A0A077Z6Q2_TRITR Loading...

Sodium coupled neutral amino acid transporter

AlphaFold DB , UniProt , Accession A0A077Z6Q2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 591 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
1M39.4Very low63.2Low109 Ų10985.3 Ų85.354%0.53743%0.434SS..  0143.80-55.8170.9178.700106.8V3 V158 D226 F298M1-V3 HydrophobicContact CB-CB 4.42Å; M1-V3 HydrophobicContact CB-CG2 3.77Å; M1-V3 PolarHBondContact O-N 2.87Å; M1-V158 HydrophobicContact CE-CG2 3.86Å; M1-V158 HydrophobicContact SD-CB 3.98Å; M1-V158 HydrophobicContact SD-CG1 4.42Å; M1-V158 HydrophobicContact SD-CG2 3.63Å; M1-D226 WeakPolarHBondContact CB-OD2 3.32Å; M1-D226 PolarHBondContact N-OD1 3.46Å; M1-D226 PolarHBondContact N-OD2 3.49Å; M1-D226 VanDerWaalsContact O-CG 3.24Å; M1-F298 HydrophobicContact CE-CE1 3.97Å; M1-F298 HydrophobicContact CE-CE2 4.13Å; M1-F298 HydrophobicContact CE-CZ 3.35Å
2E34Very low65.3Low177 Ų17780.1 Ų80.183%0.82741%0.408SS*.  trans-78.968.7172.3-80.5178.7162.700109.6R159E2-R159 PolarHBondContact O-NE 3.35Å; E2-R159 PolarHBondContact O-NH2 2.82Å
3V47.8Very low66.9Low36 Ų3675.7 Ų75.722%0.21839%0.385CS..  trans-127129.5-176.3-173.10000108.6M1 R159M1-V3 HydrophobicContact CB-CB 4.42Å; M1-V3 HydrophobicContact CB-CG2 3.77Å; M1-V3 PolarHBondContact O-N 2.87Å; V3-R159 HydrophobicContact CG1-CG 4.24Å; V3-R159 HydrophobicContact CG2-CG 3.53Å
4V50.5Low68.5Low44 Ų4470.3 Ų70.327%0.26736%0.358SS..  trans89.769.6178.2-159.60000116.6D6 T9 L10V4-D6 VanDerWaalsContact C-N 3.26Å; V4-D6 WeakPolarHBondContact CG1-O 3.36Å; V4-T9 WeakPolarHBondContact CG1-OG1 3.34Å; V4-L10 HydrophobicContact CG1-CB 3.84Å; V4-L10 HydrophobicContact CG2-CB 4.19Å
5D50Low70Confident167 Ų16765.7 Ų65.789%0.89333%0.334SS*.SBendtrans-75.5-17.3150.1-76.6-38000111.9
6D66.5Low71.3Confident107 Ų10761.8 Ų61.857%0.57231%0.314SS*.SBendtrans-107.2101.9-178.5-68.5-31.2000112.1V4 W8 T9V4-D6 VanDerWaalsContact C-N 3.26Å; V4-D6 WeakPolarHBondContact CG1-O 3.36Å; D6-W8 PolarHBondContact O-N 2.92Å; D6-T9 HydrophobicContact CB-CG2 3.92Å; D6-T9 PolarHBondContact O-N 2.74Å; D6-T9 PolarHBondContact O-OG1 3.25Å
7S74.1Confident72.3Confident70 Ų7058.6 Ų58.649%0.4930%0.299SS..Hα-helixtrans-47.6-30.1-179.3-52.30000114.2L10 V11S7-L10 PolarHBondContact O-N 3.48Å; S7-V11 VanDerWaalsContact O-CG2 3.31Å; S7-V11 WeakPolarHBondContact O-CG2 3.44Å; S7-V11 PolarHBondContact O-N 2.93Å
8W81.2Confident73.3Confident177 Ų17755.7 Ų55.767%0.6729%0.286SS*.Hα-helixtrans-65.5-36.1176-69.5108.9000114.5D6 L10 V11 L12 L240D6-W8 PolarHBondContact O-N 2.92Å; W8-L10 VanDerWaalsContact C-N 3.31Å; W8-L10 PolarHBondContact O-N 3.2Å; W8-V11 PolarHBondContact O-N 2.64Å; W8-L12 WeakPolarHBondContact O-CG 3.3Å; W8-L12 PolarHBondContact O-N 3.19Å; W8-L240 HydrophobicContact CE3-CD2 4.39Å; W8-L240 HydrophobicContact CH2-CD2 3.91Å; W8-L240 HydrophobicContact CZ3-CD2 3.69Å
9T81.9Confident74.2Confident37 Ų3752.8 Ų52.823%0.22727%0.271CS..Hα-helixtrans-66.5-36.2178.960.10000111.6V4 D6 H13V4-T9 WeakPolarHBondContact CG1-OG1 3.34Å; D6-T9 HydrophobicContact CB-CG2 3.92Å; D6-T9 PolarHBondContact O-N 2.74Å; D6-T9 PolarHBondContact O-OG1 3.25Å; T9-H13 VanDerWaalsContact O-CB 3.32Å; T9-H13 WeakPolarHBondContact O-CB 3.42Å; T9-H13 PolarHBondContact O-N 2.78Å
10L82.3Confident74.7Confident8 Ų850.3 Ų50.34%0.04226%0.259CS..Hα-helixtrans-65.5-45.8172.3174.263.1000111.9V4 S7 W8 L12 H13 L14 V223 L234 A237V4-L10 HydrophobicContact CG1-CB 3.84Å; V4-L10 HydrophobicContact CG2-CB 4.19Å; S7-L10 PolarHBondContact O-N 3.48Å; W8-L10 VanDerWaalsContact C-N 3.31Å; W8-L10 PolarHBondContact O-N 3.2Å; L10-L12 VanDerWaalsContact C-N 3.32Å; L10-L12 PolarHBondContact O-N 3.43Å; L10-H13 PolarHBondContact O-N 3.08Å; L10-L14 HydrophobicContact CD1-CD1 3.88Å; L10-L14 HydrophobicContact CD1-CG 3.96Å; L10-L14 HydrophobicContact CG-CD1 3.99Å; L10-L14 HydrophobicContact CG-CG 4.43Å; L10-L14 WeakPolarHBondContact O-CB 3.37Å; L10-L14 WeakPolarHBondContact O-CG 3.03Å; L10-L14 PolarHBondContact O-N 3.37Å; L10-V223 HydrophobicContact CD1-CG1 3.55Å; L10-L234 HydrophobicContact CD2-CD1 3.72Å; L10-A237 HydrophobicContact CD2-CB 3.84Å; L10-A237 HydrophobicContact CG-CB 4.3Å
11V88.1Confident75.2Confident6 Ų648.1 Ų48.14%0.03625%0.248CC..Hα-helixtrans-56.9-49.5177.6172.80000109.9S7 W8 H13 L14 T15 A237 L240 A241S7-V11 VanDerWaalsContact O-CG2 3.31Å; S7-V11 WeakPolarHBondContact O-CG2 3.44Å; S7-V11 PolarHBondContact O-N 2.93Å; W8-V11 PolarHBondContact O-N 2.64Å; V11-H13 PolarHBondContact O-N 3.46Å; V11-L14 PolarHBondContact O-N 3.19Å; V11-T15 WeakPolarHBondContact O-CB 3.12Å; V11-T15 PolarHBondContact O-N 3.34Å; V11-T15 PolarHBondContact O-OG1 3.01Å; V11-A237 HydrophobicContact CG2-CB 3.87Å; V11-L240 HydrophobicContact CG1-CD2 4.25Å; V11-L240 HydrophobicContact CG1-CG 4.07Å; V11-L240 HydrophobicContact CG2-CB 4.35Å; V11-L240 HydrophobicContact CG2-CD2 4.03Å; V11-L240 HydrophobicContact CG2-CG 4.39Å; V11-A241 HydrophobicContact CG1-CB 4.18Å
12L87.9Confident77.4Confident23 Ų2343.5 Ų43.512%0.1223%0.228CC..Hα-helixtrans-64.1-39.4179.4-70.5170.8000112.9W8 L10 N16 F166 F169W8-L12 WeakPolarHBondContact O-CG 3.3Å; W8-L12 PolarHBondContact O-N 3.19Å; L10-L12 VanDerWaalsContact C-N 3.32Å; L10-L12 PolarHBondContact O-N 3.43Å; L12-N16 VanDerWaalsContact O-CB 3.28Å; L12-N16 WeakPolarHBondContact O-CB 3.37Å; L12-N16 PolarHBondContact O-N 3.21Å; L12-F166 HydrophobicContact CD1-CD1 3.79Å; L12-F166 HydrophobicContact CD1-CD2 4.05Å; L12-F166 HydrophobicContact CD1-CE1 3.32Å; L12-F166 HydrophobicContact CD1-CE2 3.6Å; L12-F166 HydrophobicContact CD1-CG 4.15Å; L12-F166 HydrophobicContact CD1-CZ 3.21Å; L12-F169 HydrophobicContact CD2-CD2 4.29Å; L12-F169 HydrophobicContact CD2-CG 4.3Å
13H86.6Confident80.1Confident23 Ų2335 Ų3511%0.10619%0.188CC..Hα-helixtrans-61.7-50.9175.5-176.3122.5000111T9 L10 V11 N16 S17 L295T9-H13 VanDerWaalsContact O-CB 3.32Å; T9-H13 WeakPolarHBondContact O-CB 3.42Å; T9-H13 PolarHBondContact O-N 2.78Å; L10-H13 PolarHBondContact O-N 3.08Å; V11-H13 PolarHBondContact O-N 3.46Å; H13-N16 PolarHBondContact O-N 3.44Å; H13-S17 WeakPolarHBondContact O-CB 3.43Å; H13-S17 PolarHBondContact O-N 2.88Å; H13-S17 PolarHBondContact O-OG 3.25Å; H13-L295 VanDerWaalsContact CE1-CD2 3.42Å; H13-L295 WeakPolarHBondContact CE1-CD2 3.4Å
14L89.2Confident82Confident0 Ų033.5 Ų33.50%018%0.179CC..Hα-helixtrans-63-43.5179.7-70175.1000111.1L10 V11 S17 A18 L220 V238 A241L10-L14 HydrophobicContact CD1-CD1 3.88Å; L10-L14 HydrophobicContact CD1-CG 3.96Å; L10-L14 HydrophobicContact CG-CD1 3.99Å; L10-L14 HydrophobicContact CG-CG 4.43Å; L10-L14 WeakPolarHBondContact O-CB 3.37Å; L10-L14 WeakPolarHBondContact O-CG 3.03Å; L10-L14 PolarHBondContact O-N 3.37Å; V11-L14 PolarHBondContact O-N 3.19Å; L14-S17 WeakPolarHBondContact CA-OG 3.45Å; L14-S17 PolarHBondContact O-N 3.18Å; L14-S17 PolarHBondContact O-OG 3.47Å; L14-A18 PolarHBondContact O-N 2.83Å; L14-A18 VanDerWaalsContact O-N 3.07Å; L14-L220 HydrophobicContact CD2-CB 4.46Å; L14-V238 HydrophobicContact CD1-CG2 3.87Å; L14-A241 HydrophobicContact CB-CB 3.87Å
15T91.1Very high83.7Confident1 Ų131.6 Ų31.61%0.00617%0.168CC..Hα-helixtrans-60-48.2175.4-66.70000111.4V11 S17 A18 V19 F169 A241 V244 L248V11-T15 WeakPolarHBondContact O-CB 3.12Å; V11-T15 PolarHBondContact O-N 3.34Å; V11-T15 PolarHBondContact O-OG1 3.01Å; T15-S17 VanDerWaalsContact C-N 3.28Å; T15-S17 PolarHBondContact O-N 2.74Å; T15-A18 PolarHBondContact O-N 3.37Å; T15-V19 HydrophobicContact CG2-CG2 3.9Å; T15-V19 WeakPolarHBondContact O-CB 3.48Å; T15-V19 VanDerWaalsContact O-CG2 3.27Å; T15-V19 WeakPolarHBondContact O-CG2 3.14Å; T15-V19 PolarHBondContact O-N 2.91Å; T15-F169 HydrophobicContact CG2-CD2 4.37Å; T15-F169 HydrophobicContact CG2-CE2 4.43Å; T15-A241 WeakPolarHBondContact OG1-CA 3.15Å; T15-A241 PolarHBondContact OG1-O 3.27Å; T15-V244 HydrophobicContact CG2-CB 4.5Å; T15-V244 HydrophobicContact CG2-CG1 3.83Å; T15-L248 HydrophobicContact CG2-CD1 4.43Å
16N90.3Very high85.4Confident3 Ų323.7 Ų23.72%0.01613%0.126CC..Hα-helixtrans-62.6-38179.7-170.826.5000112L12 H13 A18 G20 S165 A168 Y172 S292 L295L12-N16 VanDerWaalsContact O-CB 3.28Å; L12-N16 WeakPolarHBondContact O-CB 3.37Å; L12-N16 PolarHBondContact O-N 3.21Å; H13-N16 PolarHBondContact O-N 3.44Å; N16-A18 VanDerWaalsContact C-N 3.33Å; N16-A18 PolarHBondContact O-N 3.17Å; N16-G20 PolarHBondContact O-N 3.37Å; N16-S165 PolarHBondContact ND2-OG 3.15Å; N16-A168 WeakPolarHBondContact OD1-CB 3.08Å; N16-Y172 PolarHBondContact OD1-OH 3.31Å; N16-Y172 VanDerWaalsContact OD1-OH 3.13Å; N16-S292 PolarHBondContact ND2-OG 3.42Å; N16-S292 PolarHBondContact OD1-OG 3.02Å; N16-L295 HydrophobicContact CB-CD1 4.35Å; N16-L295 WeakPolarHBondContact ND2-CD1 3.36Å
17S87.8Confident86.3Confident8 Ų818.6 Ų18.66%0.05610%0.098CC..Hα-helixtrans-66.9-32.4177.671.80000114.1H13 L14 T15H13-S17 WeakPolarHBondContact O-CB 3.43Å; H13-S17 PolarHBondContact O-N 2.88Å; H13-S17 PolarHBondContact O-OG 3.25Å; L14-S17 WeakPolarHBondContact CA-OG 3.45Å; L14-S17 PolarHBondContact O-N 3.18Å; L14-S17 PolarHBondContact O-OG 3.47Å; T15-S17 VanDerWaalsContact C-N 3.28Å; T15-S17 PolarHBondContact O-N 2.74Å
18A90.3Very high86.5Confident7 Ų716.3 Ų16.36%0.0588%0.079CC..Hα-helixtrans-81.4-49.3176.800000111.4L14 T15 N16 G20 A213 M216 Y249L14-A18 PolarHBondContact O-N 2.83Å; L14-A18 VanDerWaalsContact O-N 3.07Å; T15-A18 PolarHBondContact O-N 3.37Å; N16-A18 VanDerWaalsContact C-N 3.33Å; N16-A18 PolarHBondContact O-N 3.17Å; A18-G20 PolarHBondContact O-N 2.94Å; A18-A213 CarbonylContact C-O 3.45Å; A18-M216 HydrophobicContact CB-CE 4.29Å; A18-Y249 PolarHBondContact O-OH 3.18Å
19V90.2Very high86.4Confident0 Ų07.9 Ų7.90%05%0.047CC..Hα-helixtrans-55.8-58.4-173172.90000112.2T15 V21 G22 I23 Y172 L248 Y249T15-V19 HydrophobicContact CG2-CG2 3.9Å; T15-V19 WeakPolarHBondContact O-CB 3.48Å; T15-V19 VanDerWaalsContact O-CG2 3.27Å; T15-V19 WeakPolarHBondContact O-CG2 3.14Å; T15-V19 PolarHBondContact O-N 2.91Å; V19-V21 PolarHBondContact O-N 3.37Å; V19-G22 PolarHBondContact O-N 2.81Å; V19-I23 HydrophobicContact CG1-CB 3.93Å; V19-I23 HydrophobicContact CG1-CD1 3.75Å; V19-I23 HydrophobicContact CG1-CG1 4.41Å; V19-I23 HydrophobicContact CG1-CG2 4.05Å; V19-I23 PolarHBondContact O-N 2.94Å; V19-Y172 HydrophobicContact CB-CD2 4.13Å; V19-Y172 HydrophobicContact CB-CE2 3.71Å; V19-Y172 HydrophobicContact CG1-CD1 3.97Å; V19-Y172 HydrophobicContact CG1-CD2 3.54Å; V19-Y172 HydrophobicContact CG1-CE1 3.84Å; V19-Y172 HydrophobicContact CG1-CE2 3.4Å; V19-Y172 VanDerWaalsContact CG1-CE2 3.4Å; V19-Y172 HydrophobicContact CG1-CG 3.84Å; V19-L248 HydrophobicContact CG2-CD1 3.97Å; V19-Y249 VanDerWaalsContact CA-OH 3.27Å; V19-Y249 WeakPolarHBondContact CA-OH 3.45Å; V19-Y249 HydrophobicContact CB-CE1 4.23Å; V19-Y249 HydrophobicContact CG1-CE1 4.16Å; V19-Y249 HydrophobicContact CG2-CE1 3.97Å
20G84.2Confident86.3Confident3 Ų36.2 Ų6.23%0.0314%0.037CC..THydrogen-bonded Turntrans39.4-133.8173.200000115N16 A18 I23N16-G20 PolarHBondContact O-N 3.37Å; A18-G20 PolarHBondContact O-N 2.94Å; G20-I23 WeakPolarHBondContact O-CG2 3.24Å
21V85.8Confident85.8Confident5 Ų56 Ų63%0.034%0.036CC..THydrogen-bonded Turntrans-89.3-16.3174.9162.30000110.7V19 I23 L24 F109 V112 L289 V355 L359V19-V21 PolarHBondContact O-N 3.37Å; V21-I23 PolarHBondContact O-N 3.24Å; V21-I23 VanDerWaalsContact O-N 3.09Å; V21-L24 HydrophobicContact CG1-CD1 4.22Å; V21-L24 HydrophobicContact CG2-CD1 4.41Å; V21-L24 WeakPolarHBondContact O-CB 2.98Å; V21-L24 PolarHBondContact O-N 2.88Å; V21-F109 HydrophobicContact CB-CD1 3.88Å; V21-F109 HydrophobicContact CB-CE1 3.98Å; V21-F109 HydrophobicContact CG2-CD1 3.35Å; V21-F109 HydrophobicContact CG2-CE1 3.75Å; V21-F109 HydrophobicContact CG2-CG 4.49Å; V21-V112 HydrophobicContact CB-CG2 4.47Å; V21-V112 HydrophobicContact CG1-CG2 3.64Å; V21-V112 HydrophobicContact CG2-CB 4.13Å; V21-V112 HydrophobicContact CG2-CG1 4.47Å; V21-V112 HydrophobicContact CG2-CG2 3.88Å; V21-L289 HydrophobicContact CG2-CD2 3.49Å; V21-L289 VanDerWaalsContact CG2-CD2 3.49Å; V21-V355 HydrophobicContact CG1-CG1 3.68Å; V21-L359 HydrophobicContact CG1-CD1 3.94Å
22G86.1Confident84.3Confident11 Ų118.6 Ų8.611%0.1135%0.047CC..G310 helixtrans-55.4-30.2176.800000112.9V19 L24 L26V19-G22 PolarHBondContact O-N 2.81Å; G22-L24 PolarHBondContact O-N 2.71Å; G22-L26 WeakPolarHBondContact O-CG 3.46Å
23I90.4Very high82.3Confident0 Ų08.3 Ų8.30%05%0.048CC..G310 helixtrans-61.9-26.3175.8-162.8164.9000114.2V19 G20 V21 L26 L248 Y249 V252 F285V19-I23 HydrophobicContact CG1-CB 3.93Å; V19-I23 HydrophobicContact CG1-CD1 3.75Å; V19-I23 HydrophobicContact CG1-CG1 4.41Å; V19-I23 HydrophobicContact CG1-CG2 4.05Å; V19-I23 PolarHBondContact O-N 2.94Å; G20-I23 WeakPolarHBondContact O-CG2 3.24Å; V21-I23 PolarHBondContact O-N 3.24Å; V21-I23 VanDerWaalsContact O-N 3.09Å; I23-L26 HydrophobicContact CB-CD1 4.48Å; I23-L26 HydrophobicContact CG1-CD1 4.17Å; I23-L248 HydrophobicContact CD1-CB 4.27Å; I23-Y249 HydrophobicContact CB-CD1 4.22Å; I23-Y249 HydrophobicContact CB-CE1 3.91Å; I23-Y249 HydrophobicContact CD1-CD1 4.2Å; I23-Y249 HydrophobicContact CD1-CE1 4.42Å; I23-Y249 HydrophobicContact CG1-CD1 3.95Å; I23-Y249 HydrophobicContact CG1-CE1 4.14Å; I23-V252 HydrophobicContact CD1-CB 4.33Å; I23-V252 HydrophobicContact CD1-CG2 3.64Å; I23-V252 HydrophobicContact CG1-CB 3.99Å; I23-V252 HydrophobicContact CG1-CG1 4.05Å; I23-V252 HydrophobicContact CG1-CG2 3.8Å; I23-F285 HydrophobicContact CG2-CE2 3.97Å; I23-F285 HydrophobicContact CG2-CZ 4Å
24L88.4Confident80.1Confident3 Ų39.1 Ų9.12%0.0166%0.063CC..G310 helixtrans-76.9-31-172.8-59.1-177.1000113.5V21 G22 P27 V112 L175 D267 I268 L269 F285V21-L24 HydrophobicContact CG1-CD1 4.22Å; V21-L24 HydrophobicContact CG2-CD1 4.41Å; V21-L24 WeakPolarHBondContact O-CB 2.98Å; V21-L24 PolarHBondContact O-N 2.88Å; G22-L24 PolarHBondContact O-N 2.71Å; L24-P27 WeakPolarHBondContact O-CD 3.23Å; L24-V112 HydrophobicContact CD1-CG1 3.69Å; L24-V112 HydrophobicContact CD1-CG2 4.13Å; L24-L175 HydrophobicContact CD2-CD2 4.3Å; L24-D267 WeakPolarHBondContact CD1-OD1 3.49Å; L24-I268 HydrophobicContact CD2-CG2 4.01Å; L24-I268 PolarHBondContact O-N 2.93Å; L24-L269 HydrophobicContact CD1-CD1 3.82Å; L24-L269 HydrophobicContact CD1-CG 4.35Å; L24-L269 HydrophobicContact CD2-CD1 3.84Å; L24-L269 HydrophobicContact CD2-CD2 4.34Å; L24-L269 HydrophobicContact CD2-CG 3.74Å; L24-F285 HydrophobicContact CD1-CD1 4.46Å; L24-F285 HydrophobicContact CD1-CE1 3.6Å; L24-F285 HydrophobicContact CD1-CZ 3.8Å; L24-F285 HydrophobicContact CD2-CD2 4.49Å; L24-F285 HydrophobicContact CD2-CE1 4.03Å; L24-F285 HydrophobicContact CD2-CE2 3.8Å; L24-F285 HydrophobicContact CD2-CZ 3.53Å; L24-F285 HydrophobicContact CG-CE1 4.07Å; L24-F285 HydrophobicContact CG-CE2 4.46Å; L24-F285 HydrophobicContact CG-CZ 3.72Å
25A84.4Confident77.8Confident5 Ų516.3 Ų16.34%0.04111%0.107CC..SBendtrans-84.7-10.5179.100000113.1F28 C29 I209 G266A25-F28 VanDerWaalsContact O-CB 3.31Å; A25-F28 WeakPolarHBondContact O-CB 3.31Å; A25-F28 PolarHBondContact O-N 2.66Å; A25-C29 PolarHBondContact O-N 3.08Å; A25-C29 PolarHBondContact O-SG 3.02Å; A25-C29 VanDerWaalsContact O-SG 3.38Å; A25-I209 HydrophobicContact CB-CG2 4.15Å; A25-G266 VanDerWaalsContact CA-O 3.28Å; A25-G266 WeakPolarHBondContact CA-O 3.46Å
26L85.7Confident75.3Confident1 Ų123.8 Ų23.81%0.00514%0.14CC..Hα-helixtrans-63.1-42.1-175.1-58.7174000114.2G22 I23 F28 C29 F30 F210 Y249 A253G22-L26 WeakPolarHBondContact O-CG 3.46Å; I23-L26 HydrophobicContact CB-CD1 4.48Å; I23-L26 HydrophobicContact CG1-CD1 4.17Å; L26-F28 PolarHBondContact O-N 3.21Å; L26-C29 WeakPolarHBondContact O-CB 3.28Å; L26-C29 PolarHBondContact O-N 2.87Å; L26-F30 VanDerWaalsContact O-CD2 3.24Å; L26-F30 WeakPolarHBondContact O-CD2 3.04Å; L26-F30 PolarHBondContact O-N 3.32Å; L26-F210 HydrophobicContact CD2-CD1 3.47Å; L26-F210 VanDerWaalsContact CD2-CD1 3.47Å; L26-F210 HydrophobicContact CD2-CE1 3.41Å; L26-F210 VanDerWaalsContact CD2-CE1 3.41Å; L26-Y249 VanDerWaalsContact CD1-CA 3.44Å; L26-Y249 HydrophobicContact CD1-CD1 3.32Å; L26-Y249 HydrophobicContact CD1-CD2 4.02Å; L26-Y249 HydrophobicContact CD1-CE1 4Å; L26-Y249 HydrophobicContact CD1-CG 3.3Å; L26-A253 HydrophobicContact CB-CB 4.19Å
27P85.3Confident73.3Confident0 Ų029.8 Ų29.80%018%0.179CC..Hα-helixtrans-61.1-34.6176.7-23.137000111.6L24 C29 F30 A31 V252 V264 I268L24-P27 WeakPolarHBondContact O-CD 3.23Å; P27-C29 VanDerWaalsContact C-N 3.34Å; P27-C29 PolarHBondContact O-N 2.8Å; P27-F30 PolarHBondContact O-N 3.42Å; P27-F30 VanDerWaalsContact O-N 3.17Å; P27-A31 WeakPolarHBondContact O-CB 3.42Å; P27-A31 PolarHBondContact O-N 3.34Å; P27-V252 HydrophobicContact CG-CG1 3.79Å; P27-V264 HydrophobicContact CB-CG1 3.82Å; P27-I268 HydrophobicContact CB-CD1 3.81Å; P27-I268 HydrophobicContact CG-CB 4.16Å; P27-I268 HydrophobicContact CG-CD1 3.46Å; P27-I268 VanDerWaalsContact CG-CD1 3.46Å; P27-I268 HydrophobicContact CG-CG1 4.37Å; P27-I268 HydrophobicContact CG-CG2 4.39Å
28F80Confident71.1Confident21 Ų2136.9 Ų36.99%0.09222%0.216CC..Hα-helixtrans-63.8-39.5177.4-179.7-96.7000111.5A25 L26 F30 A31 A33 L41 F205 V264 E356A25-F28 VanDerWaalsContact O-CB 3.31Å; A25-F28 WeakPolarHBondContact O-CB 3.31Å; A25-F28 PolarHBondContact O-N 2.66Å; L26-F28 PolarHBondContact O-N 3.21Å; F28-F30 PolarHBondContact O-N 2.91Å; F28-A31 PolarHBondContact O-N 2.87Å; F28-A31 VanDerWaalsContact O-N 3.17Å; F28-A33 HydrophobicContact CD2-CB 3.93Å; F28-A33 HydrophobicContact CE1-CB 4.12Å; F28-A33 HydrophobicContact CE2-CB 3.25Å; F28-A33 HydrophobicContact CZ-CB 3.36Å; F28-L41 HydrophobicContact CE1-CD1 4.37Å; F28-L41 HydrophobicContact CZ-CD1 4Å; F28-F205 AromaticContact CD1-CE1 3.95Å; F28-F205 HydrophobicContact CD1-CE1 3.95Å; F28-F205 HydrophobicContact CD1-CZ 4.18Å; F28-F205 AromaticContact CE1-CE1 3.62Å; F28-F205 HydrophobicContact CE1-CE1 3.62Å; F28-F205 AromaticContact CE1-CZ 3.6Å; F28-F205 HydrophobicContact CE1-CZ 3.6Å; F28-V264 HydrophobicContact CB-CG1 4.01Å; F28-E356 WeakPolarHBondContact CD1-OE1 3.26Å; F28-E356 WeakPolarHBondContact CE1-OE1 3.31Å; F28-E356 WeakPolarHBondContact CG-OE1 3.24Å
29C79Confident69.3Low0 Ų040.4 Ų40.40%023%0.233CC..Hα-helixtrans-62.3-25.6175-62.20000114.4A25 L26 P27 G42 C43 V206 F210A25-C29 PolarHBondContact O-N 3.08Å; A25-C29 PolarHBondContact O-SG 3.02Å; A25-C29 VanDerWaalsContact O-SG 3.38Å; L26-C29 WeakPolarHBondContact O-CB 3.28Å; L26-C29 PolarHBondContact O-N 2.87Å; P27-C29 VanDerWaalsContact C-N 3.34Å; P27-C29 PolarHBondContact O-N 2.8Å; C29-G42 WeakPolarHBondContact O-CA 3.36Å; C29-C43 PolarHBondContact O-N 3.23Å; C29-V206 HydrophobicContact CB-CB 4.25Å; C29-V206 HydrophobicContact CB-CG1 3.72Å; C29-V206 HydrophobicContact CB-CG2 3.64Å; C29-V206 WeakPolarHBondContact O-CG2 3.44Å; C29-F210 HydrophobicContact CB-CE1 3.54Å; C29-F210 HydrophobicContact CB-CZ 3.7Å
30F78.9Confident67.4Low2 Ų241.6 Ų41.61%0.00924%0.24CC..Hα-helixtrans-92-26.5177.9-78.7-115.3000111.9L26 P27 F28 F45 F210 A253 Y257L26-F30 VanDerWaalsContact O-CD2 3.24Å; L26-F30 WeakPolarHBondContact O-CD2 3.04Å; L26-F30 PolarHBondContact O-N 3.32Å; P27-F30 PolarHBondContact O-N 3.42Å; P27-F30 VanDerWaalsContact O-N 3.17Å; F28-F30 PolarHBondContact O-N 2.91Å; F30-F45 HydrophobicContact CD1-CB 4.31Å; F30-F45 AromaticContact CD1-CD2 3.47Å; F30-F45 HydrophobicContact CD1-CD2 3.47Å; F30-F45 VanDerWaalsContact CD1-CD2 3.47Å; F30-F45 HydrophobicContact CD1-CE2 4.03Å; F30-F45 HydrophobicContact CD1-CG 4.24Å; F30-F45 AromaticContact CE1-CD2 3.66Å; F30-F45 HydrophobicContact CE1-CD2 3.66Å; F30-F45 AromaticContact CE1-CE2 3.84Å; F30-F45 HydrophobicContact CE1-CE2 3.84Å; F30-F45 HydrophobicContact CE1-CG 4.38Å; F30-F45 WeakPolarHBondContact CE1-O 3.17Å; F30-F210 AromaticContact CD2-CZ 3.99Å; F30-F210 HydrophobicContact CD2-CZ 3.99Å; F30-F210 HydrophobicContact CE2-CE1 4.27Å; F30-F210 HydrophobicContact CE2-CE2 4.22Å; F30-F210 AromaticContact CE2-CZ 3.46Å; F30-F210 HydrophobicContact CE2-CZ 3.46Å; F30-F210 VanDerWaalsContact CE2-CZ 3.46Å; F30-F210 HydrophobicContact CZ-CZ 4.41Å; F30-A253 HydrophobicContact CD1-CB 4.26Å; F30-A253 HydrophobicContact CD2-CB 3.58Å; F30-A253 HydrophobicContact CE1-CB 4.17Å; F30-A253 HydrophobicContact CE2-CB 3.41Å; F30-A253 VanDerWaalsContact CE2-CB 3.41Å; F30-A253 HydrophobicContact CG-CB 4Å; F30-A253 HydrophobicContact CZ-CB 3.74Å; F30-Y257 HydrophobicContact CB-CG 4.36Å
31A71.1Confident66.2Low3 Ų342.9 Ų42.93%0.02525%0.246CC..SBendtrans-72.7153.9-177.100000113.2P27 F28 A33 G42 Y257 V264P27-A31 WeakPolarHBondContact O-CB 3.42Å; P27-A31 PolarHBondContact O-N 3.34Å; F28-A31 PolarHBondContact O-N 2.87Å; F28-A31 VanDerWaalsContact O-N 3.17Å; A31-A33 PolarHBondContact O-N 3.5Å; A31-G42 WeakPolarHBondContact O-CA 3.33Å; A31-Y257 VanDerWaalsContact CA-CE2 3.5Å; A31-Y257 HydrophobicContact CB-CD2 3.89Å; A31-Y257 HydrophobicContact CB-CE2 4.12Å; A31-V264 HydrophobicContact CB-CB 3.98Å; A31-V264 HydrophobicContact CB-CG2 4.11Å
32K56.7Low65.1Low61 Ų6142.7 Ų42.727%0.26525%0.245SC..  trans-7176.6162.2-79.5174.9172.8166.60108.3G34 A196 D262K32-G34 PolarHBondContact O-N 3.23Å; K32-A196 HydrophobicContact CG-CB 4.36Å; K32-D262 WeakPolarHBondContact CB-OD1 3.48Å
33A46.3Very low64.3Low17 Ų1742.2 Ų42.214%0.1424%0.24CC..  trans-77100.9161.800000107.2F28 A31 L41F28-A33 HydrophobicContact CD2-CB 3.93Å; F28-A33 HydrophobicContact CE1-CB 4.12Å; F28-A33 HydrophobicContact CE2-CB 3.25Å; F28-A33 HydrophobicContact CZ-CB 3.36Å; A31-A33 PolarHBondContact O-N 3.5Å; A33-L41 HydrophobicContact CB-CB 4.02Å; A33-L41 HydrophobicContact CB-CD1 4.14Å; A33-L41 PolarHBondContact O-N 2.86Å
34G41.6Very low63.5Low41 Ų4142.2 Ų42.242%0.42324%0.24SC..  trans169.275.3-178.400000111.8K32K32-G34 PolarHBondContact O-N 3.23Å
35T40Very low63.2Low150 Ų15043.6 Ų43.692%0.9225%0.246SC*.SBendtrans-71.8-17.7161.3-45.60000110.6
36F38.8Very low63.1Low158 Ų15847.6 Ų47.669%0.69327%0.267SS*.SBendtrans-90.4130.2171.6-93.6-92.6000111L38F36-L38 PolarHBondContact O-N 2.9Å
37P47.5Very low63.1Low130 Ų13048.5 Ų48.584%0.84427%0.271SS*.THydrogen-bonded Turntrans-67.6-0.3-178.327-34.3000114.7
38L43.1Very low63.2Low157 Ų15748.5 Ų48.582%0.82227%0.271SS*.THydrogen-bonded Turntrans-104.5-19.3-171.9-154.366.5000114.6F36F36-L38 PolarHBondContact O-N 2.9Å
39I51.2Low63.5Low81 Ų8148.7 Ų48.742%0.41527%0.274SS..  trans-14196.3-178.9-50.5173.2000109.5L41I39-L41 HydrophobicContact CG2-CD2 3.68Å; I39-L41 HydrophobicContact CG2-CG 3.93Å; I39-L41 PolarHBondContact O-N 3.12Å
40T52Low64.1Low25 Ų2552.8 Ų52.815%0.15330%0.295CS..  trans-82.7106.2166.7-54.50000108.6E201T40-E201 PolarHBondContact OG1-OE2 2.88Å
41L59Low64.7Low29 Ų2953.2 Ų53.215%0.15230%0.298CS..  trans-78.6-19-175.8-68.1164000113.5F28 A33 I39 G202 F205 L415F28-L41 HydrophobicContact CE1-CD1 4.37Å; F28-L41 HydrophobicContact CZ-CD1 4Å; A33-L41 HydrophobicContact CB-CB 4.02Å; A33-L41 HydrophobicContact CB-CD1 4.14Å; A33-L41 PolarHBondContact O-N 2.86Å; I39-L41 HydrophobicContact CG2-CD2 3.68Å; I39-L41 HydrophobicContact CG2-CG 3.93Å; I39-L41 PolarHBondContact O-N 3.12Å; L41-G202 WeakPolarHBondContact O-CA 3.44Å; L41-F205 HydrophobicContact CB-CD1 4.05Å; L41-F205 HydrophobicContact CB-CE1 4.24Å; L41-F205 HydrophobicContact CB-CG 4.45Å; L41-F205 HydrophobicContact CD2-CB 4.27Å; L41-F205 HydrophobicContact CD2-CD1 4.19Å; L41-F205 HydrophobicContact CD2-CD2 3.72Å; L41-F205 HydrophobicContact CD2-CE2 4.1Å; L41-F205 HydrophobicContact CD2-CG 3.78Å; L41-F205 HydrophobicContact CD2-CZ 4.5Å; L41-F205 WeakPolarHBondContact O-CD1 3.23Å; L41-L415 HydrophobicContact CD1-CD2 4.43Å; L41-L415 HydrophobicContact CD2-CD2 4.29Å
42G60.9Low65.6Low2 Ų253.2 Ų53.22%0.02130%0.298CS..  trans-87.9136.1-178.100000114.4C29 A31 G44C29-G42 WeakPolarHBondContact O-CA 3.36Å; A31-G42 WeakPolarHBondContact O-CA 3.33Å; G42-G44 VanDerWaalsContact C-N 3.31Å
43C69.4Low67.4Low0 Ų055 Ų550%031%0.31CS..  trans-80.7-11176.659.20000113.9C29 L47 G48 R199 V203 V206C29-C43 PolarHBondContact O-N 3.23Å; C43-L47 HydrophobicContact CB-CD2 4.28Å; C43-L47 HydrophobicContact CB-CG 4.3Å; C43-L47 WeakPolarHBondContact O-CB 3.35Å; C43-G48 WeakPolarHBondContact SG-CA 3.42Å; C43-G48 PolarHBondContact SG-N 3.18Å; C43-G48 VanDerWaalsContact SG-N 3.44Å; C43-R199 CarbonylContact C-O 3.45Å; C43-R199 WeakPolarHBondContact CA-O 3.16Å; C43-R199 PolarHBondContact O-N 3.44Å; C43-R199 VanDerWaalsContact O-O 3.11Å; C43-V203 HydrophobicContact CB-CG2 3.86Å; C43-V206 HydrophobicContact CB-CG2 4.32Å
44G75.1Confident69.6Low1 Ų158.6 Ų58.61%0.0132%0.323CS..  trans82.3163.5-17200000113G42 G48 A196G42-G44 VanDerWaalsContact C-N 3.31Å; G44-G48 WeakPolarHBondContact O-CA 3.37Å; G44-G48 PolarHBondContact O-N 3.33Å; G44-A196 CarbonylContact C-O 3.35Å; G44-A196 WeakPolarHBondContact CA-O 3.41Å
45F80.5Confident72Confident31 Ų3156.7 Ų56.714%0.13630%0.302CS..Hα-helixtrans-67.2-47.5-165.6-177.7-96.2000114.6F30 T49 L195 A196 F250 F254F30-F45 HydrophobicContact CD1-CB 4.31Å; F30-F45 AromaticContact CD1-CD2 3.47Å; F30-F45 HydrophobicContact CD1-CD2 3.47Å; F30-F45 VanDerWaalsContact CD1-CD2 3.47Å; F30-F45 HydrophobicContact CD1-CE2 4.03Å; F30-F45 HydrophobicContact CD1-CG 4.24Å; F30-F45 AromaticContact CE1-CD2 3.66Å; F30-F45 HydrophobicContact CE1-CD2 3.66Å; F30-F45 AromaticContact CE1-CE2 3.84Å; F30-F45 HydrophobicContact CE1-CE2 3.84Å; F30-F45 HydrophobicContact CE1-CG 4.38Å; F30-F45 WeakPolarHBondContact CE1-O 3.17Å; F45-T49 WeakPolarHBondContact O-CB 3.4Å; F45-T49 PolarHBondContact O-N 2.9Å; F45-T49 VanDerWaalsContact O-N 3.07Å; F45-T49 PolarHBondContact O-OG1 2.88Å; F45-L195 HydrophobicContact CB-CD2 4.06Å; F45-L195 HydrophobicContact CG-CD2 4.15Å; F45-A196 PolarHBondContact N-O 3.3Å; F45-F250 HydrophobicContact CE1-CE2 4.29Å; F45-F250 HydrophobicContact CE2-CE2 4.24Å; F45-F250 HydrophobicContact CZ-CD2 4.49Å; F45-F250 AromaticContact CZ-CE2 3.52Å; F45-F250 HydrophobicContact CZ-CE2 3.52Å; F45-F250 AromaticContact CZ-CZ 3.74Å; F45-F250 HydrophobicContact CZ-CZ 3.74Å; F45-F254 AromaticContact CD2-CD2 3.99Å; F45-F254 HydrophobicContact CD2-CD2 3.99Å; F45-F254 HydrophobicContact CE1-CD2 4.17Å; F45-F254 HydrophobicContact CE1-CE2 4.49Å; F45-F254 HydrophobicContact CE2-CB 3.66Å; F45-F254 AromaticContact CE2-CD2 3.25Å; F45-F254 HydrophobicContact CE2-CD2 3.25Å; F45-F254 HydrophobicContact CE2-CE2 4.25Å; F45-F254 AromaticContact CE2-CG 3.87Å; F45-F254 HydrophobicContact CE2-CG 3.87Å; F45-F254 HydrophobicContact CZ-CB 4.06Å; F45-F254 AromaticContact CZ-CD2 3.32Å; F45-F254 HydrophobicContact CZ-CD2 3.32Å; F45-F254 HydrophobicContact CZ-CE2 4.02Å; F45-F254 AromaticContact CZ-CG 3.97Å; F45-F254 HydrophobicContact CZ-CG 3.97Å
46L83.6Confident74.6Confident90 Ų9050 Ų5047%0.47126%0.263SS..Hα-helixtrans-69.1-46.6-177.9-178.663.8000110.2T49 L50 L197 W198L46-T49 PolarHBondContact O-N 3.39Å; L46-L50 WeakPolarHBondContact O-CG 3.13Å; L46-L50 PolarHBondContact O-N 3.47Å; L46-L197 WeakPolarHBondContact CB-O 3.41Å; L46-L197 PolarHBondContact N-O 2.88Å; L46-L197 VanDerWaalsContact N-O 3.17Å; L46-W198 HydrophobicContact CD2-CE3 4.43Å
