å; Y471-L531 HydrophobicContact CD2-CD2 3.99Å; Y471-L531 HydrophobicContact CE1-CB 4.22Å; Y471-L531 HydrophobicContact CE1-CD1 4.26Å; Y471-L531 HydrophobicContact CG-CB 4Å; Y471-L531 HydrophobicContact CG-CD2 3.84Å; Y471-L531 HydrophobicContact CG-CG 4.4Å; P472-L531 WeakPolarHBondContact CD-O 3.24Å; G473-L531 PolarHBondContact N-O 3.37Å; Y474-L531 HydrophobicContact CD1-CD2 4.24Å; Y474-L531 HydrophobicContact CE1-CD2 3.36Å; Y474-L531 WeakPolarHBondContact OH-CD2 3.23Å; P527-L531 PolarHBondContact O-N 3.35Å; F528-L531 WeakPolarHBondContact O-CD2 3.46Å
532D91.1Very high95.7Very high51 Ų5137.8 Ų37.827%0.27317%0.167SC..SBendtrans-81.8145.8-178.217361.3000112.8L530 Y534 S535 S536L530-D532 PolarHBondContact O-N 2.81Å; D532-Y534 WeakPolarHBondContact OD2-CB 3.37Å; D532-Y534 PolarHBondContact OD2-N 3.22Å; D532-S535 PolarHBondContact OD2-N 3.14Å; D532-S535 PolarHBondContact OD2-OG 3.4Å; D532-S536 WeakPolarHBondContact O-CB 3.36Å; D532-S536 PolarHBondContact O-N 3.24Å; D532-S536 PolarHBondContact O-OG 3.18Å
533F94.2Very high95.6Very high115 Ų11538.6 Ų38.650%0.50417%0.171SC..Hα-helixtrans-64.6-49.5-178.3-177.1-103.7000112P472 I476 S536 L537P472-F533 HydrophobicContact CB-CB 3.67Å; P472-F533 HydrophobicContact CB-CD2 4.14Å; P472-F533 HydrophobicContact CB-CG 4.4Å; P472-F533 HydrophobicContact CG-CB 4.06Å; I476-F533 HydrophobicContact CD1-CD2 3.83Å; I476-F533 HydrophobicContact CD1-CE2 4.22Å; F533-S536 PolarHBondContact O-N 3.03Å; F533-L537 HydrophobicContact CD1-CD1 3.99Å; F533-L537 HydrophobicContact CE1-CD1 3.35Å; F533-L537 HydrophobicContact CE1-CG 4.23Å; F533-L537 HydrophobicContact CE2-CD1 4.29Å; F533-L537 HydrophobicContact CZ-CD1 3.54Å; F533-L537 HydrophobicContact CZ-CG 4.22Å; F533-L537 WeakPolarHBondContact O-CG 3.4Å; F533-L537 PolarHBondContact O-N 3.2Å
534Y95.8Very high95.6Very high169 Ų16945 Ų4566%0.66320%0.196SC*.Hα-helixtrans-69-42.7-175.9-179.3-100.7000111.2D532 S536 L537 K538D532-Y534 WeakPolarHBondContact OD2-CB 3.37Å; D532-Y534 PolarHBondContact OD2-N 3.22Å; Y534-S536 VanDerWaalsContact C-N 3.32Å; Y534-S536 PolarHBondContact O-N 2.93Å; Y534-L537 PolarHBondContact O-N 3.34Å; Y534-K538 WeakPolarHBondContact O-CB 3.48Å; Y534-K538 PolarHBondContact O-N 2.74Å
535S95.4Very high95.6Very high25 Ų2548.3 Ų48.318%0.17521%0.21CC..Hα-helixtrans-60.1-43.3175.6-57.70000111.4L354 D532 K538 F539L354-S535 WeakPolarHBondContact CD2-O 3.5Å; D532-S535 PolarHBondContact OD2-N 3.14Å; D532-S535 PolarHBondContact OD2-OG 3.4Å; S535-K538 PolarHBondContact O-N 2.84Å; S535-F539 PolarHBondContact O-N 3.12Å
536S96.9Very high95.6Very high0 Ų051.3 Ų51.30%023%0.226CC..Hα-helixtrans-60.8-48.6174.5-62.20000111.7P527 D532 F533 Y534 K538 F539 L540P527-S536 WeakPolarHBondContact CA-OG 3.38Å; D532-S536 WeakPolarHBondContact O-CB 3.36Å; D532-S536 PolarHBondContact O-N 3.24Å; D532-S536 PolarHBondContact O-OG 3.18Å; F533-S536 PolarHBondContact O-N 3.03Å; Y534-S536 VanDerWaalsContact C-N 3.32Å; Y534-S536 PolarHBondContact O-N 2.93Å; S536-K538 PolarHBondContact O-N 3.48Å; S536-F539 PolarHBondContact O-N 3.19Å; S536-L540 VanDerWaalsContact O-CG 3.3Å; S536-L540 WeakPolarHBondContact O-CG 3.26Å; S536-L540 PolarHBondContact O-N 2.92Å
537L96.6Very high95.6Very high59 Ų5952.8 Ų52.831%0.30924%0.236SC..Hα-helixtrans-64.4-39.6177.9-71.3-174.3000112.8F533 Y534 F539 L540 R541 F545F533-L537 HydrophobicContact CD1-CD1 3.99Å; F533-L537 HydrophobicContact CE1-CD1 3.35Å; F533-L537 HydrophobicContact CE1-CG 4.23Å; F533-L537 HydrophobicContact CE2-CD1 4.29Å; F533-L537 HydrophobicContact CZ-CD1 3.54Å; F533-L537 HydrophobicContact CZ-CG 4.22Å; F533-L537 WeakPolarHBondContact O-CG 3.4Å; F533-L537 PolarHBondContact O-N 3.2Å; Y534-L537 PolarHBondContact O-N 3.34Å; L537-F539 VanDerWaalsContact C-N 3.33Å; L537-F539 PolarHBondContact O-N 2.97Å; L537-L540 HydrophobicContact CD2-CD1 4.49Å; L537-L540 PolarHBondContact O-N 3.45Å; L537-R541 WeakPolarHBondContact O-CB 3.26Å; L537-R541 PolarHBondContact O-N 3.4Å; L537-F545 HydrophobicContact CD2-CE1 4.5Å; L537-F545 HydrophobicContact CD2-CZ 4.39Å
538K96.4Very high95.6Very high75 Ų7554.4 Ų54.433%0.32624%0.243SC..Hα-helixtrans-56.7-49.4174.9-173.8177.5-173.5177.50110L354 Y534 S535 S536 R541 V542L354-K538 HydrophobicContact CD2-CB 4.49Å; L354-K538 HydrophobicContact CD2-CD 4.44Å; L354-K538 VanDerWaalsContact O-CE 3.26Å; L354-K538 WeakPolarHBondContact O-CE 3.37Å; L354-K538 PolarHBondContact O-NZ 3.36Å; Y534-K538 WeakPolarHBondContact O-CB 3.48Å; Y534-K538 PolarHBondContact O-N 2.74Å; S535-K538 PolarHBondContact O-N 2.84Å; S536-K538 PolarHBondContact O-N 3.48Å; K538-R541 WeakPolarHBondContact O-CB 3.41Å; K538-R541 PolarHBondContact O-N 2.73Å; K538-V542 WeakPolarHBondContact O-CG2 3.31Å; K538-V542 PolarHBondContact O-N 3.4Å; K538-V542 VanDerWaalsContact O-N 3.13Å
539F97Very high95.7Very high0 Ų059 Ų590%027%0.268CS..Hα-helixtrans-59-49.3175.7171.1-90000112.5F350 V353 V370 Y523 A526 L530 S535 S536 L537 R541 V542 F543F350-F539 HydrophobicContact CZ-CE2 4.29Å; V353-F539 HydrophobicContact CB-CD2 4.13Å; V353-F539 HydrophobicContact CG2-CD2 3.75Å; V353-F539 HydrophobicContact CG2-CE2 4.42Å; V370-F539 HydrophobicContact CG1-CE2 4.3Å; V370-F539 HydrophobicContact CG1-CZ 4.17Å; V370-F539 HydrophobicContact CG2-CE2 3.85Å; V370-F539 HydrophobicContact CG2-CZ 4.43Å; Y523-F539 AromaticContact CD2-CE1 3.95Å; Y523-F539 HydrophobicContact CD2-CE1 3.95Å; Y523-F539 HydrophobicContact CD2-CZ 4.43Å; Y523-F539 HydrophobicContact CE2-CE1 4.26Å; A526-F539 HydrophobicContact CB-CD1 3.59Å; A526-F539 HydrophobicContact CB-CD2 4.27Å; A526-F539 HydrophobicContact CB-CE1 3.17Å; A526-F539 HydrophobicContact CB-CE2 3.87Å; A526-F539 HydrophobicContact CB-CG 4.14Å; A526-F539 HydrophobicContact CB-CZ 3.31Å; L530-F539 HydrophobicContact CD1-CB 3.5Å; L530-F539 VanDerWaalsContact CD1-CB 3.5Å; L530-F539 HydrophobicContact CD1-CD2 4.46Å; L530-F539 HydrophobicContact CD1-CG 3.96Å; S535-F539 PolarHBondContact O-N 3.12Å; S536-F539 PolarHBondContact O-N 3.19Å; L537-F539 VanDerWaalsContact C-N 3.33Å; L537-F539 PolarHBondContact O-N 2.97Å; F539-R541 PolarHBondContact O-N 3.02Å; F539-V542 WeakPolarHBondContact O-CB 3.4Å; F539-V542 PolarHBondContact O-N 3.35Å; F539-F543 HydrophobicContact CD2-CE2 4.26Å; F539-F543 HydrophobicContact CE1-CD2 4.27Å; F539-F543 HydrophobicContact CE1-CE2 4.38Å; F539-F543 HydrophobicContact CE2-CD2 4.18Å; F539-F543 AromaticContact CE2-CE2 3.56Å; F539-F543 HydrophobicContact CE2-CE2 3.56Å; F539-F543 AromaticContact CZ-CD2 3.95Å; F539-F543 HydrophobicContact CZ-CD2 3.95Å; F539-F543 AromaticContact CZ-CE2 3.62Å; F539-F543 HydrophobicContact CZ-CE2 3.62Å
540L97Very high95.8Very high4 Ų463.1 Ų63.12%0.02129%0.29CS..Hα-helixtrans-61.8-33.1-178.7-63.6177000112.1I476 Y523 P527 S536 L537 F543 Y544 F545I476-L540 HydrophobicContact CG2-CD1 3.84Å; Y523-L540 HydrophobicContact CD2-CD2 4.48Å; Y523-L540 HydrophobicContact CE1-CD2 3.98Å; Y523-L540 HydrophobicContact CE2-CD2 3.68Å; Y523-L540 VanDerWaalsContact CZ-CD2 3.41Å; Y523-L540 WeakPolarHBondContact OH-CD2 3.46Å; P527-L540 HydrophobicContact CG-CD2 4.25Å; S536-L540 VanDerWaalsContact O-CG 3.3Å; S536-L540 WeakPolarHBondContact O-CG 3.26Å; S536-L540 PolarHBondContact O-N 2.92Å; L537-L540 HydrophobicContact CD2-CD1 4.49Å; L537-L540 PolarHBondContact O-N 3.45Å; L540-F543 CarbonylContact O-C 3.58Å; L540-F543 PolarHBondContact O-N 3.42Å; L540-Y544 PolarHBondContact O-N 2.94Å; L540-F545 HydrophobicContact CB-CD1 3.88Å; L540-F545 HydrophobicContact CB-CE1 3.41Å; L540-F545 VanDerWaalsContact CB-CE1 3.41Å; L540-F545 HydrophobicContact CB-CE2 4.44Å; L540-F545 HydrophobicContact CB-CZ 3.72Å; L540-F545 HydrophobicContact CD1-CD1 4.47Å; L540-F545 HydrophobicContact CD1-CE1 3.86Å; L540-F545 HydrophobicContact CG-CE1 4.29Å; L540-F545 PolarHBondContact O-N 2.87Å; L540-F545 VanDerWaalsContact O-N 3.08Å
541R96.3Very high95.9Very high187 Ų18762.3 Ų62.371%0.70629%0.286SS*.Hα-helixtrans-68.9-33174.6-173.6177.4179.4174.1-0113.1L537 K538 F539 F543 Y544 F545L537-R541 WeakPolarHBondContact O-CB 3.26Å; L537-R541 PolarHBondContact O-N 3.4Å; K538-R541 WeakPolarHBondContact O-CB 3.41Å; K538-R541 PolarHBondContact O-N 2.73Å; F539-R541 PolarHBondContact O-N 3.02Å; R541-F543 PolarHBondContact O-N 3.07Å; R541-Y544 WeakPolarHBondContact O-CA 3.34Å; R541-Y544 PolarHBondContact O-N 2.9Å; R541-F545 HydrophobicContact CB-CE2 3.94Å
542V94.3Very high96.1Very high15 Ų1565.2 Ų65.29%0.09130%0.304CS..Hα-helixtrans-60.2-26175.6173.40000111.9F358 T359 R366 K538 F539F358-V542 HydrophobicContact CD1-CG1 4.21Å; F358-V542 HydrophobicContact CE1-CG1 3.75Å; T359-V542 HydrophobicContact CG2-CG2 4.12Å; R366-V542 PolarHBondContact NH1-O 2.9Å; K538-V542 WeakPolarHBondContact O-CG2 3.31Å; K538-V542 PolarHBondContact O-N 3.4Å; K538-V542 VanDerWaalsContact O-N 3.13Å; F539-V542 WeakPolarHBondContact O-CB 3.4Å; F539-V542 PolarHBondContact O-N 3.35Å
543F95.8Very high96.4Very high19 Ų1964.2 Ų64.28%0.08331%0.305CS..THydrogen-bonded Turntrans-104.717.9173.2-64.6-83.6000113.2M363 R366 I367 V370 Y523 F539 L540 R541 F545 I546M363-F543 HydrophobicContact SD-CD1 3.76Å; M363-F543 HydrophobicContact SD-CE1 4.03Å; R366-F543 HydrophobicContact CB-CE1 4.08Å; R366-F543 HydrophobicContact CB-CZ 3.97Å; I367-F543 HydrophobicContact CG1-CE1 3.9Å; V370-F543 HydrophobicContact CG2-CE2 4.16Å; V370-F543 HydrophobicContact CG2-CZ 3.9Å; Y523-F543 HydrophobicContact CD2-CB 4.15Å; Y523-F543 HydrophobicContact CD2-CD2 4.22Å; Y523-F543 HydrophobicContact CD2-CG 4.22Å; Y523-F543 HydrophobicContact CE2-CB 3.78Å; Y523-F543 HydrophobicContact CE2-CD2 4.34Å; Y523-F543 HydrophobicContact CE2-CG 4.29Å; F539-F543 HydrophobicContact CD2-CE2 4.26Å; F539-F543 HydrophobicContact CE1-CD2 4.27Å; F539-F543 HydrophobicContact CE1-CE2 4.38Å; F539-F543 HydrophobicContact CE2-CD2 4.18Å; F539-F543 AromaticContact CE2-CE2 3.56Å; F539-F543 HydrophobicContact CE2-CE2 3.56Å; F539-F543 AromaticContact CZ-CD2 3.95Å; F539-F543 HydrophobicContact CZ-CD2 3.95Å; F539-F543 AromaticContact CZ-CE2 3.62Å; F539-F543 HydrophobicContact CZ-CE2 3.62Å; L540-F543 CarbonylContact O-C 3.58Å; L540-F543 PolarHBondContact O-N 3.42Å; R541-F543 PolarHBondContact O-N 3.07Å; F543-F545 PolarHBondContact O-N 3.02Å; F543-I546 WeakPolarHBondContact O-CG1 3.19Å; F543-I546 PolarHBondContact O-N 3.33Å