47L86.2Confident77.2Confident19 Ų1947.4 Ų47.410%0.09925%0.252CS..Hα-helixtrans-65.9-41.8179.4-17357.7000111.6C43 T49 L50 V51 L197 W198 P200 V203C43-L47 HydrophobicContact CB-CD2 4.28Å; C43-L47 HydrophobicContact CB-CG 4.3Å; C43-L47 WeakPolarHBondContact O-CB 3.35Å; L47-T49 VanDerWaalsContact C-N 3.32Å; L47-T49 PolarHBondContact O-N 2.79Å; L47-L50 WeakPolarHBondContact O-CB 3.48Å; L47-L50 PolarHBondContact O-N 3.21Å; L47-L50 VanDerWaalsContact O-N 3.12Å; L47-V51 HydrophobicContact CD1-CG2 4.42Å; L47-V51 HydrophobicContact CG-CG2 4.42Å; L47-V51 VanDerWaalsContact O-CG2 3.26Å; L47-V51 WeakPolarHBondContact O-CG2 3.32Å; L47-V51 PolarHBondContact O-N 3.14Å; L47-L197 PolarHBondContact N-O 3.45Å; L47-W198 HydrophobicContact CB-CD2 4.5Å; L47-W198 HydrophobicContact CB-CE3 4.11Å; L47-W198 HydrophobicContact CB-CZ3 4.42Å; L47-W198 HydrophobicContact CD1-CE3 4.33Å; L47-W198 HydrophobicContact CD1-CH2 3.88Å; L47-W198 HydrophobicContact CD1-CZ2 4.21Å; L47-W198 HydrophobicContact CD1-CZ3 3.95Å; L47-W198 HydrophobicContact CD2-CD2 4.48Å; L47-P200 HydrophobicContact CD2-CB 4.48Å; L47-V203 HydrophobicContact CD1-CG2 4.39Å; L47-V203 HydrophobicContact CD2-CG2 3.38Å; L47-V203 HydrophobicContact CG-CG2 3.8Å
48G85.5Confident79.4Confident0 Ų041.2 Ų41.20%021%0.212CC..Hα-helixtrans-60.6-39.617500000113.2C43 G44 V51 L52 F210C43-G48 WeakPolarHBondContact SG-CA 3.42Å; C43-G48 PolarHBondContact SG-N 3.18Å; C43-G48 VanDerWaalsContact SG-N 3.44Å; G44-G48 WeakPolarHBondContact O-CA 3.37Å; G44-G48 PolarHBondContact O-N 3.33Å; G48-V51 PolarHBondContact O-N 2.93Å; G48-L52 VanDerWaalsContact O-CB 3.31Å; G48-L52 WeakPolarHBondContact O-CB 3.38Å; G48-L52 PolarHBondContact O-N 3.18Å; G48-F210 WeakPolarHBondContact O-CE2 2.93Å
49T88.1Confident81.8Confident25 Ų2533.7 Ų33.715%0.15317%0.173CC..Hα-helixtrans-63.1-43.7173.1-55.80000111.5F45 L46 L47 L52 L53 F250F45-T49 WeakPolarHBondContact O-CB 3.4Å; F45-T49 PolarHBondContact O-N 2.9Å; F45-T49 VanDerWaalsContact O-N 3.07Å; F45-T49 PolarHBondContact O-OG1 2.88Å; L46-T49 PolarHBondContact O-N 3.39Å; L47-T49 VanDerWaalsContact C-N 3.32Å; L47-T49 PolarHBondContact O-N 2.79Å; T49-L52 PolarHBondContact O-N 3.39Å; T49-L53 HydrophobicContact CG2-CD1 4.39Å; T49-L53 WeakPolarHBondContact O-CG 3.42Å; T49-L53 PolarHBondContact O-N 3.02Å; T49-F250 HydrophobicContact CG2-CD2 3.9Å; T49-F250 HydrophobicContact CG2-CE2 3.85Å
50L91.4Very high83.8Confident86 Ų8633.3 Ų33.345%0.4517%0.168SC..Hα-helixtrans-64.3-42.4176.8-69.1176.2000112.1L46 L47 L53 F54 W198L46-L50 WeakPolarHBondContact O-CG 3.13Å; L46-L50 PolarHBondContact O-N 3.47Å; L47-L50 WeakPolarHBondContact O-CB 3.48Å; L47-L50 PolarHBondContact O-N 3.21Å; L47-L50 VanDerWaalsContact O-N 3.12Å; L50-L53 PolarHBondContact O-N 3.29Å; L50-F54 WeakPolarHBondContact O-CB 3.45Å; L50-F54 PolarHBondContact O-N 2.95Å; L50-W198 HydrophobicContact CD1-CZ3 4.1Å
51V90.4Very high85.8Confident11 Ų1132.3 Ų32.37%0.06716%0.162CC..Hα-helixtrans-63.8-42.9176.7176.70000110.3L47 G48 L53 F54 C55 V203 L207 F210L47-V51 HydrophobicContact CD1-CG2 4.42Å; L47-V51 HydrophobicContact CG-CG2 4.42Å; L47-V51 VanDerWaalsContact O-CG2 3.26Å; L47-V51 WeakPolarHBondContact O-CG2 3.32Å; L47-V51 PolarHBondContact O-N 3.14Å; G48-V51 PolarHBondContact O-N 2.93Å; V51-L53 PolarHBondContact O-N 3.04Å; V51-F54 WeakPolarHBondContact O-CB 3.47Å; V51-F54 PolarHBondContact O-N 3.44Å; V51-C55 WeakPolarHBondContact O-CB 3.48Å; V51-C55 PolarHBondContact O-N 3.01Å; V51-C55 PolarHBondContact O-SG 3.46Å; V51-V203 HydrophobicContact CG2-CG1 4.01Å; V51-V203 HydrophobicContact CG2-CG2 4.38Å; V51-L207 HydrophobicContact CG1-CD2 3.65Å; V51-L207 HydrophobicContact CG1-CG 4.09Å; V51-F210 HydrophobicContact CB-CD2 4.41Å; V51-F210 HydrophobicContact CB-CE2 4.44Å; V51-F210 HydrophobicContact CG1-CD2 3.93Å; V51-F210 HydrophobicContact CG1-CE2 4.36Å
52L91.3Very high87.4Confident4 Ų431 Ų312%0.02116%0.155CC..Hα-helixtrans-59.7-47.2176.2179.966.2000111.8G48 T49 F54 C55 A56 F210 L214 Y249 F250G48-L52 VanDerWaalsContact O-CB 3.31Å; G48-L52 WeakPolarHBondContact O-CB 3.38Å; G48-L52 PolarHBondContact O-N 3.18Å; T49-L52 PolarHBondContact O-N 3.39Å; L52-F54 VanDerWaalsContact C-N 3.33Å; L52-F54 PolarHBondContact O-N 3.1Å; L52-C55 PolarHBondContact O-N 2.85Å; L52-A56 WeakPolarHBondContact O-CB 3.28Å; L52-A56 PolarHBondContact O-N 3.5Å; L52-F210 HydrophobicContact CB-CD2 4.01Å; L52-F210 HydrophobicContact CB-CE2 4.02Å; L52-F210 HydrophobicContact CD1-CD2 4.24Å; L52-F210 HydrophobicContact CD1-CG 4.25Å; L52-L214 HydrophobicContact CD1-CD1 3.93Å; L52-Y249 HydrophobicContact CD1-CD2 4.08Å; L52-F250 HydrophobicContact CD2-CB 4.45Å
53L93.3Very high88.9Confident99 Ų9930.9 Ų30.952%0.51815%0.154SC..Hα-helixtrans-64.3-38.2177.1-69.4175.9000112T49 L50 V51 A56 H57T49-L53 HydrophobicContact CG2-CD1 4.39Å; T49-L53 WeakPolarHBondContact O-CG 3.42Å; T49-L53 PolarHBondContact O-N 3.02Å; L50-L53 PolarHBondContact O-N 3.29Å; V51-L53 PolarHBondContact O-N 3.04Å; L53-A56 PolarHBondContact O-N 3.32Å; L53-H57 WeakPolarHBondContact O-CB 3.42Å; L53-H57 PolarHBondContact O-N 3.32Å
54F93Very high89.9Confident92 Ų9235.3 Ų35.340%0.40417%0.171SC..Hα-helixtrans-64-49.2174.6175.5-101.3000111.6L50 V51 L52 A56 H57 I58 Y400L50-F54 WeakPolarHBondContact O-CB 3.45Å; L50-F54 PolarHBondContact O-N 2.95Å; V51-F54 WeakPolarHBondContact O-CB 3.47Å; V51-F54 PolarHBondContact O-N 3.44Å; L52-F54 VanDerWaalsContact C-N 3.33Å; L52-F54 PolarHBondContact O-N 3.1Å; F54-A56 VanDerWaalsContact C-N 3.33Å; F54-A56 PolarHBondContact O-N 3.09Å; F54-H57 WeakPolarHBondContact O-CB 3.35Å; F54-H57 PolarHBondContact O-N 2.85Å; F54-H57 VanDerWaalsContact O-N 3.16Å; F54-I58 HydrophobicContact CD1-CG1 4.41Å; F54-I58 HydrophobicContact CD2-CG1 4.37Å; F54-I58 HydrophobicContact CE1-CG1 3.97Å; F54-I58 HydrophobicContact CE2-CD1 4.05Å; F54-I58 HydrophobicContact CE2-CG1 3.92Å; F54-I58 HydrophobicContact CZ-CD1 4.01Å; F54-I58 HydrophobicContact CZ-CG1 3.7Å; F54-I58 WeakPolarHBondContact O-CG1 3.08Å; F54-I58 PolarHBondContact O-N 3.3Å; F54-Y400 HydrophobicContact CD1-CE2 4.42Å; F54-Y400 AromaticContact CE1-CD2 3.9Å; F54-Y400 HydrophobicContact CE1-CD2 3.9Å; F54-Y400 AromaticContact CE1-CE2 3.6Å; F54-Y400 HydrophobicContact CE1-CE2 3.6Å; F54-Y400 HydrophobicContact CZ-CD2 4.35Å; F54-Y400 HydrophobicContact CZ-CE2 4.48Å
55C92.5Very high90.6Very high0 Ų035.5 Ų35.50%017%0.171CC..Hα-helixtrans-56.2-48.3174.9-70.80000110.7V51 L52 H57 I58 T59 F210 L214 Y400V51-C55 WeakPolarHBondContact O-CB 3.48Å; V51-C55 PolarHBondContact O-N 3.01Å; V51-C55 PolarHBondContact O-SG 3.46Å; L52-C55 PolarHBondContact O-N 2.85Å; C55-H57 VanDerWaalsContact C-N 3.3Å; C55-H57 PolarHBondContact O-N 3.1Å; C55-I58 PolarHBondContact O-N 3.22Å; C55-I58 VanDerWaalsContact O-N 3.17Å; C55-T59 WeakPolarHBondContact O-CB 3.32Å; C55-T59 PolarHBondContact O-N 3.12Å; C55-T59 PolarHBondContact O-OG1 2.95Å; C55-F210 HydrophobicContact CB-CB 4.4Å; C55-L214 HydrophobicContact CB-CD1 3.75Å; C55-Y400 PolarHBondContact SG-OH 2.96Å
56A93.9Very high91Very high11 Ų1134.1 Ų34.19%0.09117%0.166CC..Hα-helixtrans-60.3-38.3178.100000113.1L52 L53 F54 K60 L214 C246L52-A56 WeakPolarHBondContact O-CB 3.28Å; L52-A56 PolarHBondContact O-N 3.5Å; L53-A56 PolarHBondContact O-N 3.32Å; F54-A56 VanDerWaalsContact C-N 3.33Å; F54-A56 PolarHBondContact O-N 3.09Å; A56-K60 WeakPolarHBondContact O-CB 3.37Å; A56-K60 PolarHBondContact O-N 3.3Å; A56-L214 HydrophobicContact CB-CD1 4.01Å; A56-C246 WeakPolarHBondContact CB-SG 3.43Å
57H93.8Very high91.2Very high102 Ų10229.9 Ų29.947%0.47214%0.144SC..Hα-helixtrans-62.9-49.5174.1-17980.2000111.5L53 F54 C55 T59 K60 V61L53-H57 WeakPolarHBondContact O-CB 3.42Å; L53-H57 PolarHBondContact O-N 3.32Å; F54-H57 WeakPolarHBondContact O-CB 3.35Å; F54-H57 PolarHBondContact O-N 2.85Å; F54-H57 VanDerWaalsContact O-N 3.16Å; C55-H57 VanDerWaalsContact C-N 3.3Å; C55-H57 PolarHBondContact O-N 3.1Å; H57-T59 PolarHBondContact O-N 3.23Å; H57-K60 WeakPolarHBondContact O-CB 3.44Å; H57-K60 PolarHBondContact O-N 2.98Å; H57-V61 WeakPolarHBondContact O-CG2 3.24Å; H57-V61 PolarHBondContact O-N 2.59Å
58I93.3Very high91.2Very high0 Ų029.7 Ų29.70%015%0.145CC..Hα-helixtrans-65.3-38.4179.3-61.2-65.1000111.4F54 C55 K60 V61 S62 Y372 L396 Y400F54-I58 HydrophobicContact CD1-CG1 4.41Å; F54-I58 HydrophobicContact CD2-CG1 4.37Å; F54-I58 HydrophobicContact CE1-CG1 3.97Å; F54-I58 HydrophobicContact CE2-CD1 4.05Å; F54-I58 HydrophobicContact CE2-CG1 3.92Å; F54-I58 HydrophobicContact CZ-CD1 4.01Å; F54-I58 HydrophobicContact CZ-CG1 3.7Å; F54-I58 WeakPolarHBondContact O-CG1 3.08Å; F54-I58 PolarHBondContact O-N 3.3Å; C55-I58 PolarHBondContact O-N 3.22Å; C55-I58 VanDerWaalsContact O-N 3.17Å; I58-K60 VanDerWaalsContact C-N 3.34Å; I58-K60 PolarHBondContact O-N 3.05Å; I58-V61 PolarHBondContact O-N 2.58Å; I58-S62 PolarHBondContact O-N 2.99Å; I58-Y372 HydrophobicContact CB-CE1 4.43Å; I58-Y372 HydrophobicContact CG2-CD1 3.73Å; I58-Y372 HydrophobicContact CG2-CE1 3.67Å; I58-L396 HydrophobicContact CD1-CD2 3.81Å; I58-L396 HydrophobicContact CD1-CG 4.26Å; I58-Y400 HydrophobicContact CB-CD1 4.49Å; I58-Y400 HydrophobicContact CG2-CD1 3.62Å; I58-Y400 HydrophobicContact CG2-CE1 4.06Å; I58-Y400 HydrophobicContact CG2-CG 4.2Å
59T93.8Very high91.3Very high0 Ų029.7 Ų29.70%015%0.145CC..Hα-helixtrans-61.7-41.9173.1-53.90000111.4C55 H57 V61 S62 C63 L214 L242 Y372C55-T59 WeakPolarHBondContact O-CB 3.32Å; C55-T59 PolarHBondContact O-N 3.12Å; C55-T59 PolarHBondContact O-OG1 2.95Å; H57-T59 PolarHBondContact O-N 3.23Å; T59-V61 PolarHBondContact O-N 3.09Å; T59-S62 PolarHBondContact O-N 3.28Å; T59-C63 PolarHBondContact O-N 3.38Å; T59-C63 PolarHBondContact O-SG 3.46Å; T59-L214 WeakPolarHBondContact CG2-O 3.43Å; T59-L242 HydrophobicContact CG2-CD1 4.47Å; T59-L242 HydrophobicContact CG2-CD2 3.91Å; T59-Y372 PolarHBondContact OG1-OH 2.69Å
60K93.6Very high91.2Very high73 Ų7328.5 Ų28.532%0.31714%0.138SC..Hα-helixtrans-61-44.3175.1-171.9177.7-174.6174.80111.5A56 H57 I58 C63 R64 L242A56-K60 WeakPolarHBondContact O-CB 3.37Å; A56-K60 PolarHBondContact O-N 3.3Å; H57-K60 WeakPolarHBondContact O-CB 3.44Å; H57-K60 PolarHBondContact O-N 2.98Å; I58-K60 VanDerWaalsContact C-N 3.34Å; I58-K60 PolarHBondContact O-N 3.05Å; K60-C63 PolarHBondContact O-N 3.29Å; K60-R64 VanDerWaalsContact O-CG 3.32Å; K60-R64 WeakPolarHBondContact O-CG 3.49Å; K60-R64 PolarHBondContact O-N 3.06Å; K60-R64 VanDerWaalsContact O-N 3.08Å; K60-L242 HydrophobicContact CB-CD1 3.64Å; K60-L242 HydrophobicContact CG-CD1 4.18Å
61V92.7Very high90.8Very high4 Ų429 Ų292%0.02413%0.133CC..Hα-helixtrans-59.7-49.9174.51750000109.7H57 I58 T59 C63 R64 L65 E393 C397H57-V61 WeakPolarHBondContact O-CG2 3.24Å; H57-V61 PolarHBondContact O-N 2.59Å; I58-V61 PolarHBondContact O-N 2.58Å; T59-V61 PolarHBondContact O-N 3.09Å; V61-C63 PolarHBondContact O-N 3.31Å; V61-R64 WeakPolarHBondContact O-CA 3.45Å; V61-R64 VanDerWaalsContact O-CB 3.28Å; V61-R64 WeakPolarHBondContact O-CB 3.38Å; V61-R64 PolarHBondContact O-N 3.27Å; V61-L65 HydrophobicContact CG1-CD1 4.48Å; V61-L65 HydrophobicContact CG1-CG 4.48Å; V61-L65 WeakPolarHBondContact O-CG 3.33Å; V61-L65 PolarHBondContact O-N 2.68Å; V61-E393 HydrophobicContact CG1-CB 3.76Å; V61-E393 HydrophobicContact CG1-CG 4.21Å; V61-C397 VanDerWaalsContact CG1-SG 3.54Å
62S93.1Very high90.6Very high0 Ų031.4 Ų31.40%015%0.148CC..Hα-helixtrans-58.8-43.7178.8-176.70000113.4I58 T59 R64 L65 V66 G371 P375I58-S62 PolarHBondContact O-N 2.99Å; T59-S62 PolarHBondContact O-N 3.28Å; S62-R64 VanDerWaalsContact C-N 3.26Å; S62-R64 PolarHBondContact O-N 2.95Å; S62-L65 WeakPolarHBondContact O-CA 3.3Å; S62-L65 WeakPolarHBondContact O-CB 3.33Å; S62-L65 PolarHBondContact O-N 3.17Å; S62-V66 PolarHBondContact O-N 3.16Å; S62-G371 VanDerWaalsContact CB-O 3.27Å; S62-G371 WeakPolarHBondContact CB-O 3.46Å; S62-G371 PolarHBondContact OG-O 2.87Å; S62-P375 WeakPolarHBondContact OG-CB 3.47Å; S62-P375 WeakPolarHBondContact OG-CG 3.47Å
63C91.8Very high90.2Very high0 Ų032.4 Ų32.40%016%0.155CC..Hα-helixtrans-61.7-34.7175.4-67.20000112.5T59 K60 V61 T67 L220 V238T59-C63 PolarHBondContact O-N 3.38Å; T59-C63 PolarHBondContact O-SG 3.46Å; K60-C63 PolarHBondContact O-N 3.29Å; V61-C63 PolarHBondContact O-N 3.31Å; C63-T67 WeakPolarHBondContact O-CB 3.47Å; C63-T67 PolarHBondContact O-N 3.5Å; C63-T67 PolarHBondContact O-OG1 2.81Å; C63-L220 HydrophobicContact CB-CD2 3.7Å; C63-V238 HydrophobicContact CB-CG1 3.79Å
64R90.2Very high89.6Confident94 Ų9436.4 Ų36.436%0.35517%0.168SC..Hα-helixtrans-65.3-41.4171-69.3166.3172.8178.1-5.2111.3K60 V61 S62 T67 A68 L235K60-R64 VanDerWaalsContact O-CG 3.32Å; K60-R64 WeakPolarHBondContact O-CG 3.49Å; K60-R64 PolarHBondContact O-N 3.06Å; K60-R64 VanDerWaalsContact O-N 3.08Å; V61-R64 WeakPolarHBondContact O-CA 3.45Å; V61-R64 VanDerWaalsContact O-CB 3.28Å; V61-R64 WeakPolarHBondContact O-CB 3.38Å; V61-R64 PolarHBondContact O-N 3.27Å; S62-R64 VanDerWaalsContact C-N 3.26Å; S62-R64 PolarHBondContact O-N 2.95Å; R64-T67 PolarHBondContact O-N 3.43Å; R64-A68 WeakPolarHBondContact O-CB 3.12Å; R64-A68 PolarHBondContact O-N 3.21Å; R64-L235 HydrophobicContact CB-CD2 4.39Å; R64-L235 HydrophobicContact CG-CD1 4.23Å; R64-L235 HydrophobicContact CG-CD2 3.8Å
65L90.4Very high88.8Confident4 Ų432.4 Ų32.42%0.02115%0.151CC..Hα-helixtrans-61.7-44.1176.3-60.1176.8000111.7V61 S62 A68 S69 P375 A376 Y379 A394 C397V61-L65 HydrophobicContact CG1-CD1 4.48Å; V61-L65 HydrophobicContact CG1-CG 4.48Å; V61-L65 WeakPolarHBondContact O-CG 3.33Å; V61-L65 PolarHBondContact O-N 2.68Å; S62-L65 WeakPolarHBondContact O-CA 3.3Å; S62-L65 WeakPolarHBondContact O-CB 3.33Å; S62-L65 PolarHBondContact O-N 3.17Å; L65-A68 PolarHBondContact O-N 2.97Å; L65-S69 VanDerWaalsContact O-CB 3.3Å; L65-S69 WeakPolarHBondContact O-CB 3.29Å; L65-S69 PolarHBondContact O-N 3.03Å; L65-S69 PolarHBondContact O-OG 3.1Å; L65-P375 HydrophobicContact CB-CB 4.33Å; L65-A376 HydrophobicContact CD1-CB 4.41Å; L65-Y379 HydrophobicContact CB-CD2 4.29Å; L65-Y379 HydrophobicContact CB-CG 4.39Å; L65-Y379 HydrophobicContact CD2-CD1 3.93Å; L65-Y379 HydrophobicContact CD2-CD2 3.74Å; L65-Y379 HydrophobicContact CD2-CE1 4.27Å; L65-Y379 HydrophobicContact CD2-CE2 4.06Å; L65-Y379 HydrophobicContact CD2-CG 3.68Å; L65-A394 HydrophobicContact CD1-CB 3.99Å; L65-A394 HydrophobicContact CD2-CB 3.99Å; L65-C397 HydrophobicContact CD1-CB 4.04Å
66V89.7Confident87.9Confident2 Ų236 Ų361%0.01217%0.17CC..Hα-helixtrans-56.3-54.8174171.70000110S62 A68 S69 C70 F78 Q217 P375S62-V66 PolarHBondContact O-N 3.16Å; V66-A68 VanDerWaalsContact C-N 3.34Å; V66-A68 PolarHBondContact O-N 3.36Å; V66-S69 PolarHBondContact O-N 2.95Å; V66-C70 PolarHBondContact O-N 3Å; V66-C70 VanDerWaalsContact O-N 3.12Å; V66-C70 PolarHBondContact O-SG 2.79Å; V66-F78 HydrophobicContact CB-CD2 4.19Å; V66-F78 HydrophobicContact CB-CE2 4.46Å; V66-F78 HydrophobicContact CG1-CB 4.06Å; V66-F78 HydrophobicContact CG1-CD2 3.74Å; V66-F78 HydrophobicContact CG1-CE2 4.47Å; V66-F78 HydrophobicContact CG1-CG 4Å; V66-F78 HydrophobicContact CG2-CD2 4.19Å; V66-F78 HydrophobicContact CG2-CE2 4.15Å; V66-Q217 HydrophobicContact CG2-CG 4.41Å; V66-P375 HydrophobicContact CG2-CB 3.76Å; V66-P375 HydrophobicContact CG2-CG 3.75Å
67T87.2Confident87.2Confident2 Ų235.5 Ų35.51%0.01217%0.166CC..Hα-helixtrans-63.2-40.5-176.9-550000112.1C63 R64 R71 L234 L235C63-T67 WeakPolarHBondContact O-CB 3.47Å; C63-T67 PolarHBondContact O-N 3.5Å; C63-T67 PolarHBondContact O-OG1 2.81Å; R64-T67 PolarHBondContact O-N 3.43Å; T67-R71 WeakPolarHBondContact O-CG 3.28Å; T67-R71 PolarHBondContact O-N 3.33Å; T67-L234 HydrophobicContact CG2-CD2 4.06Å; T67-L235 HydrophobicContact CG2-CD2 4.21Å; T67-L235 HydrophobicContact CG2-CG 4.38Å
68A87.1Confident86.8Confident15 Ų1531.1 Ų31.112%0.12415%0.145CC..Hα-helixtrans-68.1-37.3178.300000111.9R64 L65 V66 R71 T72 Y379 Y383R64-A68 WeakPolarHBondContact O-CB 3.12Å; R64-A68 PolarHBondContact O-N 3.21Å; L65-A68 PolarHBondContact O-N 2.97Å; V66-A68 VanDerWaalsContact C-N 3.34Å; V66-A68 PolarHBondContact O-N 3.36Å; A68-R71 PolarHBondContact O-N 2.99Å; A68-T72 PolarHBondContact O-N 3.02Å; A68-T72 VanDerWaalsContact O-N 3.08Å; A68-T72 PolarHBondContact O-OG1 3.15Å; A68-T72 VanDerWaalsContact O-OG1 3.08Å; A68-Y379 HydrophobicContact CB-CD2 4.15Å; A68-Y379 HydrophobicContact CB-CE2 3.78Å; A68-Y383 HydrophobicContact CB-CE2 4.27Å; A68-Y383 PolarHBondContact O-OH 3.47Å
69S86.9Confident86.4Confident0 Ų031.5 Ų31.50%015%0.147CC..Hα-helixtrans-62.8-50176.5-60.60000111L65 V66 R71 T72 T73 S81 Y379L65-S69 VanDerWaalsContact O-CB 3.3Å; L65-S69 WeakPolarHBondContact O-CB 3.29Å; L65-S69 PolarHBondContact O-N 3.03Å; L65-S69 PolarHBondContact O-OG 3.1Å; V66-S69 PolarHBondContact O-N 2.95Å; S69-R71 VanDerWaalsContact C-N 3.3Å; S69-R71 PolarHBondContact O-N 3.43Å; S69-T72 PolarHBondContact O-N 3.2Å; S69-T73 PolarHBondContact O-N 3.46Å; S69-T73 PolarHBondContact O-OG1 3.47Å; S69-S81 PolarHBondContact O-OG 3.08Å; S69-Y379 WeakPolarHBondContact OG-CA 3.31Å
70C85.2Confident85.9Confident0 Ų032 Ų320%015%0.153CC..Hα-helixtrans-63.5-35.6-179.9-50.10000112.5V66 T73 K74 S75 F78 V224V66-C70 PolarHBondContact O-N 3Å; V66-C70 VanDerWaalsContact O-N 3.12Å; V66-C70 PolarHBondContact O-SG 2.79Å; C70-T73 PolarHBondContact O-OG1 2.88Å; C70-K74 WeakPolarHBondContact O-CA 3.48Å; C70-K74 PolarHBondContact O-N 3.33Å; C70-S75 PolarHBondContact O-N 3.1Å; C70-F78 VanDerWaalsContact SG-CA 3.52Å; C70-V224 HydrophobicContact CB-CG1 4.07Å
71R84Confident85.5Confident96 Ų9628.6 Ų28.636%0.36214%0.137SC..Hα-helixtrans-65.6-42.6175.2-75.2-178.2-166.6159.119.8112.7T67 A68 S69 K74 G231T67-R71 WeakPolarHBondContact O-CG 3.28Å; T67-R71 PolarHBondContact O-N 3.33Å; A68-R71 PolarHBondContact O-N 2.99Å; S69-R71 VanDerWaalsContact C-N 3.3Å; S69-R71 PolarHBondContact O-N 3.43Å; R71-K74 PolarHBondContact O-N 3.07Å; R71-G231 VanDerWaalsContact CZ-CA 3.46Å; R71-G231 PolarHBondContact NH2-O 3.01Å
72T84.9Confident85.2Confident61 Ų6128.4 Ų28.437%0.37414%0.136SC..Hα-helixtrans-70.2-42.7-178-64.80000111.8A68 S69 K74 Y383A68-T72 PolarHBondContact O-N 3.02Å; A68-T72 VanDerWaalsContact O-N 3.08Å; A68-T72 PolarHBondContact O-OG1 3.15Å; A68-T72 VanDerWaalsContact O-OG1 3.08Å; S69-T72 PolarHBondContact O-N 3.2Å; T72-K74 PolarHBondContact O-N 2.91Å; T72-Y383 HydrophobicContact CG2-CD2 4.32Å; T72-Y383 HydrophobicContact CG2-CE2 4.1Å; T72-Y383 WeakPolarHBondContact OG1-CE2 3.42Å; T72-Y383 PolarHBondContact OG1-OH 2.7Å
73T84Confident84.9Confident26 Ų2633 Ų3316%0.1615%0.154CC..Hα-helixtrans-77.6-11.9178.555.90000112.9S69 C70 S75 S81 T85 A382S69-T73 PolarHBondContact O-N 3.46Å; S69-T73 PolarHBondContact O-OG1 3.47Å; C70-T73 PolarHBondContact O-OG1 2.88Å; T73-S75 PolarHBondContact O-N 3.37Å; T73-S75 PolarHBondContact OG1-OG 3.47Å; T73-S81 VanDerWaalsContact CG2-OG 3.24Å; T73-S81 WeakPolarHBondContact CG2-OG 3.5Å; T73-S81 WeakPolarHBondContact OG1-CB 3.43Å; T73-S81 PolarHBondContact OG1-OG 2.97Å; T73-T85 HydrophobicContact CG2-CG2 3.58Å; T73-A382 HydrophobicContact CG2-CB 4.22Å
74K81Confident84.6Confident183 Ų18338 Ų3880%0.79618%0.18SC*.THydrogen-bonded Turntrans52.629.6-172.3-57-179.6-179177.90112.2C70 R71 T72C70-K74 WeakPolarHBondContact O-CA 3.48Å; C70-K74 PolarHBondContact O-N 3.33Å; R71-K74 PolarHBondContact O-N 3.07Å; T72-K74 PolarHBondContact O-N 2.91Å
75S75.8Confident84.4Confident7 Ų734.4 Ų34.45%0.04917%0.168CC..  trans-84.4146179.764.70000110.8C70 T73 G77 G80 S81 Q228C70-S75 PolarHBondContact O-N 3.1Å; T73-S75 PolarHBondContact O-N 3.37Å; T73-S75 PolarHBondContact OG1-OG 3.47Å; S75-G77 PolarHBondContact O-N 2.84Å; S75-G77 PolarHBondContact OG-O 3.34Å; S75-G80 VanDerWaalsContact CB-C 3.41Å; S75-S81 VanDerWaalsContact CB-N 3.29Å; S75-S81 WeakPolarHBondContact OG-CA 3.27Å; S75-S81 VanDerWaalsContact OG-CB 3.23Å; S75-S81 WeakPolarHBondContact OG-CB 3.5Å; S75-S81 PolarHBondContact OG-N 3.06Å; S75-Q228 PolarHBondContact O-NE2 2.85Å; S75-Q228 PolarHBondContact O-OE1 3.26Å
76L73.4Confident84.1Confident77 Ų7734.3 Ų34.340%0.40317%0.167SC..SBendtrans-72.5116.3157.1-57.9172.8000106.1F322L76-F322 WeakPolarHBondContact O-CD1 3.48Å
77G79.5Confident83.8Confident0 Ų034.9 Ų34.90%017%0.174CC..Hα-helixtrans88.6157.4174.200000113.6S75 Q79 G80 S81 D225S75-G77 PolarHBondContact O-N 2.84Å; S75-G77 PolarHBondContact OG-O 3.34Å; G77-Q79 VanDerWaalsContact C-N 3.28Å; G77-G80 PolarHBondContact O-N 3.04Å; G77-S81 PolarHBondContact O-N 2.93Å; G77-S81 VanDerWaalsContact O-N 3.14Å; G77-D225 WeakPolarHBondContact CA-OD1 3.16Å; G77-D225 VanDerWaalsContact N-CG 3.32Å; G77-D225 PolarHBondContact N-OD1 3.26Å
78F85.2Confident83.7Confident10 Ų1038.3 Ų38.34%0.04420%0.198CC..Hα-helixtrans-67.8-34.3167.4-175.8-111.9000111.2V66 C70 S81 A82 I94 L374 P375 V378V66-F78 HydrophobicContact CB-CD2 4.19Å; V66-F78 HydrophobicContact CB-CE2 4.46Å; V66-F78 HydrophobicContact CG1-CB 4.06Å; V66-F78 HydrophobicContact CG1-CD2 3.74Å; V66-F78 HydrophobicContact CG1-CE2 4.47Å; V66-F78 HydrophobicContact CG1-CG 4Å; V66-F78 HydrophobicContact CG2-CD2 4.19Å; V66-F78 HydrophobicContact CG2-CE2 4.15Å; C70-F78 VanDerWaalsContact SG-CA 3.52Å; F78-S81 WeakPolarHBondContact O-CB 3.32Å; F78-S81 PolarHBondContact O-N 2.71Å; F78-A82 PolarHBondContact O-N 2.92Å; F78-I94 HydrophobicContact CD1-CG2 4.28Å; F78-I94 HydrophobicContact CE1-CD1 4.02Å; F78-I94 HydrophobicContact CE1-CG2 4.39Å; F78-L374 HydrophobicContact CE1-CB 4.46Å; F78-P375 HydrophobicContact CZ-CB 4.45Å; F78-P375 HydrophobicContact CZ-CG 4.36Å; F78-V378 HydrophobicContact CE1-CG2 4.34Å; F78-V378 HydrophobicContact CE2-CB 3.82Å; F78-V378 HydrophobicContact CE2-CG1 3.77Å; F78-V378 HydrophobicContact CE2-CG2 4.08Å; F78-V378 HydrophobicContact CZ-CB 3.78Å; F78-V378 HydrophobicContact CZ-CG1 4.18Å; F78-V378 HydrophobicContact CZ-CG2 3.61Å
79Q85.1Confident83.4Confident8 Ų840.7 Ų40.74%0.03721%0.206CC..Hα-helixtrans-59.8-47.9173.8-62.485.5-20.500110.7G77 S81 A82 R83 C91 I94 E95G77-Q79 VanDerWaalsContact C-N 3.28Å; Q79-S81 VanDerWaalsContact C-N 3.28Å; Q79-S81 PolarHBondContact O-N 3.06Å; Q79-A82 PolarHBondContact O-N 3.47Å; Q79-R83 PolarHBondContact O-N 2.92Å; Q79-C91 PolarHBondContact O-SG 3.35Å; Q79-I94 HydrophobicContact CG-CG2 4.47Å; Q79-E95 HydrophobicContact CG-CG 4.25Å
80G82.3Confident83.2Confident11 Ų1140.7 Ų40.711%0.11321%0.206CC..Hα-helixtrans-59.8-40174.200000112.1S75 G77 A82 R83 I84S75-G80 VanDerWaalsContact CB-C 3.41Å; G77-G80 PolarHBondContact O-N 3.04Å; G80-A82 VanDerWaalsContact C-N 3.35Å; G80-A82 PolarHBondContact O-N 2.98Å; G80-R83 PolarHBondContact O-N 3.32Å; G80-I84 WeakPolarHBondContact O-CG1 3.22Å; G80-I84 PolarHBondContact O-N 2.98Å; G80-I84 VanDerWaalsContact O-N 3.1Å
81S85.6Confident83.2Confident0 Ų040.8 Ų40.80%021%0.206CC..Hα-helixtrans-61.9-45.7177.4-170.40000110.7S69 T73 S75 G77 F78 Q79 I84 T85S69-S81 PolarHBondContact O-OG 3.08Å; T73-S81 VanDerWaalsContact CG2-OG 3.24Å; T73-S81 WeakPolarHBondContact CG2-OG 3.5Å; T73-S81 WeakPolarHBondContact OG1-CB 3.43Å; T73-S81 PolarHBondContact OG1-OG 2.97Å; S75-S81 VanDerWaalsContact CB-N 3.29Å; S75-S81 WeakPolarHBondContact OG-CA 3.27Å; S75-S81 VanDerWaalsContact OG-CB 3.23Å; S75-S81 WeakPolarHBondContact OG-CB 3.5Å; S75-S81 PolarHBondContact OG-N 3.06Å; G77-S81 PolarHBondContact O-N 2.93Å; G77-S81 VanDerWaalsContact O-N 3.14Å; F78-S81 WeakPolarHBondContact O-CB 3.32Å; F78-S81 PolarHBondContact O-N 2.71Å; Q79-S81 VanDerWaalsContact C-N 3.28Å; Q79-S81 PolarHBondContact O-N 3.06Å; S81-I84 PolarHBondContact O-N 2.85Å; S81-T85 VanDerWaalsContact O-CG2 3.26Å; S81-T85 WeakPolarHBondContact O-CG2 3.47Å; S81-T85 PolarHBondContact O-N 3.46Å; S81-T85 PolarHBondContact O-OG1 3.4Å
82A86.3Confident83.4Confident0 Ų037 Ų370%019%0.193CC..Hα-helixtrans-67.6-35.7178.600000113F78 Q79 G80 I84 T85 I86 G87 I94 V378F78-A82 PolarHBondContact O-N 2.92Å; Q79-A82 PolarHBondContact O-N 3.47Å; G80-A82 VanDerWaalsContact C-N 3.35Å; G80-A82 PolarHBondContact O-N 2.98Å; A82-I84 VanDerWaalsContact C-N 3.3Å; A82-I84 PolarHBondContact O-N 3.36Å; A82-T85 WeakPolarHBondContact CA-OG1 3.45Å; A82-T85 PolarHBondContact O-N 3.03Å; A82-I86 WeakPolarHBondContact O-CA 3.42Å; A82-I86 PolarHBondContact O-N 3.47Å; A82-G87 PolarHBondContact O-N 3.21Å; A82-I94 HydrophobicContact CB-CD1 3.14Å; A82-V378 HydrophobicContact CB-CG2 3.79Å
83R86.7Confident83.4Confident96 Ų9634.1 Ų34.136%0.36218%0.175SC..Hα-helixtrans-60.7-41.1174.1-173.9178.9-72.4-165.4-2.3111.1Q79 G80 G87 C91Q79-R83 PolarHBondContact O-N 2.92Å; G80-R83 PolarHBondContact O-N 3.32Å; R83-G87 CarbonylContact O-C 3.57Å; R83-G87 WeakPolarHBondContact O-CA 3.33Å; R83-G87 PolarHBondContact O-N 3.27Å; R83-G87 VanDerWaalsContact O-N 3.16Å; R83-C91 HydrophobicContact CB-CB 4.05Å
84I85.9Confident83.6Confident107 Ų10733 Ų3355%0.54917%0.168SC..Hα-helixtrans-70.2-39.3177.5-65.9170.2000111.3G80 S81 A82G80-I84 WeakPolarHBondContact O-CG1 3.22Å; G80-I84 PolarHBondContact O-N 2.98Å; G80-I84 VanDerWaalsContact O-N 3.1Å; S81-I84 PolarHBondContact O-N 2.85Å; A82-I84 VanDerWaalsContact C-N 3.3Å; A82-I84 PolarHBondContact O-N 3.36Å
85T85.5Confident83.9Confident18 Ų1824.4 Ų24.411%0.1113%0.131CC..Hα-helixtrans-92.8-35-169.658.90000114.6T73 S81 A82 A382 H562T73-T85 HydrophobicContact CG2-CG2 3.58Å; S81-T85 VanDerWaalsContact O-CG2 3.26Å; S81-T85 WeakPolarHBondContact O-CG2 3.47Å; S81-T85 PolarHBondContact O-N 3.46Å; S81-T85 PolarHBondContact O-OG1 3.4Å; A82-T85 WeakPolarHBondContact CA-OG1 3.45Å; A82-T85 PolarHBondContact O-N 3.03Å; T85-A382 HydrophobicContact CG2-CB 3.67Å; T85-H562 PolarHBondContact O-CE1 3.23Å; T85-H562 PolarHBondContact O-ND1 2.9Å
86I84.3Confident84.5Confident1 Ų126.2 Ų26.21%0.00514%0.14CC..THydrogen-bonded Turntrans-113.4-19.7-176.4-54.9175.3000110.9A82 V378 H562 A565 L569A82-I86 WeakPolarHBondContact O-CA 3.42Å; A82-I86 PolarHBondContact O-N 3.47Å; I86-V378 HydrophobicContact CD1-CG2 3.64Å; I86-H562 VanDerWaalsContact C-ND1 3.29Å; I86-H562 PolarHBondContact O-ND1 3.39Å; I86-A565 HydrophobicContact CG2-CB 4.12Å; I86-L569 HydrophobicContact CG2-CD1 4.11Å
87G84.5Confident85.3Confident14 Ų1422.7 Ų22.714%0.14412%0.121CC..  trans97.1174.9-17800000112.5A82 R83 F89 G90 C91A82-G87 PolarHBondContact O-N 3.21Å; R83-G87 CarbonylContact O-C 3.57Å; R83-G87 WeakPolarHBondContact O-CA 3.33Å; R83-G87 PolarHBondContact O-N 3.27Å; R83-G87 VanDerWaalsContact O-N 3.16Å; G87-F89 VanDerWaalsContact C-N 3.26Å; G87-F89 PolarHBondContact O-N 2.8Å; G87-G90 PolarHBondContact O-N 3.16Å; G87-C91 PolarHBondContact O-N 3.26Å
88S84.4Confident85.8Confident74 Ų7423 Ų2352%0.51712%0.123SC..Hα-helixtrans-55.6-39.4-176.9-480000113.1G90 C91 L92 Q310S88-G90 VanDerWaalsContact C-N 3.35Å; S88-G90 PolarHBondContact O-N 2.96Å; S88-C91 VanDerWaalsContact O-CB 3.27Å; S88-C91 WeakPolarHBondContact O-CB 3.39Å; S88-C91 PolarHBondContact O-N 2.88Å; S88-C91 VanDerWaalsContact O-N 3.14Å; S88-L92 PolarHBondContact O-N 3.35Å; S88-Q310 PolarHBondContact O-OE1 2.96Å
89F82.1Confident86.1Confident66 Ų6623.1 Ų23.129%0.28913%0.125SC..Hα-helixtrans-61.4-40.4177.3-172.4-100.5000113G87 C91 L92 I93 R566 I570G87-F89 VanDerWaalsContact C-N 3.26Å; G87-F89 PolarHBondContact O-N 2.8Å; F89-C91 VanDerWaalsContact C-N 3.3Å; F89-C91 PolarHBondContact O-N 3.44Å; F89-L92 WeakPolarHBondContact O-CB 3.42Å; F89-L92 PolarHBondContact O-N 3.44Å; F89-I93 HydrophobicContact CD1-CD1 3.35Å; F89-I93 HydrophobicContact CE1-CD1 3.06Å; F89-I93 HydrophobicContact CE1-CG1 4.29Å; F89-I93 HydrophobicContact CE2-CD1 4.32Å; F89-I93 HydrophobicContact CG-CD1 4.15Å; F89-I93 HydrophobicContact CZ-CD1 3.58Å; F89-I93 HydrophobicContact CZ-CG1 4.42Å; F89-I93 VanDerWaalsContact O-CD1 3.22Å; F89-I93 WeakPolarHBondContact O-CD1 3.19Å; F89-I93 PolarHBondContact O-N 3.17Å; F89-I93 VanDerWaalsContact O-N 3.15Å; F89-R566 HydrophobicContact CB-CG 4.47Å; F89-R566 HydrophobicContact CD1-CB 3.93Å; F89-R566 HydrophobicContact CD1-CG 3.66Å; F89-R566 HydrophobicContact CE1-CB 4.11Å; F89-R566 HydrophobicContact CE1-CG 4.35Å; F89-R566 HydrophobicContact CG-CG 4.42Å; F89-I570 HydrophobicContact CE1-CD1 3.78Å; F89-I570 HydrophobicContact CE1-CG1 3.52Å; F89-I570 HydrophobicContact CZ-CD1 3.77Å; F89-I570 HydrophobicContact CZ-CG1 3.34Å
90G81.1Confident86.3Confident0 Ų025 Ų250%014%0.138CC..Hα-helixtrans-66.4-35.5175.700000112.4G87 S88 I93 I94G87-G90 PolarHBondContact O-N 3.16Å; S88-G90 VanDerWaalsContact C-N 3.35Å; S88-G90 PolarHBondContact O-N 2.96Å; G90-I93 PolarHBondContact O-N 3.2Å; G90-I94 WeakPolarHBondContact O-CG1 3.4Å; G90-I94 PolarHBondContact O-N 2.66Å; G90-I94 VanDerWaalsContact O-N 3.13Å
91C86.7Confident86.7Confident1 Ų124.9 Ų24.91%0.00714%0.135CC..Hα-helixtrans-62-43.8172.6-161.30000111.6Q79 R83 G87 S88 F89 I93 I94 E95 Q310Q79-C91 PolarHBondContact O-SG 3.35Å; R83-C91 HydrophobicContact CB-CB 4.05Å; G87-C91 PolarHBondContact O-N 3.26Å; S88-C91 VanDerWaalsContact O-CB 3.27Å; S88-C91 WeakPolarHBondContact O-CB 3.39Å; S88-C91 PolarHBondContact O-N 2.88Å; S88-C91 VanDerWaalsContact O-N 3.14Å; F89-C91 VanDerWaalsContact C-N 3.3Å; F89-C91 PolarHBondContact O-N 3.44Å; C91-I93 VanDerWaalsContact C-N 3.31Å; C91-I93 PolarHBondContact O-N 2.91Å; C91-I94 PolarHBondContact O-N 3.31Å; C91-E95 WeakPolarHBondContact O-CG 3.49Å; C91-E95 PolarHBondContact O-N 3.1Å; C91-Q310 PolarHBondContact SG-NE2 2.98Å
92L86.7Confident86.9Confident18 Ų1824.9 Ų24.99%0.09414%0.135CC..Hα-helixtrans-60.8-44.3-179.3172.962.8000110.5S88 F89 E95 I96 A307 Q310 L311S88-L92 PolarHBondContact O-N 3.35Å; F89-L92 WeakPolarHBondContact O-CB 3.42Å; F89-L92 PolarHBondContact O-N 3.44Å; L92-E95 PolarHBondContact O-N 3.18Å; L92-I96 HydrophobicContact CD1-CD1 3.81Å; L92-I96 HydrophobicContact CD1-CG1 4.13Å; L92-I96 HydrophobicContact CG-CD1 3.83Å; L92-I96 HydrophobicContact CG-CG1 4.48Å; L92-I96 WeakPolarHBondContact O-CG1 2.99Å; L92-I96 PolarHBondContact O-N 3.28Å; L92-A307 HydrophobicContact CD1-CB 3.9Å; L92-Q310 HydrophobicContact CB-CB 4.27Å; L92-Q310 HydrophobicContact CD1-CB 3.92Å; L92-L311 HydrophobicContact CD1-CD1 4.27Å; L92-L311 HydrophobicContact CD1-CD2 4.35Å; L92-L311 HydrophobicContact CD1-CG 3.84Å; L92-L311 HydrophobicContact CD2-CD2 3.79Å; L92-L311 HydrophobicContact CD2-CG 4.18Å
93I85.8Confident87.1Confident0 Ų026.6 Ų26.60%014%0.143CC..Hα-helixtrans-64.5-44178.4-70.2142000111.1F89 G90 C91 E95 I96 L97 L569 L573F89-I93 HydrophobicContact CD1-CD1 3.35Å; F89-I93 HydrophobicContact CE1-CD1 3.06Å; F89-I93 HydrophobicContact CE1-CG1 4.29Å; F89-I93 HydrophobicContact CE2-CD1 4.32Å; F89-I93 HydrophobicContact CG-CD1 4.15Å; F89-I93 HydrophobicContact CZ-CD1 3.58Å; F89-I93 HydrophobicContact CZ-CG1 4.42Å; F89-I93 VanDerWaalsContact O-CD1 3.22Å; F89-I93 WeakPolarHBondContact O-CD1 3.19Å; F89-I93 PolarHBondContact O-N 3.17Å; F89-I93 VanDerWaalsContact O-N 3.15Å; G90-I93 PolarHBondContact O-N 3.2Å; C91-I93 VanDerWaalsContact C-N 3.31Å; C91-I93 PolarHBondContact O-N 2.91Å; I93-E95 VanDerWaalsContact C-N 3.26Å; I93-E95 PolarHBondContact O-N 3.04Å; I93-I96 PolarHBondContact O-N 3.33Å; I93-L97 HydrophobicContact CG2-CD1 3.43Å; I93-L97 VanDerWaalsContact CG2-CD1 3.43Å; I93-L97 HydrophobicContact CG2-CG 3.9Å; I93-L97 VanDerWaalsContact O-CB 3.32Å; I93-L97 WeakPolarHBondContact O-CB 3.48Å; I93-L97 WeakPolarHBondContact O-CG 3.49Å; I93-L97 PolarHBondContact O-N 2.84Å; I93-L569 HydrophobicContact CB-CB 4.42Å; I93-L569 HydrophobicContact CB-CD2 4.47Å; I93-L569 HydrophobicContact CD1-CB 3.28Å; I93-L569 HydrophobicContact CD1-CD1 3.9Å; I93-L569 HydrophobicContact CD1-CG 4.11Å; I93-L569 HydrophobicContact CG1-CB 4.14Å; I93-L569 HydrophobicContact CG2-CB 4.09Å; I93-L569 HydrophobicContact CG2-CD2 3.74Å; I93-L569 HydrophobicContact CG2-CG 4.38Å; I93-L573 HydrophobicContact CD1-CD1 4.36Å; I93-L573 HydrophobicContact CG1-CD1 3.5Å; I93-L573 VanDerWaalsContact CG1-CD1 3.5Å; I93-L573 HydrophobicContact CG1-CG 4.23Å; I93-L573 HydrophobicContact CG2-CD1 4.5Å; I93-L573 HydrophobicContact CG2-CG 4.36Å
94I88Confident87.2Confident1 Ų122.1 Ų22.11%0.00513%0.127CC..Hα-helixtrans-58.7-42.3175.7-72.3162.3000110.9F78 Q79 A82 G90 C91 N98 L374 V378F78-I94 HydrophobicContact CD1-CG2 4.28Å; F78-I94 HydrophobicContact CE1-CD1 4.02Å; F78-I94 HydrophobicContact CE1-CG2 4.39Å; Q79-I94 HydrophobicContact CG-CG2 4.47Å; A82-I94 HydrophobicContact CB-CD1 3.14Å; G90-I94 WeakPolarHBondContact O-CG1 3.4Å; G90-I94 PolarHBondContact O-N 2.66Å; G90-I94 VanDerWaalsContact O-N 3.13Å; C91-I94 PolarHBondContact O-N 3.31Å; I94-N98 WeakPolarHBondContact O-CB 3.39Å; I94-N98 PolarHBondContact O-N 2.87Å; I94-N98 PolarHBondContact O-ND2 2.87Å; I94-L374 HydrophobicContact CB-CD1 4.3Å; I94-L374 HydrophobicContact CG1-CB 4.24Å; I94-L374 HydrophobicContact CG1-CD1 3.57Å; I94-L374 HydrophobicContact CG1-CD2 3.85Å; I94-L374 HydrophobicContact CG1-CG 4.08Å; I94-V378 HydrophobicContact CD1-CG2 4.16Å
95E87.9Confident87.4Confident4 Ų417.7 Ų17.72%0.01911%0.105CC..Hα-helixtrans-64.5-46.3177.4-75.4171.9173.900112.3Q79 C91 L92 I93 N98 A99 A303 G306 A307 Q310Q79-E95 HydrophobicContact CG-CG 4.25Å; C91-E95 WeakPolarHBondContact O-CG 3.49Å; C91-E95 PolarHBondContact O-N 3.1Å; L92-E95 PolarHBondContact O-N 3.18Å; I93-E95 VanDerWaalsContact C-N 3.26Å; I93-E95 PolarHBondContact O-N 3.04Å; E95-N98 PolarHBondContact O-N 3.03Å; E95-A99 VanDerWaalsContact O-CB 3.32Å; E95-A99 WeakPolarHBondContact O-CB 3.47Å; E95-A99 PolarHBondContact O-N 3.21Å; E95-A303 WeakPolarHBondContact O-CB 3.41Å; E95-G306 VanDerWaalsContact CD-C 3.48Å; E95-G306 WeakPolarHBondContact OE2-CA 3.42Å; E95-G306 VanDerWaalsContact OE2-O 3.11Å; E95-A307 HydrophobicContact CB-CB 4.11Å; E95-A307 WeakPolarHBondContact OE2-CA 3.41Å; E95-A307 PolarHBondContact OE2-N 3.17Å; E95-Q310 PolarHBondContact OE1-NE2 3.29Å; E95-Q310 PolarHBondContact OE2-NE2 3.49Å
96I88.5Confident87.6Confident45 Ų4516.9 Ų16.923%0.23110%0.1CC..Hα-helixtrans-61.5-49.1176.2-68.1169.2000110.6L92 I93 N98 A99 C100 A307 L573L92-I96 HydrophobicContact CD1-CD1 3.81Å; L92-I96 HydrophobicContact CD1-CG1 4.13Å; L92-I96 HydrophobicContact CG-CD1 3.83Å; L92-I96 HydrophobicContact CG-CG1 4.48Å; L92-I96 WeakPolarHBondContact O-CG1 2.99Å; L92-I96 PolarHBondContact O-N 3.28Å; I93-I96 PolarHBondContact O-N 3.33Å; I96-N98 PolarHBondContact O-N 3.42Å; I96-A99 WeakPolarHBondContact O-CB 3.02Å; I96-A99 PolarHBondContact O-N 3.32Å; I96-C100 WeakPolarHBondContact O-CB 3.23Å; I96-C100 PolarHBondContact O-N 2.95Å; I96-C100 PolarHBondContact O-SG 3.3Å; I96-A307 HydrophobicContact CG1-CB 4.04Å; I96-L573 HydrophobicContact CB-CD2 4.43Å; I96-L573 HydrophobicContact CG2-CD2 3.78Å
97L90.2Very high87.9Confident3 Ų317 Ų172%0.01610%0.101CC..Hα-helixtrans-64.8-40.2-178.2-64.9174.5000111.8I93 C100 F101 A369 V370 L374 L573 M576I93-L97 HydrophobicContact CG2-CD1 3.43Å; I93-L97 VanDerWaalsContact CG2-CD1 3.43Å; I93-L97 HydrophobicContact CG2-CG 3.9Å; I93-L97 VanDerWaalsContact O-CB 3.32Å; I93-L97 WeakPolarHBondContact O-CB 3.48Å; I93-L97 WeakPolarHBondContact O-CG 3.49Å; I93-L97 PolarHBondContact O-N 2.84Å; L97-C100 PolarHBondContact O-N 3.29Å; L97-F101 WeakPolarHBondContact O-CB 3.4Å; L97-F101 PolarHBondContact O-N 3.29Å; L97-A369 HydrophobicContact CD1-CB 3.88Å; L97-V370 HydrophobicContact CB-CG2 3.64Å; L97-L374 HydrophobicContact CB-CD1 4.38Å; L97-L374 HydrophobicContact CD1-CD1 3.56Å; L97-L374 HydrophobicContact CD1-CD2 4.42Å; L97-L374 HydrophobicContact CD1-CG 4.34Å; L97-L573 HydrophobicContact CD2-CD2 4.3Å; L97-M576 HydrophobicContact CD2-CE 3.1Å; L97-M576 HydrophobicContact CD2-SD 3.95Å; L97-M576 HydrophobicContact CG-CE 4.49Å
98N89.9Confident88.1Confident7 Ų716.3 Ų16.34%0.0379%0.094CC..Hα-helixtrans-60.9-45.8172.4-80-13.7000111.1I94 E95 I96 F101 L102 A303 V370I94-N98 WeakPolarHBondContact O-CB 3.39Å; I94-N98 PolarHBondContact O-N 2.87Å; I94-N98 PolarHBondContact O-ND2 2.87Å; E95-N98 PolarHBondContact O-N 3.03Å; I96-N98 PolarHBondContact O-N 3.42Å; N98-F101 PolarHBondContact O-N 2.84Å; N98-L102 WeakPolarHBondContact O-CB 3.44Å; N98-L102 WeakPolarHBondContact O-CD1 3.36Å; N98-L102 WeakPolarHBondContact O-CG 3.23Å; N98-L102 PolarHBondContact O-N 3.44Å; N98-A303 HydrophobicContact CB-CB 4.06Å; N98-V370 WeakPolarHBondContact OD1-CG1 3.42Å; N98-V370 VanDerWaalsContact OD1-CG2 3.23Å; N98-V370 WeakPolarHBondContact OD1-CG2 3.42Å
99A90.3Very high88.4Confident11 Ų1113.2 Ų13.29%0.0917%0.071CC..Hα-helixtrans-60.8-48.3177.400000110.9E95 I96 F101 L102 F103 A303 V304E95-A99 VanDerWaalsContact O-CB 3.32Å; E95-A99 WeakPolarHBondContact O-CB 3.47Å; E95-A99 PolarHBondContact O-N 3.21Å; I96-A99 WeakPolarHBondContact O-CB 3.02Å; I96-A99 PolarHBondContact O-N 3.32Å; A99-F101 PolarHBondContact O-N 2.82Å; A99-L102 PolarHBondContact O-N 3.24Å; A99-F103 WeakPolarHBondContact O-CB 3.38Å; A99-F103 PolarHBondContact O-N 3.49Å; A99-A303 HydrophobicContact CB-CB 4.01Å; A99-V304 HydrophobicContact CB-CG2 3.79Å
100C89.9Confident88.9Confident47 Ų4710.1 Ų10.132%0.3186%0.058SC..Hα-helixtrans-58.7-46.4177.8-69.40000112.5I96 L97 G104 A366 M576I96-C100 WeakPolarHBondContact O-CB 3.23Å; I96-C100 PolarHBondContact O-N 2.95Å; I96-C100 PolarHBondContact O-SG 3.3Å; L97-C100 PolarHBondContact O-N 3.29Å; C100-G104 PolarHBondContact O-N 3.03Å; C100-A366 HydrophobicContact CB-CB 4.17Å; C100-M576 HydrophobicContact CB-CE 4.34Å; C100-M576 HydrophobicContact CB-SD 4.05Å
101F89.8Confident89.3Confident9 Ų910.1 Ų10.14%0.0396%0.058CC..Hα-helixtrans-63.9-48.4179.1176.7-102.9000112.4L97 N98 A99 F103 G104 S105 L215 P218 A366 G367L97-F101 WeakPolarHBondContact O-CB 3.4Å; L97-F101 PolarHBondContact O-N 3.29Å; N98-F101 PolarHBondContact O-N 2.84Å; A99-F101 PolarHBondContact O-N 2.82Å; F101-F103 VanDerWaalsContact C-N 3.34Å; F101-G104 PolarHBondContact O-N 3.39Å; F101-S105 PolarHBondContact O-N 3.3Å; F101-S105 PolarHBondContact O-OG 3Å; F101-L215 HydrophobicContact CD1-CD2 4.04Å; F101-L215 HydrophobicContact CD2-CD2 4.2Å; F101-L215 HydrophobicContact CE1-CB 4.17Å; F101-L215 HydrophobicContact CE1-CD2 3.62Å; F101-L215 HydrophobicContact CE1-CG 4.42Å; F101-L215 HydrophobicContact CE2-CD2 3.78Å; F101-L215 HydrophobicContact CG-CD2 4.31Å; F101-L215 HydrophobicContact CZ-CB 3.76Å; F101-L215 HydrophobicContact CZ-CD2 3.48Å; F101-L215 VanDerWaalsContact CZ-CD2 3.48Å; F101-L215 HydrophobicContact CZ-CG 4.22Å; F101-P218 HydrophobicContact CD1-CG 3.79Å; F101-P218 HydrophobicContact CE1-CG 3.99Å; F101-A366 HydrophobicContact CB-CB 3.7Å; F101-G367 VanDerWaalsContact CD2-CA 3.46Å
102L91.3Very high89.4Confident1 Ų110 Ų101%0.0056%0.057CC..Hα-helixtrans-66.3-40.1-179.5-69.1167.4000111.2N98 A99 S105 M106 P218 M296 P299 C300N98-L102 WeakPolarHBondContact O-CB 3.44Å; N98-L102 WeakPolarHBondContact O-CD1 3.36Å; N98-L102 WeakPolarHBondContact O-CG 3.23Å; N98-L102 PolarHBondContact O-N 3.44Å; A99-L102 PolarHBondContact O-N 3.24Å; L102-S105 WeakPolarHBondContact O-CB 3.17Å; L102-S105 PolarHBondContact O-N 3.48Å; L102-M106 VanDerWaalsContact O-CG 3.28Å; L102-M106 WeakPolarHBondContact O-CG 3.45Å; L102-M106 PolarHBondContact O-N 2.9Å; L102-P218 HydrophobicContact CD1-CB 4.14Å; L102-P218 HydrophobicContact CD2-CB 3.95Å; L102-P218 HydrophobicContact CD2-CG 4.45Å; L102-P218 HydrophobicContact CG-CB 4.17Å; L102-M296 HydrophobicContact CD2-CE 3.53Å; L102-M296 HydrophobicContact CD2-SD 4.03Å; L102-P299 HydrophobicContact CD1-CB 3.75Å; L102-P299 HydrophobicContact CD1-CG 3.85Å; L102-P299 HydrophobicContact CD2-CG 4.17Å; L102-C300 HydrophobicContact CB-CB 3.78Å; L102-C300 HydrophobicContact CD1-CB 4.14Å
103F90.9Very high89.6Confident35 Ų359.2 Ų9.215%0.1545%0.053CC..Hα-helixtrans-63-46.3175.9179.9-104.2000111.9A99 F101 S105 M106 V107 I341 L344 L348A99-F103 WeakPolarHBondContact O-CB 3.38Å; A99-F103 PolarHBondContact O-N 3.49Å; F101-F103 VanDerWaalsContact C-N 3.34Å; F103-S105 VanDerWaalsContact C-N 3.3Å; F103-S105 PolarHBondContact O-N 3.43Å; F103-M106 WeakPolarHBondContact O-CB 3.25Å; F103-M106 PolarHBondContact O-N 3.2Å; F103-M106 VanDerWaalsContact O-N 3.08Å; F103-V107 HydrophobicContact CD1-CG2 4.44Å; F103-V107 HydrophobicContact CE1-CG2 4.12Å; F103-V107 HydrophobicContact CZ-CG2 4.23Å; F103-V107 WeakPolarHBondContact O-CG2 3.04Å; F103-V107 PolarHBondContact O-N 2.78Å; F103-I341 HydrophobicContact CD2-CG2 3.97Å; F103-I341 HydrophobicContact CE2-CG2 4.34Å; F103-L344 HydrophobicContact CE1-CD2 4.44Å; F103-L344 HydrophobicContact CE2-CB 4.12Å; F103-L344 HydrophobicContact CE2-CD2 4.28Å; F103-L344 HydrophobicContact CE2-CG 4.28Å; F103-L344 HydrophobicContact CZ-CB 3.98Å; F103-L344 HydrophobicContact CZ-CD2 3.79Å; F103-L344 HydrophobicContact CZ-CG 3.68Å; F103-L348 HydrophobicContact CE1-CD1 3.33Å; F103-L348 HydrophobicContact CZ-CD1 3.64Å
104G88Confident89.7Confident3 Ų39.2 Ų9.23%0.0315%0.053CC..Hα-helixtrans-59-40.417400000112.9C100 F101 M106 V107 A108C100-G104 PolarHBondContact O-N 3.03Å; F101-G104 PolarHBondContact O-N 3.39Å; G104-M106 VanDerWaalsContact C-N 3.31Å; G104-M106 PolarHBondContact O-N 3.35Å; G104-V107 WeakPolarHBondContact O-CB 3.22Å; G104-V107 PolarHBondContact O-N 2.98Å; G104-A108 PolarHBondContact O-N 2.86Å
105S89Confident89.6Confident14 Ų149.6 Ų9.610%0.0986%0.055CC..Hα-helixtrans-63.4-37174.4-560000112.3F101 L102 F103 A108 F109 M296F101-S105 PolarHBondContact O-N 3.3Å; F101-S105 PolarHBondContact O-OG 3Å; L102-S105 WeakPolarHBondContact O-CB 3.17Å; L102-S105 PolarHBondContact O-N 3.48Å; F103-S105 VanDerWaalsContact C-N 3.3Å; F103-S105 PolarHBondContact O-N 3.43Å; S105-A108 PolarHBondContact O-N 2.79Å; S105-F109 WeakPolarHBondContact O-CG 3.46Å; S105-F109 PolarHBondContact O-N 2.95Å; S105-M296 VanDerWaalsContact CB-CE 3.48Å
106M91Very high89.6Confident0 Ų09.4 Ų9.40%05%0.054CC..Hα-helixtrans-68.6-37.5175.2-71.2171.563.300112.7L102 F103 G104 A108 F109 L110 Y293 M296 L297 C300 I341L102-M106 VanDerWaalsContact O-CG 3.28Å; L102-M106 WeakPolarHBondContact O-CG 3.45Å; L102-M106 PolarHBondContact O-N 2.9Å; F103-M106 WeakPolarHBondContact O-CB 3.25Å; F103-M106 PolarHBondContact O-N 3.2Å; F103-M106 VanDerWaalsContact O-N 3.08Å; G104-M106 VanDerWaalsContact C-N 3.31Å; G104-M106 PolarHBondContact O-N 3.35Å; M106-A108 VanDerWaalsContact C-N 3.34Å; M106-F109 WeakPolarHBondContact O-CB 3.5Å; M106-F109 PolarHBondContact O-N 3.47Å; M106-L110 PolarHBondContact O-N 2.98Å; M106-Y293 HydrophobicContact CB-CD2 4.27Å; M106-Y293 HydrophobicContact CB-CE2 3.77Å; M106-Y293 HydrophobicContact CE-CD1 4.37Å; M106-Y293 HydrophobicContact CE-CD2 4.4Å; M106-Y293 HydrophobicContact CE-CE1 3.61Å; M106-Y293 HydrophobicContact CE-CE2 3.64Å; M106-Y293 WeakPolarHBondContact CE-OH 3.21Å; M106-Y293 HydrophobicContact CG-CD2 4.38Å; M106-Y293 HydrophobicContact CG-CE2 4.16Å; M106-M296 HydrophobicContact CG-CB 3.72Å; M106-M296 HydrophobicContact SD-CB 4.36Å; M106-L297 HydrophobicContact CE-CB 3.83Å; M106-L297 HydrophobicContact CE-CD1 3.41Å; M106-L297 VanDerWaalsContact CE-CD1 3.41Å; M106-L297 HydrophobicContact CE-CG 4.21Å; M106-L297 HydrophobicContact SD-CB 4.12Å; M106-L297 HydrophobicContact SD-CD1 4.16Å; M106-C300 HydrophobicContact SD-CB 4.21Å; M106-I341 HydrophobicContact CE-CG2 3.9Å; M106-I341 HydrophobicContact SD-CG2 4.26Å
107V90.6Very high89.6Confident4 Ų48 Ų82%0.0245%0.048CC..Hα-helixtrans-60.4-46.6172.7176.40000109.9F103 G104 F109 L110 N111 L348 A349 I358F103-V107 HydrophobicContact CD1-CG2 4.44Å; F103-V107 HydrophobicContact CE1-CG2 4.12Å; F103-V107 HydrophobicContact CZ-CG2 4.23Å; F103-V107 WeakPolarHBondContact O-CG2 3.04Å; F103-V107 PolarHBondContact O-N 2.78Å; G104-V107 WeakPolarHBondContact O-CB 3.22Å; G104-V107 PolarHBondContact O-N 2.98Å; V107-F109 VanDerWaalsContact C-N 3.33Å; V107-F109 PolarHBondContact O-N 3.49Å; V107-L110 PolarHBondContact O-N 2.89Å; V107-L110 VanDerWaalsContact O-N 3.16Å; V107-N111 PolarHBondContact O-N 3.05Å; V107-L348 HydrophobicContact CG1-CB 4.08Å; V107-L348 HydrophobicContact CG2-CB 4.01Å; V107-L348 HydrophobicContact CG2-CD1 4.37Å; V107-A349 HydrophobicContact CG1-CB 4Å; V107-I358 HydrophobicContact CB-CG2 4.42Å; V107-I358 HydrophobicContact CG1-CD1 3.61Å; V107-I358 HydrophobicContact CG1-CG2 4.35Å
108A88.7Confident89.3Confident0 Ų08 Ų80%05%0.048CC..Hα-helixtrans-59.1-41.3175.300000112.5G104 S105 M106 L110 N111 V112 V355 L359G104-A108 PolarHBondContact O-N 2.86Å; S105-A108 PolarHBondContact O-N 2.79Å; M106-A108 VanDerWaalsContact C-N 3.34Å; A108-L110 PolarHBondContact O-N 3.09Å; A108-N111 PolarHBondContact O-N 3.41Å; A108-V112 WeakPolarHBondContact O-CG2 3.38Å; A108-V112 PolarHBondContact O-N 3.32Å; A108-V112 VanDerWaalsContact O-N 3.1Å; A108-V355 HydrophobicContact CB-CG1 4.09Å; A108-L359 HydrophobicContact CB-CD1 4.42Å; A108-L359 HydrophobicContact CB-CD2 3.65Å; A108-L359 HydrophobicContact CB-CG 3.91Å
109F91.3Very high89Confident9 Ų98.2 Ų8.24%0.0395%0.05CC..Hα-helixtrans-59.1-43.9173.8-76-6.1000113V21 S105 M106 V107 A113 L289 Y293 M296V21-F109 HydrophobicContact CB-CD1 3.88Å; V21-F109 HydrophobicContact CB-CE1 3.98Å; V21-F109 HydrophobicContact CG2-CD1 3.35Å; V21-F109 HydrophobicContact CG2-CE1 3.75Å; V21-F109 HydrophobicContact CG2-CG 4.49Å; S105-F109 WeakPolarHBondContact O-CG 3.46Å; S105-F109 PolarHBondContact O-N 2.95Å; M106-F109 WeakPolarHBondContact O-CB 3.5Å; M106-F109 PolarHBondContact O-N 3.47Å; V107-F109 VanDerWaalsContact C-N 3.33Å; V107-F109 PolarHBondContact O-N 3.49Å; F109-A113 VanDerWaalsContact O-CB 3.23Å; F109-A113 WeakPolarHBondContact O-CB 3.27Å; F109-A113 PolarHBondContact O-N 3.07Å; F109-L289 HydrophobicContact CD1-CD2 3.98Å; F109-L289 HydrophobicContact CE1-CD2 4.3Å; F109-L289 HydrophobicContact CG-CD2 4.4Å; F109-Y293 HydrophobicContact CB-CD2 4.07Å; F109-Y293 HydrophobicContact CD2-CD2 4.25Å; F109-M296 HydrophobicContact CD2-CG 4.31Å; F109-M296 HydrophobicContact CE2-CB 4.38Å; F109-M296 HydrophobicContact CE2-CG 3.47Å; F109-M296 VanDerWaalsContact CE2-CG 3.47Å; F109-M296 HydrophobicContact CZ-CG 4.1Å
110L91.8Very high88.7Confident0 Ų09 Ų90%05%0.053CC..Hα-helixtrans-69.6-37.4-179.8-71179.4000112.5M106 V107 A108 A113 G114 V141 F144 T145 Y293 S345 A346 A349M106-L110 PolarHBondContact O-N 2.98Å; V107-L110 PolarHBondContact O-N 2.89Å; V107-L110 VanDerWaalsContact O-N 3.16Å; A108-L110 PolarHBondContact O-N 3.09Å; L110-A113 PolarHBondContact O-N 3.24Å; L110-G114 PolarHBondContact O-N 2.96Å; L110-V141 HydrophobicContact CB-CG1 4.34Å; L110-F144 HydrophobicContact CD2-CD1 3.83Å; L110-F144 HydrophobicContact CD2-CE1 4.1Å; L110-T145 WeakPolarHBondContact CD2-OG1 3.36Å; L110-Y293 HydrophobicContact CD1-CE2 3.85Å; L110-Y293 HydrophobicContact CD2-CD2 4.11Å; L110-Y293 HydrophobicContact CD2-CE2 3.76Å; L110-Y293 HydrophobicContact CG-CD2 4.18Å; L110-Y293 HydrophobicContact CG-CE2 3.58Å; L110-S345 VanDerWaalsContact CD1-OG 3.3Å; L110-S345 WeakPolarHBondContact CD1-OG 3.47Å; L110-A346 HydrophobicContact CD1-CB 3.99Å; L110-A349 HydrophobicContact CB-CB 3.74Å
111N88.6Confident88.4Confident0 Ų012.7 Ų12.70%07%0.068CC..Hα-helixtrans-63-51.1176.9179.5-13.3000111.2V107 A108 A113 G114 N115 Y137 A349 S352 P353 V355V107-N111 PolarHBondContact O-N 3.05Å; A108-N111 PolarHBondContact O-N 3.41Å; N111-A113 VanDerWaalsContact C-N 3.31Å; N111-A113 PolarHBondContact O-N 3.34Å; N111-G114 PolarHBondContact O-N 2.84Å; N111-G114 VanDerWaalsContact O-N 3.14Å; N111-N115 PolarHBondContact O-N 3.33Å; N111-N115 PolarHBondContact O-ND2 3.46Å; N111-N115 PolarHBondContact OD1-ND2 3.27Å; N111-N115 VanDerWaalsContact OD1-ND2 3.08Å; N111-Y137 WeakPolarHBondContact CA-OH 3.42Å; N111-Y137 VanDerWaalsContact CG-OH 3.31Å; N111-Y137 PolarHBondContact OD1-OH 3.37Å; N111-A349 HydrophobicContact CB-CB 4.4Å; N111-S352 PolarHBondContact ND2-O 2.9Å; N111-P353 VanDerWaalsContact ND2-CA 3.26Å; N111-P353 WeakPolarHBondContact ND2-CA 3.38Å; N111-P353 PolarHBondContact ND2-O 2.85Å; N111-P353 PolarHBondContact OD1-O 2.75Å; N111-V355 HydrophobicContact CB-CG2 3.94Å; N111-V355 VanDerWaalsContact ND2-CG2 3.26Å; N111-V355 WeakPolarHBondContact ND2-CG2 3.34Å; N111-V355 PolarHBondContact ND2-N 3.4Å
112V88.5Confident87.9Confident0 Ų016.2 Ų16.20%08%0.083CC..Hα-helixtrans-60.8-41.5174.9179.60000111.2V21 L24 A108 G114 N115 M116 L269 F285 L289 V355V21-V112 HydrophobicContact CB-CG2 4.47Å; V21-V112 HydrophobicContact CG1-CG2 3.64Å; V21-V112 HydrophobicContact CG2-CB 4.13Å; V21-V112 HydrophobicContact CG2-CG1 4.47Å; V21-V112 HydrophobicContact CG2-CG2 3.88Å; L24-V112 HydrophobicContact CD1-CG1 3.69Å; L24-V112 HydrophobicContact CD1-CG2 4.13Å; A108-V112 WeakPolarHBondContact O-CG2 3.38Å; A108-V112 PolarHBondContact O-N 3.32Å; A108-V112 VanDerWaalsContact O-N 3.1Å; V112-G114 VanDerWaalsContact C-N 3.32Å; V112-G114 PolarHBondContact O-N 3.45Å; V112-N115 PolarHBondContact O-N 3Å; V112-M116 HydrophobicContact CG1-CG 4.09Å; V112-M116 WeakPolarHBondContact O-CB 3.33Å; V112-M116 VanDerWaalsContact O-CG 3.29Å; V112-M116 WeakPolarHBondContact O-CG 3.42Å; V112-M116 PolarHBondContact O-N 3.34Å; V112-L269 HydrophobicContact CG1-CD1 4.38Å; V112-F285 HydrophobicContact CG1-CE1 4.4Å; V112-L289 HydrophobicContact CB-CD1 3.98Å; V112-L289 HydrophobicContact CG1-CD1 3.66Å; V112-V355 HydrophobicContact CG2-CG1 3.98Å; V112-V355 HydrophobicContact CG2-CG2 3.74Å
113A91.4Very high86.6Confident0 Ų021.1 Ų21.10%011%0.11CC..Hα-helixtrans-61.4-39.9176.800000112.4F109 L110 N111 M116 S117 F144 L286 L289F109-A113 VanDerWaalsContact O-CB 3.23Å; F109-A113 WeakPolarHBondContact O-CB 3.27Å; F109-A113 PolarHBondContact O-N 3.07Å; L110-A113 PolarHBondContact O-N 3.24Å; N111-A113 VanDerWaalsContact C-N 3.31Å; N111-A113 PolarHBondContact O-N 3.34Å; A113-M116 PolarHBondContact O-N 3.2Å; A113-S117 VanDerWaalsContact O-CB 3.26Å; A113-S117 WeakPolarHBondContact O-CB 3.41Å; A113-S117 PolarHBondContact O-N 2.89Å; A113-S117 PolarHBondContact O-OG 2.95Å; A113-F144 HydrophobicContact CB-CD1 3.71Å; A113-F144 HydrophobicContact CB-CD2 4.13Å; A113-F144 HydrophobicContact CB-CE1 3.58Å; A113-F144 HydrophobicContact CB-CE2 4.02Å; A113-F144 HydrophobicContact CB-CG 3.99Å; A113-F144 HydrophobicContact CB-CZ 3.74Å; A113-L286 HydrophobicContact CB-CD1 3.77Å; A113-L289 HydrophobicContact CB-CD1 4.18Å
114G89.3Confident85Confident0 Ų027.6 Ų27.60%014%0.14CC..Hα-helixtrans-57.6-52.5172.600000111.8L110 N111 V112 M116 S117 L118L110-G114 PolarHBondContact O-N 2.96Å; N111-G114 PolarHBondContact O-N 2.84Å; N111-G114 VanDerWaalsContact O-N 3.14Å; V112-G114 VanDerWaalsContact C-N 3.32Å; V112-G114 PolarHBondContact O-N 3.45Å; G114-M116 PolarHBondContact O-N 3.33Å; G114-S117 PolarHBondContact O-N 3.2Å; G114-S117 PolarHBondContact O-OG 3.48Å; G114-L118 WeakPolarHBondContact O-CB 3.2Å; G114-L118 PolarHBondContact O-N 3.48Å; G114-L118 VanDerWaalsContact O-N 3.11Å
115N84.6Confident83.5Confident9 Ų931.2 Ų31.25%0.04815%0.153CC..Hα-helixtrans-61.5-42.9179.6-66.3-27.6000112.5N111 V112 S119 V127 Y137 L270N111-N115 PolarHBondContact O-N 3.33Å; N111-N115 PolarHBondContact O-ND2 3.46Å; N111-N115 PolarHBondContact OD1-ND2 3.27Å; N111-N115 VanDerWaalsContact OD1-ND2 3.08Å; V112-N115 PolarHBondContact O-N 3Å; N115-S119 WeakPolarHBondContact O-CB 3.46Å; N115-S119 PolarHBondContact O-N 2.8Å; N115-S119 PolarHBondContact O-OG 2.99Å; N115-V127 HydrophobicContact CB-CG2 4.41Å; N115-V127 WeakPolarHBondContact OD1-CG1 3.29Å; N115-Y137 VanDerWaalsContact OD1-CE2 3.26Å; N115-Y137 WeakPolarHBondContact OD1-CE2 3.45Å; N115-L270 HydrophobicContact CB-CD2 4.45Å
116M87.9Confident81.8Confident0 Ų036.4 Ų36.40%018%0.18CC..Hα-helixtrans-69.3-43.4179.6-68.9-53.5111.700112.2V112 A113 G114 L118 S119 L120 L269 L270 R282 L286V112-M116 HydrophobicContact CG1-CG 4.09Å; V112-M116 WeakPolarHBondContact O-CB 3.33Å; V112-M116 VanDerWaalsContact O-CG 3.29Å; V112-M116 WeakPolarHBondContact O-CG 3.42Å; V112-M116 PolarHBondContact O-N 3.34Å; A113-M116 PolarHBondContact O-N 3.2Å; G114-M116 PolarHBondContact O-N 3.33Å; M116-L118 VanDerWaalsContact C-N 3.27Å; M116-L118 PolarHBondContact O-N 2.93Å; M116-S119 PolarHBondContact O-N 3.39Å; M116-L120 WeakPolarHBondContact O-CB 3.29Å; M116-L120 WeakPolarHBondContact O-CG 3.37Å; M116-L120 PolarHBondContact O-N 3.42Å; M116-L269 HydrophobicContact CE-CB 3.45Å; M116-L269 VanDerWaalsContact CE-CB 3.45Å; M116-L269 HydrophobicContact CE-CD1 4.07Å; M116-L269 HydrophobicContact CE-CG 4.41Å; M116-L269 HydrophobicContact CG-CD1 4.06Å; M116-L269 HydrophobicContact SD-CB 3.62Å; M116-L269 HydrophobicContact SD-CD1 3.61Å; M116-L269 HydrophobicContact SD-CG 4.2Å; M116-L270 HydrophobicContact CE-CD2 3.87Å; M116-L270 HydrophobicContact CE-CG 4.43Å; M116-R282 HydrophobicContact SD-CB 4.02Å; M116-R282 HydrophobicContact SD-CG 3.7Å; M116-L286 HydrophobicContact CB-CB 4.41Å; M116-L286 HydrophobicContact CB-CD1 4.27Å
117S87.9Confident80.1Confident16 Ų1638 Ų3811%0.11219%0.189CC..Hα-helixtrans-61.5-38.6178.563.20000111.8A113 G114 L120 I121 A140A113-S117 VanDerWaalsContact O-CB 3.26Å; A113-S117 WeakPolarHBondContact O-CB 3.41Å; A113-S117 PolarHBondContact O-N 2.89Å; A113-S117 PolarHBondContact O-OG 2.95Å; G114-S117 PolarHBondContact O-N 3.2Å; G114-S117 PolarHBondContact O-OG 3.48Å; S117-L120 PolarHBondContact O-N 2.86Å; S117-I121 WeakPolarHBondContact O-CD1 3.49Å; S117-I121 WeakPolarHBondContact O-CG1 3.18Å; S117-I121 PolarHBondContact O-N 3.27Å; S117-A140 WeakPolarHBondContact OG-CB 3.49Å
118L85.3Confident78.1Confident3 Ų343.4 Ų43.42%0.01621%0.209CC..Hα-helixtrans-69.1-43.5176.6-163.661.9000111.9G114 M116 L120 I121 F122 W125 L136G114-L118 WeakPolarHBondContact O-CB 3.2Å; G114-L118 PolarHBondContact O-N 3.48Å; G114-L118 VanDerWaalsContact O-N 3.11Å; M116-L118 VanDerWaalsContact C-N 3.27Å; M116-L118 PolarHBondContact O-N 2.93Å; L118-L120 PolarHBondContact O-N 3.26Å; L118-I121 PolarHBondContact O-N 3.49Å; L118-F122 HydrophobicContact CD1-CD2 3.43Å; L118-F122 VanDerWaalsContact CD1-CD2 3.43Å; L118-F122 HydrophobicContact CD1-CE2 3.67Å; L118-F122 HydrophobicContact CG-CD2 4.26Å; L118-F122 PolarHBondContact O-N 2.88Å; L118-W125 HydrophobicContact CD1-CD2 4.38Å; L118-W125 HydrophobicContact CD1-CG 4.32Å; L118-W125 HydrophobicContact CD2-CD2 3.97Å; L118-W125 HydrophobicContact CD2-CG 3.6Å; L118-W125 HydrophobicContact CG-CB 4.11Å; L118-W125 HydrophobicContact CG-CD2 4.12Å; L118-W125 HydrophobicContact CG-CG 3.6Å; L118-L136 HydrophobicContact CD1-CB 3.63Å; L118-L136 HydrophobicContact CD1-CD1 4.35Å
119S82.4Confident76.2Confident12 Ų1245.9 Ų45.98%0.08423%0.226CC..Hα-helixtrans-62.6-26.3175.8-59.70000113.6N115 M116N115-S119 WeakPolarHBondContact O-CB 3.46Å; N115-S119 PolarHBondContact O-N 2.8Å; N115-S119 PolarHBondContact O-OG 2.99Å; M116-S119 PolarHBondContact O-N 3.39Å
120L85.5Confident74.2Confident28 Ų2855.4 Ų55.415%0.14727%0.268CS..Hα-helixtrans-81.7-29.7178.1-72.5168.1000113.1M116 S117 L118 W279 R282 F283 L286M116-L120 WeakPolarHBondContact O-CB 3.29Å; M116-L120 WeakPolarHBondContact O-CG 3.37Å; M116-L120 PolarHBondContact O-N 3.42Å; S117-L120 PolarHBondContact O-N 2.86Å; L118-L120 PolarHBondContact O-N 3.26Å; L120-W279 HydrophobicContact CD2-CD2 3.97Å; L120-W279 HydrophobicContact CD2-CG 3.97Å; L120-W279 HydrophobicContact CD2-CZ2 4.28Å; L120-W279 WeakPolarHBondContact CD2-O 3.49Å; L120-W279 PolarHBondContact O-NE1 3.39Å; L120-R282 HydrophobicContact CD2-CB 3.89Å; L120-R282 HydrophobicContact CG-CB 4.29Å; L120-F283 HydrophobicContact CD1-CB 4.29Å; L120-F283 HydrophobicContact CD1-CD2 4.31Å; L120-F283 HydrophobicContact CD2-CB 3.99Å; L120-L286 HydrophobicContact CD1-CB 4.44Å; L120-L286 HydrophobicContact CD1-CD2 3.6Å