544Y95.5Very high96.4Very high144 Ų14460.7 Ų60.757%0.56529%0.291SS*.THydrogen-bonded Turntrans51.926.8176.6-50.3-78000114.9M363 L540 R541 I546M363-Y544 HydrophobicContact CE-CD2 3.9Å; M363-Y544 HydrophobicContact CE-CE2 3.81Å; L540-Y544 PolarHBondContact O-N 2.94Å; R541-Y544 WeakPolarHBondContact O-CA 3.34Å; R541-Y544 PolarHBondContact O-N 2.9Å; Y544-I546 HydrophobicContact CD2-CD1 4.31Å; Y544-I546 PolarHBondContact O-N 3.49Å
545F96.9Very high96.3Very high71 Ų7153.4 Ų53.431%0.31126%0.264SS..THydrogen-bonded Turntrans5520.2-173.8-61.8-94.2000114.8L537 L540 R541 F543 H548 L549L537-F545 HydrophobicContact CD2-CE1 4.5Å; L537-F545 HydrophobicContact CD2-CZ 4.39Å; L540-F545 HydrophobicContact CB-CD1 3.88Å; L540-F545 HydrophobicContact CB-CE1 3.41Å; L540-F545 VanDerWaalsContact CB-CE1 3.41Å; L540-F545 HydrophobicContact CB-CE2 4.44Å; L540-F545 HydrophobicContact CB-CZ 3.72Å; L540-F545 HydrophobicContact CD1-CD1 4.47Å; L540-F545 HydrophobicContact CD1-CE1 3.86Å; L540-F545 HydrophobicContact CG-CE1 4.29Å; L540-F545 PolarHBondContact O-N 2.87Å; L540-F545 VanDerWaalsContact O-N 3.08Å; R541-F545 HydrophobicContact CB-CE2 3.94Å; F543-F545 PolarHBondContact O-N 3.02Å; F545-H548 HydrophobicContact CB-CB 4.43Å; F545-H548 WeakPolarHBondContact O-CA 3.5Å; F545-H548 WeakPolarHBondContact O-CB 3.43Å; F545-H548 PolarHBondContact O-N 3.32Å; F545-L549 HydrophobicContact CB-CG 4.41Å; F545-L549 WeakPolarHBondContact O-CG 3.31Å; F545-L549 PolarHBondContact O-N 3Å
546I96.8Very high96.2Very high77 Ų7755.3 Ų55.340%0.39528%0.277SS..Hα-helixtrans-52-49.1-173.2-71.5165.3000112.6F543 Y544 H548 L549 I550F543-I546 WeakPolarHBondContact O-CG1 3.19Å; F543-I546 PolarHBondContact O-N 3.33Å; Y544-I546 HydrophobicContact CD2-CD1 4.31Å; Y544-I546 PolarHBondContact O-N 3.49Å; I546-H548 VanDerWaalsContact C-N 3.31Å; I546-H548 PolarHBondContact O-N 2.93Å; I546-L549 PolarHBondContact O-N 2.87Å; I546-I550 HydrophobicContact CG2-CD1 3.62Å; I546-I550 HydrophobicContact CG2-CG1 4.32Å; I546-I550 WeakPolarHBondContact O-CG1 3.39Å; I546-I550 PolarHBondContact O-N 3.31Å
547P96.7Very high96Very high32 Ų3261.3 Ų61.321%0.20831%0.308CS..Hα-helixtrans-63.5-34.4179.4-25.137.3000113.6F484 Y523 A551F484-P547 HydrophobicContact CE1-CB 4.32Å; F484-P547 WeakPolarHBondContact CE1-O 3.45Å; F484-P547 HydrophobicContact CZ-CB 4.04Å; Y523-P547 HydrophobicContact CD1-CB 3.63Å; Y523-P547 HydrophobicContact CD1-CG 3.54Å; Y523-P547 HydrophobicContact CD2-CG 4.11Å; Y523-P547 HydrophobicContact CE1-CB 3.59Å; Y523-P547 HydrophobicContact CE1-CG 3.62Å; Y523-P547 HydrophobicContact CE2-CG 4.21Å; Y523-P547 HydrophobicContact CG-CB 4.35Å; Y523-P547 HydrophobicContact CG-CG 3.77Å; P547-A551 VanDerWaalsContact O-CB 3.29Å; P547-A551 WeakPolarHBondContact O-CB 3.15Å; P547-A551 PolarHBondContact O-N 3.41Å
548H97.9Very high95.7Very high33 Ų3361.6 Ų61.615%0.15331%0.305CS..Hα-helixtrans-67.2-47.3174.6-71.995.6000111.6S480 F484 Y523 F545 I546 I550 A551 V552S480-H548 PolarHBondContact OG-NE2 2.96Å; F484-H548 AromaticContact CZ-CD2 3.92Å; F484-H548 AromaticContact CZ-CE1 3.91Å; F484-H548 AromaticContact CZ-NE2 3.79Å; Y523-H548 AromaticContact CE1-CE1 3.45Å; Y523-H548 VanDerWaalsContact CE1-CE1 3.45Å; Y523-H548 WeakPolarHBondContact CE1-CE1 3.31Å; Y523-H548 AromaticContact CE1-ND1 3.35Å; Y523-H548 WeakPolarHBondContact CE1-ND1 3.27Å; Y523-H548 AromaticContact CZ-CE1 3.84Å; Y523-H548 AromaticContact CZ-ND1 3.53Å; Y523-H548 PolarHBondContact OH-CE1 3.4Å; Y523-H548 PolarHBondContact OH-ND1 3.24Å; F545-H548 HydrophobicContact CB-CB 4.43Å; F545-H548 WeakPolarHBondContact O-CA 3.5Å; F545-H548 WeakPolarHBondContact O-CB 3.43Å; F545-H548 PolarHBondContact O-N 3.32Å; I546-H548 VanDerWaalsContact C-N 3.31Å; I546-H548 PolarHBondContact O-N 2.93Å; H548-I550 VanDerWaalsContact C-N 3.35Å; H548-I550 PolarHBondContact O-N 2.98Å; H548-A551 PolarHBondContact O-N 2.74Å; H548-V552 WeakPolarHBondContact O-CG2 3.26Å; H548-V552 PolarHBondContact O-N 3.36Å
549L97.6Very high95.4Very high117 Ų11764 Ų6461%0.61332%0.316SS*.Hα-helixtrans-61.3-43.1179.1-66.1174.7000111.5F545 I546 G553F545-L549 HydrophobicContact CB-CG 4.41Å; F545-L549 WeakPolarHBondContact O-CG 3.31Å; F545-L549 PolarHBondContact O-N 3Å; I546-L549 PolarHBondContact O-N 2.87Å; L549-G553 PolarHBondContact O-N 3.46Å