121I83.3Confident72.2Confident123 Ų12362.9 Ų62.963%0.63131%0.308SS*.Hα-helixtrans-89.1-41.2-178.7-63.1166.9000110.7S117 L118S117-I121 WeakPolarHBondContact O-CD1 3.49Å; S117-I121 WeakPolarHBondContact O-CG1 3.18Å; S117-I121 PolarHBondContact O-N 3.27Å; L118-I121 PolarHBondContact O-N 3.49Å
122F78.6Confident70.9Confident83 Ų8364.7 Ų64.736%0.36433%0.326SS..  trans-119.5100.1-175.2-57.8-78000109.7L118 H124 W125 L136L118-F122 HydrophobicContact CD1-CD2 3.43Å; L118-F122 VanDerWaalsContact CD1-CD2 3.43Å; L118-F122 HydrophobicContact CD1-CE2 3.67Å; L118-F122 HydrophobicContact CG-CD2 4.26Å; L118-F122 PolarHBondContact O-N 2.88Å; F122-H124 PolarHBondContact O-N 3.32Å; F122-W125 HydrophobicContact CB-CB 3.84Å; F122-W125 PolarHBondContact O-N 3.35Å; F122-W125 VanDerWaalsContact O-N 3.09Å; F122-L136 HydrophobicContact CD2-CD1 4.42Å; F122-L136 HydrophobicContact CE2-CD1 3.84Å; F122-L136 HydrophobicContact CE2-CD2 4.38Å; F122-L136 HydrophobicContact CZ-CD1 3.94Å; F122-L136 HydrophobicContact CZ-CD2 4.33Å
123D63.4Low69.9Low104 Ų10467.8 Ų67.856%0.55634%0.342SS*.THydrogen-bonded Turntrans-60.6-12.5177.4-111.6-6.6000113.6K274D123-K274 PolarHBondContact O-NZ 3.47Å
124H58.1Low69.1Low172 Ų17268.1 Ų68.180%0.79635%0.345SS*.THydrogen-bonded Turntrans-110.211.1-178.9-61.4-59.3000114.3F122 D126F122-H124 PolarHBondContact O-N 3.32Å; H124-D126 PolarHBondContact O-N 3.14Å
125W55.5Low68.8Low78 Ų7875.7 Ų75.730%0.29538%0.378SS..  trans-84.4117.7-177.4-157.4-87.9000112.6L118 F122 S134 L136L118-W125 HydrophobicContact CD1-CD2 4.38Å; L118-W125 HydrophobicContact CD1-CG 4.32Å; L118-W125 HydrophobicContact CD2-CD2 3.97Å; L118-W125 HydrophobicContact CD2-CG 3.6Å; L118-W125 HydrophobicContact CG-CB 4.11Å; L118-W125 HydrophobicContact CG-CD2 4.12Å; L118-W125 HydrophobicContact CG-CG 3.6Å; F122-W125 HydrophobicContact CB-CB 3.84Å; F122-W125 PolarHBondContact O-N 3.35Å; F122-W125 VanDerWaalsContact O-N 3.09Å; W125-S134 VanDerWaalsContact CZ2-OG 3.23Å; W125-S134 WeakPolarHBondContact CZ2-OG 3.43Å; W125-L136 HydrophobicContact CE3-CD1 3.95Å; W125-L136 HydrophobicContact CH2-CD1 3.74Å; W125-L136 HydrophobicContact CZ2-CD1 4.38Å; W125-L136 HydrophobicContact CZ3-CD1 3.49Å; W125-L136 VanDerWaalsContact CZ3-CD1 3.49Å
126D55.1Low68.8Low123 Ų12378 Ų7866%0.65839%0.39SS*.  trans-94.1123.2157.5-163.2-9.5000106.9H124 R128 S129H124-D126 PolarHBondContact O-N 3.14Å; D126-R128 CarbonylContact O-C 3.46Å; D126-R128 PolarHBondContact O-N 2.91Å; D126-S129 PolarHBondContact O-N 3.33Å
127V53.6Low68.7Low34 Ų3478.1 Ų78.121%0.20639%0.39CS..SBendtrans-55.4-21.5-171.2174.80000112N115 S134N115-V127 HydrophobicContact CB-CG2 4.41Å; N115-V127 WeakPolarHBondContact OD1-CG1 3.29Å; V127-S134 PolarHBondContact O-OG 3.5Å
128R48.8Very low68.7Low118 Ų11879.1 Ų79.145%0.44540%0.396SS..  trans-107.690.4169.8-95.1168.2156.6116.9-6.9111D126D126-R128 CarbonylContact O-C 3.46Å; D126-R128 PolarHBondContact O-N 2.91Å
129S48.8Very low68.9Low51 Ų5181.3 Ų81.336%0.35741%0.409SS..  trans-56.2141.9147.5520000108.2D126 D131 G132 S134D126-S129 PolarHBondContact O-N 3.33Å; S129-D131 PolarHBondContact O-N 3.25Å; S129-G132 PolarHBondContact O-N 3.47Å; S129-S134 PolarHBondContact OG-OG 3.31Å
130K49Very low69.2Low209 Ų20981.4 Ų81.491%0.90941%0.411SS*.THydrogen-bonded Turntrans-50.1-7-174.9-81.6178.7171.5175.40116.8
131D51Low69.4Low158 Ų15880.1 Ų80.185%0.84540%0.404SS*.THydrogen-bonded Turntrans-123.317.9-167.6-50.7-36.9000114.7S129S129-D131 PolarHBondContact O-N 3.25Å
132G61.9Low69.7Low37 Ų3777.3 Ų77.338%0.38139%0.387SS..SBendtrans118.9-166.2171.400000115.9S129 S134S129-G132 PolarHBondContact O-N 3.47Å; G132-S134 PolarHBondContact O-N 2.98Å
133I65.6Low70.3Confident66 Ų6677.9 Ų77.934%0.33839%0.393SS..SBendtrans-61.1118.2179.7-60.9160.2000108.9F135 Y137 V138 V350 L591I133-F135 PolarHBondContact O-N 3Å; I133-Y137 HydrophobicContact CG2-CD1 3.81Å; I133-Y137 HydrophobicContact CG2-CE1 4.48Å; I133-V138 HydrophobicContact CG2-CG2 3.89Å; I133-V350 WeakPolarHBondContact CD1-O 3.23Å; I133-L591 HydrophobicContact CD1-CD2 4.1Å; I133-L591 HydrophobicContact CG1-CD2 4.34Å
134S74.6Confident71.7Confident7 Ų773.4 Ų73.45%0.04937%0.368CS..  trans-67.2129.4-175.5-48.30000111W125 V127 S129 G132 L136 Y137 V138W125-S134 VanDerWaalsContact CZ2-OG 3.23Å; W125-S134 WeakPolarHBondContact CZ2-OG 3.43Å; V127-S134 PolarHBondContact O-OG 3.5Å; S129-S134 PolarHBondContact OG-OG 3.31Å; G132-S134 PolarHBondContact O-N 2.98Å; S134-L136 PolarHBondContact O-N 3.44Å; S134-Y137 WeakPolarHBondContact O-CA 3.18Å; S134-Y137 WeakPolarHBondContact O-CB 3.43Å; S134-Y137 PolarHBondContact O-N 3.49Å; S134-V138 PolarHBondContact O-N 2.84Å
135F84.2Confident73.2Confident159 Ų15965.4 Ų65.470%0.69733%0.332SS*.Hα-helixtrans-50.1-36.1174.4175.4-102.3000112.2I133 Y137 V138 V139I133-F135 PolarHBondContact O-N 3Å; F135-Y137 PolarHBondContact O-N 3.13Å; F135-V138 PolarHBondContact O-N 2.87Å; F135-V139 HydrophobicContact CD1-CG2 4.02Å; F135-V139 HydrophobicContact CD2-CG2 4.43Å; F135-V139 HydrophobicContact CE1-CG2 3.55Å; F135-V139 HydrophobicContact CE2-CG2 4Å; F135-V139 HydrophobicContact CG-CG2 4.44Å; F135-V139 HydrophobicContact CZ-CG2 3.54Å; F135-V139 WeakPolarHBondContact O-CG2 3.23Å; F135-V139 PolarHBondContact O-N 2.53Å
136L84.6Confident74.8Confident58 Ų5865.6 Ų65.630%0.30434%0.342SS..Hα-helixtrans-63-36.2175.5-65.7176.4000113.6L118 F122 W125 S134 A140L118-L136 HydrophobicContact CD1-CB 3.63Å; L118-L136 HydrophobicContact CD1-CD1 4.35Å; F122-L136 HydrophobicContact CD2-CD1 4.42Å; F122-L136 HydrophobicContact CE2-CD1 3.84Å; F122-L136 HydrophobicContact CE2-CD2 4.38Å; F122-L136 HydrophobicContact CZ-CD1 3.94Å; F122-L136 HydrophobicContact CZ-CD2 4.33Å; W125-L136 HydrophobicContact CE3-CD1 3.95Å; W125-L136 HydrophobicContact CH2-CD1 3.74Å; W125-L136 HydrophobicContact CZ2-CD1 4.38Å; W125-L136 HydrophobicContact CZ3-CD1 3.49Å; W125-L136 VanDerWaalsContact CZ3-CD1 3.49Å; S134-L136 PolarHBondContact O-N 3.44Å; L136-A140 WeakPolarHBondContact O-CB 3.43Å; L136-A140 PolarHBondContact O-N 2.93Å
137Y86.1Confident76.5Confident2 Ų264.4 Ų64.41%0.00834%0.339CS..Hα-helixtrans-65.5-44.6174.4170.6-99.5000110.8N111 N115 I133 S134 F135 V139 A140 V141 A349N111-Y137 WeakPolarHBondContact CA-OH 3.42Å; N111-Y137 VanDerWaalsContact CG-OH 3.31Å; N111-Y137 PolarHBondContact OD1-OH 3.37Å; N115-Y137 VanDerWaalsContact OD1-CE2 3.26Å; N115-Y137 WeakPolarHBondContact OD1-CE2 3.45Å; I133-Y137 HydrophobicContact CG2-CD1 3.81Å; I133-Y137 HydrophobicContact CG2-CE1 4.48Å; S134-Y137 WeakPolarHBondContact O-CA 3.18Å; S134-Y137 WeakPolarHBondContact O-CB 3.43Å; S134-Y137 PolarHBondContact O-N 3.49Å; F135-Y137 PolarHBondContact O-N 3.13Å; Y137-V139 PolarHBondContact O-N 2.88Å; Y137-A140 WeakPolarHBondContact O-CB 3.45Å; Y137-A140 PolarHBondContact O-N 3.2Å; Y137-V141 HydrophobicContact CD1-CG2 4.49Å; Y137-V141 HydrophobicContact CD2-CG2 4.31Å; Y137-V141 HydrophobicContact CE1-CG2 4.1Å; Y137-V141 HydrophobicContact CE2-CG2 3.87Å; Y137-V141 WeakPolarHBondContact O-CG2 3.19Å; Y137-V141 PolarHBondContact O-N 2.9Å; Y137-A349 PolarHBondContact OH-O 3.21Å
138V87.1Confident78.2Confident37 Ų3766.1 Ų66.122%0.22435%0.346CS..Hα-helixtrans-58-51.1175.7-176.20000110.4I133 S134 F135 A140 V141 F142 V350I133-V138 HydrophobicContact CG2-CG2 3.89Å; S134-V138 PolarHBondContact O-N 2.84Å; F135-V138 PolarHBondContact O-N 2.87Å; V138-A140 VanDerWaalsContact C-N 3.32Å; V138-A140 PolarHBondContact O-N 3.29Å; V138-V141 PolarHBondContact O-N 3.34Å; V138-F142 HydrophobicContact CG1-CD2 3.74Å; V138-F142 HydrophobicContact CG1-CE2 3.84Å; V138-F142 VanDerWaalsContact O-CD2 3.3Å; V138-F142 WeakPolarHBondContact O-CD2 3.22Å; V138-F142 PolarHBondContact O-N 3.37Å; V138-V350 HydrophobicContact CB-CG1 4.44Å; V138-V350 HydrophobicContact CG1-CG1 4.14Å; V138-V350 HydrophobicContact CG1-CG2 4.15Å; V138-V350 HydrophobicContact CG2-CG1 3.73Å
139V88.6Confident80.1Confident49 Ų4960.5 Ų60.530%0.29733%0.325SS..Hα-helixtrans-59.2-44.21781710000111.2F135 Y137 F142 I143F135-V139 HydrophobicContact CD1-CG2 4.02Å; F135-V139 HydrophobicContact CD2-CG2 4.43Å; F135-V139 HydrophobicContact CE1-CG2 3.55Å; F135-V139 HydrophobicContact CE2-CG2 4Å; F135-V139 HydrophobicContact CG-CG2 4.44Å; F135-V139 HydrophobicContact CZ-CG2 3.54Å; F135-V139 WeakPolarHBondContact O-CG2 3.23Å; F135-V139 PolarHBondContact O-N 2.53Å; Y137-V139 PolarHBondContact O-N 2.88Å; V139-F142 PolarHBondContact O-N 3.22Å; V139-I143 HydrophobicContact CG1-CD1 3.46Å; V139-I143 VanDerWaalsContact CG1-CD1 3.46Å; V139-I143 HydrophobicContact CG1-CG1 4.14Å; V139-I143 WeakPolarHBondContact O-CB 3.06Å; V139-I143 WeakPolarHBondContact O-CG1 3.47Å; V139-I143 PolarHBondContact O-N 3.49Å
140A89.3Confident82Confident14 Ų1459.5 Ų59.512%0.11632%0.315CS..Hα-helixtrans-58.8-49177.600000112.6S117 L136 Y137 V138 I143 F144S117-A140 WeakPolarHBondContact OG-CB 3.49Å; L136-A140 WeakPolarHBondContact O-CB 3.43Å; L136-A140 PolarHBondContact O-N 2.93Å; Y137-A140 WeakPolarHBondContact O-CB 3.45Å; Y137-A140 PolarHBondContact O-N 3.2Å; V138-A140 VanDerWaalsContact C-N 3.32Å; V138-A140 PolarHBondContact O-N 3.29Å; A140-I143 PolarHBondContact O-N 3Å; A140-F144 WeakPolarHBondContact O-CB 2.88Å; A140-F144 PolarHBondContact O-N 3.45Å
141V89.2Confident83.9Confident0 Ų052.4 Ų52.40%029%0.291CS..Hα-helixtrans-60.7-47.6177.3172.70000110.7L110 Y137 V138 F144 T145 A346 A349 V350L110-V141 HydrophobicContact CB-CG1 4.34Å; Y137-V141 HydrophobicContact CD1-CG2 4.49Å; Y137-V141 HydrophobicContact CD2-CG2 4.31Å; Y137-V141 HydrophobicContact CE1-CG2 4.1Å; Y137-V141 HydrophobicContact CE2-CG2 3.87Å; Y137-V141 WeakPolarHBondContact O-CG2 3.19Å; Y137-V141 PolarHBondContact O-N 2.9Å; V138-V141 PolarHBondContact O-N 3.34Å; V141-F144 PolarHBondContact O-N 3.48Å; V141-T145 WeakPolarHBondContact O-CB 3.49Å; V141-T145 PolarHBondContact O-N 3.23Å; V141-T145 PolarHBondContact O-OG1 2.97Å; V141-A346 HydrophobicContact CG1-CB 4.3Å; V141-A349 HydrophobicContact CG1-CB 4.35Å; V141-V350 HydrophobicContact CB-CG2 4.23Å; V141-V350 HydrophobicContact CG1-CG2 4.16Å
142F90.9Very high85.6Confident64 Ų6447 Ų4728%0.28126%0.262SS..Hα-helixtrans-67.2-37.9-179.6-86-76.4000113.1V138 V139 T146 F343 A346 V350V138-F142 HydrophobicContact CG1-CD2 3.74Å; V138-F142 HydrophobicContact CG1-CE2 3.84Å; V138-F142 VanDerWaalsContact O-CD2 3.3Å; V138-F142 WeakPolarHBondContact O-CD2 3.22Å; V138-F142 PolarHBondContact O-N 3.37Å; V139-F142 PolarHBondContact O-N 3.22Å; F142-T146 VanDerWaalsContact O-CB 3.23Å; F142-T146 WeakPolarHBondContact O-CB 3.28Å; F142-T146 PolarHBondContact O-N 2.8Å; F142-T146 PolarHBondContact O-OG1 3.3Å; F142-F343 HydrophobicContact CE1-CD2 4.48Å; F142-F343 HydrophobicContact CE1-CE2 4.24Å; F142-A346 HydrophobicContact CE1-CB 4.36Å; F142-V350 HydrophobicContact CD2-CG2 4.48Å; F142-V350 HydrophobicContact CE2-CG2 4.09Å
143I91.4Very high86.7Confident95 Ų9545.4 Ų45.449%0.48725%0.245SC..Hα-helixtrans-65.7-50.8175.1-71.6174.2000110.1V139 A140 T145 T146 V147V139-I143 HydrophobicContact CG1-CD1 3.46Å; V139-I143 VanDerWaalsContact CG1-CD1 3.46Å; V139-I143 HydrophobicContact CG1-CG1 4.14Å; V139-I143 WeakPolarHBondContact O-CB 3.06Å; V139-I143 WeakPolarHBondContact O-CG1 3.47Å; V139-I143 PolarHBondContact O-N 3.49Å; A140-I143 PolarHBondContact O-N 3Å; I143-T145 VanDerWaalsContact C-N 3.26Å; I143-T145 PolarHBondContact O-N 3.02Å; I143-T146 PolarHBondContact O-N 3.29Å; I143-V147 HydrophobicContact CG2-CG2 4.1Å; I143-V147 VanDerWaalsContact O-CB 3.23Å; I143-V147 WeakPolarHBondContact O-CB 3.29Å; I143-V147 WeakPolarHBondContact O-CG2 3.32Å; I143-V147 PolarHBondContact O-N 3.28Å
144F91.5Very high87.5Confident10 Ų1046.6 Ų46.64%0.04425%0.251CS..Iπ-helixtrans-56.2-45.3177.3-178.7-90.3000110.8L110 A113 A140 V141 I148 A149 L286 A290L110-F144 HydrophobicContact CD2-CD1 3.83Å; L110-F144 HydrophobicContact CD2-CE1 4.1Å; A113-F144 HydrophobicContact CB-CD1 3.71Å; A113-F144 HydrophobicContact CB-CD2 4.13Å; A113-F144 HydrophobicContact CB-CE1 3.58Å; A113-F144 HydrophobicContact CB-CE2 4.02Å; A113-F144 HydrophobicContact CB-CG 3.99Å; A113-F144 HydrophobicContact CB-CZ 3.74Å; A140-F144 WeakPolarHBondContact O-CB 2.88Å; A140-F144 PolarHBondContact O-N 3.45Å; V141-F144 PolarHBondContact O-N 3.48Å; F144-I148 HydrophobicContact CD2-CD1 3.77Å; F144-I148 HydrophobicContact CE2-CD1 4.05Å; F144-I148 HydrophobicContact CE2-CG2 4.42Å; F144-I148 WeakPolarHBondContact O-CA 3.38Å; F144-I148 VanDerWaalsContact O-CB 3.3Å; F144-I148 WeakPolarHBondContact O-CB 3.22Å; F144-I148 PolarHBondContact O-N 2.84Å; F144-A149 HydrophobicContact CE1-CB 4.43Å; F144-A149 PolarHBondContact O-N 3.36Å; F144-L286 HydrophobicContact CD2-CD1 3.88Å; F144-L286 HydrophobicContact CE2-CD1 3.46Å; F144-L286 VanDerWaalsContact CE2-CD1 3.46Å; F144-L286 HydrophobicContact CE2-CG 4.06Å; F144-L286 HydrophobicContact CZ-CD1 4.19Å; F144-A290 HydrophobicContact CE2-CB 4.25Å; F144-A290 HydrophobicContact CZ-CB 3.98Å
145T90.2Very high87.7Confident5 Ų554.9 Ų54.93%0.03128%0.283CS..Iπ-helixtrans-62.7-50179-57.80000111.9L110 V141 I143 A149 L150 V342 A346L110-T145 WeakPolarHBondContact CD2-OG1 3.36Å; V141-T145 WeakPolarHBondContact O-CB 3.49Å; V141-T145 PolarHBondContact O-N 3.23Å; V141-T145 PolarHBondContact O-OG1 2.97Å; I143-T145 VanDerWaalsContact C-N 3.26Å; I143-T145 PolarHBondContact O-N 3.02Å; T145-A149 WeakPolarHBondContact O-CB 3.41Å; T145-A149 PolarHBondContact O-N 2.87Å; T145-L150 VanDerWaalsContact O-CB 3.27Å; T145-L150 WeakPolarHBondContact O-CB 3.39Å; T145-L150 PolarHBondContact O-N 2.91Å; T145-V342 HydrophobicContact CG2-CG1 3.17Å; T145-A346 HydrophobicContact CG2-CB 4.04Å
146T89.5Confident87Confident82 Ų8248.2 Ų48.250%0.50326%0.257SS..Iπ-helixtrans-78-37.1-171.8-52.50000112.5F142 I143 P151F142-T146 VanDerWaalsContact O-CB 3.23Å; F142-T146 WeakPolarHBondContact O-CB 3.28Å; F142-T146 PolarHBondContact O-N 2.8Å; F142-T146 PolarHBondContact O-OG1 3.3Å; I143-T146 PolarHBondContact O-N 3.29Å; T146-P151 VanDerWaalsContact O-CD 3.24Å; T146-P151 WeakPolarHBondContact O-CD 3.4Å
147V90Very high86.3Confident97 Ų9749.7 Ų49.759%0.58827%0.268SS*.Iπ-helixtrans-91.4-31.2-173.1-179.50000112.2I143 P151I143-V147 HydrophobicContact CG2-CG2 4.1Å; I143-V147 VanDerWaalsContact O-CB 3.23Å; I143-V147 WeakPolarHBondContact O-CB 3.29Å; I143-V147 WeakPolarHBondContact O-CG2 3.32Å; I143-V147 PolarHBondContact O-N 3.28Å; V147-P151 WeakPolarHBondContact O-CG 3.46Å
148I89.4Confident85.3Confident71 Ų7150.8 Ų50.836%0.36428%0.275SS..Iπ-helixtrans-113-61.1-174.1-55.5174.9000110F144 P151 L152 A290F144-I148 HydrophobicContact CD2-CD1 3.77Å; F144-I148 HydrophobicContact CE2-CD1 4.05Å; F144-I148 HydrophobicContact CE2-CG2 4.42Å; F144-I148 WeakPolarHBondContact O-CA 3.38Å; F144-I148 VanDerWaalsContact O-CB 3.3Å; F144-I148 WeakPolarHBondContact O-CB 3.22Å; F144-I148 PolarHBondContact O-N 2.84Å; I148-P151 WeakPolarHBondContact O-CD 3.42Å; I148-L152 WeakPolarHBondContact O-CB 3.4Å; I148-L152 PolarHBondContact O-N 3.2Å; I148-A290 HydrophobicContact CG2-CB 3.59Å
149A88.7Confident84.3Confident0 Ų055.4 Ų55.40%029%0.288CS..Iπ-helixtrans-65.4-48.4-170.500000112.4F144 T145 S153 Y293F144-A149 HydrophobicContact CE1-CB 4.43Å; F144-A149 PolarHBondContact O-N 3.36Å; T145-A149 WeakPolarHBondContact O-CB 3.41Å; T145-A149 PolarHBondContact O-N 2.87Å; A149-S153 WeakPolarHBondContact O-CB 3.49Å; A149-S153 PolarHBondContact O-N 3.25Å; A149-S153 PolarHBondContact O-OG 3.39Å; A149-Y293 HydrophobicContact CB-CD1 3.69Å; A149-Y293 HydrophobicContact CB-CE1 3.76Å; A149-Y293 HydrophobicContact CB-CG 4.25Å
150L89.9Confident83.6Confident29 Ų2955.7 Ų55.715%0.15229%0.288CS..Hα-helixtrans-62.9-56.3-177.5-175.670.1000113.1T145 L152 S153 L154 T338 F339 V342T145-L150 VanDerWaalsContact O-CB 3.27Å; T145-L150 WeakPolarHBondContact O-CB 3.39Å; T145-L150 PolarHBondContact O-N 2.91Å; L150-L152 VanDerWaalsContact C-N 3.31Å; L150-L152 PolarHBondContact O-N 3.28Å; L150-S153 PolarHBondContact O-N 3.45Å; L150-S153 VanDerWaalsContact O-N 3.11Å; L150-S153 PolarHBondContact O-OG 2.97Å; L150-L154 HydrophobicContact CG-CD1 4.37Å; L150-L154 WeakPolarHBondContact O-CG 3.32Å; L150-L154 PolarHBondContact O-N 3.46Å; L150-T338 HydrophobicContact CD1-CG2 4.36Å; L150-F339 HydrophobicContact CD1-CD2 4.48Å; L150-F339 HydrophobicContact CD2-CD2 4.35Å; L150-V342 HydrophobicContact CB-CG1 4.44Å; L150-V342 HydrophobicContact CD1-CB 4.26Å; L150-V342 HydrophobicContact CD1-CG1 4.16Å; L150-V342 HydrophobicContact CD1-CG2 4.24Å
151P88.1Confident82.7Confident61 Ų6155.3 Ų55.340%0.39628%0.284SS..Hα-helixtrans-64.1-39.2-178.423-32.1000111.7T146 V147 I148 S153 L154 Y155T146-P151 VanDerWaalsContact O-CD 3.24Å; T146-P151 WeakPolarHBondContact O-CD 3.4Å; V147-P151 WeakPolarHBondContact O-CG 3.46Å; I148-P151 WeakPolarHBondContact O-CD 3.42Å; P151-S153 VanDerWaalsContact C-N 3.28Å; P151-S153 PolarHBondContact O-N 3.46Å; P151-L154 PolarHBondContact O-N 3.4Å; P151-Y155 PolarHBondContact O-N 3.22Å; P151-Y155 VanDerWaalsContact O-N 3.09Å
152L86.2Confident81.9Confident45 Ų4555.7 Ų55.724%0.23629%0.288CS..Hα-helixtrans-63.9-37.8176-167.961.8000110.8I148 L150 L154 Y155 A156 A290 P294I148-L152 WeakPolarHBondContact O-CB 3.4Å; I148-L152 PolarHBondContact O-N 3.2Å; L150-L152 VanDerWaalsContact C-N 3.31Å; L150-L152 PolarHBondContact O-N 3.28Å; L152-L154 VanDerWaalsContact C-N 3.35Å; L152-L154 PolarHBondContact O-N 2.93Å; L152-Y155 PolarHBondContact O-N 2.91Å; L152-A156 WeakPolarHBondContact O-CA 3.32Å; L152-A156 WeakPolarHBondContact O-CB 3.44Å; L152-A156 PolarHBondContact O-N 3.07Å; L152-A290 VanDerWaalsContact CD2-O 3.26Å; L152-A290 WeakPolarHBondContact CD2-O 3.1Å; L152-P294 HydrophobicContact CB-CG 4.18Å; L152-P294 HydrophobicContact CD2-CG 3.85Å; L152-P294 HydrophobicContact CG-CG 3.79Å
153S84.7Confident81.2Confident3 Ų359.1 Ų59.12%0.02131%0.305CS..Hα-helixtrans-71.6-24.5178.979.70000115.4A149 L150 P151A149-S153 WeakPolarHBondContact O-CB 3.49Å; A149-S153 PolarHBondContact O-N 3.25Å; A149-S153 PolarHBondContact O-OG 3.39Å; L150-S153 PolarHBondContact O-N 3.45Å; L150-S153 VanDerWaalsContact O-N 3.11Å; L150-S153 PolarHBondContact O-OG 2.97Å; P151-S153 VanDerWaalsContact C-N 3.28Å; P151-S153 PolarHBondContact O-N 3.46Å
154L83.4Confident80.8Confident91 Ų9156.2 Ų56.248%0.47629%0.29SS..Hα-helixtrans-79.9-36.4173.9-69.6172.7000111.6L150 P151 L152 T338L150-L154 HydrophobicContact CG-CD1 4.37Å; L150-L154 WeakPolarHBondContact O-CG 3.32Å; L150-L154 PolarHBondContact O-N 3.46Å; P151-L154 PolarHBondContact O-N 3.4Å; L152-L154 VanDerWaalsContact C-N 3.35Å; L152-L154 PolarHBondContact O-N 2.93Å; L154-T338 HydrophobicContact CD2-CG2 3.86Å; L154-T338 HydrophobicContact CG-CG2 4.44Å
155Y79.2Confident80.5Confident181 Ų18155.8 Ų55.871%0.7129%0.289SS*.Hα-helixtrans-91-28.1-176.7-169.7-99.9000113.9P151 L152 T157 L160P151-Y155 PolarHBondContact O-N 3.22Å; P151-Y155 VanDerWaalsContact O-N 3.09Å; L152-Y155 PolarHBondContact O-N 2.91Å; Y155-T157 PolarHBondContact O-N 3.36Å; Y155-T157 VanDerWaalsContact O-N 3.09Å; Y155-L160 HydrophobicContact CD1-CD2 4.36Å; Y155-L160 HydrophobicContact CE1-CD2 4.43Å
156A70.1Confident80.4Confident19 Ų1961 Ų6116%0.15731%0.311CS..  trans-59.1117.5-171.200000111.8L152 L161 P294L152-A156 WeakPolarHBondContact O-CA 3.32Å; L152-A156 WeakPolarHBondContact O-CB 3.44Å; L152-A156 PolarHBondContact O-N 3.07Å; A156-L161 HydrophobicContact CB-CD1 4.25Å; A156-L161 HydrophobicContact CB-CD2 4.36Å; A156-P294 HydrophobicContact CB-CB 4.03Å
157T68.5Low80.4Confident88 Ų8860.8 Ų60.854%0.5431%0.306SS..  trans-91.9143.9164.6-58.10000108.5Y155 R159 L160 L161Y155-T157 PolarHBondContact O-N 3.36Å; Y155-T157 VanDerWaalsContact O-N 3.09Å; T157-R159 HydrophobicContact CG2-CB 4.39Å; T157-R159 PolarHBondContact O-N 2.86Å; T157-L160 WeakPolarHBondContact O-CB 3.05Å; T157-L160 PolarHBondContact O-N 3.14Å; T157-L161 PolarHBondContact O-N 3.32Å
158V65.2Low80.4Confident25 Ų2556.2 Ų56.215%0.15228%0.278CS..Hα-helixtrans-51.3-35.2-179.9179.90000112.7M1 L161 G162 F298M1-V158 HydrophobicContact CE-CG2 3.86Å; M1-V158 HydrophobicContact SD-CB 3.98Å; M1-V158 HydrophobicContact SD-CG1 4.42Å; M1-V158 HydrophobicContact SD-CG2 3.63Å; V158-L161 PolarHBondContact O-N 3.46Å; V158-G162 PolarHBondContact O-N 2.96Å; V158-F298 HydrophobicContact CG2-CD1 4.38Å; V158-F298 HydrophobicContact CG2-CD2 4.46Å; V158-F298 HydrophobicContact CG2-CE1 4.22Å; V158-F298 HydrophobicContact CG2-CE2 4.32Å; V158-F298 HydrophobicContact CG2-CZ 4.24Å
159R65.9Low80.5Confident134 Ų13456 Ų5651%0.50628%0.275SS..Hα-helixtrans-60.6-51.9174.6-70-177.7179.6162.8-2.4113E2 V3 T157 L161 G162 Q163E2-R159 PolarHBondContact O-NE 3.35Å; E2-R159 PolarHBondContact O-NH2 2.82Å; V3-R159 HydrophobicContact CG1-CG 4.24Å; V3-R159 HydrophobicContact CG2-CG 3.53Å; T157-R159 HydrophobicContact CG2-CB 4.39Å; T157-R159 PolarHBondContact O-N 2.86Å; R159-L161 PolarHBondContact O-N 2.72Å; R159-G162 PolarHBondContact O-N 3.36Å; R159-Q163 PolarHBondContact O-N 3.27Å; R159-Q163 VanDerWaalsContact O-N 3.12Å
160L74Confident80.7Confident56 Ų5658.4 Ų58.429%0.29329%0.294SS..Hα-helixtrans-58.2-39.3176.817763000109.8Y155 T157 Q163 L164Y155-L160 HydrophobicContact CD1-CD2 4.36Å; Y155-L160 HydrophobicContact CE1-CD2 4.43Å; T157-L160 WeakPolarHBondContact O-CB 3.05Å; T157-L160 PolarHBondContact O-N 3.14Å; L160-Q163 WeakPolarHBondContact O-CB 3.37Å; L160-Q163 PolarHBondContact O-N 2.88Å; L160-L164 HydrophobicContact CD1-CD1 4.28Å; L160-L164 HydrophobicContact CD1-CG 4.27Å; L160-L164 HydrophobicContact CD2-CD1 4.39Å; L160-L164 HydrophobicContact CG-CD1 3.84Å; L160-L164 HydrophobicContact CG-CG 4.27Å; L160-L164 WeakPolarHBondContact O-CB 3.44Å; L160-L164 WeakPolarHBondContact O-CG 3.36Å; L160-L164 PolarHBondContact O-N 3.13Å
161L71.8Confident80.8Confident5 Ų557.3 Ų57.33%0.02629%0.29CS..Hα-helixtrans-74.2-33.7-175.2-145.758.3000113.3A156 T157 V158 R159 L164 S165 V291 P294 L295A156-L161 HydrophobicContact CB-CD1 4.25Å; A156-L161 HydrophobicContact CB-CD2 4.36Å; T157-L161 PolarHBondContact O-N 3.32Å; V158-L161 PolarHBondContact O-N 3.46Å; R159-L161 PolarHBondContact O-N 2.72Å; L161-L164 HydrophobicContact CD1-CD1 4.06Å; L161-L164 PolarHBondContact O-N 3.42Å; L161-S165 PolarHBondContact O-N 3.42Å; L161-S165 PolarHBondContact O-OG 3.26Å; L161-V291 HydrophobicContact CD1-CG1 4.5Å; L161-V291 WeakPolarHBondContact CD1-O 3.26Å; L161-P294 HydrophobicContact CD1-CB 4.07Å; L161-P294 HydrophobicContact CD1-CG 4.48Å; L161-P294 HydrophobicContact CD2-CB 3.98Å; L161-L295 HydrophobicContact CB-CD2 3.94Å; L161-L295 HydrophobicContact CB-CG 4.48Å; L161-L295 HydrophobicContact CD1-CG 4.29Å; L161-L295 HydrophobicContact CD2-CB 4.09Å; L161-L295 HydrophobicContact CD2-CD2 3.28Å; L161-L295 HydrophobicContact CD2-CG 3.41Å; L161-L295 VanDerWaalsContact CD2-CG 3.41Å; L161-L295 HydrophobicContact CG-CD1 4.25Å; L161-L295 HydrophobicContact CG-CD2 3.37Å; L161-L295 HydrophobicContact CG-CG 3.42Å; L161-L295 VanDerWaalsContact CG-CG 3.42Å
162G72.1Confident81.1Confident9 Ų954.4 Ų54.49%0.09327%0.271CS..Hα-helixtrans-62-41.8166.900000112.1V158 R159 S165V158-G162 PolarHBondContact O-N 2.96Å; R159-G162 PolarHBondContact O-N 3.36Å; G162-S165 WeakPolarHBondContact O-CB 3.28Å; G162-S165 PolarHBondContact O-N 3.49Å
163Q75.5Confident81.4Confident135 Ų13554 Ų5463%0.63127%0.274SS*.Hα-helixtrans-67.7-39.9175.1-68.6177.2-33.100112.3R159 L160 S165 F166R159-Q163 PolarHBondContact O-N 3.27Å; R159-Q163 VanDerWaalsContact O-N 3.12Å; L160-Q163 WeakPolarHBondContact O-CB 3.37Å; L160-Q163 PolarHBondContact O-N 2.88Å; Q163-S165 PolarHBondContact O-N 3.23Å; Q163-F166 WeakPolarHBondContact O-CB 3.4Å; Q163-F166 WeakPolarHBondContact O-CD2 3.31Å; Q163-F166 PolarHBondContact O-N 2.94Å
164L82.5Confident81.9Confident34 Ų3457.8 Ų57.818%0.17829%0.294CS..Hα-helixtrans-67.2-21.1176-68.7170.2000112.4L160 L161 F166 I167 A168 V291L160-L164 HydrophobicContact CD1-CD1 4.28Å; L160-L164 HydrophobicContact CD1-CG 4.27Å; L160-L164 HydrophobicContact CD2-CD1 4.39Å; L160-L164 HydrophobicContact CG-CD1 3.84Å; L160-L164 HydrophobicContact CG-CG 4.27Å; L160-L164 WeakPolarHBondContact O-CB 3.44Å; L160-L164 WeakPolarHBondContact O-CG 3.36Å; L160-L164 PolarHBondContact O-N 3.13Å; L161-L164 HydrophobicContact CD1-CD1 4.06Å; L161-L164 PolarHBondContact O-N 3.42Å; L164-F166 PolarHBondContact O-N 3.47Å; L164-I167 HydrophobicContact CD2-CD1 3.64Å; L164-I167 WeakPolarHBondContact O-CA 3.15Å; L164-I167 VanDerWaalsContact O-CB 3.28Å; L164-I167 WeakPolarHBondContact O-CB 3.22Å; L164-I167 PolarHBondContact O-N 3.14Å; L164-A168 PolarHBondContact O-N 3.25Å; L164-V291 HydrophobicContact CB-CB 4.35Å; L164-V291 HydrophobicContact CB-CG1 3.44Å; L164-V291 VanDerWaalsContact CB-CG1 3.44Å; L164-V291 HydrophobicContact CB-CG2 3.97Å; L164-V291 HydrophobicContact CD1-CG2 4.47Å; L164-V291 HydrophobicContact CD2-CG2 4.43Å
165S85.7Confident82.4Confident1 Ų153.5 Ų53.51%0.00727%0.271CS..Hα-helixtrans-62.4-22.3176.4-610000112.8N16 L161 G162 Q163 I167 A168 F169N16-S165 PolarHBondContact ND2-OG 3.15Å; L161-S165 PolarHBondContact O-N 3.42Å; L161-S165 PolarHBondContact O-OG 3.26Å; G162-S165 WeakPolarHBondContact O-CB 3.28Å; G162-S165 PolarHBondContact O-N 3.49Å; Q163-S165 PolarHBondContact O-N 3.23Å; S165-I167 VanDerWaalsContact C-N 3.3Å; S165-I167 PolarHBondContact O-N 3.39Å; S165-A168 PolarHBondContact O-N 3.46Å; S165-F169 WeakPolarHBondContact O-CB 3.33Å; S165-F169 PolarHBondContact O-N 3.4Å
166F87.8Confident83.1Confident116 Ų11645.9 Ų45.951%0.50924%0.243SC..Hα-helixtrans-62-37.3168.6-78.9-82.5000112.4L12 Q163 L164 F169 A170L12-F166 HydrophobicContact CD1-CD1 3.79Å; L12-F166 HydrophobicContact CD1-CD2 4.05Å; L12-F166 HydrophobicContact CD1-CE1 3.32Å; L12-F166 HydrophobicContact CD1-CE2 3.6Å; L12-F166 HydrophobicContact CD1-CG 4.15Å; L12-F166 HydrophobicContact CD1-CZ 3.21Å; Q163-F166 WeakPolarHBondContact O-CB 3.4Å; Q163-F166 WeakPolarHBondContact O-CD2 3.31Å; Q163-F166 PolarHBondContact O-N 2.94Å; L164-F166 PolarHBondContact O-N 3.47Å; F166-F169 PolarHBondContact O-N 3.39Å; F166-A170 WeakPolarHBondContact O-CB 3.35Å; F166-A170 PolarHBondContact O-N 3.13Å
167I89.1Confident84.3Confident77 Ų7749.5 Ų49.540%0.39526%0.264SS..Hα-helixtrans-67.1-44.2178.3-57178.2000109.8L164 S165 A170 A171 V287L164-I167 HydrophobicContact CD2-CD1 3.64Å; L164-I167 WeakPolarHBondContact O-CA 3.15Å; L164-I167 VanDerWaalsContact O-CB 3.28Å; L164-I167 WeakPolarHBondContact O-CB 3.22Å; L164-I167 PolarHBondContact O-N 3.14Å; S165-I167 VanDerWaalsContact C-N 3.3Å; S165-I167 PolarHBondContact O-N 3.39Å; I167-A170 PolarHBondContact O-N 2.88Å; I167-A171 PolarHBondContact O-N 2.94Å; I167-V287 HydrophobicContact CG2-CG1 3.81Å
168A91Very high85.5Confident0 Ų046.6 Ų46.60%024%0.244CC..Hα-helixtrans-62.1-44.7176.700000111.5N16 L164 S165 A170 A171 Y172N16-A168 WeakPolarHBondContact OD1-CB 3.08Å; L164-A168 PolarHBondContact O-N 3.25Å; S165-A168 PolarHBondContact O-N 3.46Å; A168-A170 VanDerWaalsContact C-N 3.33Å; A168-A170 PolarHBondContact O-N 3.21Å; A168-A171 WeakPolarHBondContact O-CB 3.04Å; A168-A171 PolarHBondContact O-N 3.27Å; A168-A171 VanDerWaalsContact O-N 3.13Å; A168-Y172 HydrophobicContact CB-CE2 4.12Å; A168-Y172 VanDerWaalsContact O-CD2 3.25Å; A168-Y172 WeakPolarHBondContact O-CD2 3.33Å; A168-Y172 VanDerWaalsContact O-CG 3.25Å; A168-Y172 PolarHBondContact O-N 3.46Å
169F91Very high86.8Confident67 Ų6745.4 Ų45.429%0.29424%0.237SC..Hα-helixtrans-60.8-40.9175.7-167.8-94000112.7L12 T15 S165 F166 A171 Y172 A173 V244 L248L12-F169 HydrophobicContact CD2-CD2 4.29Å; L12-F169 HydrophobicContact CD2-CG 4.3Å; T15-F169 HydrophobicContact CG2-CD2 4.37Å; T15-F169 HydrophobicContact CG2-CE2 4.43Å; S165-F169 WeakPolarHBondContact O-CB 3.33Å; S165-F169 PolarHBondContact O-N 3.4Å; F166-F169 PolarHBondContact O-N 3.39Å; F169-A171 VanDerWaalsContact C-N 3.32Å; F169-A171 PolarHBondContact O-N 3.02Å; F169-Y172 PolarHBondContact O-N 3.48Å; F169-A173 WeakPolarHBondContact O-CB 3.49Å; F169-A173 PolarHBondContact O-N 2.89Å; F169-V244 HydrophobicContact CE2-CG1 3.62Å; F169-V244 HydrophobicContact CZ-CG1 4.19Å; F169-L248 HydrophobicContact CD2-CD1 4.33Å; F169-L248 HydrophobicContact CE2-CD1 3.86Å
170A92.4Very high88.1Confident50 Ų5039.8 Ų39.841%0.41322%0.219SC..Hα-helixtrans-61.3-40.3174.700000111.8F166 I167 A168 A173 L174F166-A170 WeakPolarHBondContact O-CB 3.35Å; F166-A170 PolarHBondContact O-N 3.13Å; I167-A170 PolarHBondContact O-N 2.88Å; A168-A170 VanDerWaalsContact C-N 3.33Å; A168-A170 PolarHBondContact O-N 3.21Å; A170-A173 PolarHBondContact O-N 3.09Å; A170-L174 VanDerWaalsContact O-CG 3.3Å; A170-L174 WeakPolarHBondContact O-CG 3.38Å; A170-L174 PolarHBondContact O-N 2.92Å
171A93.2Very high89Confident6 Ų640 Ų405%0.0523%0.229CC..Hα-helixtrans-63.6-42.2174.600000112.3I167 A168 F169 L174 L175 A284I167-A171 PolarHBondContact O-N 2.94Å; A168-A171 WeakPolarHBondContact O-CB 3.04Å; A168-A171 PolarHBondContact O-N 3.27Å; A168-A171 VanDerWaalsContact O-N 3.13Å; F169-A171 VanDerWaalsContact C-N 3.32Å; F169-A171 PolarHBondContact O-N 3.02Å; A171-L174 PolarHBondContact O-N 3.24Å; A171-L175 PolarHBondContact O-N 3.18Å; A171-A284 HydrophobicContact CB-CB 4.1Å; A171-A284 WeakPolarHBondContact CB-O 3.45Å
172Y93.4Very high89.9Confident0 Ų041.5 Ų41.50%024%0.238CC..Hα-helixtrans-63.4-41.3175.2-54.6-33.5000112N16 V19 A168 F169 L175 V176 F285N16-Y172 PolarHBondContact OD1-OH 3.31Å; N16-Y172 VanDerWaalsContact OD1-OH 3.13Å; V19-Y172 HydrophobicContact CB-CD2 4.13Å; V19-Y172 HydrophobicContact CB-CE2 3.71Å; V19-Y172 HydrophobicContact CG1-CD1 3.97Å; V19-Y172 HydrophobicContact CG1-CD2 3.54Å; V19-Y172 HydrophobicContact CG1-CE1 3.84Å; V19-Y172 HydrophobicContact CG1-CE2 3.4Å; V19-Y172 VanDerWaalsContact CG1-CE2 3.4Å; V19-Y172 HydrophobicContact CG1-CG 3.84Å; A168-Y172 HydrophobicContact CB-CE2 4.12Å; A168-Y172 VanDerWaalsContact O-CD2 3.25Å; A168-Y172 WeakPolarHBondContact O-CD2 3.33Å; A168-Y172 VanDerWaalsContact O-CG 3.25Å; A168-Y172 PolarHBondContact O-N 3.46Å; F169-Y172 PolarHBondContact O-N 3.48Å; Y172-L175 WeakPolarHBondContact O-CB 3.45Å; Y172-L175 PolarHBondContact O-N 3.15Å; Y172-V176 WeakPolarHBondContact O-CG2 3.43Å; Y172-V176 PolarHBondContact O-N 3.16Å; Y172-F285 HydrophobicContact CD1-CD2 4.3Å; Y172-F285 AromaticContact CD1-CE2 3.83Å; Y172-F285 HydrophobicContact CD1-CE2 3.83Å; Y172-F285 HydrophobicContact CE1-CD2 4.33Å; Y172-F285 AromaticContact CE1-CE2 3.69Å; Y172-F285 HydrophobicContact CE1-CE2 3.69Å; Y172-F285 HydrophobicContact CE1-CZ 4.22Å
173A93.8Very high90.7Very high38 Ų3841.1 Ų41.131%0.31423%0.234SC..Hα-helixtrans-63.8-42174.800000111.9F169 A170 L175 V176 V177F169-A173 WeakPolarHBondContact O-CB 3.49Å; F169-A173 PolarHBondContact O-N 2.89Å; A170-A173 PolarHBondContact O-N 3.09Å; A173-L175 VanDerWaalsContact C-N 3.34Å; A173-L175 PolarHBondContact O-N 3.47Å; A173-V176 PolarHBondContact O-N 3.41Å; A173-V177 VanDerWaalsContact O-CG2 3.3Å; A173-V177 WeakPolarHBondContact O-CG2 3.42Å; A173-V177 PolarHBondContact O-N 3.49Å
174L94.6Very high91.4Very high82 Ų8238.9 Ų38.943%0.42923%0.226SC..Hα-helixtrans-61.8-41175-73.8174.6000112.1A170 A171 V177 H178 A284A170-L174 VanDerWaalsContact O-CG 3.3Å; A170-L174 WeakPolarHBondContact O-CG 3.38Å; A170-L174 PolarHBondContact O-N 2.92Å; A171-L174 PolarHBondContact O-N 3.24Å; L174-V177 PolarHBondContact O-N 2.93Å; L174-H178 WeakPolarHBondContact O-CB 3.45Å; L174-H178 PolarHBondContact O-N 2.9Å; L174-A284 HydrophobicContact CD1-CB 4.18Å
175L93.6Very high91.7Very high0 Ų040.9 Ų40.90%024%0.241CC..Hα-helixtrans-59.4-49.3173.5177.363.9000110.8L24 A171 Y172 A173 V177 H178 L179 V252 L269 I281 F285L24-L175 HydrophobicContact CD2-CD2 4.3Å; A171-L175 PolarHBondContact O-N 3.18Å; Y172-L175 WeakPolarHBondContact O-CB 3.45Å; Y172-L175 PolarHBondContact O-N 3.15Å; A173-L175 VanDerWaalsContact C-N 3.34Å; A173-L175 PolarHBondContact O-N 3.47Å; L175-V177 PolarHBondContact O-N 3.43Å; L175-H178 PolarHBondContact O-N 2.87Å; L175-L179 HydrophobicContact CD1-CD1 4.09Å; L175-L179 HydrophobicContact CD1-CG 4.19Å; L175-L179 HydrophobicContact CG-CD1 4.09Å; L175-L179 VanDerWaalsContact O-CG 3.31Å; L175-L179 WeakPolarHBondContact O-CG 3.42Å; L175-L179 PolarHBondContact O-N 3.14Å; L175-V252 HydrophobicContact CD2-CG2 4.3Å; L175-L269 HydrophobicContact CD1-CD2 4Å; L175-I281 HydrophobicContact CB-CG2 4.39Å; L175-I281 HydrophobicContact CD1-CG2 3.82Å; L175-F285 HydrophobicContact CD2-CD2 4.36Å; L175-F285 HydrophobicContact CD2-CE2 4.25Å
176V94.4Very high91.7Very high21 Ų2143 Ų4313%0.12725%0.252CS..Hα-helixtrans-59.1-46.3177.3170.70000111.6Y172 A173 H178 L179 A180 L248 C251 V252 F255Y172-V176 WeakPolarHBondContact O-CG2 3.43Å; Y172-V176 PolarHBondContact O-N 3.16Å; A173-V176 PolarHBondContact O-N 3.41Å; V176-H178 VanDerWaalsContact C-N 3.33Å; V176-H178 PolarHBondContact O-N 3.31Å; V176-L179 PolarHBondContact O-N 3.36Å; V176-A180 VanDerWaalsContact O-CB 3.29Å; V176-A180 WeakPolarHBondContact O-CB 3.04Å; V176-A180 PolarHBondContact O-N 3.26Å; V176-L248 HydrophobicContact CG2-CD2 4.16Å; V176-C251 HydrophobicContact CG1-CB 3.77Å; V176-C251 HydrophobicContact CG2-CB 4.12Å; V176-V252 HydrophobicContact CG2-CG2 3.57Å; V176-F255 HydrophobicContact CG1-CD2 4.49Å
177V94.8Very high91.6Very high96 Ų9640.6 Ų40.658%0.58224%0.244SC*.Hα-helixtrans-61.8-41.8179.6169.10000111.2A173 L174 L175 A180 A181A173-V177 VanDerWaalsContact O-CG2 3.3Å; A173-V177 WeakPolarHBondContact O-CG2 3.42Å; A173-V177 PolarHBondContact O-N 3.49Å; L174-V177 PolarHBondContact O-N 2.93Å; L175-V177 PolarHBondContact O-N 3.43Å; V177-A180 PolarHBondContact O-N 2.98Å; V177-A181 WeakPolarHBondContact O-CB 3.39Å; V177-A181 PolarHBondContact O-N 3.04Å
178H93.8Very high91.5Very high26 Ų2645.4 Ų45.412%0.1226%0.262CS..Hα-helixtrans-65.1-48.5176.9177.969.3000112.4L174 L175 V176 A180 A181 T182 S277 I281L174-H178 WeakPolarHBondContact O-CB 3.45Å; L174-H178 PolarHBondContact O-N 2.9Å; L175-H178 PolarHBondContact O-N 2.87Å; V176-H178 VanDerWaalsContact C-N 3.33Å; V176-H178 PolarHBondContact O-N 3.31Å; H178-A180 VanDerWaalsContact C-N 3.26Å; H178-A180 PolarHBondContact O-N 2.88Å; H178-A181 WeakPolarHBondContact O-CB 3.28Å; H178-A181 PolarHBondContact O-N 3.46Å; H178-A181 VanDerWaalsContact O-N 3.12Å; H178-T182 PolarHBondContact O-N 2.98Å; H178-T182 PolarHBondContact O-OG1 3.42Å; H178-S277 PolarHBondContact CE1-OG 3.19Å; H178-I281 HydrophobicContact CB-CD1 3.18Å; H178-I281 HydrophobicContact CB-CG1 4.19Å; H178-I281 WeakPolarHBondContact CD2-CD1 2.93Å; H178-I281 WeakPolarHBondContact ND1-CD1 3.36Å
179L93.1Very high91Very high0 Ų048.6 Ų48.60%028%0.284CS..Hα-helixtrans-60.3-40.6177.7-66.4176.4000110.7L175 V176 T182 A183 V252 F255 S259 Y260 I268 L272L175-L179 HydrophobicContact CD1-CD1 4.09Å; L175-L179 HydrophobicContact CD1-CG 4.19Å; L175-L179 HydrophobicContact CG-CD1 4.09Å; L175-L179 VanDerWaalsContact O-CG 3.31Å; L175-L179 WeakPolarHBondContact O-CG 3.42Å; L175-L179 PolarHBondContact O-N 3.14Å; V176-L179 PolarHBondContact O-N 3.36Å; L179-T182 PolarHBondContact O-N 3.25Å; L179-A183 VanDerWaalsContact O-CB 3.22Å; L179-A183 WeakPolarHBondContact O-CB 3.47Å; L179-A183 PolarHBondContact O-N 2.89Å; L179-V252 HydrophobicContact CD1-CB 4.31Å; L179-V252 HydrophobicContact CD1-CG1 3.88Å; L179-V252 HydrophobicContact CD1-CG2 4.25Å; L179-F255 HydrophobicContact CB-CB 3.67Å; L179-S259 PolarHBondContact O-OG 3.49Å; L179-Y260 HydrophobicContact CD2-CE2 3.96Å; L179-I268 HydrophobicContact CD1-CD1 4.07Å; L179-I268 HydrophobicContact CD2-CD1 3.81Å; L179-I268 HydrophobicContact CD2-CG1 4.37Å; L179-L272 HydrophobicContact CD2-CD2 4.14Å
180A93.3Very high89.8Confident16 Ų1650 Ų5013%0.13230%0.303CS..Hα-helixtrans-62.9-43.8174.500000111.8V176 V177 H178 T182 A183 L184 F255V176-A180 VanDerWaalsContact O-CB 3.29Å; V176-A180 WeakPolarHBondContact O-CB 3.04Å; V176-A180 PolarHBondContact O-N 3.26Å; V177-A180 PolarHBondContact O-N 2.98Å; H178-A180 VanDerWaalsContact C-N 3.26Å; H178-A180 PolarHBondContact O-N 2.88Å; A180-T182 VanDerWaalsContact C-N 3.27Å; A180-T182 PolarHBondContact O-N 2.78Å; A180-A183 PolarHBondContact O-N 3.48Å; A180-L184 VanDerWaalsContact O-CB 3.28Å; A180-L184 WeakPolarHBondContact O-CB 3.48Å; A180-L184 WeakPolarHBondContact O-CD1 3.36Å; A180-L184 WeakPolarHBondContact O-CG 3.37Å; A180-L184 PolarHBondContact O-N 2.93Å; A180-F255 HydrophobicContact CB-CD1 4.13Å; A180-F255 HydrophobicContact CB-CD2 3.85Å; A180-F255 HydrophobicContact CB-CE1 4.07Å; A180-F255 HydrophobicContact CB-CE2 3.81Å; A180-F255 HydrophobicContact CB-CG 4.02Å; A180-F255 HydrophobicContact CB-CZ 3.92Å
181A92.7Very high88.3Confident61 Ų6154.5 Ų54.550%0.50432%0.32SS..Hα-helixtrans-61.8-35177.900000112.6V177 H178 P185V177-A181 WeakPolarHBondContact O-CB 3.39Å; V177-A181 PolarHBondContact O-N 3.04Å; H178-A181 WeakPolarHBondContact O-CB 3.28Å; H178-A181 PolarHBondContact O-N 3.46Å; H178-A181 VanDerWaalsContact O-N 3.12Å; A181-P185 WeakPolarHBondContact O-CD 3.43Å
182T89.8Confident86.8Confident37 Ų3756.9 Ų56.923%0.22734%0.344CS..Hα-helixtrans-76.6-38.1175.3-53.60000112.2H178 L179 A180 P185H178-T182 PolarHBondContact O-N 2.98Å; H178-T182 PolarHBondContact O-OG1 3.42Å; L179-T182 PolarHBondContact O-N 3.25Å; A180-T182 VanDerWaalsContact C-N 3.27Å; A180-T182 PolarHBondContact O-N 2.78Å; T182-P185 WeakPolarHBondContact O-CD 3.37Å; T182-P185 VanDerWaalsContact O-CG 3.3Å; T182-P185 WeakPolarHBondContact O-CG 3.33Å
183A88.8Confident85.5Confident0 Ų058.8 Ų58.80%035%0.354CS..Hα-helixtrans-76.6-37.8-178.400000113.9L179 A180 I186 L187 F255 V258 S259L179-A183 VanDerWaalsContact O-CB 3.22Å; L179-A183 WeakPolarHBondContact O-CB 3.47Å; L179-A183 PolarHBondContact O-N 2.89Å; A180-A183 PolarHBondContact O-N 3.48Å; A183-I186 WeakPolarHBondContact O-CB 3.43Å; A183-I186 PolarHBondContact O-N 3.24Å; A183-I186 VanDerWaalsContact O-N 3.14Å; A183-L187 WeakPolarHBondContact O-CG 3.2Å; A183-L187 PolarHBondContact O-N 3.45Å; A183-F255 HydrophobicContact CB-CB 4.1Å; A183-F255 HydrophobicContact CB-CD1 3.71Å; A183-F255 HydrophobicContact CB-CG 4.36Å; A183-V258 HydrophobicContact CB-CB 4.04Å; A183-V258 HydrophobicContact CB-CG1 3.77Å; A183-S259 PolarHBondContact N-OG 2.91Å
184L90.1Very high84.2Confident89 Ų8960.9 Ų60.947%0.46636%0.363SS..Hα-helixtrans-55.5-43.8-177.5-78170.1000115A180 I186 L187 K188A180-L184 VanDerWaalsContact O-CB 3.28Å; A180-L184 WeakPolarHBondContact O-CB 3.48Å; A180-L184 WeakPolarHBondContact O-CD1 3.36Å; A180-L184 WeakPolarHBondContact O-CG 3.37Å; A180-L184 PolarHBondContact O-N 2.93Å; L184-I186 VanDerWaalsContact C-N 3.34Å; L184-L187 PolarHBondContact O-N 3.23Å; L184-K188 WeakPolarHBondContact O-CG 3.23Å; L184-K188 PolarHBondContact O-N 3.44Å; L184-K188 VanDerWaalsContact O-N 3.1Å
185P88.4Confident82.9Confident75 Ų7560 Ų6049%0.48736%0.359SS..Hα-helixtrans-64.3-37.8175.423.7-33.3000112.4A181 T182 K188 S189A181-P185 WeakPolarHBondContact O-CD 3.43Å; T182-P185 WeakPolarHBondContact O-CD 3.37Å; T182-P185 VanDerWaalsContact O-CG 3.3Å; T182-P185 WeakPolarHBondContact O-CG 3.33Å; P185-K188 PolarHBondContact O-N 3.41Å; P185-S189 PolarHBondContact O-N 2.86Å; P185-S189 VanDerWaalsContact O-N 3.07Å; P185-S189 PolarHBondContact O-OG 3.45Å
186I86.4Confident81.7Confident46 Ų4660.7 Ų60.724%0.23636%0.364CS..Hα-helixtrans-65.7-41.6177.8-57.3170.3000110.5A183 L184 K188 S189 I193 V258A183-I186 WeakPolarHBondContact O-CB 3.43Å; A183-I186 PolarHBondContact O-N 3.24Å; A183-I186 VanDerWaalsContact O-N 3.14Å; L184-I186 VanDerWaalsContact C-N 3.34Å; I186-K188 VanDerWaalsContact C-N 3.27Å; I186-K188 PolarHBondContact O-N 3.05Å; I186-S189 PolarHBondContact O-N 3.41Å; I186-S189 PolarHBondContact O-OG 2.92Å; I186-I193 HydrophobicContact CG2-CD1 4.01Å; I186-I193 HydrophobicContact CG2-CG1 4Å; I186-V258 HydrophobicContact CB-CG1 4.44Å; I186-V258 HydrophobicContact CG2-CG1 4.38Å
187L85.5Confident80.8Confident66 Ų6664.3 Ų64.335%0.34638%0.382SS..Hα-helixtrans-63.7-33175-70.9167.7000112.5A183 L184 I193 F254 V258A183-L187 WeakPolarHBondContact O-CG 3.2Å; A183-L187 PolarHBondContact O-N 3.45Å; L184-L187 PolarHBondContact O-N 3.23Å; L187-I193 HydrophobicContact CD2-CD1 3.77Å; L187-I193 HydrophobicContact CG-CD1 4.48Å; L187-F254 HydrophobicContact CD1-CE1 4.19Å; L187-F254 HydrophobicContact CD1-CZ 4.24Å; L187-F254 HydrophobicContact CD2-CZ 4.39Å; L187-V258 HydrophobicContact CD1-CG1 4.4Å; L187-V258 HydrophobicContact CD2-CG1 3.99Å; L187-V258 HydrophobicContact CD2-CG2 4.3Å; L187-V258 HydrophobicContact CG-CG1 3.86Å
188K87.1Confident79.9Confident177 Ų17766.9 Ų66.977%0.7738%0.382SS*.Hα-helixtrans-75.1-31.8177.5-76.4179-179.7-179.40113L184 P185 I186 S190L184-K188 WeakPolarHBondContact O-CG 3.23Å; L184-K188 PolarHBondContact O-N 3.44Å; L184-K188 VanDerWaalsContact O-N 3.1Å; P185-K188 PolarHBondContact O-N 3.41Å; I186-K188 VanDerWaalsContact C-N 3.27Å; I186-K188 PolarHBondContact O-N 3.05Å; K188-S190 VanDerWaalsContact C-N 3.31Å
189S80.9Confident79Confident67 Ų6769.2 Ų69.247%0.46939%0.389SS..Hα-helixtrans-76.8-14.7-17951.20000113.8P185 I186 D191P185-S189 PolarHBondContact O-N 2.86Å; P185-S189 VanDerWaalsContact O-N 3.07Å; P185-S189 PolarHBondContact O-OG 3.45Å; I186-S189 PolarHBondContact O-N 3.41Å; I186-S189 PolarHBondContact O-OG 2.92Å; S189-D191 PolarHBondContact O-N 3.11Å
190S65.8Low78.2Confident98 Ų9873 Ų7369%0.68541%0.414SS*.  trans53.2-15.2179.7-164.10000117.5K188 G192K188-S190 VanDerWaalsContact C-N 3.31Å; S190-G192 PolarHBondContact O-N 3.4Å
191D60.6Low77.1Confident144 Ų14478.8 Ų78.877%0.7744%0.438SS*.SBendtrans-83.1114.2-177.1-70.1-23000109.8S189S189-D191 PolarHBondContact O-N 3.11Å
192G61.4Low76.2Confident55 Ų5575.9 Ų75.957%0.56742%0.415SS*.SBendtrans99.26.3162.900000118.1S190 T194S190-G192 PolarHBondContact O-N 3.4Å; G192-T194 PolarHBondContact O-N 2.71Å; G192-T194 VanDerWaalsContact O-N 3.13Å
193I66.6Low75.6Confident40 Ų4075.5 Ų75.521%0.20541%0.412CS..  trans-80.498.3175.4-48178000110.2I186 L187 L195 V258I186-I193 HydrophobicContact CG2-CD1 4.01Å; I186-I193 HydrophobicContact CG2-CG1 4Å; L187-I193 HydrophobicContact CD2-CD1 3.77Å; L187-I193 HydrophobicContact CG-CD1 4.48Å; I193-L195 HydrophobicContact CB-CD1 4.3Å; I193-L195 HydrophobicContact CG2-CD1 3.41Å; I193-L195 VanDerWaalsContact CG2-CD1 3.41Å; I193-L195 HydrophobicContact CG2-CG 3.75Å; I193-L195 PolarHBondContact O-N 3.26Å; I193-V258 HydrophobicContact CD1-CG1 4.37Å
194T66.4Low75Confident82 Ų8279.7 Ų79.750%0.50343%0.434SS..  trans-87.176.4172.161.60000111G192 A196 Y257G192-T194 PolarHBondContact O-N 2.71Å; G192-T194 VanDerWaalsContact O-N 3.13Å; T194-A196 PolarHBondContact O-N 2.67Å; T194-A196 VanDerWaalsContact O-N 3.11Å; T194-Y257 PolarHBondContact O-OH 3.35Å
195L67.4Low74.3Confident65 Ų6576.2 Ų76.234%0.3442%0.415SS..  trans-66.3110.5174.3-79.2124.4000110.3F45 I193 L197 Y257F45-L195 HydrophobicContact CB-CD2 4.06Å; F45-L195 HydrophobicContact CG-CD2 4.15Å; I193-L195 HydrophobicContact CB-CD1 4.3Å; I193-L195 HydrophobicContact CG2-CD1 3.41Å; I193-L195 VanDerWaalsContact CG2-CD1 3.41Å; I193-L195 HydrophobicContact CG2-CG 3.75Å; I193-L195 PolarHBondContact O-N 3.26Å; L195-L197 HydrophobicContact CB-CD2 4.4Å; L195-L197 PolarHBondContact O-N 3.14Å; L195-L197 VanDerWaalsContact O-N 3.16Å; L195-Y257 HydrophobicContact CD2-CD1 4.25Å; L195-Y257 HydrophobicContact CD2-CE1 3.87Å; L195-Y257 HydrophobicContact CG-CE1 4.12Å
196A69.3Low73.9Confident13 Ų1372.7 Ų72.711%0.10739%0.392CS..  trans-70.4107.416300000107.9K32 G44 F45 T194 R199 Y257K32-A196 HydrophobicContact CG-CB 4.36Å; G44-A196 CarbonylContact C-O 3.35Å; G44-A196 WeakPolarHBondContact CA-O 3.41Å; F45-A196 PolarHBondContact N-O 3.3Å; T194-A196 PolarHBondContact O-N 2.67Å; T194-A196 VanDerWaalsContact O-N 3.11Å; A196-R199 HydrophobicContact CB-CG 4.49Å; A196-Y257 PolarHBondContact N-OH 2.99Å
197L73.9Confident73.7Confident98 Ų9871.6 Ų71.651%0.51339%0.387SS..  trans-84.4-36.2-175.2-70.5168000113L46 L47 L195L46-L197 WeakPolarHBondContact CB-O 3.41Å; L46-L197 PolarHBondContact N-O 2.88Å; L46-L197 VanDerWaalsContact N-O 3.17Å; L47-L197 PolarHBondContact N-O 3.45Å; L195-L197 HydrophobicContact CB-CD2 4.4Å; L195-L197 PolarHBondContact O-N 3.14Å; L195-L197 VanDerWaalsContact O-N 3.16Å
198W76.3Confident73.4Confident150 Ų15068.7 Ų68.757%0.56837%0.372SS*.  trans-144.3108.1-170-168.6-86.8000111.1L46 L47 L50L46-W198 HydrophobicContact CD2-CE3 4.43Å; L47-W198 HydrophobicContact CB-CD2 4.5Å; L47-W198 HydrophobicContact CB-CE3 4.11Å; L47-W198 HydrophobicContact CB-CZ3 4.42Å; L47-W198 HydrophobicContact CD1-CE3 4.33Å; L47-W198 HydrophobicContact CD1-CH2 3.88Å; L47-W198 HydrophobicContact CD1-CZ2 4.21Å; L47-W198 HydrophobicContact CD1-CZ3 3.95Å; L47-W198 HydrophobicContact CD2-CD2 4.48Å; L50-W198 HydrophobicContact CD1-CZ3 4.1Å
199R75.1Confident73.1Confident75 Ų7561 Ų6128%0.28334%0.339SS..  trans-139.998.2175.4-66.4-165.5176.3-157.3-11.7109.9C43 A196 E201C43-R199 CarbonylContact C-O 3.45Å; C43-R199 WeakPolarHBondContact CA-O 3.16Å; C43-R199 PolarHBondContact O-N 3.44Å; C43-R199 VanDerWaalsContact O-O 3.11Å; A196-R199 HydrophobicContact CB-CG 4.49Å; R199-E201 PolarHBondContact O-N 3.04Å
200P76Confident73.4Confident80 Ų8057.8 Ų57.852%0.51932%0.316SS..G310 helixtrans-67.5-21.7-175.327.4-34.2000113.5L47 G202 V203L47-P200 HydrophobicContact CD2-CB 4.48Å; P200-G202 VanDerWaalsContact C-N 3.33Å; P200-G202 PolarHBondContact O-N 3.4Å; P200-V203 WeakPolarHBondContact O-CB 3.19Å; P200-V203 WeakPolarHBondContact O-CG2 3.4Å; P200-V203 PolarHBondContact O-N 3.31Å; P200-V203 VanDerWaalsContact O-N 3.16Å
201E71.5Confident74.5Confident136 Ų13653.3 Ų53.364%0.63629%0.285SS*.G310 helixtrans-54.2-44.4-178.7-67.1160.8-156.900112.6T40 R199 V203T40-E201 PolarHBondContact OG1-OE2 2.88Å; R199-E201 PolarHBondContact O-N 3.04Å; E201-V203 VanDerWaalsContact C-N 3.34Å; E201-V203 PolarHBondContact O-N 2.92Å
202G72.3Confident75.7Confident1 Ų147.1 Ų47.11%0.0126%0.256CS..G310 helixtrans-79.8-7.5-177.600000115.2L41 P200 L204 F205 V206L41-G202 WeakPolarHBondContact O-CA 3.44Å; P200-G202 VanDerWaalsContact C-N 3.33Å; P200-G202 PolarHBondContact O-N 3.4Å; G202-L204 VanDerWaalsContact C-N 3.27Å; G202-L204 PolarHBondContact O-N 3.48Å; G202-F205 PolarHBondContact O-N 3.05Å; G202-F205 VanDerWaalsContact O-N 3.16Å; G202-V206 WeakPolarHBondContact O-CG2 3.41Å; G202-V206 PolarHBondContact O-N 2.89Å
203V78.6Confident77Confident29 Ų2944.9 Ų44.918%0.17623%0.232CC..Hα-helixtrans-60-40.7-174.41740000111.3C43 L47 V51 P200 E201 F205 V206 L207C43-V203 HydrophobicContact CB-CG2 3.86Å; L47-V203 HydrophobicContact CD1-CG2 4.39Å; L47-V203 HydrophobicContact CD2-CG2 3.38Å; L47-V203 HydrophobicContact CG-CG2 3.8Å; V51-V203 HydrophobicContact CG2-CG1 4.01Å; V51-V203 HydrophobicContact CG2-CG2 4.38Å; P200-V203 WeakPolarHBondContact O-CB 3.19Å; P200-V203 WeakPolarHBondContact O-CG2 3.4Å; P200-V203 PolarHBondContact O-N 3.31Å; P200-V203 VanDerWaalsContact O-N 3.16Å; E201-V203 VanDerWaalsContact C-N 3.34Å; E201-V203 PolarHBondContact O-N 2.92Å; V203-F205 VanDerWaalsContact C-N 3.28Å; V203-F205 PolarHBondContact O-N 3.39Å; V203-V206 PolarHBondContact O-N 2.76Å; V203-L207 HydrophobicContact CG1-CD1 3.86Å; V203-L207 HydrophobicContact CG1-CG 4.06Å; V203-L207 VanDerWaalsContact O-CB 3.3Å; V203-L207 WeakPolarHBondContact O-CB 3.48Å; V203-L207 WeakPolarHBondContact O-CG 3.3Å; V203-L207 PolarHBondContact O-N 3.19Å
204L75.9Confident78.2Confident87 Ų8743 Ų4346%0.45522%0.222SC..Hα-helixtrans-65.1-32.3-178.4-61.8-171000112.7G202 L207 P208 V407 V411G202-L204 VanDerWaalsContact C-N 3.27Å; G202-L204 PolarHBondContact O-N 3.48Å; L204-L207 HydrophobicContact CD2-CD1 4.47Å; L204-P208 VanDerWaalsContact O-CD 3.22Å; L204-P208 WeakPolarHBondContact O-CD 3.27Å; L204-V407 HydrophobicContact CB-CG1 3.52Å; L204-V407 HydrophobicContact CD1-CG1 3.99Å; L204-V407 HydrophobicContact CD2-CG1 3.81Å; L204-V407 HydrophobicContact CD2-CG2 4.5Å; L204-V407 HydrophobicContact CG-CG1 3.93Å; L204-V411 HydrophobicContact CB-CG2 4.29Å
205F75.6Confident79.4Confident17 Ų1739.2 Ų39.28%0.07520%0.199CC..Hα-helixtrans-75.5-44.2175170.9-98.1000112.4F28 L41 G202 V203 L207 P208 I209 V411 L415F28-F205 AromaticContact CD1-CE1 3.95Å; F28-F205 HydrophobicContact CD1-CE1 3.95Å; F28-F205 HydrophobicContact CD1-CZ 4.18Å; F28-F205 AromaticContact CE1-CE1 3.62Å; F28-F205 HydrophobicContact CE1-CE1 3.62Å; F28-F205 AromaticContact CE1-CZ 3.6Å; F28-F205 HydrophobicContact CE1-CZ 3.6Å; L41-F205 HydrophobicContact CB-CD1 4.05Å; L41-F205 HydrophobicContact CB-CE1 4.24Å; L41-F205 HydrophobicContact CB-CG 4.45Å; L41-F205 HydrophobicContact CD2-CB 4.27Å; L41-F205 HydrophobicContact CD2-CD1 4.19Å; L41-F205 HydrophobicContact CD2-CD2 3.72Å; L41-F205 HydrophobicContact CD2-CE2 4.1Å; L41-F205 HydrophobicContact CD2-CG 3.78Å; L41-F205 HydrophobicContact CD2-CZ 4.5Å; L41-F205 WeakPolarHBondContact O-CD1 3.23Å; G202-F205 PolarHBondContact O-N 3.05Å; G202-F205 VanDerWaalsContact O-N 3.16Å; V203-F205 VanDerWaalsContact C-N 3.28Å; V203-F205 PolarHBondContact O-N 3.39Å; F205-L207 VanDerWaalsContact C-N 3.35Å; F205-L207 PolarHBondContact O-N 3.24Å; F205-P208 VanDerWaalsContact O-CD 3.28Å; F205-P208 WeakPolarHBondContact O-CD 3.27Å; F205-P208 VanDerWaalsContact O-CG 3.29Å; F205-P208 WeakPolarHBondContact O-CG 3.41Å; F205-I209 HydrophobicContact CD1-CD1 4.27Å; F205-I209 HydrophobicContact CE1-CD1 3.55Å; F205-I209 HydrophobicContact CE2-CD1 4.17Å; F205-I209 HydrophobicContact CZ-CD1 3.48Å; F205-I209 VanDerWaalsContact CZ-CD1 3.48Å; F205-V411 HydrophobicContact CB-CG1 3.99Å; F205-V411 HydrophobicContact CD2-CG1 3.76Å; F205-V411 HydrophobicContact CG-CG1 4.38Å; F205-L415 HydrophobicContact CD2-CD1 3.98Å; F205-L415 HydrophobicContact CE2-CD1 3.68Å; F205-L415 HydrophobicContact CE2-CD2 4.06Å; F205-L415 HydrophobicContact CE2-CG 4.43Å
206V79Confident80.4Confident0 Ų036.1 Ų36.10%018%0.183CC..Hα-helixtrans-71.2-32.9-174.7171.10000112.6C29 C43 G202 V203 I209 F210C29-V206 HydrophobicContact CB-CB 4.25Å; C29-V206 HydrophobicContact CB-CG1 3.72Å; C29-V206 HydrophobicContact CB-CG2 3.64Å; C29-V206 WeakPolarHBondContact O-CG2 3.44Å; C43-V206 HydrophobicContact CB-CG2 4.32Å; G202-V206 WeakPolarHBondContact O-CG2 3.41Å; G202-V206 PolarHBondContact O-N 2.89Å; V203-V206 PolarHBondContact O-N 2.76Å; V206-I209 PolarHBondContact O-N 2.87Å; V206-F210 HydrophobicContact CG1-CD1 3.93Å; V206-F210 HydrophobicContact CG1-CD2 3.49Å; V206-F210 VanDerWaalsContact CG1-CD2 3.49Å; V206-F210 HydrophobicContact CG1-CE1 3.6Å; V206-F210 HydrophobicContact CG1-CE2 3.12Å; V206-F210 HydrophobicContact CG1-CG 3.86Å; V206-F210 HydrophobicContact CG1-CZ 3.16Å; V206-F210 PolarHBondContact O-N 2.85Å
207L82.5Confident81.4Confident24 Ų2435.7 Ų35.713%0.12618%0.178CC..Hα-helixtrans-50.7-57-178.5-91.2173.8000113.9V51 V203 L204 F205 I209 F210 S211 Y400 M404V51-L207 HydrophobicContact CG1-CD2 3.65Å; V51-L207 HydrophobicContact CG1-CG 4.09Å; V203-L207 HydrophobicContact CG1-CD1 3.86Å; V203-L207 HydrophobicContact CG1-CG 4.06Å; V203-L207 VanDerWaalsContact O-CB 3.3Å; V203-L207 WeakPolarHBondContact O-CB 3.48Å; V203-L207 WeakPolarHBondContact O-CG 3.3Å; V203-L207 PolarHBondContact O-N 3.19Å; L204-L207 HydrophobicContact CD2-CD1 4.47Å; F205-L207 VanDerWaalsContact C-N 3.35Å; F205-L207 PolarHBondContact O-N 3.24Å; L207-I209 VanDerWaalsContact C-N 3.3Å; L207-I209 PolarHBondContact O-N 3Å; L207-F210 PolarHBondContact O-N 3.5Å; L207-S211 VanDerWaalsContact O-CB 3.3Å; L207-S211 WeakPolarHBondContact O-CB 3.15Å; L207-S211 PolarHBondContact O-N 3.3Å; L207-Y400 HydrophobicContact CD2-CE2 4.13Å; L207-Y400 WeakPolarHBondContact CD2-OH 3.24Å; L207-M404 HydrophobicContact CB-CE 3.82Å; L207-M404 HydrophobicContact CB-SD 3.59Å; L207-M404 VanDerWaalsContact CB-SD 3.59Å; L207-M404 HydrophobicContact CD1-SD 4.07Å; L207-M404 HydrophobicContact CD2-SD 4.01Å; L207-M404 HydrophobicContact CG-SD 4.11Å; L207-M404 WeakPolarHBondContact O-CE 3.44Å
208P78.9Confident82Confident5 Ų531.1 Ų31.13%0.03215%0.154CC..Hα-helixtrans-60.4-35.9178.917.7-30.6000113.6L204 F205 G212 M404 S408L204-P208 VanDerWaalsContact O-CD 3.22Å; L204-P208 WeakPolarHBondContact O-CD 3.27Å; F205-P208 VanDerWaalsContact O-CD 3.28Å; F205-P208 WeakPolarHBondContact O-CD 3.27Å; F205-P208 VanDerWaalsContact O-CG 3.29Å; F205-P208 WeakPolarHBondContact O-CG 3.41Å; P208-G212 PolarHBondContact O-N 3.48Å; P208-M404 HydrophobicContact CB-CE 4.13Å; P208-S408 VanDerWaalsContact CB-OG 3.23Å; P208-S408 WeakPolarHBondContact CB-OG 3.35Å; P208-S408 WeakPolarHBondContact CD-OG 3.2Å; P208-S408 WeakPolarHBondContact CG-OG 3.31Å
209I80.9Confident82.4Confident14 Ų1424.1 Ų24.17%0.07213%0.128CC..Hα-helixtrans-65.6-50.2178.1-59.4173000109.8A25 F205 V206 L207 G212 A213A25-I209 HydrophobicContact CB-CG2 4.15Å; F205-I209 HydrophobicContact CD1-CD1 4.27Å; F205-I209 HydrophobicContact CE1-CD1 3.55Å; F205-I209 HydrophobicContact CE2-CD1 4.17Å; F205-I209 HydrophobicContact CZ-CD1 3.48Å; F205-I209 VanDerWaalsContact CZ-CD1 3.48Å; V206-I209 PolarHBondContact O-N 2.87Å; L207-I209 VanDerWaalsContact C-N 3.3Å; L207-I209 PolarHBondContact O-N 3Å; I209-G212 PolarHBondContact O-N 3.25Å; I209-A213 VanDerWaalsContact O-CB 3.25Å; I209-A213 WeakPolarHBondContact O-CB 3.26Å; I209-A213 PolarHBondContact O-N 2.94Å
210F87.4Confident82.9Confident0 Ų020.6 Ų20.60%012%0.115CC..Hα-helixtrans-65.4-41.6178.5-71.1-2.8000112.5L26 C29 F30 G48 V51 L52 C55 V206 L207 A213 L214L26-F210 HydrophobicContact CD2-CD1 3.47Å; L26-F210 VanDerWaalsContact CD2-CD1 3.47Å; L26-F210 HydrophobicContact CD2-CE1 3.41Å; L26-F210 VanDerWaalsContact CD2-CE1 3.41Å; C29-F210 HydrophobicContact CB-CE1 3.54Å; C29-F210 HydrophobicContact CB-CZ 3.7Å; F30-F210 AromaticContact CD2-CZ 3.99Å; F30-F210 HydrophobicContact CD2-CZ 3.99Å; F30-F210 HydrophobicContact CE2-CE1 4.27Å; F30-F210 HydrophobicContact CE2-CE2 4.22Å; F30-F210 AromaticContact CE2-CZ 3.46Å; F30-F210 HydrophobicContact CE2-CZ 3.46Å; F30-F210 VanDerWaalsContact CE2-CZ 3.46Å; F30-F210 HydrophobicContact CZ-CZ 4.41Å; G48-F210 WeakPolarHBondContact O-CE2 2.93Å; V51-F210 HydrophobicContact CB-CD2 4.41Å; V51-F210 HydrophobicContact CB-CE2 4.44Å; V51-F210 HydrophobicContact CG1-CD2 3.93Å; V51-F210 HydrophobicContact CG1-CE2 4.36Å; L52-F210 HydrophobicContact CB-CD2 4.01Å; L52-F210 HydrophobicContact CB-CE2 4.02Å; L52-F210 HydrophobicContact CD1-CD2 4.24Å; L52-F210 HydrophobicContact CD1-CG 4.25Å; C55-F210 HydrophobicContact CB-CB 4.4Å; V206-F210 HydrophobicContact CG1-CD1 3.93Å; V206-F210 HydrophobicContact CG1-CD2 3.49Å; V206-F210 VanDerWaalsContact CG1-CD2 3.49Å; V206-F210 HydrophobicContact CG1-CE1 3.6Å; V206-F210 HydrophobicContact CG1-CE2 3.12Å; V206-F210 HydrophobicContact CG1-CG 3.86Å; V206-F210 HydrophobicContact CG1-CZ 3.16Å; V206-F210 PolarHBondContact O-N 2.85Å; L207-F210 PolarHBondContact O-N 3.5Å; F210-A213 PolarHBondContact O-N 3.45Å; F210-L214 WeakPolarHBondContact O-CB 3.23Å; F210-L214 WeakPolarHBondContact O-CG 3.46Å; F210-L214 PolarHBondContact O-N 3.38Å