550I96.4Very high95.1Very high99 Ų9970.3 Ų70.351%0.50834%0.344SS..Hα-helixtrans-62.4-45.5175.2-68.8170.9000110.7I546 H548 G553 I554I546-I550 HydrophobicContact CG2-CD1 3.62Å; I546-I550 HydrophobicContact CG2-CG1 4.32Å; I546-I550 WeakPolarHBondContact O-CG1 3.39Å; I546-I550 PolarHBondContact O-N 3.31Å; H548-I550 VanDerWaalsContact C-N 3.35Å; H548-I550 PolarHBondContact O-N 2.98Å; I550-G553 PolarHBondContact O-N 2.87Å; I550-I554 HydrophobicContact CG2-CD1 3.75Å; I550-I554 HydrophobicContact CG2-CG1 4.39Å; I550-I554 WeakPolarHBondContact O-CG1 3.39Å; I550-I554 PolarHBondContact O-N 3.18Å
551A97Very high94.7Very high3 Ų375.4 Ų75.43%0.02537%0.366CS..Hα-helixtrans-62.9-47.5-179.400000112.2L483 F484 T487 P547 H548 G553 I554 L555L483-A551 HydrophobicContact CD1-CB 4.41Å; L483-A551 HydrophobicContact CD2-CB 3.96Å; L483-A551 HydrophobicContact CG-CB 3.9Å; F484-A551 HydrophobicContact CD1-CB 3.73Å; F484-A551 HydrophobicContact CE1-CB 3.85Å; T487-A551 HydrophobicContact CG2-CB 4.12Å; P547-A551 VanDerWaalsContact O-CB 3.29Å; P547-A551 WeakPolarHBondContact O-CB 3.15Å; P547-A551 PolarHBondContact O-N 3.41Å; H548-A551 PolarHBondContact O-N 2.74Å; A551-G553 VanDerWaalsContact C-N 3.33Å; A551-G553 PolarHBondContact O-N 2.87Å; A551-I554 PolarHBondContact O-N 2.93Å; A551-L555 WeakPolarHBondContact O-CG 3.36Å; A551-L555 PolarHBondContact O-N 3.13Å
552V96.9Very high94.3Very high75 Ų7568.5 Ų68.546%0.45534%0.344SS..Hα-helixtrans-61-43.2174.3173.60000110.6L483 H548 I554 L555 S556L483-V552 HydrophobicContact CD1-CG2 4.37Å; L483-V552 HydrophobicContact CD2-CG2 4.2Å; H548-V552 WeakPolarHBondContact O-CG2 3.26Å; H548-V552 PolarHBondContact O-N 3.36Å; V552-I554 PolarHBondContact O-N 2.87Å; V552-L555 PolarHBondContact O-N 2.96Å; V552-S556 WeakPolarHBondContact O-CB 3.41Å; V552-S556 PolarHBondContact O-N 2.7Å; V552-S556 PolarHBondContact O-OG 3.25Å
553G96.6Very high94Very high29 Ų2974.7 Ų74.730%0.29937%0.367SS..Hα-helixtrans-58.1-48.5176.700000113.2L549 I550 A551 L555 S556 I557L549-G553 PolarHBondContact O-N 3.46Å; I550-G553 PolarHBondContact O-N 2.87Å; A551-G553 VanDerWaalsContact C-N 3.33Å; A551-G553 PolarHBondContact O-N 2.87Å; G553-L555 PolarHBondContact O-N 3.15Å; G553-S556 PolarHBondContact O-N 3.43Å; G553-I557 VanDerWaalsContact O-CG1 3.26Å; G553-I557 WeakPolarHBondContact O-CG1 3.36Å; G553-I557 PolarHBondContact O-N 3.04Å
554I94.8Very high93.6Very high42 Ų4277.6 Ų77.622%0.21538%0.383CS..Hα-helixtrans-61.6-45.1177.6-69.4167.9000110.9T487 W491 I550 A551 V552 I557 Y558T487-I554 HydrophobicContact CG2-CB 3.93Å; T487-I554 HydrophobicContact CG2-CD1 3.89Å; T487-I554 HydrophobicContact CG2-CG2 3.86Å; W491-I554 HydrophobicContact CE3-CD1 3.99Å; W491-I554 HydrophobicContact CZ3-CD1 4.35Å; I550-I554 HydrophobicContact CG2-CD1 3.75Å; I550-I554 HydrophobicContact CG2-CG1 4.39Å; I550-I554 WeakPolarHBondContact O-CG1 3.39Å; I550-I554 PolarHBondContact O-N 3.18Å; A551-I554 PolarHBondContact O-N 2.93Å; V552-I554 PolarHBondContact O-N 2.87Å; I554-I557 PolarHBondContact O-N 3.26Å; I554-Y558 PolarHBondContact O-N 3.43Å
555L93.7Very high93.1Very high15 Ų1576.2 Ų76.28%0.07938%0.383CS..Hα-helixtrans-62.8-45.6177.2-70.2-177.8000111.5L483 L490 A551 V552 G553 I557 Y558 F559L483-L555 HydrophobicContact CD1-CD1 3.41Å; L483-L555 VanDerWaalsContact CD1-CD1 3.41Å; L490-L555 HydrophobicContact CD1-CD2 3.28Å; A551-L555 WeakPolarHBondContact O-CG 3.36Å; A551-L555 PolarHBondContact O-N 3.13Å; V552-L555 PolarHBondContact O-N 2.96Å; G553-L555 PolarHBondContact O-N 3.15Å; L555-I557 PolarHBondContact O-N 2.99Å; L555-Y558 PolarHBondContact O-N 2.92Å; L555-Y558 VanDerWaalsContact O-N 3.17Å; L555-F559 HydrophobicContact CB-CD2 4.24Å; L555-F559 HydrophobicContact CB-CE2 4.18Å; L555-F559 WeakPolarHBondContact O-CD2 3.06Å; L555-F559 PolarHBondContact O-N 3.08Å
556S93.7Very high92.5Very high66 Ų6678.9 Ų78.946%0.46239%0.394SS..Hα-helixtrans-60.8-44.2178.4-67.20000112.1V552 G553 Y558 F559 F560V552-S556 WeakPolarHBondContact O-CB 3.41Å; V552-S556 PolarHBondContact O-N 2.7Å; V552-S556 PolarHBondContact O-OG 3.25Å; G553-S556 PolarHBondContact O-N 3.43Å; S556-Y558 VanDerWaalsContact C-N 3.3Å; S556-Y558 PolarHBondContact O-N 3.3Å; S556-F559 PolarHBondContact O-N 2.91Å; S556-F560 VanDerWaalsContact O-CB 3.27Å; S556-F560 WeakPolarHBondContact O-CB 3.4Å; S556-F560 PolarHBondContact O-N 3.39Å
557I93Very high91.9Very high126 Ų12679.8 Ų79.865%0.64640%0.399SS*.Hα-helixtrans-59.3-43.7174.7-69164.3000110.5G553 I554 L555 K561G553-I557 VanDerWaalsContact O-CG1 3.26Å; G553-I557 WeakPolarHBondContact O-CG1 3.36Å; G553-I557 PolarHBondContact O-N 3.04Å; I554-I557 PolarHBondContact O-N 3.26Å; L555-I557 PolarHBondContact O-N 2.99Å; I557-K561 WeakPolarHBondContact O-CB 3.19Å; I557-K561 PolarHBondContact O-N 2.75Å
558Y89.9Confident91.2Very high65 Ų6581.1 Ų81.126%0.25541%0.409SS..Hα-helixtrans-67-46.4178.6179.9-99.8000112.4L490 H494 I554 L555 S556 F560 K561 V562L490-Y558 HydrophobicContact CD1-CD1 3.95Å; L490-Y558 HydrophobicContact CD1-CE1 4.38Å; L490-Y558 HydrophobicContact CD1-CG 4.32Å; L490-Y558 HydrophobicContact CD2-CD1 3.85Å; L490-Y558 HydrophobicContact CD2-CD2 4.19Å; L490-Y558 HydrophobicContact CD2-CE1 3.6Å; L490-Y558 HydrophobicContact CD2-CE2 3.97Å; L490-Y558 HydrophobicContact CD2-CG 4.12Å; H494-Y558 AromaticContact CD2-CE2 3.93Å; H494-Y558 AromaticContact CE1-CE2 3.98Å; H494-Y558 AromaticContact NE2-CD2 3.8Å; H494-Y558 AromaticContact NE2-CE2 3.19Å; H494-Y558 WeakPolarHBondContact NE2-CE2 3.26Å; I554-Y558 PolarHBondContact O-N 3.43Å; L555-Y558 PolarHBondContact O-N 2.92Å; L555-Y558 VanDerWaalsContact O-N 3.17Å; S556-Y558 VanDerWaalsContact C-N 3.3Å; S556-Y558 PolarHBondContact O-N 3.3Å; Y558-F560 VanDerWaalsContact C-N 3.3Å; Y558-F560 PolarHBondContact O-N 2.99Å; Y558-K561 PolarHBondContact O-N 2.96Å; Y558-V562 HydrophobicContact CD1-CG2 4.18Å; Y558-V562 HydrophobicContact CD2-CG2 4.48Å; Y558-V562 HydrophobicContact CE1-CG2 3.66Å; Y558-V562 HydrophobicContact CE2-CG2 3.98Å; Y558-V562 WeakPolarHBondContact O-CG2 3.49Å; Y558-V562 PolarHBondContact O-N 3.4Å
559F89.2Confident90.4Very high126 Ų12685 Ų8555%0.55343%0.431SS*.Hα-helixtrans-60-42.1176.5-79.7-62.5000111.4L555 S556 V562 Y563L555-F559 HydrophobicContact CB-CD2 4.24Å; L555-F559 HydrophobicContact CB-CE2 4.18Å; L555-F559 WeakPolarHBondContact O-CD2 3.06Å; L555-F559 PolarHBondContact O-N 3.08Å; S556-F559 PolarHBondContact O-N 2.91Å; F559-V562 PolarHBondContact O-N 2.89Å; F559-Y563 VanDerWaalsContact O-CB 3.27Å; F559-Y563 WeakPolarHBondContact O-CB 3.37Å; F559-Y563 PolarHBondContact O-N 3.42Å
560F90.7Very high89.7Confident131 Ų13185.9 Ų85.958%0.57543%0.429SS*.Hα-helixtrans-64.6-41.8175.7-170.1-109.6000112S556 Y558 Y563 I564S556-F560 VanDerWaalsContact O-CB 3.27Å; S556-F560 WeakPolarHBondContact O-CB 3.4Å; S556-F560 PolarHBondContact O-N 3.39Å; Y558-F560 VanDerWaalsContact C-N 3.3Å; Y558-F560 PolarHBondContact O-N 2.99Å; F560-Y563 PolarHBondContact O-N 3.46Å; F560-I564 HydrophobicContact CD1-CD1 3.64Å; F560-I564 HydrophobicContact CD1-CG1 4.42Å; F560-I564 HydrophobicContact CE1-CD1 3.21Å; F560-I564 HydrophobicContact CE1-CG1 4.18Å; F560-I564 HydrophobicContact CE2-CD1 4.38Å; F560-I564 HydrophobicContact CG-CD1 4.41Å; F560-I564 HydrophobicContact CZ-CD1 3.63Å; F560-I564 HydrophobicContact CZ-CG1 4.26Å; F560-I564 WeakPolarHBondContact O-CG1 3.49Å; F560-I564 PolarHBondContact O-N 3.13Å
561K88.9Confident88.8Confident112 Ų11288.6 Ų88.649%0.48744%0.435SS..Hα-helixtrans-59.9-47.4173.5-177.9180178.2177.90111.9I557 Y558 Y563 I564 M565I557-K561 WeakPolarHBondContact O-CB 3.19Å; I557-K561 PolarHBondContact O-N 2.75Å; Y558-K561 PolarHBondContact O-N 2.96Å; K561-Y563 VanDerWaalsContact C-N 3.32Å; K561-Y563 PolarHBondContact O-N 2.86Å; K561-I564 PolarHBondContact O-N 3.12Å; K561-M565 HydrophobicContact CG-SD 4.24Å; K561-M565 WeakPolarHBondContact O-CB 3.43Å; K561-M565 VanDerWaalsContact O-CG 3.3Å; K561-M565 WeakPolarHBondContact O-CG 3.35Å; K561-M565 PolarHBondContact O-N 3.09Å
562V87.7Confident87.7Confident42 Ų4293.9 Ų93.926%0.25546%0.459SS..Hα-helixtrans-64-39.9177.6172.40000110.9Y558 F559 M565 K566Y558-V562 HydrophobicContact CD1-CG2 4.18Å; Y558-V562 HydrophobicContact CD2-CG2 4.48Å; Y558-V562 HydrophobicContact CE1-CG2 3.66Å; Y558-V562 HydrophobicContact CE2-CG2 3.98Å; Y558-V562 WeakPolarHBondContact O-CG2 3.49Å; Y558-V562 PolarHBondContact O-N 3.4Å; F559-V562 PolarHBondContact O-N 2.89Å; V562-M565 PolarHBondContact O-N 2.92Å; V562-K566 HydrophobicContact CG1-CD 4.39Å; V562-K566 WeakPolarHBondContact O-CB 3.46Å; V562-K566 WeakPolarHBondContact O-CG 3.35Å; V562-K566 PolarHBondContact O-N 2.9Å
563Y87.5Confident86.7Confident144 Ų14494.1 Ų94.157%0.56546%0.46SS*.Hα-helixtrans-61.6-49.3176179.8-100000111.7F559 F560 K561 M565 K566 L567F559-Y563 VanDerWaalsContact O-CB 3.27Å; F559-Y563 WeakPolarHBondContact O-CB 3.37Å; F559-Y563 PolarHBondContact O-N 3.42Å; F560-Y563 PolarHBondContact O-N 3.46Å; K561-Y563 VanDerWaalsContact C-N 3.32Å; K561-Y563 PolarHBondContact O-N 2.86Å; Y563-M565 PolarHBondContact O-N 3.17Å; Y563-K566 PolarHBondContact O-N 3.49Å; Y563-L567 WeakPolarHBondContact O-CB 3.49Å; Y563-L567 PolarHBondContact O-N 3.42Å
564I88Confident85.8Confident81 Ų8196.3 Ų96.342%0.41547%0.465SS..Hα-helixtrans-60.2-44.3175.1-71.3175.3000111.2F560 K561 K566 L567 S568F560-I564 HydrophobicContact CD1-CD1 3.64Å; F560-I564 HydrophobicContact CD1-CG1 4.42Å; F560-I564 HydrophobicContact CE1-CD1 3.21Å; F560-I564 HydrophobicContact CE1-CG1 4.18Å; F560-I564 HydrophobicContact CE2-CD1 4.38Å; F560-I564 HydrophobicContact CG-CD1 4.41Å; F560-I564 HydrophobicContact CZ-CD1 3.63Å; F560-I564 HydrophobicContact CZ-CG1 4.26Å; F560-I564 WeakPolarHBondContact O-CG1 3.49Å; F560-I564 PolarHBondContact O-N 3.13Å; K561-I564 PolarHBondContact O-N 3.12Å; I564-K566 VanDerWaalsContact C-N 3.34Å; I564-K566 PolarHBondContact O-N 3.27Å; I564-L567 PolarHBondContact O-N 2.87Å; I564-S568 WeakPolarHBondContact O-CB 3.29Å; I564-S568 PolarHBondContact O-N 2.9Å