211S88.3Confident83.1Confident4 Ų416.9 Ų16.93%0.0289%0.091CC..Hα-helixtrans-62.1-43.8175.5-90.80000112.9L207 L215 Y372 Y400 M404L207-S211 VanDerWaalsContact O-CB 3.3Å; L207-S211 WeakPolarHBondContact O-CB 3.15Å; L207-S211 PolarHBondContact O-N 3.3Å; S211-L215 PolarHBondContact O-N 2.92Å; S211-Y372 WeakPolarHBondContact CB-OH 3.05Å; S211-Y372 WeakPolarHBondContact OG-CE2 3.23Å; S211-Y372 PolarHBondContact OG-OH 3.11Å; S211-Y400 PolarHBondContact OG-OH 3.2Å; S211-M404 WeakPolarHBondContact OG-CE 3.36Å
212G86Confident83.2Confident15 Ų1511.8 Ų11.816%0.1557%0.069CC..Hα-helixtrans-67-41.5177.400000112P208 I209 L215P208-G212 PolarHBondContact O-N 3.48Å; I209-G212 PolarHBondContact O-N 3.25Å; G212-L215 VanDerWaalsContact O-CB 3.26Å; G212-L215 WeakPolarHBondContact O-CB 2.95Å; G212-L215 PolarHBondContact O-N 3.39Å
213A88.7Confident83.5Confident8 Ų812.7 Ų12.77%0.0667%0.074CC..Hα-helixtrans-66-39.7177.900000112.3A18 I209 F210 L215 Y249A18-A213 CarbonylContact C-O 3.45Å; I209-A213 VanDerWaalsContact O-CB 3.25Å; I209-A213 WeakPolarHBondContact O-CB 3.26Å; I209-A213 PolarHBondContact O-N 2.94Å; F210-A213 PolarHBondContact O-N 3.45Å; A213-L215 PolarHBondContact O-N 3.49Å; A213-Y249 HydrophobicContact CB-CE2 3.96Å; A213-Y249 PolarHBondContact O-OH 3.16Å
214L92.2Very high83.3Confident0 Ų011.3 Ų11.30%07%0.066CC..THydrogen-bonded Turntrans-77.8-1.6178.4-71.1167.8000113.6L52 C55 A56 T59 F210 M216 L242 C245 Y249L52-L214 HydrophobicContact CD1-CD1 3.93Å; C55-L214 HydrophobicContact CB-CD1 3.75Å; A56-L214 HydrophobicContact CB-CD1 4.01Å; T59-L214 WeakPolarHBondContact CG2-O 3.43Å; F210-L214 WeakPolarHBondContact O-CB 3.23Å; F210-L214 WeakPolarHBondContact O-CG 3.46Å; F210-L214 PolarHBondContact O-N 3.38Å; L214-M216 PolarHBondContact O-N 2.81Å; L214-L242 HydrophobicContact CD2-CD2 4.3Å; L214-C245 HydrophobicContact CD2-CB 4.14Å; L214-Y249 HydrophobicContact CD2-CD2 3.8Å; L214-Y249 HydrophobicContact CD2-CE2 3.54Å; L214-Y249 HydrophobicContact CG-CD2 4.27Å; L214-Y249 HydrophobicContact CG-CE2 3.9Å
215L91.2Very high82.9Confident3 Ų38.9 Ų8.92%0.0165%0.053CC..  trans-72.2111.5-173.9-142.474.2000112.1F101 S211 G212 A213 G367 V370F101-L215 HydrophobicContact CD1-CD2 4.04Å; F101-L215 HydrophobicContact CD2-CD2 4.2Å; F101-L215 HydrophobicContact CE1-CB 4.17Å; F101-L215 HydrophobicContact CE1-CD2 3.62Å; F101-L215 HydrophobicContact CE1-CG 4.42Å; F101-L215 HydrophobicContact CE2-CD2 3.78Å; F101-L215 HydrophobicContact CG-CD2 4.31Å; F101-L215 HydrophobicContact CZ-CB 3.76Å; F101-L215 HydrophobicContact CZ-CD2 3.48Å; F101-L215 VanDerWaalsContact CZ-CD2 3.48Å; F101-L215 HydrophobicContact CZ-CG 4.22Å; S211-L215 PolarHBondContact O-N 2.92Å; G212-L215 VanDerWaalsContact O-CB 3.26Å; G212-L215 WeakPolarHBondContact O-CB 2.95Å; G212-L215 PolarHBondContact O-N 3.39Å; A213-L215 PolarHBondContact O-N 3.49Å; L215-G367 WeakPolarHBondContact CD2-O 3.22Å; L215-V370 HydrophobicContact CD2-CG1 4.45Å
216M89.4Confident82.3Confident0 Ų010.9 Ų10.90%07%0.065CC..  trans-119.5-2.317762.6-179.158.500113.3A18 L214 P218 Q219 L220 V238 L242A18-M216 HydrophobicContact CB-CE 4.29Å; L214-M216 PolarHBondContact O-N 2.81Å; M216-P218 VanDerWaalsContact C-CD 3.49Å; M216-Q219 PolarHBondContact O-N 3.17Å; M216-Q219 PolarHBondContact O-OE1 2.95Å; M216-L220 VanDerWaalsContact O-CB 3.29Å; M216-L220 WeakPolarHBondContact O-CB 3.28Å; M216-L220 PolarHBondContact O-N 3.32Å; M216-V238 HydrophobicContact SD-CG1 3.89Å; M216-L242 HydrophobicContact CE-CB 4.44Å; M216-L242 HydrophobicContact CE-CD2 3.29Å; M216-L242 HydrophobicContact CE-CG 3.46Å; M216-L242 VanDerWaalsContact CE-CG 3.46Å; M216-L242 HydrophobicContact SD-CD1 4.46Å; M216-L242 HydrophobicContact SD-CD2 4.14Å; M216-L242 HydrophobicContact SD-CG 3.91Å
217Q89.6Confident81.4Confident4 Ų411.5 Ų11.52%0.0197%0.069CC..Hα-helixtrans-58.7-43-176.7-66.484.6-38.100113V66 Q219 L220 S221 G371V66-Q217 HydrophobicContact CG2-CG 4.41Å; Q217-Q219 VanDerWaalsContact C-N 3.3Å; Q217-Q219 PolarHBondContact O-N 3.16Å; Q217-L220 PolarHBondContact O-N 3.41Å; Q217-S221 WeakPolarHBondContact O-CB 3.35Å; Q217-S221 PolarHBondContact O-N 2.89Å; Q217-G371 PolarHBondContact NE2-O 2.83Å
218P86.1Confident80.3Confident1 Ų112.8 Ų12.81%0.0067%0.074CC..Hα-helixtrans-57.3-43.1176.9-20.728.5000112.5F101 L102 M216 S221 V370F101-P218 HydrophobicContact CD1-CG 3.79Å; F101-P218 HydrophobicContact CE1-CG 3.99Å; L102-P218 HydrophobicContact CD1-CB 4.14Å; L102-P218 HydrophobicContact CD2-CB 3.95Å; L102-P218 HydrophobicContact CD2-CG 4.45Å; L102-P218 HydrophobicContact CG-CB 4.17Å; M216-P218 VanDerWaalsContact C-CD 3.49Å; P218-S221 PolarHBondContact O-OG 3.39Å; P218-V370 HydrophobicContact CG-CG1 3.86Å
219Q85.5Confident79.2Confident4 Ų423.5 Ų23.52%0.01911%0.114CC..Hα-helixtrans-77.1-40.3-178.2-59.685.5-10.900110.9M216 Q217 S221 V222 V223 M296M216-Q219 PolarHBondContact O-N 3.17Å; M216-Q219 PolarHBondContact O-OE1 2.95Å; Q217-Q219 VanDerWaalsContact C-N 3.3Å; Q217-Q219 PolarHBondContact O-N 3.16Å; Q219-S221 VanDerWaalsContact C-N 3.25Å; Q219-S221 PolarHBondContact O-N 3.43Å; Q219-V222 PolarHBondContact O-N 2.91Å; Q219-V223 WeakPolarHBondContact O-CG2 3.29Å; Q219-V223 PolarHBondContact O-N 3.4Å; Q219-M296 PolarHBondContact NE2-SD 2.89Å
220L85.9Confident78.1Confident0 Ų028.7 Ų28.70%014%0.138CC..Hα-helixtrans-56.7-41.5172.3-176.962.2000111L14 C63 M216 Q217 V222 V223 V224 L234 V238L14-L220 HydrophobicContact CD2-CB 4.46Å; C63-L220 HydrophobicContact CB-CD2 3.7Å; M216-L220 VanDerWaalsContact O-CB 3.29Å; M216-L220 WeakPolarHBondContact O-CB 3.28Å; M216-L220 PolarHBondContact O-N 3.32Å; Q217-L220 PolarHBondContact O-N 3.41Å; L220-V222 PolarHBondContact O-N 3.31Å; L220-V223 PolarHBondContact O-N 3.48Å; L220-V223 VanDerWaalsContact O-N 3.1Å; L220-V224 HydrophobicContact CD1-CG2 3.79Å; L220-V224 HydrophobicContact CG-CG2 3.75Å; L220-V224 WeakPolarHBondContact O-CB 3.42Å; L220-V224 WeakPolarHBondContact O-CG2 3.42Å; L220-V224 PolarHBondContact O-N 2.98Å; L220-L234 HydrophobicContact CD1-CD1 3.88Å; L220-L234 HydrophobicContact CD1-CD2 4.36Å; L220-L234 HydrophobicContact CD1-CG 4.33Å; L220-V238 HydrophobicContact CD1-CG2 3.8Å; L220-V238 HydrophobicContact CD2-CG2 4.15Å
221S78.9Confident76.9Confident3 Ų329.3 Ų29.32%0.02114%0.143CC..Hα-helixtrans-59.7-29.1-178.977.30000114Q217 P218 Q219Q217-S221 WeakPolarHBondContact O-CB 3.35Å; Q217-S221 PolarHBondContact O-N 2.89Å; P218-S221 PolarHBondContact O-OG 3.39Å; Q219-S221 VanDerWaalsContact C-N 3.25Å; Q219-S221 PolarHBondContact O-N 3.43Å
222V75.3Confident75.9Confident28 Ų2833.3 Ų33.317%0.1717%0.172CC..Hα-helixtrans-84.9-31.3178.61770000111.6Q219 L220 F298 P299 L302Q219-V222 PolarHBondContact O-N 2.91Å; L220-V222 PolarHBondContact O-N 3.31Å; V222-F298 HydrophobicContact CG1-CE1 3.94Å; V222-P299 HydrophobicContact CG2-CB 3.97Å; V222-L302 HydrophobicContact CG1-CD1 4.1Å; V222-L302 HydrophobicContact CG2-CD1 4.47Å
223V76.9Confident75.5Confident21 Ų2134.7 Ų34.713%0.12718%0.179CC..Hα-helixtrans-88.9-25-176.7-179.20000112.7L10 Q219 L220 D225 D226 V227L10-V223 HydrophobicContact CD1-CG1 3.55Å; Q219-V223 WeakPolarHBondContact O-CG2 3.29Å; Q219-V223 PolarHBondContact O-N 3.4Å; L220-V223 PolarHBondContact O-N 3.48Å; L220-V223 VanDerWaalsContact O-N 3.1Å; V223-D225 PolarHBondContact O-N 3.13Å; V223-D225 VanDerWaalsContact O-N 3.09Å; V223-D226 PolarHBondContact O-N 2.93Å; V223-V227 HydrophobicContact CG1-CG2 3.98Å; V223-V227 PolarHBondContact O-N 2.83Å
224V74.9Confident75.3Confident0 Ų034.3 Ų34.30%018%0.176CC..Hα-helixtrans-52.9-34.2178.2163.20000111.4C70 L220 D226 V227 Q228 L234C70-V224 HydrophobicContact CB-CG1 4.07Å; L220-V224 HydrophobicContact CD1-CG2 3.79Å; L220-V224 HydrophobicContact CG-CG2 3.75Å; L220-V224 WeakPolarHBondContact O-CB 3.42Å; L220-V224 WeakPolarHBondContact O-CG2 3.42Å; L220-V224 PolarHBondContact O-N 2.98Å; V224-D226 VanDerWaalsContact C-N 3.32Å; V224-D226 PolarHBondContact O-N 3.2Å; V224-V227 PolarHBondContact O-N 2.81Å; V224-Q228 HydrophobicContact CG1-CG 3.86Å; V224-Q228 VanDerWaalsContact O-CG 3.3Å; V224-Q228 WeakPolarHBondContact O-CG 3.28Å; V224-Q228 PolarHBondContact O-N 3.35Å; V224-L234 HydrophobicContact CG2-CD2 3.85Å
225D68Low75Confident35 Ų3536.3 Ų36.319%0.18719%0.186CC..Hα-helixtrans-60-41.6-177.2-66.46000112.7G77 V223 F322G77-D225 WeakPolarHBondContact CA-OD1 3.16Å; G77-D225 VanDerWaalsContact N-CG 3.32Å; G77-D225 PolarHBondContact N-OD1 3.26Å; V223-D225 PolarHBondContact O-N 3.13Å; V223-D225 VanDerWaalsContact O-N 3.09Å; D225-F322 WeakPolarHBondContact OD2-CE1 3.43Å
226D62.3Low74.8Confident60 Ų6041.6 Ų41.632%0.32122%0.215SC..Hα-helixtrans-79.4-32-177.8-72.4-26.6000111M1 V223 V224M1-D226 WeakPolarHBondContact CB-OD2 3.32Å; M1-D226 PolarHBondContact N-OD1 3.46Å; M1-D226 PolarHBondContact N-OD2 3.49Å; M1-D226 VanDerWaalsContact O-CG 3.24Å; V223-D226 PolarHBondContact O-N 2.93Å; V224-D226 VanDerWaalsContact C-N 3.32Å; V224-D226 PolarHBondContact O-N 3.2Å
227V60.6Low74.7Confident13 Ų1341.9 Ų41.98%0.07922%0.217CC..Hα-helixtrans-97.8-7.2-172.2-166.60000113.5V223 V224 R229 H230 L234V223-V227 HydrophobicContact CG1-CG2 3.98Å; V223-V227 PolarHBondContact O-N 2.83Å; V224-V227 PolarHBondContact O-N 2.81Å; V227-R229 PolarHBondContact O-N 2.92Å; V227-H230 HydrophobicContact CG1-CB 4.47Å; V227-H230 PolarHBondContact O-N 3.26Å; V227-L234 HydrophobicContact CB-CD1 4.28Å; V227-L234 HydrophobicContact CB-CD2 4.42Å; V227-L234 HydrophobicContact CG1-CB 3.87Å; V227-L234 HydrophobicContact CG1-CD1 4.13Å; V227-L234 HydrophobicContact CG1-CG 4.4Å
228Q59.3Low74.7Confident51 Ų5141.8 Ų41.824%0.23822%0.216CC..G310 helixtrans-51.6-23178.3-96.1-179.319.100113.8S75 V224 H230S75-Q228 PolarHBondContact O-NE2 2.85Å; S75-Q228 PolarHBondContact O-OE1 3.26Å; V224-Q228 HydrophobicContact CG1-CG 3.86Å; V224-Q228 VanDerWaalsContact O-CG 3.3Å; V224-Q228 WeakPolarHBondContact O-CG 3.28Å; V224-Q228 PolarHBondContact O-N 3.35Å; Q228-H230 VanDerWaalsContact C-N 3.27Å; Q228-H230 PolarHBondContact O-N 3.26Å
229R55.3Low75Confident229 Ų22942.7 Ų42.786%0.86423%0.226SC*.G310 helixtrans-64.1-22.4172.7-65.3-176.6-175.9168.32.7114.6V227V227-R229 PolarHBondContact O-N 2.92Å
230H59.1Low75.3Confident124 Ų12446.1 Ų46.157%0.57424%0.244SC*.G310 helixtrans-123.625.9-172.2-62.6112.2000114.5V227 Q228 S232 S233V227-H230 HydrophobicContact CG1-CB 4.47Å; V227-H230 PolarHBondContact O-N 3.26Å; Q228-H230 VanDerWaalsContact C-N 3.27Å; Q228-H230 PolarHBondContact O-N 3.26Å; H230-S232 VanDerWaalsContact C-N 3.33Å; H230-S232 PolarHBondContact O-N 2.82Å; H230-S233 WeakPolarHBondContact CB-OG 3.35Å; H230-S233 PolarHBondContact O-N 3.35Å; H230-S233 PolarHBondContact O-OG 3.47Å
231G61.7Low75.7Confident12 Ų1246.1 Ų46.112%0.12424%0.244CC..Hα-helixtrans-33.4-40.2-160.600000121.4R71 L234R71-G231 VanDerWaalsContact CZ-CA 3.46Å; R71-G231 PolarHBondContact NH2-O 3.01Å; G231-L234 PolarHBondContact O-N 3.45Å
232S67.5Low76.4Confident89 Ų8946.3 Ų46.362%0.62225%0.245SC*.Hα-helixtrans-63.4-41.6177.148.40000112.6H230 L234 L235 D236H230-S232 VanDerWaalsContact C-N 3.33Å; H230-S232 PolarHBondContact O-N 2.82Å; S232-L234 PolarHBondContact O-N 2.92Å; S232-L235 PolarHBondContact O-N 3.39Å; S232-D236 PolarHBondContact O-N 2.96Å
233S77.7Confident77.3Confident44 Ų4446.9 Ų46.931%0.30826%0.256SS..Hα-helixtrans-64.1-29.9-178.768.20000112.7H230 D236 A237H230-S233 WeakPolarHBondContact CB-OG 3.35Å; H230-S233 PolarHBondContact O-N 3.35Å; H230-S233 PolarHBondContact O-OG 3.47Å; S233-D236 PolarHBondContact O-N 3.27Å; S233-A237 VanDerWaalsContact O-CB 3.31Å; S233-A237 WeakPolarHBondContact O-CB 3.48Å; S233-A237 PolarHBondContact O-N 2.78Å
234L83.6Confident78.1Confident0 Ų047.6 Ų47.60%026%0.261CS..Hα-helixtrans-64.4-46176.1179.860.2000111.9L10 T67 L220 V224 V227 G231 S232 D236 A237 V238L10-L234 HydrophobicContact CD2-CD1 3.72Å; T67-L234 HydrophobicContact CG2-CD2 4.06Å; L220-L234 HydrophobicContact CD1-CD1 3.88Å; L220-L234 HydrophobicContact CD1-CD2 4.36Å; L220-L234 HydrophobicContact CD1-CG 4.33Å; V224-L234 HydrophobicContact CG2-CD2 3.85Å; V227-L234 HydrophobicContact CB-CD1 4.28Å; V227-L234 HydrophobicContact CB-CD2 4.42Å; V227-L234 HydrophobicContact CG1-CB 3.87Å; V227-L234 HydrophobicContact CG1-CD1 4.13Å; V227-L234 HydrophobicContact CG1-CG 4.4Å; G231-L234 PolarHBondContact O-N 3.45Å; S232-L234 PolarHBondContact O-N 2.92Å; L234-D236 VanDerWaalsContact C-N 3.32Å; L234-A237 PolarHBondContact O-N 3.43Å; L234-V238 HydrophobicContact CD1-CG2 4.49Å; L234-V238 VanDerWaalsContact O-CG2 3.28Å; L234-V238 WeakPolarHBondContact O-CG2 3.3Å; L234-V238 PolarHBondContact O-N 2.9Å
235L86.1Confident79Confident41 Ų4147.6 Ų47.622%0.21526%0.261CS..Hα-helixtrans-71.1-31.8-179-69.8177.7000111.8R64 T67 S232 G239R64-L235 HydrophobicContact CB-CD2 4.39Å; R64-L235 HydrophobicContact CG-CD1 4.23Å; R64-L235 HydrophobicContact CG-CD2 3.8Å; T67-L235 HydrophobicContact CG2-CD2 4.21Å; T67-L235 HydrophobicContact CG2-CG 4.38Å; S232-L235 PolarHBondContact O-N 3.39Å; L235-G239 PolarHBondContact O-N 3.28Å
236D87.1Confident80.3Confident115 Ų11546.8 Ų46.862%0.61526%0.257SS*.Hα-helixtrans-67.7-43.1172.5-65.4-25.3000110.8S232 S233 L234 G239 L240S232-D236 PolarHBondContact O-N 2.96Å; S233-D236 PolarHBondContact O-N 3.27Å; L234-D236 VanDerWaalsContact C-N 3.32Å; D236-G239 PolarHBondContact O-N 3.39Å; D236-L240 WeakPolarHBondContact O-CB 3.49Å; D236-L240 PolarHBondContact O-N 3.45Å
237A87.5Confident81.8Confident6 Ų647.5 Ų47.55%0.0527%0.267CS..Hα-helixtrans-62.2-43.1173.900000112.4L10 V11 S233 L234 G239 L240 A241L10-A237 HydrophobicContact CD2-CB 3.84Å; L10-A237 HydrophobicContact CG-CB 4.3Å; V11-A237 HydrophobicContact CG2-CB 3.87Å; S233-A237 VanDerWaalsContact O-CB 3.31Å; S233-A237 WeakPolarHBondContact O-CB 3.48Å; S233-A237 PolarHBondContact O-N 2.78Å; L234-A237 PolarHBondContact O-N 3.43Å; A237-G239 VanDerWaalsContact C-N 3.35Å; A237-L240 PolarHBondContact O-N 3.45Å; A237-A241 WeakPolarHBondContact O-CB 3.25Å; A237-A241 PolarHBondContact O-N 2.96Å
238V90.3Very high83.4Confident1 Ų147.7 Ų47.71%0.00627%0.267CS..Hα-helixtrans-61.1-44.2173.11670000110.9L14 C63 M216 L220 L234 L240 A241 L242L14-V238 HydrophobicContact CD1-CG2 3.87Å; C63-V238 HydrophobicContact CB-CG1 3.79Å; M216-V238 HydrophobicContact SD-CG1 3.89Å; L220-V238 HydrophobicContact CD1-CG2 3.8Å; L220-V238 HydrophobicContact CD2-CG2 4.15Å; L234-V238 HydrophobicContact CD1-CG2 4.49Å; L234-V238 VanDerWaalsContact O-CG2 3.28Å; L234-V238 WeakPolarHBondContact O-CG2 3.3Å; L234-V238 PolarHBondContact O-N 2.9Å; V238-L240 VanDerWaalsContact C-N 3.33Å; V238-L240 PolarHBondContact O-N 3.19Å; V238-A241 PolarHBondContact O-N 2.9Å; V238-L242 HydrophobicContact CG1-CD1 4.16Å; V238-L242 WeakPolarHBondContact O-CB 3.46Å; V238-L242 PolarHBondContact O-N 2.93Å
239G91.9Very high85Confident20 Ų2045.3 Ų45.321%0.20626%0.256CS..Hα-helixtrans-61.2-41.8177.200000112.6L235 D236 A237 G243L235-G239 PolarHBondContact O-N 3.28Å; D236-G239 PolarHBondContact O-N 3.39Å; A237-G239 VanDerWaalsContact C-N 3.35Å; G239-G243 PolarHBondContact O-N 3.38Å
240L92.5Very high86.8Confident76 Ų7637.9 Ų37.940%0.39823%0.23SC..Hα-helixtrans-68.1-44.9175.9-17658.9000111.6W8 V11 D236 A237 V238 L242 G243 V244W8-L240 HydrophobicContact CE3-CD2 4.39Å; W8-L240 HydrophobicContact CH2-CD2 3.91Å; W8-L240 HydrophobicContact CZ3-CD2 3.69Å; V11-L240 HydrophobicContact CG1-CD2 4.25Å; V11-L240 HydrophobicContact CG1-CG 4.07Å; V11-L240 HydrophobicContact CG2-CB 4.35Å; V11-L240 HydrophobicContact CG2-CD2 4.03Å; V11-L240 HydrophobicContact CG2-CG 4.39Å; D236-L240 WeakPolarHBondContact O-CB 3.49Å; D236-L240 PolarHBondContact O-N 3.45Å; A237-L240 PolarHBondContact O-N 3.45Å; V238-L240 VanDerWaalsContact C-N 3.33Å; V238-L240 PolarHBondContact O-N 3.19Å; L240-L242 PolarHBondContact O-N 2.98Å; L240-G243 PolarHBondContact O-N 3.42Å; L240-G243 VanDerWaalsContact O-N 3.15Å; L240-V244 WeakPolarHBondContact O-CG2 3.41Å; L240-V244 PolarHBondContact O-N 3.48Å
241A92.5Very high88.5Confident0 Ų033.2 Ų33.20%021%0.211CC..Hα-helixtrans-59.1-46.1177.200000111.7V11 L14 T15 A237 V238 G243 V244 C245V11-A241 HydrophobicContact CG1-CB 4.18Å; L14-A241 HydrophobicContact CB-CB 3.87Å; T15-A241 WeakPolarHBondContact OG1-CA 3.15Å; T15-A241 PolarHBondContact OG1-O 3.27Å; A237-A241 WeakPolarHBondContact O-CB 3.25Å; A237-A241 PolarHBondContact O-N 2.96Å; V238-A241 PolarHBondContact O-N 2.9Å; A241-G243 PolarHBondContact O-N 3.48Å; A241-V244 PolarHBondContact O-N 3.34Å; A241-C245 PolarHBondContact O-N 3.29Å; A241-C245 PolarHBondContact O-SG 2.9Å
242L94Very high90Very high7 Ų732.7 Ų32.74%0.03721%0.205CC..Hα-helixtrans-60.2-42.9173.6-81171.5000112.1T59 K60 L214 M216 V238 L240 V244 C245 C246T59-L242 HydrophobicContact CG2-CD1 4.47Å; T59-L242 HydrophobicContact CG2-CD2 3.91Å; K60-L242 HydrophobicContact CB-CD1 3.64Å; K60-L242 HydrophobicContact CG-CD1 4.18Å; L214-L242 HydrophobicContact CD2-CD2 4.3Å; M216-L242 HydrophobicContact CE-CB 4.44Å; M216-L242 HydrophobicContact CE-CD2 3.29Å; M216-L242 HydrophobicContact CE-CG 3.46Å; M216-L242 VanDerWaalsContact CE-CG 3.46Å; M216-L242 HydrophobicContact SD-CD1 4.46Å; M216-L242 HydrophobicContact SD-CD2 4.14Å; M216-L242 HydrophobicContact SD-CG 3.91Å; V238-L242 HydrophobicContact CG1-CD1 4.16Å; V238-L242 WeakPolarHBondContact O-CB 3.46Å; V238-L242 PolarHBondContact O-N 2.93Å; L240-L242 PolarHBondContact O-N 2.98Å; L242-V244 VanDerWaalsContact C-N 3.35Å; L242-V244 PolarHBondContact O-N 3Å; L242-C245 PolarHBondContact O-N 3.49Å; L242-C246 WeakPolarHBondContact O-CB 3.32Å; L242-C246 PolarHBondContact O-N 3.31Å; L242-C246 PolarHBondContact O-SG 3.27Å
243G94.5Very high91Very high40 Ų4028.4 Ų28.441%0.41218%0.176SC..Hα-helixtrans-60.8-43.1176.800000112.5G239 L240 A241 C246 C247G239-G243 PolarHBondContact O-N 3.38Å; L240-G243 PolarHBondContact O-N 3.42Å; L240-G243 VanDerWaalsContact O-N 3.15Å; A241-G243 PolarHBondContact O-N 3.48Å; G243-C246 PolarHBondContact O-N 3.36Å; G243-C247 WeakPolarHBondContact O-CB 3.38Å; G243-C247 PolarHBondContact O-N 3Å
244V93.6Very high91.6Very high37 Ų3728.5 Ų28.522%0.22417%0.171CC..Hα-helixtrans-64-45.7175174.30000111T15 F169 L240 A241 L242 C246 C247 L248T15-V244 HydrophobicContact CG2-CB 4.5Å; T15-V244 HydrophobicContact CG2-CG1 3.83Å; F169-V244 HydrophobicContact CE2-CG1 3.62Å; F169-V244 HydrophobicContact CZ-CG1 4.19Å; L240-V244 WeakPolarHBondContact O-CG2 3.41Å; L240-V244 PolarHBondContact O-N 3.48Å; A241-V244 PolarHBondContact O-N 3.34Å; L242-V244 VanDerWaalsContact C-N 3.35Å; L242-V244 PolarHBondContact O-N 3Å; V244-C246 PolarHBondContact O-N 2.95Å; V244-C247 PolarHBondContact O-N 3.46Å; V244-L248 HydrophobicContact CG1-CD1 4.29Å; V244-L248 WeakPolarHBondContact O-CG 3.33Å; V244-L248 PolarHBondContact O-N 3.2Å
245C94.4Very high91.9Very high0 Ų030.3 Ų30.30%018%0.179CC..Hα-helixtrans-57.6-48.8175.2-660000111.3L214 A241 L242 C247 L248 Y249L214-C245 HydrophobicContact CD2-CB 4.14Å; A241-C245 PolarHBondContact O-N 3.29Å; A241-C245 PolarHBondContact O-SG 2.9Å; L242-C245 PolarHBondContact O-N 3.49Å; C245-C247 VanDerWaalsContact C-N 3.29Å; C245-C247 PolarHBondContact O-N 3.48Å; C245-L248 PolarHBondContact O-N 3.3Å; C245-Y249 HydrophobicContact CB-CE2 4.41Å; C245-Y249 WeakPolarHBondContact O-CB 3.33Å; C245-Y249 WeakPolarHBondContact O-CD1 3.37Å; C245-Y249 PolarHBondContact O-N 3.4Å
246C94Very high92.1Very high17 Ų1728.4 Ų28.412%0.11517%0.168CC..Hα-helixtrans-59.3-40.6178.4-67.50000112.2A56 L242 G243 V244 F250A56-C246 WeakPolarHBondContact CB-SG 3.43Å; L242-C246 WeakPolarHBondContact O-CB 3.32Å; L242-C246 PolarHBondContact O-N 3.31Å; L242-C246 PolarHBondContact O-SG 3.27Å; G243-C246 PolarHBondContact O-N 3.36Å; V244-C246 PolarHBondContact O-N 2.95Å; C246-F250 WeakPolarHBondContact O-CB 3.46Å; C246-F250 PolarHBondContact O-N 3.46Å
247C94.6Very high92Very high76 Ų7623 Ų2351%0.51414%0.14SC..Hα-helixtrans-63.6-48.8177.1-174.90000111.6G243 V244 C245 Y249 F250 C251G243-C247 WeakPolarHBondContact O-CB 3.38Å; G243-C247 PolarHBondContact O-N 3Å; V244-C247 PolarHBondContact O-N 3.46Å; C245-C247 VanDerWaalsContact C-N 3.29Å; C245-C247 PolarHBondContact O-N 3.48Å; C247-Y249 PolarHBondContact O-N 2.96Å; C247-F250 PolarHBondContact O-N 3.43Å; C247-C251 WeakPolarHBondContact O-CB 3.47Å; C247-C251 PolarHBondContact O-N 2.83Å; C247-C251 PolarHBondContact O-SG 3.32Å
248L94.7Very high92Very high17 Ų1722.8 Ų22.89%0.08914%0.138CC..Hα-helixtrans-60.4-46.8176.6-72.3175.9000111.5T15 V19 I23 F169 V176 V244 C245 C251 V252T15-L248 HydrophobicContact CG2-CD1 4.43Å; V19-L248 HydrophobicContact CG2-CD1 3.97Å; I23-L248 HydrophobicContact CD1-CB 4.27Å; F169-L248 HydrophobicContact CD2-CD1 4.33Å; F169-L248 HydrophobicContact CE2-CD1 3.86Å; V176-L248 HydrophobicContact CG2-CD2 4.16Å; V244-L248 HydrophobicContact CG1-CD1 4.29Å; V244-L248 WeakPolarHBondContact O-CG 3.33Å; V244-L248 PolarHBondContact O-N 3.2Å; C245-L248 PolarHBondContact O-N 3.3Å; L248-C251 PolarHBondContact O-N 2.62Å; L248-V252 WeakPolarHBondContact O-CG2 2.98Å; L248-V252 PolarHBondContact O-N 2.97Å
249Y93.6Very high91.8Very high1 Ų123.3 Ų23.30%0.00414%0.141CC..Hα-helixtrans-61.8-46.3179.9-73.2-1.7000112.1A18 V19 I23 L26 L52 A213 L214 C245 C247 A253A18-Y249 PolarHBondContact O-OH 3.18Å; V19-Y249 VanDerWaalsContact CA-OH 3.27Å; V19-Y249 WeakPolarHBondContact CA-OH 3.45Å; V19-Y249 HydrophobicContact CB-CE1 4.23Å; V19-Y249 HydrophobicContact CG1-CE1 4.16Å; V19-Y249 HydrophobicContact CG2-CE1 3.97Å; I23-Y249 HydrophobicContact CB-CD1 4.22Å; I23-Y249 HydrophobicContact CB-CE1 3.91Å; I23-Y249 HydrophobicContact CD1-CD1 4.2Å; I23-Y249 HydrophobicContact CD1-CE1 4.42Å; I23-Y249 HydrophobicContact CG1-CD1 3.95Å; I23-Y249 HydrophobicContact CG1-CE1 4.14Å; L26-Y249 VanDerWaalsContact CD1-CA 3.44Å; L26-Y249 HydrophobicContact CD1-CD1 3.32Å; L26-Y249 HydrophobicContact CD1-CD2 4.02Å; L26-Y249 HydrophobicContact CD1-CE1 4Å; L26-Y249 HydrophobicContact CD1-CG 3.3Å; L52-Y249 HydrophobicContact CD1-CD2 4.08Å; A213-Y249 HydrophobicContact CB-CE2 3.96Å; A213-Y249 PolarHBondContact O-OH 3.16Å; L214-Y249 HydrophobicContact CD2-CD2 3.8Å; L214-Y249 HydrophobicContact CD2-CE2 3.54Å; L214-Y249 HydrophobicContact CG-CD2 4.27Å; L214-Y249 HydrophobicContact CG-CE2 3.9Å; C245-Y249 HydrophobicContact CB-CE2 4.41Å; C245-Y249 WeakPolarHBondContact O-CB 3.33Å; C245-Y249 WeakPolarHBondContact O-CD1 3.37Å; C245-Y249 PolarHBondContact O-N 3.4Å; C247-Y249 PolarHBondContact O-N 2.96Å; Y249-A253 WeakPolarHBondContact O-CB 3.21Å; Y249-A253 PolarHBondContact O-N 3.43Å
250F92.6Very high91.4Very high72 Ų7222.9 Ų22.932%0.31613%0.133SC..Hα-helixtrans-60.9-45.5174.3175.5-95.5000111.8F45 T49 L52 C246 C247 A253 F254F45-F250 HydrophobicContact CE1-CE2 4.29Å; F45-F250 HydrophobicContact CE2-CE2 4.24Å; F45-F250 HydrophobicContact CZ-CD2 4.49Å; F45-F250 AromaticContact CZ-CE2 3.52Å; F45-F250 HydrophobicContact CZ-CE2 3.52Å; F45-F250 AromaticContact CZ-CZ 3.74Å; F45-F250 HydrophobicContact CZ-CZ 3.74Å; T49-F250 HydrophobicContact CG2-CD2 3.9Å; T49-F250 HydrophobicContact CG2-CE2 3.85Å; L52-F250 HydrophobicContact CD2-CB 4.45Å; C246-F250 WeakPolarHBondContact O-CB 3.46Å; C246-F250 PolarHBondContact O-N 3.46Å; C247-F250 PolarHBondContact O-N 3.43Å; F250-A253 PolarHBondContact O-N 3Å; F250-F254 VanDerWaalsContact O-CB 3.23Å; F250-F254 WeakPolarHBondContact O-CB 3.28Å; F250-F254 PolarHBondContact O-N 3.13Å
251C93.7Very high90.8Very high27 Ų2721.9 Ų21.918%0.18213%0.127CC..Hα-helixtrans-63.9-47.4-179.9-690000111.8V176 C247 L248 F254 F255V176-C251 HydrophobicContact CG1-CB 3.77Å; V176-C251 HydrophobicContact CG2-CB 4.12Å; C247-C251 WeakPolarHBondContact O-CB 3.47Å; C247-C251 PolarHBondContact O-N 2.83Å; C247-C251 PolarHBondContact O-SG 3.32Å; L248-C251 PolarHBondContact O-N 2.62Å; C251-F254 PolarHBondContact O-N 3.11Å; C251-F255 HydrophobicContact CB-CD2 4.17Å; C251-F255 HydrophobicContact CB-CE2 4.23Å; C251-F255 WeakPolarHBondContact O-CB 3.34Å; C251-F255 WeakPolarHBondContact O-CD2 3.46Å; C251-F255 PolarHBondContact O-N 2.82Å
252V93.2Very high89.8Confident0 Ų026.2 Ų26.20%015%0.15CC..Hα-helixtrans-64.1-45177.8170.90000110.8I23 P27 L175 V176 L179 L248 G256I23-V252 HydrophobicContact CD1-CB 4.33Å; I23-V252 HydrophobicContact CD1-CG2 3.64Å; I23-V252 HydrophobicContact CG1-CB 3.99Å; I23-V252 HydrophobicContact CG1-CG1 4.05Å; I23-V252 HydrophobicContact CG1-CG2 3.8Å; P27-V252 HydrophobicContact CG-CG1 3.79Å; L175-V252 HydrophobicContact CD2-CG2 4.3Å; V176-V252 HydrophobicContact CG2-CG2 3.57Å; L179-V252 HydrophobicContact CD1-CB 4.31Å; L179-V252 HydrophobicContact CD1-CG1 3.88Å; L179-V252 HydrophobicContact CD1-CG2 4.25Å; L248-V252 WeakPolarHBondContact O-CG2 2.98Å; L248-V252 PolarHBondContact O-N 2.97Å; V252-G256 VanDerWaalsContact O-CA 3.27Å; V252-G256 WeakPolarHBondContact O-CA 3.36Å; V252-G256 PolarHBondContact O-N 3.26Å
253A89.8Confident88.9Confident0 Ų034.3 Ų34.30%018%0.18CC..Hα-helixtrans-59.9-48.7176.700000112.1L26 F30 Y249 F250 Y257L26-A253 HydrophobicContact CB-CB 4.19Å; F30-A253 HydrophobicContact CD1-CB 4.26Å; F30-A253 HydrophobicContact CD2-CB 3.58Å; F30-A253 HydrophobicContact CE1-CB 4.17Å; F30-A253 HydrophobicContact CE2-CB 3.41Å; F30-A253 VanDerWaalsContact CE2-CB 3.41Å; F30-A253 HydrophobicContact CG-CB 4Å; F30-A253 HydrophobicContact CZ-CB 3.74Å; Y249-A253 WeakPolarHBondContact O-CB 3.21Å; Y249-A253 PolarHBondContact O-N 3.43Å; F250-A253 PolarHBondContact O-N 3Å; A253-Y257 WeakPolarHBondContact O-CB 3.46Å; A253-Y257 PolarHBondContact O-N 2.96Å
254F88.9Confident88Confident46 Ų4633 Ų3320%0.20216%0.164CC..Hα-helixtrans-64.8-57.5-179.3178.3-117.3000112.2F45 L187 F250 C251 G256 Y257 V258F45-F254 AromaticContact CD2-CD2 3.99Å; F45-F254 HydrophobicContact CD2-CD2 3.99Å; F45-F254 HydrophobicContact CE1-CD2 4.17Å; F45-F254 HydrophobicContact CE1-CE2 4.49Å; F45-F254 HydrophobicContact CE2-CB 3.66Å; F45-F254 AromaticContact CE2-CD2 3.25Å; F45-F254 HydrophobicContact CE2-CD2 3.25Å; F45-F254 HydrophobicContact CE2-CE2 4.25Å; F45-F254 AromaticContact CE2-CG 3.87Å; F45-F254 HydrophobicContact CE2-CG 3.87Å; F45-F254 HydrophobicContact CZ-CB 4.06Å; F45-F254 AromaticContact CZ-CD2 3.32Å; F45-F254 HydrophobicContact CZ-CD2 3.32Å; F45-F254 HydrophobicContact CZ-CE2 4.02Å; F45-F254 AromaticContact CZ-CG 3.97Å; F45-F254 HydrophobicContact CZ-CG 3.97Å; L187-F254 HydrophobicContact CD1-CE1 4.19Å; L187-F254 HydrophobicContact CD1-CZ 4.24Å; L187-F254 HydrophobicContact CD2-CZ 4.39Å; F250-F254 VanDerWaalsContact O-CB 3.23Å; F250-F254 WeakPolarHBondContact O-CB 3.28Å; F250-F254 PolarHBondContact O-N 3.13Å; C251-F254 PolarHBondContact O-N 3.11Å; F254-G256 VanDerWaalsContact C-N 3.35Å; F254-G256 PolarHBondContact O-N 3.46Å; F254-Y257 PolarHBondContact O-N 3.29Å; F254-V258 HydrophobicContact CD2-CG2 4.16Å; F254-V258 HydrophobicContact CE2-CG2 3.93Å; F254-V258 HydrophobicContact CZ-CG2 4.22Å; F254-V258 WeakPolarHBondContact O-CB 3.49Å; F254-V258 VanDerWaalsContact O-CG2 3.27Å; F254-V258 WeakPolarHBondContact O-CG2 3.37Å; F254-V258 PolarHBondContact O-N 3.47Å
255F91.1Very high87.2Confident38 Ų3835.9 Ų35.917%0.16718%0.175CC..Hα-helixtrans-70.1-34.4-175.9-65.3-55000112V176 L179 A180 A183 C251 S259V176-F255 HydrophobicContact CG1-CD2 4.49Å; L179-F255 HydrophobicContact CB-CB 3.67Å; A180-F255 HydrophobicContact CB-CD1 4.13Å; A180-F255 HydrophobicContact CB-CD2 3.85Å; A180-F255 HydrophobicContact CB-CE1 4.07Å; A180-F255 HydrophobicContact CB-CE2 3.81Å; A180-F255 HydrophobicContact CB-CG 4.02Å; A180-F255 HydrophobicContact CB-CZ 3.92Å; A183-F255 HydrophobicContact CB-CB 4.1Å; A183-F255 HydrophobicContact CB-CD1 3.71Å; A183-F255 HydrophobicContact CB-CG 4.36Å; C251-F255 HydrophobicContact CB-CD2 4.17Å; C251-F255 HydrophobicContact CB-CE2 4.23Å; C251-F255 WeakPolarHBondContact O-CB 3.34Å; C251-F255 WeakPolarHBondContact O-CD2 3.46Å; C251-F255 PolarHBondContact O-N 2.82Å; F255-S259 VanDerWaalsContact O-CB 3.3Å; F255-S259 WeakPolarHBondContact O-CB 3.41Å; F255-S259 PolarHBondContact O-N 2.83Å; F255-S259 PolarHBondContact O-OG 3.18Å
256G89Confident86Confident0 Ų036.7 Ų36.70%018%0.183CC..Hα-helixtrans-64.5-45.9173.600000112.4V252 F254 S259 Y260 I268V252-G256 VanDerWaalsContact O-CA 3.27Å; V252-G256 WeakPolarHBondContact O-CA 3.36Å; V252-G256 PolarHBondContact O-N 3.26Å; F254-G256 VanDerWaalsContact C-N 3.35Å; F254-G256 PolarHBondContact O-N 3.46Å; G256-S259 PolarHBondContact O-N 3.38Å; G256-Y260 WeakPolarHBondContact O-CD2 3.3Å; G256-Y260 PolarHBondContact O-N 3.28Å; G256-Y260 VanDerWaalsContact O-N 3.15Å; G256-I268 VanDerWaalsContact CA-CD1 3.4Å
257Y85.9Confident85.4Confident3 Ų336.3 Ų36.31%0.01218%0.18CC..Hα-helixtrans-63-45.2176.4177.3-118.3000112.1F30 A31 T194 L195 A196 A253 F254 S259 Q261F30-Y257 HydrophobicContact CB-CG 4.36Å; A31-Y257 VanDerWaalsContact CA-CE2 3.5Å; A31-Y257 HydrophobicContact CB-CD2 3.89Å; A31-Y257 HydrophobicContact CB-CE2 4.12Å; T194-Y257 PolarHBondContact O-OH 3.35Å; L195-Y257 HydrophobicContact CD2-CD1 4.25Å; L195-Y257 HydrophobicContact CD2-CE1 3.87Å; L195-Y257 HydrophobicContact CG-CE1 4.12Å; A196-Y257 PolarHBondContact N-OH 2.99Å; A253-Y257 WeakPolarHBondContact O-CB 3.46Å; A253-Y257 PolarHBondContact O-N 2.96Å; F254-Y257 PolarHBondContact O-N 3.29Å; Y257-S259 VanDerWaalsContact C-N 3.31Å; Y257-S259 PolarHBondContact O-N 3Å; Y257-Q261 VanDerWaalsContact O-CA 3.29Å; Y257-Q261 WeakPolarHBondContact O-CA 3.19Å; Y257-Q261 PolarHBondContact O-N 3.17Å
258V87.3Confident85Confident1 Ų132.7 Ų32.71%0.00616%0.155CC..Hα-helixtrans-63.5-37.4178.3170.80000111.9A183 I186 L187 I193 F254A183-V258 HydrophobicContact CB-CB 4.04Å; A183-V258 HydrophobicContact CB-CG1 3.77Å; I186-V258 HydrophobicContact CB-CG1 4.44Å; I186-V258 HydrophobicContact CG2-CG1 4.38Å; L187-V258 HydrophobicContact CD1-CG1 4.4Å; L187-V258 HydrophobicContact CD2-CG1 3.99Å; L187-V258 HydrophobicContact CD2-CG2 4.3Å; L187-V258 HydrophobicContact CG-CG1 3.86Å; I193-V258 HydrophobicContact CD1-CG1 4.37Å; F254-V258 HydrophobicContact CD2-CG2 4.16Å; F254-V258 HydrophobicContact CE2-CG2 3.93Å; F254-V258 HydrophobicContact CZ-CG2 4.22Å; F254-V258 WeakPolarHBondContact O-CB 3.49Å; F254-V258 VanDerWaalsContact O-CG2 3.27Å; F254-V258 WeakPolarHBondContact O-CG2 3.37Å; F254-V258 PolarHBondContact O-N 3.47Å
259S86.5Confident84.7Confident12 Ų1231.9 Ų31.98%0.08415%0.151CC..Hα-helixtrans-71.3-41.3-177.4-60.70000113.2L179 A183 F255 G256 Y257L179-S259 PolarHBondContact O-OG 3.49Å; A183-S259 PolarHBondContact N-OG 2.91Å; F255-S259 VanDerWaalsContact O-CB 3.3Å; F255-S259 WeakPolarHBondContact O-CB 3.41Å; F255-S259 PolarHBondContact O-N 2.83Å; F255-S259 PolarHBondContact O-OG 3.18Å; G256-S259 PolarHBondContact O-N 3.38Å; Y257-S259 VanDerWaalsContact C-N 3.31Å; Y257-S259 PolarHBondContact O-N 3Å
260Y83.7Confident84.2Confident10 Ų1034.4 Ų34.44%0.03916%0.164CC..Hα-helixtrans-115-17.8-169.2-60.1-65.4000114.8L179 G256 D262 R263 I268 S271 L272 E273L179-Y260 HydrophobicContact CD2-CE2 3.96Å; G256-Y260 WeakPolarHBondContact O-CD2 3.3Å; G256-Y260 PolarHBondContact O-N 3.28Å; G256-Y260 VanDerWaalsContact O-N 3.15Å; Y260-D262 PolarHBondContact O-N 3.44Å; Y260-R263 WeakPolarHBondContact O-CB 3.19Å; Y260-R263 PolarHBondContact O-N 3.27Å; Y260-I268 HydrophobicContact CD2-CD1 3.9Å; Y260-I268 HydrophobicContact CD2-CG1 4.11Å; Y260-I268 HydrophobicContact CE2-CD1 3.99Å; Y260-I268 HydrophobicContact CE2-CG1 4Å; Y260-S271 WeakPolarHBondContact CE1-O 3.45Å; Y260-L272 HydrophobicContact CE2-CD2 4.28Å; Y260-L272 WeakPolarHBondContact OH-CA 3.27Å; Y260-L272 VanDerWaalsContact OH-CD2 3.26Å; Y260-L272 WeakPolarHBondContact OH-CD2 3.19Å; Y260-E273 HydrophobicContact CE1-CG 4.44Å
261Q79.1Confident83.8Confident56 Ų5631.7 Ų31.726%0.26215%0.154SC..G310 helixtrans49.4-118.2178-57.2-178.2-5.800112.5Y257 R263 V264Y257-Q261 VanDerWaalsContact O-CA 3.29Å; Y257-Q261 WeakPolarHBondContact O-CA 3.19Å; Y257-Q261 PolarHBondContact O-N 3.17Å; Q261-R263 PolarHBondContact O-N 3.05Å; Q261-V264 VanDerWaalsContact O-CG2 3.31Å; Q261-V264 WeakPolarHBondContact O-CG2 3.49Å
262D71.1Confident83.4Confident91 Ų9130.7 Ų30.749%0.48715%0.147SC..G310 helixtrans-74.6-5.1-177.6-59.6-25.9000113.3K32 Y260K32-D262 WeakPolarHBondContact CB-OD1 3.48Å; Y260-D262 PolarHBondContact O-N 3.44Å
263R75Confident82.8Confident177 Ų17736.9 Ų36.967%0.66818%0.176SC*.G310 helixtrans-100.110.5-179.3-59.4-175.7-67.3-174.82.6114Y260 Q261 Q265 S271Y260-R263 WeakPolarHBondContact O-CB 3.19Å; Y260-R263 PolarHBondContact O-N 3.27Å; Q261-R263 PolarHBondContact O-N 3.05Å; R263-Q265 PolarHBondContact O-N 2.95Å; R263-S271 PolarHBondContact O-OG 2.95Å
264V76.4Confident82.1Confident11 Ų1144.2 Ų44.27%0.06721%0.208CC..  trans-68.3119.9177.2176.60000109.1P27 F28 A31 Q261P27-V264 HydrophobicContact CB-CG1 3.82Å; F28-V264 HydrophobicContact CB-CG1 4.01Å; A31-V264 HydrophobicContact CB-CB 3.98Å; A31-V264 HydrophobicContact CB-CG2 4.11Å; Q261-V264 VanDerWaalsContact O-CG2 3.31Å; Q261-V264 WeakPolarHBondContact O-CG2 3.49Å
265Q76.4Confident81.9Confident99 Ų9943.9 Ų43.946%0.46322%0.218SC..  trans-84.3163168.7-63-174.510.600110R263 D267 S271R263-Q265 PolarHBondContact O-N 2.95Å; Q265-D267 CarbonylContact O-C 3.57Å; Q265-D267 PolarHBondContact O-N 3.5Å; Q265-D267 VanDerWaalsContact O-N 3.11Å; Q265-S271 PolarHBondContact N-OG 3.44Å
266G69.5Low81.7Confident16 Ų1653.1 Ų53.117%0.16525%0.251CS..SBendtrans-57.9-22.7176.300000115.9A25 E356A25-G266 VanDerWaalsContact CA-O 3.28Å; A25-G266 WeakPolarHBondContact CA-O 3.46Å; G266-E356 WeakPolarHBondContact CA-OE1 3.4Å
267D82.1Confident81.6Confident10 Ų1056 Ų565%0.05327%0.271CS..SBendtrans-113.9108.5163.9-179.7-5.4000109.1L24 Q265 L269 L270L24-D267 WeakPolarHBondContact CD1-OD1 3.49Å; Q265-D267 CarbonylContact O-C 3.57Å; Q265-D267 PolarHBondContact O-N 3.5Å; Q265-D267 VanDerWaalsContact O-N 3.11Å; D267-L269 PolarHBondContact O-N 3.38Å; D267-L269 VanDerWaalsContact O-N 3.11Å; D267-L269 VanDerWaalsContact OD1-CB 3.24Å; D267-L269 WeakPolarHBondContact OD1-CB 3.22Å; D267-L269 WeakPolarHBondContact OD1-CG 3.23Å; D267-L269 PolarHBondContact OD1-N 3.24Å; D267-L270 HydrophobicContact CB-CD1 4.03Å; D267-L270 HydrophobicContact CB-CG 4.07Å; D267-L270 WeakPolarHBondContact O-CB 3.37Å; D267-L270 PolarHBondContact O-N 3.04Å
268I86.6Confident81.7Confident0 Ų055.8 Ų55.80%027%0.271CS..Hα-helixtrans-59.7-22.2178.6-171.1156000113.8L24 P27 L179 G256 Y260 L270 S271 L272L24-I268 HydrophobicContact CD2-CG2 4.01Å; L24-I268 PolarHBondContact O-N 2.93Å; P27-I268 HydrophobicContact CB-CD1 3.81Å; P27-I268 HydrophobicContact CG-CB 4.16Å; P27-I268 HydrophobicContact CG-CD1 3.46Å; P27-I268 VanDerWaalsContact CG-CD1 3.46Å; P27-I268 HydrophobicContact CG-CG1 4.37Å; P27-I268 HydrophobicContact CG-CG2 4.39Å; L179-I268 HydrophobicContact CD1-CD1 4.07Å; L179-I268 HydrophobicContact CD2-CD1 3.81Å; L179-I268 HydrophobicContact CD2-CG1 4.37Å; G256-I268 VanDerWaalsContact CA-CD1 3.4Å; Y260-I268 HydrophobicContact CD2-CD1 3.9Å; Y260-I268 HydrophobicContact CD2-CG1 4.11Å; Y260-I268 HydrophobicContact CE2-CD1 3.99Å; Y260-I268 HydrophobicContact CE2-CG1 4Å; I268-L270 PolarHBondContact O-N 2.98Å; I268-S271 WeakPolarHBondContact O-CB 3.24Å; I268-S271 PolarHBondContact O-N 2.82Å; I268-S271 VanDerWaalsContact O-N 3.09Å; I268-L272 PolarHBondContact O-N 3.42Å
269L87.1Confident81.8Confident0 Ų061.2 Ų61.20%029%0.291CS..Hα-helixtrans-66.7-25.4177.3-61.6174.4000112.5L24 V112 M116 L175 D267 L272 I281 R282 F285L24-L269 HydrophobicContact CD1-CD1 3.82Å; L24-L269 HydrophobicContact CD1-CG 4.35Å; L24-L269 HydrophobicContact CD2-CD1 3.84Å; L24-L269 HydrophobicContact CD2-CD2 4.34Å; L24-L269 HydrophobicContact CD2-CG 3.74Å; V112-L269 HydrophobicContact CG1-CD1 4.38Å; M116-L269 HydrophobicContact CE-CB 3.45Å; M116-L269 VanDerWaalsContact CE-CB 3.45Å; M116-L269 HydrophobicContact CE-CD1 4.07Å; M116-L269 HydrophobicContact CE-CG 4.41Å; M116-L269 HydrophobicContact CG-CD1 4.06Å; M116-L269 HydrophobicContact SD-CB 3.62Å; M116-L269 HydrophobicContact SD-CD1 3.61Å; M116-L269 HydrophobicContact SD-CG 4.2Å; L175-L269 HydrophobicContact CD1-CD2 4Å; D267-L269 PolarHBondContact O-N 3.38Å; D267-L269 VanDerWaalsContact O-N 3.11Å; D267-L269 VanDerWaalsContact OD1-CB 3.24Å; D267-L269 WeakPolarHBondContact OD1-CB 3.22Å; D267-L269 WeakPolarHBondContact OD1-CG 3.23Å; D267-L269 PolarHBondContact OD1-N 3.24Å; L269-L272 HydrophobicContact CD2-CD1 3.88Å; L269-I281 HydrophobicContact CD2-CG2 4.16Å; L269-R282 PolarHBondContact O-NE 2.86Å; L269-R282 PolarHBondContact O-NH2 3.32Å; L269-F285 HydrophobicContact CD1-CB 4.1Å; L269-F285 HydrophobicContact CD1-CD1 3.45Å; L269-F285 VanDerWaalsContact CD1-CD1 3.45Å; L269-F285 HydrophobicContact CD1-CD2 4.41Å; L269-F285 HydrophobicContact CD1-CE1 3.94Å; L269-F285 HydrophobicContact CD1-CG 3.72Å
270L82.6Confident82Confident54 Ų5465.1 Ų65.128%0.28331%0.311SS..Hα-helixtrans-76.5-29.3173.4-59.6178.5000111.6N115 M116 D267 I268 L272N115-L270 HydrophobicContact CB-CD2 4.45Å; M116-L270 HydrophobicContact CE-CD2 3.87Å; M116-L270 HydrophobicContact CE-CG 4.43Å; D267-L270 HydrophobicContact CB-CD1 4.03Å; D267-L270 HydrophobicContact CB-CG 4.07Å; D267-L270 WeakPolarHBondContact O-CB 3.37Å; D267-L270 PolarHBondContact O-N 3.04Å; I268-L270 PolarHBondContact O-N 2.98Å; L270-L272 VanDerWaalsContact C-N 3.31Å; L270-L272 PolarHBondContact O-N 3.38Å
271S84.2Confident82.5Confident15 Ų1565 Ų6511%0.10531%0.311CS..Hα-helixtrans-75-14.6174.3-62.50000113.9Y260 R263 Q265 I268 E273Y260-S271 WeakPolarHBondContact CE1-O 3.45Å; R263-S271 PolarHBondContact O-OG 2.95Å; Q265-S271 PolarHBondContact N-OG 3.44Å; I268-S271 WeakPolarHBondContact O-CB 3.24Å; I268-S271 PolarHBondContact O-N 2.82Å; I268-S271 VanDerWaalsContact O-N 3.09Å; S271-E273 PolarHBondContact O-N 3Å
272L86.2Confident83.1Confident5 Ų563.5 Ų63.53%0.02630%0.303CS..SBendtrans-60.8122.6-179.7-62.5-179.8000112L179 Y260 I268 L269 L270 A278 I281 R282L179-L272 HydrophobicContact CD2-CD2 4.14Å; Y260-L272 HydrophobicContact CE2-CD2 4.28Å; Y260-L272 WeakPolarHBondContact OH-CA 3.27Å; Y260-L272 VanDerWaalsContact OH-CD2 3.26Å; Y260-L272 WeakPolarHBondContact OH-CD2 3.19Å; I268-L272 PolarHBondContact O-N 3.42Å; L269-L272 HydrophobicContact CD2-CD1 3.88Å; L270-L272 VanDerWaalsContact C-N 3.31Å; L270-L272 PolarHBondContact O-N 3.38Å; L272-A278 HydrophobicContact CB-CB 4Å; L272-A278 HydrophobicContact CD1-CB 4.5Å; L272-I281 HydrophobicContact CD1-CB 4.36Å; L272-I281 HydrophobicContact CD1-CG2 4.02Å; L272-R282 PolarHBondContact O-NH2 3.21Å
273E79.6Confident84.1Confident131 Ų13163.7 Ų63.761%0.61230%0.299SS*.PPolyproline II helixtrans-59.9143.6176.2-65.5-174.1169.300111.2Y260 S271 G275 A278Y260-E273 HydrophobicContact CE1-CG 4.44Å; S271-E273 PolarHBondContact O-N 3Å; E273-G275 PolarHBondContact O-N 2.79Å; E273-A278 WeakPolarHBondContact O-CB 3.36Å
274K75.8Confident85Confident153 Ų15356 Ų5667%0.66527%0.274SS*.SBendtrans-64.3131.4-174.5-58.4-171.3-178.5-162.60110.7D123D123-K274 PolarHBondContact O-NZ 3.47Å
275G84.2Confident85.7Confident40 Ų4055.6 Ų55.641%0.41227%0.271SS..SBendtrans169.1171.217900000112.9E273 S277 A278 W279E273-G275 PolarHBondContact O-N 2.79Å; G275-S277 VanDerWaalsContact C-N 3.28Å; G275-S277 PolarHBondContact O-N 2.84Å; G275-A278 PolarHBondContact O-N 2.83Å; G275-W279 PolarHBondContact O-N 3.02Å
276R86.7Confident86.5Confident231 Ų23151.9 Ų51.987%0.87225%0.254SS*.Hα-helixtrans-62.2-34.8-178.6-61.1-173.976.3154.93.9112.7L280R276-L280 PolarHBondContact O-N 2.9Å; R276-L280 VanDerWaalsContact O-N 3.1Å
277S87.8Confident87.5Confident60 Ų6053.4 Ų53.442%0.4226%0.26SS..Hα-helixtrans-65.5-46.5175.5510000111.6H178 G275 W279 L280 I281H178-S277 PolarHBondContact CE1-OG 3.19Å; G275-S277 VanDerWaalsContact C-N 3.28Å; G275-S277 PolarHBondContact O-N 2.84Å; S277-W279 VanDerWaalsContact C-N 3.34Å; S277-W279 PolarHBondContact O-N 2.87Å; S277-L280 PolarHBondContact O-N 3.31Å; S277-I281 WeakPolarHBondContact O-CD1 3.41Å; S277-I281 VanDerWaalsContact O-CG1 3.23Å; S277-I281 WeakPolarHBondContact O-CG1 3.35Å; S277-I281 PolarHBondContact O-N 2.88Å
278A87.1Confident88Confident0 Ų053 Ų530%026%0.258CS..Hα-helixtrans-62.8-41.8178.600000111.5L272 E273 G275 L280 I281 R282L272-A278 HydrophobicContact CB-CB 4Å; L272-A278 HydrophobicContact CD1-CB 4.5Å; E273-A278 WeakPolarHBondContact O-CB 3.36Å; G275-A278 PolarHBondContact O-N 2.83Å; A278-L280 PolarHBondContact O-N 3.4Å; A278-I281 PolarHBondContact O-N 3.12Å; A278-R282 WeakPolarHBondContact O-CB 3.5Å; A278-R282 VanDerWaalsContact O-CG 3.29Å; A278-R282 WeakPolarHBondContact O-CG 3.5Å; A278-R282 PolarHBondContact O-N 3.48Å
279W89.9Confident88.3Confident114 Ų11453 Ų5343%0.43226%0.258SS..Hα-helixtrans-58.7-46.8174.2-171.895.4000111.9L120 G275 S277 I281 R282 F283L120-W279 HydrophobicContact CD2-CD2 3.97Å; L120-W279 HydrophobicContact CD2-CG 3.97Å; L120-W279 HydrophobicContact CD2-CZ2 4.28Å; L120-W279 WeakPolarHBondContact CD2-O 3.49Å; L120-W279 PolarHBondContact O-NE1 3.39Å; G275-W279 PolarHBondContact O-N 3.02Å; S277-W279 VanDerWaalsContact C-N 3.34Å; S277-W279 PolarHBondContact O-N 2.87Å; W279-I281 VanDerWaalsContact C-N 3.31Å; W279-I281 PolarHBondContact O-N 3.05Å; W279-R282 PolarHBondContact O-N 3.4Å; W279-F283 HydrophobicContact CE3-CB 4.5Å; W279-F283 HydrophobicContact CH2-CD2 4.47Å; W279-F283 HydrophobicContact CH2-CG 4.44Å; W279-F283 HydrophobicContact CZ3-CB 4.29Å; W279-F283 HydrophobicContact CZ3-CG 4.45Å; W279-F283 WeakPolarHBondContact O-CB 3.31Å; W279-F283 PolarHBondContact O-N 3.48Å
280L92.1Very high88.5Confident94 Ų9453.5 Ų53.549%0.49226%0.262SS..Hα-helixtrans-61-39.4178.4-179.463.6000112.1R276 S277 A278 F283 A284R276-L280 PolarHBondContact O-N 2.9Å; R276-L280 VanDerWaalsContact O-N 3.1Å; S277-L280 PolarHBondContact O-N 3.31Å; A278-L280 PolarHBondContact O-N 3.4Å; L280-F283 PolarHBondContact O-N 2.8Å; L280-A284 WeakPolarHBondContact O-CB 3.44Å; L280-A284 PolarHBondContact O-N 2.88Å
281I92.5Very high88.7Confident9 Ų951.3 Ų51.35%0.04625%0.251CS..Hα-helixtrans-71.6-44.5-179.8-65.2153.9000111.1L175 H178 L269 L272 S277 A278 W279 F283 A284 F285L175-I281 HydrophobicContact CB-CG2 4.39Å; L175-I281 HydrophobicContact CD1-CG2 3.82Å; H178-I281 HydrophobicContact CB-CD1 3.18Å; H178-I281 HydrophobicContact CB-CG1 4.19Å; H178-I281 WeakPolarHBondContact CD2-CD1 2.93Å; H178-I281 WeakPolarHBondContact ND1-CD1 3.36Å; L269-I281 HydrophobicContact CD2-CG2 4.16Å; L272-I281 HydrophobicContact CD1-CB 4.36Å; L272-I281 HydrophobicContact CD1-CG2 4.02Å; S277-I281 WeakPolarHBondContact O-CD1 3.41Å; S277-I281 VanDerWaalsContact O-CG1 3.23Å; S277-I281 WeakPolarHBondContact O-CG1 3.35Å; S277-I281 PolarHBondContact O-N 2.88Å; A278-I281 PolarHBondContact O-N 3.12Å; W279-I281 VanDerWaalsContact C-N 3.31Å; W279-I281 PolarHBondContact O-N 3.05Å; I281-F283 VanDerWaalsContact C-N 3.25Å; I281-F283 PolarHBondContact O-N 2.82Å; I281-A284 PolarHBondContact O-N 3.02Å; I281-F285 VanDerWaalsContact O-CB 3.3Å; I281-F285 WeakPolarHBondContact O-CB 3.48Å; I281-F285 PolarHBondContact O-N 3.23Å
282R91.8Very high89Confident24 Ų2450.7 Ų50.79%0.09125%0.247CC..Hα-helixtrans-57.7-42.7174.5-71.4178.6178.5142.75.6110.8M116 L120 L269 L272 A278 W279 L286M116-R282 HydrophobicContact SD-CB 4.02Å; M116-R282 HydrophobicContact SD-CG 3.7Å; L120-R282 HydrophobicContact CD2-CB 3.89Å; L120-R282 HydrophobicContact CG-CB 4.29Å; L269-R282 PolarHBondContact O-NE 2.86Å; L269-R282 PolarHBondContact O-NH2 3.32Å; L272-R282 PolarHBondContact O-NH2 3.21Å; A278-R282 WeakPolarHBondContact O-CB 3.5Å; A278-R282 VanDerWaalsContact O-CG 3.29Å; A278-R282 WeakPolarHBondContact O-CG 3.5Å; A278-R282 PolarHBondContact O-N 3.48Å; W279-R282 PolarHBondContact O-N 3.4Å; R282-L286 VanDerWaalsContact O-CB 3.3Å; R282-L286 WeakPolarHBondContact O-CB 3.45Å; R282-L286 PolarHBondContact O-N 2.83Å
283F92.6Very high89.2Confident95 Ų9550.5 Ų50.542%0.41725%0.245SC..Hα-helixtrans-64.7-49.4175.4-179.8-100000112.2L120 W279 L280 I281 F285 L286 V287L120-F283 HydrophobicContact CD1-CB 4.29Å; L120-F283 HydrophobicContact CD1-CD2 4.31Å; L120-F283 HydrophobicContact CD2-CB 3.99Å; W279-F283 HydrophobicContact CE3-CB 4.5Å; W279-F283 HydrophobicContact CH2-CD2 4.47Å; W279-F283 HydrophobicContact CH2-CG 4.44Å; W279-F283 HydrophobicContact CZ3-CB 4.29Å; W279-F283 HydrophobicContact CZ3-CG 4.45Å; W279-F283 WeakPolarHBondContact O-CB 3.31Å; W279-F283 PolarHBondContact O-N 3.48Å; L280-F283 PolarHBondContact O-N 2.8Å; I281-F283 VanDerWaalsContact C-N 3.25Å; I281-F283 PolarHBondContact O-N 2.82Å; F283-F285 VanDerWaalsContact C-N 3.31Å; F283-F285 PolarHBondContact O-N 2.88Å; F283-L286 PolarHBondContact O-N 3.33Å; F283-V287 HydrophobicContact CD1-CG2 4.45Å; F283-V287 HydrophobicContact CE1-CG2 4.03Å; F283-V287 HydrophobicContact CE2-CG2 4.43Å; F283-V287 HydrophobicContact CZ-CG2 4.01Å; F283-V287 WeakPolarHBondContact O-CG2 3.23Å; F283-V287 PolarHBondContact O-N 3.45Å
284A93.1Very high89.6Confident15 Ų1544.4 Ų44.412%0.12422%0.218CC..Hα-helixtrans-60.2-41.8178.600000111.9A171 L174 L280 I281 V287 S288A171-A284 HydrophobicContact CB-CB 4.1Å; A171-A284 WeakPolarHBondContact CB-O 3.45Å; L174-A284 HydrophobicContact CD1-CB 4.18Å; L280-A284 WeakPolarHBondContact O-CB 3.44Å; L280-A284 PolarHBondContact O-N 2.88Å; I281-A284 PolarHBondContact O-N 3.02Å; A284-V287 PolarHBondContact O-N 3.48Å; A284-S288 PolarHBondContact O-N 3.18Å
285F92Very high90.1Very high2 Ų237.4 Ų37.41%0.00919%0.187CC..Hα-helixtrans-68.2-40.1177.4-158.6-86.8000111.4I23 L24 V112 Y172 L175 L269 I281 F283 V287 S288 L289I23-F285 HydrophobicContact CG2-CE2 3.97Å; I23-F285 HydrophobicContact CG2-CZ 4Å; L24-F285 HydrophobicContact CD1-CD1 4.46Å; L24-F285 HydrophobicContact CD1-CE1 3.6Å; L24-F285 HydrophobicContact CD1-CZ 3.8Å; L24-F285 HydrophobicContact CD2-CD2 4.49Å; L24-F285 HydrophobicContact CD2-CE1 4.03Å; L24-F285 HydrophobicContact CD2-CE2 3.8Å; L24-F285 HydrophobicContact CD2-CZ 3.53Å; L24-F285 HydrophobicContact CG-CE1 4.07Å; L24-F285 HydrophobicContact CG-CE2 4.46Å; L24-F285 HydrophobicContact CG-CZ 3.72Å; V112-F285 HydrophobicContact CG1-CE1 4.4Å; Y172-F285 HydrophobicContact CD1-CD2 4.3Å; Y172-F285 AromaticContact CD1-CE2 3.83Å; Y172-F285 HydrophobicContact CD1-CE2 3.83Å; Y172-F285 HydrophobicContact CE1-CD2 4.33Å; Y172-F285 AromaticContact CE1-CE2 3.69Å; Y172-F285 HydrophobicContact CE1-CE2 3.69Å; Y172-F285 HydrophobicContact CE1-CZ 4.22Å; L175-F285 HydrophobicContact CD2-CD2 4.36Å; L175-F285 HydrophobicContact CD2-CE2 4.25Å; L269-F285 HydrophobicContact CD1-CB 4.1Å; L269-F285 HydrophobicContact CD1-CD1 3.45Å; L269-F285 VanDerWaalsContact CD1-CD1 3.45Å; L269-F285 HydrophobicContact CD1-CD2 4.41Å; L269-F285 HydrophobicContact CD1-CE1 3.94Å; L269-F285 HydrophobicContact CD1-CG 3.72Å; I281-F285 VanDerWaalsContact O-CB 3.3Å; I281-F285 WeakPolarHBondContact O-CB 3.48Å; I281-F285 PolarHBondContact O-N 3.23Å; F283-F285 VanDerWaalsContact C-N 3.31Å; F283-F285 PolarHBondContact O-N 2.88Å; F285-V287 VanDerWaalsContact C-N 3.31Å; F285-V287 PolarHBondContact O-N 2.89Å; F285-S288 WeakPolarHBondContact O-CA 3.03Å; F285-S288 WeakPolarHBondContact O-CB 3.49Å; F285-S288 PolarHBondContact O-N 2.89Å; F285-S288 PolarHBondContact O-OG 3.48Å; F285-L289 HydrophobicContact CD1-CD1 4.01Å; F285-L289 HydrophobicContact CD1-CD2 4.34Å; F285-L289 HydrophobicContact CD1-CG 3.96Å; F285-L289 HydrophobicContact CE1-CD1 4.06Å; F285-L289 HydrophobicContact CE1-CD2 3.77Å; F285-L289 HydrophobicContact CE1-CG 3.91Å; F285-L289 WeakPolarHBondContact O-CG 3.48Å; F285-L289 PolarHBondContact O-N 3.28Å
286L92.7Very high90.3Very high21 Ų2135.8 Ų35.811%0.1117%0.169CC..Hα-helixtrans-58.8-41.3173-177.763.8000112.2A113 M116 L120 F144 R282 F283 S288 L289 A290A113-L286 HydrophobicContact CB-CD1 3.77Å; M116-L286 HydrophobicContact CB-CB 4.41Å; M116-L286 HydrophobicContact CB-CD1 4.27Å; L120-L286 HydrophobicContact CD1-CB 4.44Å; L120-L286 HydrophobicContact CD1-CD2 3.6Å; F144-L286 HydrophobicContact CD2-CD1 3.88Å; F144-L286 HydrophobicContact CE2-CD1 3.46Å; F144-L286 VanDerWaalsContact CE2-CD1 3.46Å; F144-L286 HydrophobicContact CE2-CG 4.06Å; F144-L286 HydrophobicContact CZ-CD1 4.19Å; R282-L286 VanDerWaalsContact O-CB 3.3Å; R282-L286 WeakPolarHBondContact O-CB 3.45Å; R282-L286 PolarHBondContact O-N 2.83Å; F283-L286 PolarHBondContact O-N 3.33Å; L286-S288 VanDerWaalsContact C-N 3.33Å; L286-S288 PolarHBondContact O-N 2.92Å; L286-L289 PolarHBondContact O-N 2.84Å; L286-A290 PolarHBondContact O-N 3.45Å
287V92Very high90.4Very high49 Ų4924.9 Ų24.930%0.29713%0.128SC..Hα-helixtrans-63.2-40173.5174.50000111.1I167 F283 A284 F285 L289 A290 V291I167-V287 HydrophobicContact CG2-CG1 3.81Å; F283-V287 HydrophobicContact CD1-CG2 4.45Å; F283-V287 HydrophobicContact CE1-CG2 4.03Å; F283-V287 HydrophobicContact CE2-CG2 4.43Å; F283-V287 HydrophobicContact CZ-CG2 4.01Å; F283-V287 WeakPolarHBondContact O-CG2 3.23Å; F283-V287 PolarHBondContact O-N 3.45Å; A284-V287 PolarHBondContact O-N 3.48Å; F285-V287 VanDerWaalsContact C-N 3.31Å; F285-V287 PolarHBondContact O-N 2.89Å; V287-L289 VanDerWaalsContact C-N 3.32Å; V287-L289 PolarHBondContact O-N 2.89Å; V287-A290 WeakPolarHBondContact O-CB 3.47Å; V287-A290 PolarHBondContact O-N 2.96Å; V287-V291 PolarHBondContact O-N 2.98Å; V287-V291 VanDerWaalsContact O-N 3.14Å
288S92Very high90.3Very high0 Ų023.5 Ų23.50%012%0.115CC..Hα-helixtrans-61.1-40.3174.882.40000112.3A284 F285 L286 A290 V291 S292A284-S288 PolarHBondContact O-N 3.18Å; F285-S288 WeakPolarHBondContact O-CA 3.03Å; F285-S288 WeakPolarHBondContact O-CB 3.49Å; F285-S288 PolarHBondContact O-N 2.89Å; F285-S288 PolarHBondContact O-OG 3.48Å; L286-S288 VanDerWaalsContact C-N 3.33Å; L286-S288 PolarHBondContact O-N 2.92Å; S288-A290 PolarHBondContact O-N 3.36Å; S288-V291 PolarHBondContact O-N 3.38Å; S288-S292 WeakPolarHBondContact O-CB 3.13Å; S288-S292 PolarHBondContact O-N 2.91Å; S288-S292 PolarHBondContact O-OG 3.46Å; S288-S292 VanDerWaalsContact O-OG 3.11Å
289L92.2Very high90.3Very high1 Ų124 Ų241%0.00512%0.118CC..Hα-helixtrans-65-40176.7-65.1178.2000111.9V21 F109 V112 A113 F285 L286 V287 V291 S292 Y293V21-L289 HydrophobicContact CG2-CD2 3.49Å; V21-L289 VanDerWaalsContact CG2-CD2 3.49Å; F109-L289 HydrophobicContact CD1-CD2 3.98Å; F109-L289 HydrophobicContact CE1-CD2 4.3Å; F109-L289 HydrophobicContact CG-CD2 4.4Å; V112-L289 HydrophobicContact CB-CD1 3.98Å; V112-L289 HydrophobicContact CG1-CD1 3.66Å; A113-L289 HydrophobicContact CB-CD1 4.18Å; F285-L289 HydrophobicContact CD1-CD1 4.01Å; F285-L289 HydrophobicContact CD1-CD2 4.34Å; F285-L289 HydrophobicContact CD1-CG 3.96Å; F285-L289 HydrophobicContact CE1-CD1 4.06Å; F285-L289 HydrophobicContact CE1-CD2 3.77Å; F285-L289 HydrophobicContact CE1-CG 3.91Å; F285-L289 WeakPolarHBondContact O-CG 3.48Å; F285-L289 PolarHBondContact O-N 3.28Å; L286-L289 PolarHBondContact O-N 2.84Å; V287-L289 VanDerWaalsContact C-N 3.32Å; V287-L289 PolarHBondContact O-N 2.89Å; L289-V291 VanDerWaalsContact C-N 3.25Å; L289-V291 PolarHBondContact O-N 3Å; L289-S292 PolarHBondContact O-N 3.4Å; L289-Y293 WeakPolarHBondContact O-CB 3.37Å; L289-Y293 PolarHBondContact O-N 2.85Å
290A90.9Very high90.3Very high11 Ų1118.6 Ų18.69%0.09110%0.097CC..Hα-helixtrans-59.3-38.5174.700000111.7F144 I148 L152 L286 V287 S288 P294F144-A290 HydrophobicContact CE2-CB 4.25Å; F144-A290 HydrophobicContact CZ-CB 3.98Å; I148-A290 HydrophobicContact CG2-CB 3.59Å; L152-A290 VanDerWaalsContact CD2-O 3.26Å; L152-A290 WeakPolarHBondContact CD2-O 3.1Å; L286-A290 PolarHBondContact O-N 3.45Å; V287-A290 WeakPolarHBondContact O-CB 3.47Å; V287-A290 PolarHBondContact O-N 2.96Å; S288-A290 PolarHBondContact O-N 3.36Å; A290-P294 WeakPolarHBondContact O-CD 3.23Å
291V88.2Confident90.1Very high7 Ų714.4 Ų14.44%0.0428%0.075CC..Hα-helixtrans-72.6-41.1175.8170.10000112.3L161 L164 V287 S288 L289 P294L161-V291 HydrophobicContact CD1-CG1 4.5Å; L161-V291 WeakPolarHBondContact CD1-O 3.26Å; L164-V291 HydrophobicContact CB-CB 4.35Å; L164-V291 HydrophobicContact CB-CG1 3.44Å; L164-V291 VanDerWaalsContact CB-CG1 3.44Å; L164-V291 HydrophobicContact CB-CG2 3.97Å; L164-V291 HydrophobicContact CD1-CG2 4.47Å; L164-V291 HydrophobicContact CD2-CG2 4.43Å; V287-V291 PolarHBondContact O-N 2.98Å; V287-V291 VanDerWaalsContact O-N 3.14Å; S288-V291 PolarHBondContact O-N 3.38Å; L289-V291 VanDerWaalsContact C-N 3.25Å; L289-V291 PolarHBondContact O-N 3Å; V291-P294 WeakPolarHBondContact O-CD 3.14Å
292S89.7Confident89.8Confident2 Ų215 Ų151%0.0148%0.078CC..Hα-helixtrans-78.6-25.2-173.7-60.90000113.2N16 S288 L289 L295 M296N16-S292 PolarHBondContact ND2-OG 3.42Å; N16-S292 PolarHBondContact OD1-OG 3.02Å; S288-S292 WeakPolarHBondContact O-CB 3.13Å; S288-S292 PolarHBondContact O-N 2.91Å; S288-S292 PolarHBondContact O-OG 3.46Å; S288-S292 VanDerWaalsContact O-OG 3.11Å; L289-S292 PolarHBondContact O-N 3.4Å; S292-L295 WeakPolarHBondContact O-CB 3.34Å; S292-L295 PolarHBondContact O-N 2.88Å; S292-L295 VanDerWaalsContact O-N 3.09Å; S292-M296 PolarHBondContact O-N 3.12Å
293Y90.8Very high89.6Confident1 Ų114 Ų140%0.0048%0.075CC..Hα-helixtrans-60.6-49.3179.1-176.6-81.8000113.7M106 F109 L110 A149 L289 L295 M296 L297 V342 S345M106-Y293 HydrophobicContact CB-CD2 4.27Å; M106-Y293 HydrophobicContact CB-CE2 3.77Å; M106-Y293 HydrophobicContact CE-CD1 4.37Å; M106-Y293 HydrophobicContact CE-CD2 4.4Å; M106-Y293 HydrophobicContact CE-CE1 3.61Å; M106-Y293 HydrophobicContact CE-CE2 3.64Å; M106-Y293 WeakPolarHBondContact CE-OH 3.21Å; M106-Y293 HydrophobicContact CG-CD2 4.38Å; M106-Y293 HydrophobicContact CG-CE2 4.16Å; F109-Y293 HydrophobicContact CB-CD2 4.07Å; F109-Y293 HydrophobicContact CD2-CD2 4.25Å; L110-Y293 HydrophobicContact CD1-CE2 3.85Å; L110-Y293 HydrophobicContact CD2-CD2 4.11Å; L110-Y293 HydrophobicContact CD2-CE2 3.76Å; L110-Y293 HydrophobicContact CG-CD2 4.18Å; L110-Y293 HydrophobicContact CG-CE2 3.58Å; A149-Y293 HydrophobicContact CB-CD1 3.69Å; A149-Y293 HydrophobicContact CB-CE1 3.76Å; A149-Y293 HydrophobicContact CB-CG 4.25Å; L289-Y293 WeakPolarHBondContact O-CB 3.37Å; L289-Y293 PolarHBondContact O-N 2.85Å; Y293-L295 PolarHBondContact O-N 3.37Å; Y293-M296 PolarHBondContact O-N 2.96Å; Y293-L297 PolarHBondContact O-N 2.88Å; Y293-V342 HydrophobicContact CE1-CG2 4.11Å; Y293-S345 PolarHBondContact OH-OG 3.37Å
294P88.2Confident89.4Confident4 Ų411.1 Ų11.13%0.0267%0.065CC..Hα-helixtrans-59.7-28.6172-22.931000114.2L152 A156 L161 A290 V291 M296 L297 F298L152-P294 HydrophobicContact CB-CG 4.18Å; L152-P294 HydrophobicContact CD2-CG 3.85Å; L152-P294 HydrophobicContact CG-CG 3.79Å; A156-P294 HydrophobicContact CB-CB 4.03Å; L161-P294 HydrophobicContact CD1-CB 4.07Å; L161-P294 HydrophobicContact CD1-CG 4.48Å; L161-P294 HydrophobicContact CD2-CB 3.98Å; A290-P294 WeakPolarHBondContact O-CD 3.23Å; V291-P294 WeakPolarHBondContact O-CD 3.14Å; P294-M296 VanDerWaalsContact C-N 3.28Å; P294-M296 PolarHBondContact O-N 3.45Å; P294-L297 PolarHBondContact O-N 3.44Å; P294-F298 PolarHBondContact O-N 3.28Å