565M85.4Confident84.9Confident115 Ų11597.6 Ų97.657%0.56747%0.471SS*.Hα-helixtrans-61.3-42.8178.2-75179.469.200111.5K561 V562 Y563 L567 S568 L569K561-M565 HydrophobicContact CG-SD 4.24Å; K561-M565 WeakPolarHBondContact O-CB 3.43Å; K561-M565 VanDerWaalsContact O-CG 3.3Å; K561-M565 WeakPolarHBondContact O-CG 3.35Å; K561-M565 PolarHBondContact O-N 3.09Å; V562-M565 PolarHBondContact O-N 2.92Å; Y563-M565 PolarHBondContact O-N 3.17Å; M565-L567 VanDerWaalsContact C-N 3.34Å; M565-S568 PolarHBondContact O-N 3.17Å; M565-L569 WeakPolarHBondContact O-CB 3.3Å; M565-L569 PolarHBondContact O-N 2.96Å
566K84.5Confident83.9Confident127 Ų127104 Ų10455%0.55250%0.499SS*.Hα-helixtrans-63.9-39.3174.8-76.9-175.7175.6-171.20112.1V562 Y563 I564 L569 K570V562-K566 HydrophobicContact CG1-CD 4.39Å; V562-K566 WeakPolarHBondContact O-CB 3.46Å; V562-K566 WeakPolarHBondContact O-CG 3.35Å; V562-K566 PolarHBondContact O-N 2.9Å; Y563-K566 PolarHBondContact O-N 3.49Å; I564-K566 VanDerWaalsContact C-N 3.34Å; I564-K566 PolarHBondContact O-N 3.27Å; K566-L569 PolarHBondContact O-N 3.02Å; K566-K570 WeakPolarHBondContact O-CB 3.49Å; K566-K570 PolarHBondContact O-N 3.01Å
567L83.9Confident82.9Confident95 Ų95109 Ų10950%0.49751%0.507SS..Hα-helixtrans-66.8-42.5177.4-16175.9000111.6Y563 I564 M565 K570 Y571Y563-L567 WeakPolarHBondContact O-CB 3.49Å; Y563-L567 PolarHBondContact O-N 3.42Å; I564-L567 PolarHBondContact O-N 2.87Å; M565-L567 VanDerWaalsContact C-N 3.34Å; L567-K570 WeakPolarHBondContact O-CB 3.4Å; L567-K570 PolarHBondContact O-N 3.2Å; L567-Y571 WeakPolarHBondContact O-CB 3.31Å; L567-Y571 PolarHBondContact O-N 3.1Å
568S82.5Confident82.1Confident61 Ų61109.6 Ų109.643%0.42751%0.506SS..Hα-helixtrans-65.1-42175.1178.10000111.9I564 M565 K570 Y571 Q572I564-S568 WeakPolarHBondContact O-CB 3.29Å; I564-S568 PolarHBondContact O-N 2.9Å; M565-S568 PolarHBondContact O-N 3.17Å; S568-K570 VanDerWaalsContact C-N 3.33Å; S568-K570 PolarHBondContact O-N 2.68Å; S568-Y571 PolarHBondContact O-N 3.27Å; S568-Q572 PolarHBondContact O-N 3.47Å
569L80.9Confident81.3Confident114 Ų114110.9 Ų110.960%0.59752%0.517SS*.Hα-helixtrans-62.5-43.2174.8-143.793.5000110.9M565 K566 Q572 V573M565-L569 WeakPolarHBondContact O-CB 3.3Å; M565-L569 PolarHBondContact O-N 2.96Å; K566-L569 PolarHBondContact O-N 3.02Å; L569-Q572 PolarHBondContact O-N 3.06Å; L569-V573 VanDerWaalsContact O-CG2 3.28Å; L569-V573 WeakPolarHBondContact O-CG2 3.34Å; L569-V573 PolarHBondContact O-N 2.97Å
570K81.9Confident80.5Confident135 Ų135111.9 Ų111.959%0.58752%0.518SS*.Hα-helixtrans-59.8-46.1174.5-171.7-179.5178.1-173.90110.9K566 L567 S568 Q572 V573 D574K566-K570 WeakPolarHBondContact O-CB 3.49Å; K566-K570 PolarHBondContact O-N 3.01Å; L567-K570 WeakPolarHBondContact O-CB 3.4Å; L567-K570 PolarHBondContact O-N 3.2Å; S568-K570 VanDerWaalsContact C-N 3.33Å; S568-K570 PolarHBondContact O-N 2.68Å; K570-Q572 PolarHBondContact O-N 3.45Å; K570-V573 PolarHBondContact O-N 3.28Å; K570-D574 WeakPolarHBondContact O-CB 3.45Å; K570-D574 PolarHBondContact O-N 3.35Å
571Y77.6Confident79.7Confident157 Ų157109.6 Ų109.662%0.61651%0.512SS*.Hα-helixtrans-63.4-40.1177.6-169.3-107.3000113L567 S568 D574 I575L567-Y571 WeakPolarHBondContact O-CB 3.31Å; L567-Y571 PolarHBondContact O-N 3.1Å; S568-Y571 PolarHBondContact O-N 3.27Å; Y571-D574 PolarHBondContact O-N 2.97Å; Y571-I575 HydrophobicContact CD1-CD1 3.62Å; Y571-I575 HydrophobicContact CD1-CG1 4.38Å; Y571-I575 HydrophobicContact CE1-CD1 3.27Å; Y571-I575 HydrophobicContact CE1-CG1 4.13Å; Y571-I575 HydrophobicContact CG-CD1 4.48Å; Y571-I575 WeakPolarHBondContact O-CG1 3.47Å; Y571-I575 PolarHBondContact O-N 3.17Å
572Q73.8Confident79.1Confident113 Ų113109.9 Ų109.953%0.52851%0.513SS..Hα-helixtrans-66.5-37.1174.4-76.4-160.4-9.200112.8S568 L569 K570 K576S568-Q572 PolarHBondContact O-N 3.47Å; L569-Q572 PolarHBondContact O-N 3.06Å; K570-Q572 PolarHBondContact O-N 3.45Å; Q572-K576 WeakPolarHBondContact O-CB 3.28Å; Q572-K576 WeakPolarHBondContact O-CG 3.32Å; Q572-K576 PolarHBondContact O-N 2.88Å
573V76.6Confident78.2Confident81 Ų81110.7 Ų110.749%0.49152%0.521SS..Hα-helixtrans-66.3-41.5173.7171.90000110.3L569 K570 K576 R577L569-V573 VanDerWaalsContact O-CG2 3.28Å; L569-V573 WeakPolarHBondContact O-CG2 3.34Å; L569-V573 PolarHBondContact O-N 2.97Å; K570-V573 PolarHBondContact O-N 3.28Å; V573-K576 PolarHBondContact O-N 3.18Å; V573-R577 WeakPolarHBondContact O-CB 3.22Å; V573-R577 PolarHBondContact O-N 2.99Å
574D77.5Confident77.4Confident75 Ų75106.8 Ų106.840%0.40151%0.51SS..Hα-helixtrans-65.8-40.5177.6-68-25000111.8K570 Y571 R577 F578K570-D574 WeakPolarHBondContact O-CB 3.45Å; K570-D574 PolarHBondContact O-N 3.35Å; Y571-D574 PolarHBondContact O-N 2.97Å; D574-R577 WeakPolarHBondContact O-CB 3.41Å; D574-R577 PolarHBondContact O-N 3.25Å; D574-F578 WeakPolarHBondContact O-CB 3.48Å; D574-F578 PolarHBondContact O-N 2.92Å
575I76.4Confident76.6Confident68 Ų68108.3 Ų108.335%0.34952%0.519SS..Hα-helixtrans-62.9-48.7172.9-71.5169.1000111.1Y571 R577 F578 D579Y571-I575 HydrophobicContact CD1-CD1 3.62Å; Y571-I575 HydrophobicContact CD1-CG1 4.38Å; Y571-I575 HydrophobicContact CE1-CD1 3.27Å; Y571-I575 HydrophobicContact CE1-CG1 4.13Å; Y571-I575 HydrophobicContact CG-CD1 4.48Å; Y571-I575 WeakPolarHBondContact O-CG1 3.47Å; Y571-I575 PolarHBondContact O-N 3.17Å; I575-R577 PolarHBondContact O-N 3.35Å; I575-F578 WeakPolarHBondContact O-CB 3.42Å; I575-F578 PolarHBondContact O-N 3.43Å; I575-F578 VanDerWaalsContact O-N 3.08Å; I575-D579 PolarHBondContact O-N 3.48Å
576K72.8Confident75.9Confident151 Ų151106.9 Ų106.966%0.65751%0.514SS*.Hα-helixtrans-60.3-33.7178.3-77.6-177.5178.5-177.20111.9Q572 V573 Y580Q572-K576 WeakPolarHBondContact O-CB 3.28Å; Q572-K576 WeakPolarHBondContact O-CG 3.32Å; Q572-K576 PolarHBondContact O-N 2.88Å; V573-K576 PolarHBondContact O-N 3.18Å; K576-Y580 VanDerWaalsContact O-CB 3.27Å; K576-Y580 WeakPolarHBondContact O-CB 3.38Å; K576-Y580 PolarHBondContact O-N 2.91Å; K576-Y580 VanDerWaalsContact O-N 3.07Å
577R72.5Confident75.1Confident169 Ų169107.3 Ų107.364%0.63852%0.515SS*.Hα-helixtrans-68.6-44.2174.4-159.9175.3-165171.33.5111.3V573 D574 I575 Y580 D581V573-R577 WeakPolarHBondContact O-CB 3.22Å; V573-R577 PolarHBondContact O-N 2.99Å; D574-R577 WeakPolarHBondContact O-CB 3.41Å; D574-R577 PolarHBondContact O-N 3.25Å; I575-R577 PolarHBondContact O-N 3.35Å; R577-Y580 PolarHBondContact O-N 3.36Å; R577-D581 VanDerWaalsContact O-CG 3.26Å; R577-D581 PolarHBondContact O-N 3.01Å
578F76.1Confident74.3Confident139 Ų139106.8 Ų106.861%0.6152%0.518SS*.Hα-helixtrans-63.2-43.3176.2-172-95.1000112.9D574 I575 Y580 D581 K582D574-F578 WeakPolarHBondContact O-CB 3.48Å; D574-F578 PolarHBondContact O-N 2.92Å; I575-F578 WeakPolarHBondContact O-CB 3.42Å; I575-F578 PolarHBondContact O-N 3.43Å; I575-F578 VanDerWaalsContact O-N 3.08Å; F578-Y580 VanDerWaalsContact C-N 3.33Å; F578-Y580 PolarHBondContact O-N 2.61Å; F578-D581 PolarHBondContact O-N 3.49Å; F578-K582 HydrophobicContact CE1-CD 4.41Å; F578-K582 WeakPolarHBondContact O-CB 3.27Å; F578-K582 PolarHBondContact O-N 2.97Å
579D73.2Confident73.5Confident93 Ų93112.3 Ų112.350%0.49753%0.53SS..Hα-helixtrans-66.1-36.1176.2-74.7-24.8000111.9I575 S583I575-D579 PolarHBondContact O-N 3.48Å; D579-S583 VanDerWaalsContact O-CB 3.29Å; D579-S583 WeakPolarHBondContact O-CB 3.42Å; D579-S583 PolarHBondContact O-N 3.48Å
580Y72.2Confident72.7Confident147 Ų147114.6 Ų114.658%0.57654%0.535SS*.Hα-helixtrans-65.6-44.6174.4-174.2-94000111.8K576 R577 F578 S583 N584K576-Y580 VanDerWaalsContact O-CB 3.27Å; K576-Y580 WeakPolarHBondContact O-CB 3.38Å; K576-Y580 PolarHBondContact O-N 2.91Å; K576-Y580 VanDerWaalsContact O-N 3.07Å; R577-Y580 PolarHBondContact O-N 3.36Å; F578-Y580 VanDerWaalsContact C-N 3.33Å; F578-Y580 PolarHBondContact O-N 2.61Å; Y580-S583 PolarHBondContact O-N 2.84Å; Y580-N584 WeakPolarHBondContact CE1-ND2 3.45Å; Y580-N584 PolarHBondContact O-N 2.88Å; Y580-N584 VanDerWaalsContact O-N 3.14Å; Y580-N584 PolarHBondContact O-ND2 2.64Å
581D74.8Confident71.8Confident82 Ų82114 Ų11444%0.43954%0.538SS..Hα-helixtrans-65.8-41.6178.1-68.1-20.7000110.9R577 F578 N584 D585R577-D581 VanDerWaalsContact O-CG 3.26Å; R577-D581 PolarHBondContact O-N 3.01Å; F578-D581 PolarHBondContact O-N 3.49Å; D581-N584 PolarHBondContact O-N 3.38Å; D581-D585 PolarHBondContact O-N 3.38Å
582K74.7Confident71Confident118 Ų118109.2 Ų109.251%0.51353%0.527SS..Hα-helixtrans-65.5-39.8176.7-165.7176.2-177.4178.80113.3F578 N584 D585 D586F578-K582 HydrophobicContact CE1-CD 4.41Å; F578-K582 WeakPolarHBondContact O-CB 3.27Å; F578-K582 PolarHBondContact O-N 2.97Å; K582-N584 VanDerWaalsContact C-N 3.32Å; K582-N584 PolarHBondContact O-N 2.93Å; K582-D585 PolarHBondContact O-N 2.95Å; K582-D586 PolarHBondContact O-N 2.91Å
583S69.2Low70.4Confident60 Ų60109.1 Ų109.142%0.4253%0.529SS..Hα-helixtrans-62.7-38.1174.7175.70000112.3D579 Y580 K587D579-S583 VanDerWaalsContact O-CB 3.29Å; D579-S583 WeakPolarHBondContact O-CB 3.42Å; D579-S583 PolarHBondContact O-N 3.48Å; Y580-S583 PolarHBondContact O-N 2.84Å; S583-K587 PolarHBondContact O-N 3.3Å; S583-K587 VanDerWaalsContact O-N 3.08Å
584N70.6Confident69.5Low62 Ų62109 Ų10933%0.33253%0.531SS..Hα-helixtrans-70.6-39.4174.9-79.2-29.5000112.3Y580 D581 K582 K587 C588Y580-N584 WeakPolarHBondContact CE1-ND2 3.45Å; Y580-N584 PolarHBondContact O-N 2.88Å; Y580-N584 VanDerWaalsContact O-N 3.14Å; Y580-N584 PolarHBondContact O-ND2 2.64Å; D581-N584 PolarHBondContact O-N 3.38Å; K582-N584 VanDerWaalsContact C-N 3.32Å; K582-N584 PolarHBondContact O-N 2.93Å; N584-K587 PolarHBondContact O-N 2.94Å; N584-C588 WeakPolarHBondContact O-CB 3.43Å; N584-C588 PolarHBondContact O-N 3.11Å
585D71.3Confident68.5Low112 Ų112108.4 Ų108.460%0.59953%0.534SS*.Hα-helixtrans-63.8-41.8175.1-83.9-12.6000112.3D581 K582 C588 R589D581-D585 PolarHBondContact O-N 3.38Å; K582-D585 PolarHBondContact O-N 2.95Å; D585-C588 PolarHBondContact O-N 2.92Å; D585-R589 PolarHBondContact O-N 2.89Å
586D71Confident67.4Low86 Ų86111.3 Ų111.346%0.4655%0.55SS..Hα-helixtrans-66.8-36.5176.1-80.8-22.3000112.2K582 R589 K590K582-D586 PolarHBondContact O-N 2.91Å; D586-R589 PolarHBondContact O-N 3.16Å; D586-K590 WeakPolarHBondContact O-CG 3.14Å; D586-K590 PolarHBondContact O-N 3.18Å
587K68.7Low66.5Low136 Ų136111.7 Ų111.759%0.59155%0.554SS**Hα-helixtrans-63.7-45.2170.8-88.6-179.1177.6176.50111.6S583 N584 R589 K590 L591S583-K587 PolarHBondContact O-N 3.3Å; S583-K587 VanDerWaalsContact O-N 3.08Å; N584-K587 PolarHBondContact O-N 2.94Å; K587-R589 VanDerWaalsContact C-N 3.34Å; K587-R589 PolarHBondContact O-N 3.11Å; K587-K590 PolarHBondContact O-N 3.25Å; K587-L591 WeakPolarHBondContact O-CB 3.16Å; K587-L591 WeakPolarHBondContact O-CD1 3.47Å; K587-L591 WeakPolarHBondContact O-CG 3.33Å; K587-L591 PolarHBondContact O-N 3.37Å
588C66.1Low65.6Low83 Ų83110.6 Ų110.656%0.56156%0.56SS**Hα-helixtrans-61.8-39.5176.2-83.10000112.1N584 D585 L591 S592N584-C588 WeakPolarHBondContact O-CB 3.43Å; N584-C588 PolarHBondContact O-N 3.11Å; D585-C588 PolarHBondContact O-N 2.92Å; C588-L591 PolarHBondContact O-N 2.71Å; C588-S592 PolarHBondContact O-N 3.23Å; C588-S592 PolarHBondContact O-OG 3.04Å
589R65.3Low64.6Low178 Ų178114.8 Ų114.867%0.67257%0.572SS**Hα-helixtrans-65.9-42.4174.6-106.7-176.5-170.7-169.93.1113.2D585 D586 K587 L591 S592 I593D585-R589 PolarHBondContact O-N 2.89Å; D586-R589 PolarHBondContact O-N 3.16Å; K587-R589 VanDerWaalsContact C-N 3.34Å; K587-R589 PolarHBondContact O-N 3.11Å; R589-L591 VanDerWaalsContact C-N 3.32Å; R589-L591 PolarHBondContact O-N 3.33Å; R589-S592 PolarHBondContact O-N 3.3Å; R589-S592 PolarHBondContact O-OG 3.49Å; R589-I593 VanDerWaalsContact O-CG1 3.29Å; R589-I593 WeakPolarHBondContact O-CG1 3.41Å; R589-I593 PolarHBondContact O-N 2.91Å
590K65.2Low63.4Low162 Ų162113 Ų11370%0.70458%0.575SS**Hα-helixtrans-65.3-37.5176.8-77.2-176.6178.9-178.50111.9D586 K587 S594D586-K590 WeakPolarHBondContact O-CG 3.14Å; D586-K590 PolarHBondContact O-N 3.18Å; K587-K590 PolarHBondContact O-N 3.25Å; K590-S594 WeakPolarHBondContact O-CB 3.48Å; K590-S594 PolarHBondContact O-N 2.75Å; K590-S594 VanDerWaalsContact O-N 3.09Å
591L63.2Low62.3Low123 Ų123114.4 Ų114.464%0.64459%0.591SS**Hα-helixtrans-68.3-35.3176-73.9162000112.5K587 C588 R589 S595K587-L591 WeakPolarHBondContact O-CB 3.16Å; K587-L591 WeakPolarHBondContact O-CD1 3.47Å; K587-L591 WeakPolarHBondContact O-CG 3.33Å; K587-L591 PolarHBondContact O-N 3.37Å; C588-L591 PolarHBondContact O-N 2.71Å; R589-L591 VanDerWaalsContact C-N 3.32Å; R589-L591 PolarHBondContact O-N 3.33Å; L591-S595 PolarHBondContact O-N 3Å; L591-S595 VanDerWaalsContact O-N 3.16Å; L591-S595 PolarHBondContact O-OG 3.18Å
592S60.3Low60.7Low56 Ų56113.7 Ų113.739%0.39260%0.603SS.*Hα-helixtrans-76.6-30.2177.767.40000113.9C588 R589 S595 N596C588-S592 PolarHBondContact O-N 3.23Å; C588-S592 PolarHBondContact O-OG 3.04Å; R589-S592 PolarHBondContact O-N 3.3Å; R589-S592 PolarHBondContact O-OG 3.49Å; S592-S595 PolarHBondContact O-OG 3.09Å; S592-N596 PolarHBondContact O-N 3.42Å
593I60.2Low59.1Low111 Ų111111.9 Ų111.957%0.56962%0.617SS**Hα-helixtrans-73.6-38.1174.1-63.9165.5000110.5R589 S595R589-I593 VanDerWaalsContact O-CG1 3.29Å; R589-I593 WeakPolarHBondContact O-CG1 3.41Å; R589-I593 PolarHBondContact O-N 2.91Å; I593-S595 PolarHBondContact O-N 3.47Å
594S58.5Low57.3Low77 Ų77121.5 Ų121.554%0.53866%0.655SS.*Hα-helixtrans-65.7-35.1175.4-179.30000112.7K590K590-S594 WeakPolarHBondContact O-CB 3.48Å; K590-S594 PolarHBondContact O-N 2.75Å; K590-S594 VanDerWaalsContact O-N 3.09Å
595S56.8Low56.7Low64 Ų64124.5 Ų124.545%0.44867%0.671SS.*Hα-helixtrans-79.3-18.5-177.871.90000114.1L591 S592 I593L591-S595 PolarHBondContact O-N 3Å; L591-S595 VanDerWaalsContact O-N 3.16Å; L591-S595 PolarHBondContact O-OG 3.18Å; S592-S595 PolarHBondContact O-OG 3.09Å; I593-S595 PolarHBondContact O-N 3.47Å
596N54Low55.9Low128 Ų128125.1 Ų125.168%0.68468%0.675SS**Hα-helixtrans-85-18.4178.1-83.7-16.9000113.6S592S592-N596 PolarHBondContact O-N 3.42Å
597H52.5Low55.1Low160 Ų160127.3 Ų127.374%0.74169%0.687SS**Hα-helixtrans-82.1-21.8178.3-111.9-47.8000114.2
598D53.6Low54.3Low145 Ų145126.8 Ų126.878%0.77569%0.693SS**THydrogen-bonded Turntrans-92.18.4-177.4-75.8-20.6000114.6
599R54.7Low53.5Low228 Ų228129.5 Ų129.586%0.8670%0.701SS**THydrogen-bonded Turntrans-110.516.1-177.1-75.6-169.6-179.5178.51.6116.1
600G48.8Very low52.8Low54 Ų54126.3 Ų126.356%0.55770%0.703SS**SBendtrans-135.1106.3173.100000111.2
601I48.3Very low51.9Low178 Ų178123.7 Ų123.791%0.91370%0.703SS**  trans142122.1156.5-73.5155.9000109.9
602G41.3Very low51Low67 Ų67123.8 Ų123.869%0.69171%0.707SS**  trans35.4128150.700000119.7
603G42.6Very low50.2Low79 Ų79129.4 Ų129.481%0.81473%0.734SS**  cis68.654.439.900000111.7
604H31.6Very low49.3Very low262 Ų262131.1 Ų131.1100%1.21375%0.749SS**  trans-162.70134.2-110.6-56.1000111

Retrieved 604 of 604 residues in 1005.9 ms (Link to these results)

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