295L85.9Confident89.1Confident6 Ų610.4 Ų10.43%0.0316%0.059CC..Hα-helixtrans-66.2-34.9178.6-78.2168000111.2H13 N16 L161 S292 Y293 P299H13-L295 VanDerWaalsContact CE1-CD2 3.42Å; H13-L295 WeakPolarHBondContact CE1-CD2 3.4Å; N16-L295 HydrophobicContact CB-CD1 4.35Å; N16-L295 WeakPolarHBondContact ND2-CD1 3.36Å; L161-L295 HydrophobicContact CB-CD2 3.94Å; L161-L295 HydrophobicContact CB-CG 4.48Å; L161-L295 HydrophobicContact CD1-CG 4.29Å; L161-L295 HydrophobicContact CD2-CB 4.09Å; L161-L295 HydrophobicContact CD2-CD2 3.28Å; L161-L295 HydrophobicContact CD2-CG 3.41Å; L161-L295 VanDerWaalsContact CD2-CG 3.41Å; L161-L295 HydrophobicContact CG-CD1 4.25Å; L161-L295 HydrophobicContact CG-CD2 3.37Å; L161-L295 HydrophobicContact CG-CG 3.42Å; L161-L295 VanDerWaalsContact CG-CG 3.42Å; S292-L295 WeakPolarHBondContact O-CB 3.34Å; S292-L295 PolarHBondContact O-N 2.88Å; S292-L295 VanDerWaalsContact O-N 3.09Å; Y293-L295 PolarHBondContact O-N 3.37Å; L295-P299 WeakPolarHBondContact O-CD 3.49Å; L295-P299 WeakPolarHBondContact O-CG 3.3Å
296M88.2Confident88.7Confident6 Ų610.5 Ų10.53%0.036%0.06CC..Hα-helixtrans-83-37.1177.8-59.9-60.5-84.500111.5L102 S105 M106 F109 Q219 S292 Y293 P294 F298 P299 C300L102-M296 HydrophobicContact CD2-CE 3.53Å; L102-M296 HydrophobicContact CD2-SD 4.03Å; S105-M296 VanDerWaalsContact CB-CE 3.48Å; M106-M296 HydrophobicContact CG-CB 3.72Å; M106-M296 HydrophobicContact SD-CB 4.36Å; F109-M296 HydrophobicContact CD2-CG 4.31Å; F109-M296 HydrophobicContact CE2-CB 4.38Å; F109-M296 HydrophobicContact CE2-CG 3.47Å; F109-M296 VanDerWaalsContact CE2-CG 3.47Å; F109-M296 HydrophobicContact CZ-CG 4.1Å; Q219-M296 PolarHBondContact NE2-SD 2.89Å; S292-M296 PolarHBondContact O-N 3.12Å; Y293-M296 PolarHBondContact O-N 2.96Å; P294-M296 VanDerWaalsContact C-N 3.28Å; P294-M296 PolarHBondContact O-N 3.45Å; M296-F298 VanDerWaalsContact C-N 3.32Å; M296-F298 PolarHBondContact O-N 3.41Å; M296-P299 VanDerWaalsContact O-CD 3.29Å; M296-P299 WeakPolarHBondContact O-CD 3.49Å; M296-P299 WeakPolarHBondContact O-CG 3.01Å; M296-C300 WeakPolarHBondContact O-CB 3.17Å; M296-C300 PolarHBondContact O-N 3.39Å; M296-C300 VanDerWaalsContact O-N 3.15Å
297L89.7Confident88.3Confident1 Ų19.9 Ų9.91%0.0056%0.059CC..Hα-helixtrans-60.8-42.3176.4-17782.5000111.3M106 Y293 P294 C300 R301 T338 I341 V342M106-L297 HydrophobicContact CE-CB 3.83Å; M106-L297 HydrophobicContact CE-CD1 3.41Å; M106-L297 VanDerWaalsContact CE-CD1 3.41Å; M106-L297 HydrophobicContact CE-CG 4.21Å; M106-L297 HydrophobicContact SD-CB 4.12Å; M106-L297 HydrophobicContact SD-CD1 4.16Å; Y293-L297 PolarHBondContact O-N 2.88Å; P294-L297 PolarHBondContact O-N 3.44Å; L297-C300 WeakPolarHBondContact O-CB 3.35Å; L297-C300 PolarHBondContact O-N 3.44Å; L297-C300 VanDerWaalsContact O-N 3.16Å; L297-R301 WeakPolarHBondContact O-CB 3.29Å; L297-R301 PolarHBondContact O-N 2.57Å; L297-T338 HydrophobicContact CD2-CG2 3.6Å; L297-I341 HydrophobicContact CD1-CB 3.92Å; L297-I341 HydrophobicContact CD1-CD1 4.36Å; L297-I341 HydrophobicContact CD1-CG2 3.51Å; L297-V342 HydrophobicContact CD1-CG2 4.01Å; L297-V342 HydrophobicContact CD2-CG2 4.39Å
298F85.3Confident88Confident32 Ų329.9 Ų9.914%0.146%0.057CC..Hα-helixtrans-54.2-58.2-176.3-178.5-90.8000113.5M1 V158 V222 P294 M296 C300 R301 L302 W334M1-F298 HydrophobicContact CE-CE1 3.97Å; M1-F298 HydrophobicContact CE-CE2 4.13Å; M1-F298 HydrophobicContact CE-CZ 3.35Å; V158-F298 HydrophobicContact CG2-CD1 4.38Å; V158-F298 HydrophobicContact CG2-CD2 4.46Å; V158-F298 HydrophobicContact CG2-CE1 4.22Å; V158-F298 HydrophobicContact CG2-CE2 4.32Å; V158-F298 HydrophobicContact CG2-CZ 4.24Å; V222-F298 HydrophobicContact CG1-CE1 3.94Å; P294-F298 PolarHBondContact O-N 3.28Å; M296-F298 VanDerWaalsContact C-N 3.32Å; M296-F298 PolarHBondContact O-N 3.41Å; F298-C300 VanDerWaalsContact C-N 3.31Å; F298-C300 PolarHBondContact O-N 3.31Å; F298-R301 PolarHBondContact O-N 2.88Å; F298-L302 HydrophobicContact CD1-CD1 4.19Å; F298-L302 HydrophobicContact CE1-CD1 3.49Å; F298-L302 VanDerWaalsContact CE1-CD1 3.49Å; F298-L302 HydrophobicContact CE1-CG 4.36Å; F298-L302 HydrophobicContact CZ-CD1 3.8Å; F298-L302 HydrophobicContact CZ-CG 4.41Å; F298-L302 PolarHBondContact O-N 3.39Å; F298-W334 AromaticContact CE2-CH2 3.95Å; F298-W334 HydrophobicContact CE2-CH2 3.95Å; F298-W334 HydrophobicContact CE2-CZ2 4.45Å
299P86.4Confident87.5Confident10 Ų1012.1 Ų12.17%0.0657%0.067CC..Hα-helixtrans-66-32174.926.7-33.3000112.2L102 V222 L295 M296 R301 L302 A303L102-P299 HydrophobicContact CD1-CB 3.75Å; L102-P299 HydrophobicContact CD1-CG 3.85Å; L102-P299 HydrophobicContact CD2-CG 4.17Å; V222-P299 HydrophobicContact CG2-CB 3.97Å; L295-P299 WeakPolarHBondContact O-CD 3.49Å; L295-P299 WeakPolarHBondContact O-CG 3.3Å; M296-P299 VanDerWaalsContact O-CD 3.29Å; M296-P299 WeakPolarHBondContact O-CD 3.49Å; M296-P299 WeakPolarHBondContact O-CG 3.01Å; P299-R301 PolarHBondContact O-N 2.84Å; P299-L302 PolarHBondContact O-N 2.89Å; P299-A303 WeakPolarHBondContact O-CB 3.25Å; P299-A303 PolarHBondContact O-N 3.05Å
300C89.3Confident86.8Confident1 Ų114 Ų141%0.0078%0.076CC..Hα-helixtrans-62.4-45.4177.4-173.60000111.1L102 M106 M296 L297 F298 L302 A303 V304L102-C300 HydrophobicContact CB-CB 3.78Å; L102-C300 HydrophobicContact CD1-CB 4.14Å; M106-C300 HydrophobicContact SD-CB 4.21Å; M296-C300 WeakPolarHBondContact O-CB 3.17Å; M296-C300 PolarHBondContact O-N 3.39Å; M296-C300 VanDerWaalsContact O-N 3.15Å; L297-C300 WeakPolarHBondContact O-CB 3.35Å; L297-C300 PolarHBondContact O-N 3.44Å; L297-C300 VanDerWaalsContact O-N 3.16Å; F298-C300 VanDerWaalsContact C-N 3.31Å; F298-C300 PolarHBondContact O-N 3.31Å; C300-L302 VanDerWaalsContact C-N 3.35Å; C300-L302 PolarHBondContact O-N 3.47Å; C300-A303 PolarHBondContact O-N 3.24Å; C300-V304 WeakPolarHBondContact O-CG2 3.5Å; C300-V304 PolarHBondContact O-N 3Å
301R88.8Confident86.3Confident5 Ų517.7 Ų17.72%0.0199%0.094CC..Hα-helixtrans-62.3-42.3177.1178.1173.759.7-145.4-12.9111.2L297 F298 P299 A303 V304 L305 W334 T337 T338 I341L297-R301 WeakPolarHBondContact O-CB 3.29Å; L297-R301 PolarHBondContact O-N 2.57Å; F298-R301 PolarHBondContact O-N 2.88Å; P299-R301 PolarHBondContact O-N 2.84Å; R301-A303 VanDerWaalsContact C-N 3.33Å; R301-V304 PolarHBondContact O-N 3.25Å; R301-L305 HydrophobicContact CG-CD1 3.93Å; R301-L305 HydrophobicContact CG-CG 4.35Å; R301-L305 WeakPolarHBondContact O-CB 3.25Å; R301-L305 WeakPolarHBondContact O-CG 3.47Å; R301-L305 PolarHBondContact O-N 2.85Å; R301-W334 VanDerWaalsContact NH1-CE2 3.34Å; R301-W334 VanDerWaalsContact NH1-NE1 3.16Å; R301-W334 VanDerWaalsContact NH2-CH2 3.33Å; R301-T337 HydrophobicContact CG-CG2 4.07Å; R301-T338 WeakPolarHBondContact CD-OG1 3.3Å; R301-T338 PolarHBondContact NH1-OG1 2.84Å; R301-I341 HydrophobicContact CB-CD1 4.21Å
302L85.4Confident85.4Confident21 Ų2122.1 Ų22.111%0.1113%0.125CC..Hα-helixtrans-62.5-41.9175.6-68.2179.2000111.8V222 F298 P299 C300 L305 G306V222-L302 HydrophobicContact CG1-CD1 4.1Å; V222-L302 HydrophobicContact CG2-CD1 4.47Å; F298-L302 HydrophobicContact CD1-CD1 4.19Å; F298-L302 HydrophobicContact CE1-CD1 3.49Å; F298-L302 VanDerWaalsContact CE1-CD1 3.49Å; F298-L302 HydrophobicContact CE1-CG 4.36Å; F298-L302 HydrophobicContact CZ-CD1 3.8Å; F298-L302 HydrophobicContact CZ-CG 4.41Å; F298-L302 PolarHBondContact O-N 3.39Å; P299-L302 PolarHBondContact O-N 2.89Å; C300-L302 VanDerWaalsContact C-N 3.35Å; C300-L302 PolarHBondContact O-N 3.47Å; L302-L305 PolarHBondContact O-N 3Å; L302-G306 PolarHBondContact O-N 3.25Å
303A87.8Confident84.3Confident3 Ų327 Ų273%0.02516%0.155CC..Hα-helixtrans-64.3-43.8177.100000112E95 N98 A99 P299 C300 R301 G306 A307E95-A303 WeakPolarHBondContact O-CB 3.41Å; N98-A303 HydrophobicContact CB-CB 4.06Å; A99-A303 HydrophobicContact CB-CB 4.01Å; P299-A303 WeakPolarHBondContact O-CB 3.25Å; P299-A303 PolarHBondContact O-N 3.05Å; C300-A303 PolarHBondContact O-N 3.24Å; R301-A303 VanDerWaalsContact C-N 3.33Å; A303-G306 PolarHBondContact O-N 3.34Å; A303-A307 WeakPolarHBondContact O-CB 3.23Å; A303-A307 PolarHBondContact O-N 3.36Å
304V88.7Confident82.8Confident36 Ų3630 Ų3022%0.21817%0.171CC..Hα-helixtrans-63.9-45.9175.8171.40000111.5A99 C300 R301 G306 A307 L308 T337 I341A99-V304 HydrophobicContact CB-CG2 3.79Å; C300-V304 WeakPolarHBondContact O-CG2 3.5Å; C300-V304 PolarHBondContact O-N 3Å; R301-V304 PolarHBondContact O-N 3.25Å; V304-G306 VanDerWaalsContact C-N 3.34Å; V304-G306 PolarHBondContact O-N 3.09Å; V304-A307 PolarHBondContact O-N 3.02Å; V304-L308 HydrophobicContact CG1-CD1 3.96Å; V304-L308 HydrophobicContact CG1-CG 4.35Å; V304-L308 VanDerWaalsContact O-CG 3.28Å; V304-L308 WeakPolarHBondContact O-CG 3.33Å; V304-L308 PolarHBondContact O-N 3.29Å; V304-T337 HydrophobicContact CB-CG2 4.33Å; V304-T337 HydrophobicContact CG1-CG2 3.84Å; V304-I341 HydrophobicContact CB-CD1 4.31Å; V304-I341 HydrophobicContact CG2-CD1 3.99Å; V304-I341 HydrophobicContact CG2-CG1 4.47Å
305L86.7Confident81.2Confident0 Ų035.7 Ų35.70%021%0.21CC..Hα-helixtrans-63.5-41.1178.4-70174000111.7R301 L302 L308 E309 L320 C333 W334 T337R301-L305 HydrophobicContact CG-CD1 3.93Å; R301-L305 HydrophobicContact CG-CG 4.35Å; R301-L305 WeakPolarHBondContact O-CB 3.25Å; R301-L305 WeakPolarHBondContact O-CG 3.47Å; R301-L305 PolarHBondContact O-N 2.85Å; L302-L305 PolarHBondContact O-N 3Å; L305-L308 PolarHBondContact O-N 2.95Å; L305-E309 PolarHBondContact O-N 2.94Å; L305-L320 HydrophobicContact CB-CD1 4.31Å; L305-L320 HydrophobicContact CB-CD2 4.04Å; L305-L320 WeakPolarHBondContact O-CD1 3.5Å; L305-C333 WeakPolarHBondContact CD2-SG 3.44Å; L305-W334 HydrophobicContact CD1-CE3 4.35Å; L305-T337 HydrophobicContact CD2-CG2 4.22Å; L305-T337 HydrophobicContact CG-CG2 4.34Å
306G83.2Confident79.6Confident3 Ų336.4 Ų36.43%0.03121%0.214CC..Hα-helixtrans-55.8-50.9171.200000111.7E95 L302 A303 V304 L308 E309 Q310E95-G306 VanDerWaalsContact CD-C 3.48Å; E95-G306 WeakPolarHBondContact OE2-CA 3.42Å; E95-G306 VanDerWaalsContact OE2-O 3.11Å; L302-G306 PolarHBondContact O-N 3.25Å; A303-G306 PolarHBondContact O-N 3.34Å; V304-G306 VanDerWaalsContact C-N 3.34Å; V304-G306 PolarHBondContact O-N 3.09Å; G306-L308 VanDerWaalsContact C-N 3.32Å; G306-L308 PolarHBondContact O-N 2.93Å; G306-E309 WeakPolarHBondContact O-CB 3.42Å; G306-E309 PolarHBondContact O-N 2.83Å; G306-Q310 WeakPolarHBondContact O-CG 3.37Å; G306-Q310 PolarHBondContact O-N 3.33Å
307A85.9Confident77.4Confident9 Ų940 Ų407%0.07424%0.238CC..Hα-helixtrans-62.5-40.3-178.500000111.9L92 E95 I96 A303 V304 Q310 L311L92-A307 HydrophobicContact CD1-CB 3.9Å; E95-A307 HydrophobicContact CB-CB 4.11Å; E95-A307 WeakPolarHBondContact OE2-CA 3.41Å; E95-A307 PolarHBondContact OE2-N 3.17Å; I96-A307 HydrophobicContact CG1-CB 4.04Å; A303-A307 WeakPolarHBondContact O-CB 3.23Å; A303-A307 PolarHBondContact O-N 3.36Å; V304-A307 PolarHBondContact O-N 3.02Å; A307-Q310 PolarHBondContact O-N 3.02Å; A307-L311 WeakPolarHBondContact O-CB 3.41Å; A307-L311 VanDerWaalsContact O-CG 3.31Å; A307-L311 WeakPolarHBondContact O-CG 3.46Å; A307-L311 PolarHBondContact O-N 3.11Å
308L85.4Confident75.3Confident49 Ų4948.3 Ų48.326%0.25728%0.276SS..Hα-helixtrans-65.3-37.7177.5-71.3173.7000112.9V304 L305 G306 S312 V313 L314V304-L308 HydrophobicContact CG1-CD1 3.96Å; V304-L308 HydrophobicContact CG1-CG 4.35Å; V304-L308 VanDerWaalsContact O-CG 3.28Å; V304-L308 WeakPolarHBondContact O-CG 3.33Å; V304-L308 PolarHBondContact O-N 3.29Å; L305-L308 PolarHBondContact O-N 2.95Å; G306-L308 VanDerWaalsContact C-N 3.32Å; G306-L308 PolarHBondContact O-N 2.93Å; L308-S312 PolarHBondContact O-N 3.4Å; L308-V313 HydrophobicContact CD2-CB 4.38Å; L308-V313 HydrophobicContact CD2-CG1 4.34Å; L308-V313 PolarHBondContact O-N 2.95Å; L308-L314 HydrophobicContact CB-CB 4.46Å; L308-L314 PolarHBondContact O-N 3.22Å
309E79.8Confident73.2Confident47 Ų4748.1 Ų48.122%0.2228%0.278CS..Hα-helixtrans-64.2-46173.1-177.7-171.9-146.800110.3L305 G306 L311 S312 L320L305-E309 PolarHBondContact O-N 2.94Å; G306-E309 WeakPolarHBondContact O-CB 3.42Å; G306-E309 PolarHBondContact O-N 2.83Å; E309-L311 VanDerWaalsContact C-N 3.33Å; E309-L311 PolarHBondContact O-N 3.36Å; E309-S312 PolarHBondContact O-N 2.98Å; E309-L320 HydrophobicContact CB-CD1 3.73Å; E309-L320 HydrophobicContact CG-CD1 4.25Å; E309-L320 WeakPolarHBondContact OE2-CD1 3.3Å
310Q77.5Confident71.3Confident41 Ų4148.5 Ų48.519%0.19228%0.279CS..Hα-helixtrans-70.2-29-177.5-68.2-171.131.700113.7S88 C91 L92 E95 G306 A307 S312S88-Q310 PolarHBondContact O-OE1 2.96Å; C91-Q310 PolarHBondContact SG-NE2 2.98Å; L92-Q310 HydrophobicContact CB-CB 4.27Å; L92-Q310 HydrophobicContact CD1-CB 3.92Å; E95-Q310 PolarHBondContact OE1-NE2 3.29Å; E95-Q310 PolarHBondContact OE2-NE2 3.49Å; G306-Q310 WeakPolarHBondContact O-CG 3.37Å; G306-Q310 PolarHBondContact O-N 3.33Å; A307-Q310 PolarHBondContact O-N 3.02Å; Q310-S312 PolarHBondContact O-N 2.88Å
311L80.3Confident69.2Low87 Ų8751.9 Ų51.946%0.45530%0.301SS..THydrogen-bonded Turntrans-77.9-0.5171.1-71.7166.5000112.9L92 A307 E309 V313L92-L311 HydrophobicContact CD1-CD1 4.27Å; L92-L311 HydrophobicContact CD1-CD2 4.35Å; L92-L311 HydrophobicContact CD1-CG 3.84Å; L92-L311 HydrophobicContact CD2-CD2 3.79Å; L92-L311 HydrophobicContact CD2-CG 4.18Å; A307-L311 WeakPolarHBondContact O-CB 3.41Å; A307-L311 VanDerWaalsContact O-CG 3.31Å; A307-L311 WeakPolarHBondContact O-CG 3.46Å; A307-L311 PolarHBondContact O-N 3.11Å; E309-L311 VanDerWaalsContact C-N 3.33Å; E309-L311 PolarHBondContact O-N 3.36Å; L311-V313 HydrophobicContact CB-CG2 3.85Å; L311-V313 PolarHBondContact O-N 3.26Å
312S70.4Confident67.4Low101 Ų10153.8 Ų53.871%0.70631%0.31SS*.THydrogen-bonded Turntrans5617.4-175.9640000114.8L308 E309 Q310 L314L308-S312 PolarHBondContact O-N 3.4Å; E309-S312 PolarHBondContact O-N 2.98Å; Q310-S312 PolarHBondContact O-N 2.88Å; S312-L314 VanDerWaalsContact C-N 3.32Å
313V66Low65.1Low104 Ų10456.2 Ų56.263%0.6333%0.329SS*.SBendtrans-71.6-34.9177.4175.10000110.2L308 L311L308-V313 HydrophobicContact CD2-CB 4.38Å; L308-V313 HydrophobicContact CD2-CG1 4.34Å; L308-V313 PolarHBondContact O-N 2.95Å; L311-V313 HydrophobicContact CB-CG2 3.85Å; L311-V313 PolarHBondContact O-N 3.26Å
314L60.1Low62.6Low65 Ų6559.4 Ų59.434%0.3436%0.362SS..SBendtrans-122112.4177.5-159.967.4000108.9L308 S312 L316 C333L308-L314 HydrophobicContact CB-CB 4.46Å; L308-L314 PolarHBondContact O-N 3.22Å; S312-L314 VanDerWaalsContact C-N 3.32Å; L314-L316 HydrophobicContact CB-CG 4.45Å; L314-L316 HydrophobicContact CD2-CD1 3.9Å; L314-L316 HydrophobicContact CD2-CD2 3.85Å; L314-L316 HydrophobicContact CD2-CG 3.65Å; L314-L316 HydrophobicContact CG-CD2 4.35Å; L314-L316 HydrophobicContact CG-CG 3.92Å; L314-L316 PolarHBondContact O-N 3.5Å; L314-C333 WeakPolarHBondContact CD2-SG 3.49Å
315S53.9Low59.8Low122 Ų12265.8 Ų65.885%0.85339%0.387SS*.  trans-71.467.5168.8-45.40000109.3
316L53Low57.4Low21 Ų2175.5 Ų75.511%0.1143%0.431CS..  trans-65132.5168-76168.6000107.3L314 E318 L320 P330L314-L316 HydrophobicContact CB-CG 4.45Å; L314-L316 HydrophobicContact CD2-CD1 3.9Å; L314-L316 HydrophobicContact CD2-CD2 3.85Å; L314-L316 HydrophobicContact CD2-CG 3.65Å; L314-L316 HydrophobicContact CG-CD2 4.35Å; L314-L316 HydrophobicContact CG-CG 3.92Å; L314-L316 PolarHBondContact O-N 3.5Å; L316-E318 PolarHBondContact O-N 3.47Å; L316-L320 HydrophobicContact CD1-CD1 3.91Å; L316-L320 HydrophobicContact CD1-CG 4.3Å; L316-P330 HydrophobicContact CD2-CG 4.17Å
317P42.1Very low55.3Low83 Ų8378.5 Ų78.554%0.53945%0.452SS..  trans-54.3133.7171.420.6-28.7000108.2T319P317-T319 WeakPolarHBondContact O-CA 3.21Å; P317-T319 WeakPolarHBondContact O-CB 3.34Å; P317-T319 PolarHBondContact O-N 3.46Å; P317-T319 PolarHBondContact O-OG1 3.23Å
318E44.8Very low53.7Low174 Ų17487.4 Ų87.481%0.81349%0.489SS*.SBendtrans-41.650.8-169.5-65.9-167.3121.800118.1L316L316-E318 PolarHBondContact O-N 3.47Å
319T41.7Very low52.4Low28 Ų2886.8 Ų86.817%0.17249%0.488CS..  trans-14615.4-155.760.60000113.9P317 S327P317-T319 WeakPolarHBondContact O-CA 3.21Å; P317-T319 WeakPolarHBondContact O-CB 3.34Å; P317-T319 PolarHBondContact O-N 3.46Å; P317-T319 PolarHBondContact O-OG1 3.23Å; T319-S327 WeakPolarHBondContact OG1-CB 3.19Å
320L47.3Very low51.6Low18 Ų1887.2 Ų87.29%0.09450%0.495CS..SBendtrans-57.4139.5159.1-85.6165.6000108.4L305 E309 L316 F322 S323L305-L320 HydrophobicContact CB-CD1 4.31Å; L305-L320 HydrophobicContact CB-CD2 4.04Å; L305-L320 WeakPolarHBondContact O-CD1 3.5Å; E309-L320 HydrophobicContact CB-CD1 3.73Å; E309-L320 HydrophobicContact CG-CD1 4.25Å; E309-L320 WeakPolarHBondContact OE2-CD1 3.3Å; L316-L320 HydrophobicContact CD1-CD1 3.91Å; L316-L320 HydrophobicContact CD1-CG 4.3Å; L320-F322 PolarHBondContact O-N 3.02Å; L320-S323 PolarHBondContact O-N 2.92Å
321P44.6Very low51.3Low72 Ų7291.3 Ų91.347%0.46852%0.522SS..THydrogen-bonded Turntrans-62.80.7-152.622.1-33.9000116.2
322F49.9Very low51Low45 Ų4592.2 Ų92.220%0.19753%0.532CS..THydrogen-bonded Turntrans-89-4.1-179.7-56.7-68.3000113.8L76 D225 L320L76-F322 WeakPolarHBondContact O-CD1 3.48Å; D225-F322 WeakPolarHBondContact OD2-CE1 3.43Å; L320-F322 PolarHBondContact O-N 3.02Å
323S37.5Very low51.4Low73 Ų7388.3 Ų88.351%0.5150%0.504SS..SBendtrans-127.783.6173.6-163.50000111.8L320 K325L320-S323 PolarHBondContact O-N 2.92Å; S323-K325 VanDerWaalsContact C-N 3.31Å; S323-K325 PolarHBondContact O-N 3.39Å
324G34.8Very low52.1Low69 Ų6986.4 Ų86.471%0.71149%0.486SS*.SBendtrans59.2-6.4143.900000122.7
325K30.5Very low53.2Low171 Ų17184.5 Ų84.574%0.74348%0.482SS*.  trans-145.8118.2177.6-70.4-175.4-178.9170.90112.5S323 S327S323-K325 VanDerWaalsContact C-N 3.31Å; S323-K325 PolarHBondContact O-N 3.39Å; K325-S327 VanDerWaalsContact C-N 3.35Å; K325-S327 PolarHBondContact O-N 3.27Å
326H36.5Very low54.8Low203 Ų20383.5 Ų83.594%0.9447%0.47SS*.  trans-65.171.9-179.3-75-80.7000114.6
327S40.3Very low56.4Low66 Ų6683.1 Ų83.146%0.46247%0.468SS..PPolyproline II helixtrans-98.9118.9160.9-74.10000109.3T319 K325T319-S327 WeakPolarHBondContact OG1-CB 3.19Å; K325-S327 VanDerWaalsContact C-N 3.35Å; K325-S327 PolarHBondContact O-N 3.27Å
328K51.9Low58.6Low196 Ų19679.1 Ų79.185%0.85244%0.443SS*.PPolyproline II helixtrans-59.2135.2172.3-65.1176.6-178.2174.30107.9
329P56.8Low60.7Low36 Ų3676.8 Ų76.823%0.23443%0.43CS..PPolyproline II helixtrans-55.1147.3171.824.2-32.9000109.2V331 W334P329-V331 PolarHBondContact O-N 2.8Å; P329-W334 HydrophobicContact CG-CE3 3.52Å; P329-W334 HydrophobicContact CG-CZ3 3.89Å
330P64.6Low63.1Low56 Ų5678 Ų7836%0.36444%0.442SS..PPolyproline II helixtrans-55.5132.7179.519.7-28.1000109.6L316 T332 C333 W334L316-P330 HydrophobicContact CD2-CG 4.17Å; P330-T332 PolarHBondContact O-N 3.37Å; P330-C333 HydrophobicContact CG-CB 3.83Å; P330-C333 WeakPolarHBondContact O-CB 3.23Å; P330-C333 PolarHBondContact O-N 3.25Å; P330-W334 PolarHBondContact O-N 3.38Å; P330-W334 VanDerWaalsContact O-N 3.07Å
331V71.2Confident65.2Low127 Ų12777.7 Ų77.777%0.7744%0.441SS*.Hα-helixtrans-54.4-32.5-173.81790000111.6P329 W334 G335P329-V331 PolarHBondContact O-N 2.8Å; V331-W334 PolarHBondContact O-N 3.4Å; V331-G335 PolarHBondContact O-N 2.99Å
332T73.5Confident67.4Low107 Ų10774.5 Ų74.566%0.65642%0.42SS*.Hα-helixtrans-64.6-48.7176.150.50000112.3P330 W334 G335 V336P330-T332 PolarHBondContact O-N 3.37Å; T332-W334 VanDerWaalsContact C-N 3.32Å; T332-W334 PolarHBondContact O-N 3.3Å; T332-G335 PolarHBondContact O-N 3.42Å; T332-V336 WeakPolarHBondContact O-CB 3.3Å; T332-V336 VanDerWaalsContact O-CG2 3.23Å; T332-V336 WeakPolarHBondContact O-CG2 3.43Å; T332-V336 PolarHBondContact O-N 3.39Å
333C79.1Confident69.4Low18 Ų1877.3 Ų77.312%0.12243%0.433CS..Hα-helixtrans-61.6-43.9176.2177.70000110.9L305 L314 P330 G335 V336 T337L305-C333 WeakPolarHBondContact CD2-SG 3.44Å; L314-C333 WeakPolarHBondContact CD2-SG 3.49Å; P330-C333 HydrophobicContact CG-CB 3.83Å; P330-C333 WeakPolarHBondContact O-CB 3.23Å; P330-C333 PolarHBondContact O-N 3.25Å; C333-G335 PolarHBondContact O-N 3.04Å; C333-V336 PolarHBondContact O-N 3.08Å; C333-T337 WeakPolarHBondContact O-CB 3.46Å; C333-T337 PolarHBondContact O-N 3.26Å; C333-T337 PolarHBondContact O-OG1 3.38Å; C333-T337 VanDerWaalsContact O-OG1 3.04Å
334W79.3Confident71.9Confident65 Ų6578 Ų7825%0.24643%0.43CS..Hα-helixtrans-57.3-46.9176.3-174.2-92.2000112.7F298 R301 L305 P329 P330 V331 T332 T338F298-W334 AromaticContact CE2-CH2 3.95Å; F298-W334 HydrophobicContact CE2-CH2 3.95Å; F298-W334 HydrophobicContact CE2-CZ2 4.45Å; R301-W334 VanDerWaalsContact NH1-CE2 3.34Å; R301-W334 VanDerWaalsContact NH1-NE1 3.16Å; R301-W334 VanDerWaalsContact NH2-CH2 3.33Å; L305-W334 HydrophobicContact CD1-CE3 4.35Å; P329-W334 HydrophobicContact CG-CE3 3.52Å; P329-W334 HydrophobicContact CG-CZ3 3.89Å; P330-W334 PolarHBondContact O-N 3.38Å; P330-W334 VanDerWaalsContact O-N 3.07Å; V331-W334 PolarHBondContact O-N 3.4Å; T332-W334 VanDerWaalsContact C-N 3.32Å; T332-W334 PolarHBondContact O-N 3.3Å; W334-T338 WeakPolarHBondContact O-CB 3.41Å; W334-T338 PolarHBondContact O-N 3.42Å; W334-T338 VanDerWaalsContact O-N 3.14Å; W334-T338 PolarHBondContact O-OG1 2.85Å
335G84Confident74.6Confident25 Ų2574.7 Ų74.726%0.25840%0.396SS..Hα-helixtrans-66.6-47.217800000112.8V331 T332 C333 T338 F339V331-G335 PolarHBondContact O-N 2.99Å; T332-G335 PolarHBondContact O-N 3.42Å; C333-G335 PolarHBondContact O-N 3.04Å; G335-T338 WeakPolarHBondContact O-CB 3.46Å; G335-T338 PolarHBondContact O-N 2.92Å; G335-F339 WeakPolarHBondContact O-CB 3.5Å; G335-F339 PolarHBondContact O-N 3.43Å
336V86.7Confident77.5Confident100 Ų10066.5 Ų66.561%0.60636%0.36SS*.Hα-helixtrans-63.5-46.6-178.9171.40000111.3T332 C333 T338 F339 A340T332-V336 WeakPolarHBondContact O-CB 3.3Å; T332-V336 VanDerWaalsContact O-CG2 3.23Å; T332-V336 WeakPolarHBondContact O-CG2 3.43Å; T332-V336 PolarHBondContact O-N 3.39Å; C333-V336 PolarHBondContact O-N 3.08Å; V336-T338 VanDerWaalsContact C-N 3.32Å; V336-T338 PolarHBondContact O-N 3.21Å; V336-F339 PolarHBondContact O-N 2.87Å; V336-A340 WeakPolarHBondContact O-CB 3.23Å; V336-A340 PolarHBondContact O-N 2.95Å
337T86.1Confident80Confident13 Ų1360.5 Ų60.58%0.0834%0.335CS..Hα-helixtrans-63-40.4177.2-58.30000111.3R301 V304 L305 C333 A340 I341R301-T337 HydrophobicContact CG-CG2 4.07Å; V304-T337 HydrophobicContact CB-CG2 4.33Å; V304-T337 HydrophobicContact CG1-CG2 3.84Å; L305-T337 HydrophobicContact CD2-CG2 4.22Å; L305-T337 HydrophobicContact CG-CG2 4.34Å; C333-T337 WeakPolarHBondContact O-CB 3.46Å; C333-T337 PolarHBondContact O-N 3.26Å; C333-T337 PolarHBondContact O-OG1 3.38Å; C333-T337 VanDerWaalsContact O-OG1 3.04Å; T337-A340 PolarHBondContact O-N 3.04Å; T337-I341 HydrophobicContact CG2-CD1 3.74Å; T337-I341 HydrophobicContact CG2-CG1 4.35Å; T337-I341 WeakPolarHBondContact O-CB 3.44Å; T337-I341 VanDerWaalsContact O-CG1 3.22Å; T337-I341 WeakPolarHBondContact O-CG1 3.33Å; T337-I341 PolarHBondContact O-N 3.1Å
338T88.6Confident82.2Confident0 Ų060 Ų600%033%0.327CS..Hα-helixtrans-60.6-50.8175.2-58.90000111L150 L154 L297 R301 W334 G335 V336 A340 I341 V342L150-T338 HydrophobicContact CD1-CG2 4.36Å; L154-T338 HydrophobicContact CD2-CG2 3.86Å; L154-T338 HydrophobicContact CG-CG2 4.44Å; L297-T338 HydrophobicContact CD2-CG2 3.6Å; R301-T338 WeakPolarHBondContact CD-OG1 3.3Å; R301-T338 PolarHBondContact NH1-OG1 2.84Å; W334-T338 WeakPolarHBondContact O-CB 3.41Å; W334-T338 PolarHBondContact O-N 3.42Å; W334-T338 VanDerWaalsContact O-N 3.14Å; W334-T338 PolarHBondContact O-OG1 2.85Å; G335-T338 WeakPolarHBondContact O-CB 3.46Å; G335-T338 PolarHBondContact O-N 2.92Å; V336-T338 VanDerWaalsContact C-N 3.32Å; V336-T338 PolarHBondContact O-N 3.21Å; T338-A340 VanDerWaalsContact C-N 3.34Å; T338-A340 PolarHBondContact O-N 3.13Å; T338-I341 PolarHBondContact O-N 3.49Å; T338-V342 HydrophobicContact CG2-CG2 4.27Å; T338-V342 WeakPolarHBondContact O-CB 3.41Å; T338-V342 WeakPolarHBondContact O-CG2 3.32Å; T338-V342 PolarHBondContact O-N 3.23Å
339F89.8Confident83.9Confident125 Ų12550.7 Ų50.755%0.54829%0.286SS..Hα-helixtrans-60.3-44179.7-175.1-95000111.9L150 G335 V336 V342 F343L150-F339 HydrophobicContact CD1-CD2 4.48Å; L150-F339 HydrophobicContact CD2-CD2 4.35Å; G335-F339 WeakPolarHBondContact O-CB 3.5Å; G335-F339 PolarHBondContact O-N 3.43Å; V336-F339 PolarHBondContact O-N 2.87Å; F339-V342 PolarHBondContact O-N 2.91Å; F339-F343 WeakPolarHBondContact O-CB 3.43Å; F339-F343 PolarHBondContact O-N 3.49Å
340A91.1Very high85.3Confident52 Ų5249.9 Ų49.943%0.4328%0.28SS..Hα-helixtrans-62.2-47.4178.400000112.3V336 T337 T338 L344V336-A340 WeakPolarHBondContact O-CB 3.23Å; V336-A340 PolarHBondContact O-N 2.95Å; T337-A340 PolarHBondContact O-N 3.04Å; T338-A340 VanDerWaalsContact C-N 3.34Å; T338-A340 PolarHBondContact O-N 3.13Å; A340-L344 VanDerWaalsContact O-CB 3.27Å; A340-L344 WeakPolarHBondContact O-CB 3.33Å; A340-L344 PolarHBondContact O-N 3.05Å
341I91.7Very high86.1Confident13 Ų1349.5 Ų49.57%0.06728%0.277CS..Hα-helixtrans-61.9-47.9177.9-66.4167.7000110.2F103 M106 L297 R301 V304 T337 T338 L344 S345F103-I341 HydrophobicContact CD2-CG2 3.97Å; F103-I341 HydrophobicContact CE2-CG2 4.34Å; M106-I341 HydrophobicContact CE-CG2 3.9Å; M106-I341 HydrophobicContact SD-CG2 4.26Å; L297-I341 HydrophobicContact CD1-CB 3.92Å; L297-I341 HydrophobicContact CD1-CD1 4.36Å; L297-I341 HydrophobicContact CD1-CG2 3.51Å; R301-I341 HydrophobicContact CB-CD1 4.21Å; V304-I341 HydrophobicContact CB-CD1 4.31Å; V304-I341 HydrophobicContact CG2-CD1 3.99Å; V304-I341 HydrophobicContact CG2-CG1 4.47Å; T337-I341 HydrophobicContact CG2-CD1 3.74Å; T337-I341 HydrophobicContact CG2-CG1 4.35Å; T337-I341 WeakPolarHBondContact O-CB 3.44Å; T337-I341 VanDerWaalsContact O-CG1 3.22Å; T337-I341 WeakPolarHBondContact O-CG1 3.33Å; T337-I341 PolarHBondContact O-N 3.1Å; T338-I341 PolarHBondContact O-N 3.49Å; I341-L344 PolarHBondContact O-N 2.95Å; I341-S345 WeakPolarHBondContact O-CB 3.3Å; I341-S345 PolarHBondContact O-N 2.95Å; I341-S345 PolarHBondContact O-OG 3.02Å
342V92.3Very high86.3Confident4 Ų443.9 Ų43.92%0.02424%0.243CC..Hα-helixtrans-63.2-48.2-177.9172.80000111T145 L150 Y293 L297 T338 F339 S345 A346T145-V342 HydrophobicContact CG2-CG1 3.17Å; L150-V342 HydrophobicContact CB-CG1 4.44Å; L150-V342 HydrophobicContact CD1-CB 4.26Å; L150-V342 HydrophobicContact CD1-CG1 4.16Å; L150-V342 HydrophobicContact CD1-CG2 4.24Å; Y293-V342 HydrophobicContact CE1-CG2 4.11Å; L297-V342 HydrophobicContact CD1-CG2 4.01Å; L297-V342 HydrophobicContact CD2-CG2 4.39Å; T338-V342 HydrophobicContact CG2-CG2 4.27Å; T338-V342 WeakPolarHBondContact O-CB 3.41Å; T338-V342 WeakPolarHBondContact O-CG2 3.32Å; T338-V342 PolarHBondContact O-N 3.23Å; F339-V342 PolarHBondContact O-N 2.91Å; V342-S345 PolarHBondContact O-N 2.66Å; V342-S345 PolarHBondContact O-OG 2.75Å; V342-A346 PolarHBondContact O-N 3.23Å
343F90.8Very high86.3Confident105 Ų10540 Ų4046%0.46122%0.22SC..Hα-helixtrans-61.9-46.6178.7-178.4-98000112.4F142 F339 S345 A346 L347F142-F343 HydrophobicContact CE1-CD2 4.48Å; F142-F343 HydrophobicContact CE1-CE2 4.24Å; F339-F343 WeakPolarHBondContact O-CB 3.43Å; F339-F343 PolarHBondContact O-N 3.49Å; F343-S345 VanDerWaalsContact C-N 3.32Å; F343-S345 PolarHBondContact O-N 3.27Å; F343-A346 PolarHBondContact O-N 3.45Å; F343-L347 PolarHBondContact O-N 3.16Å
344L91.1Very high86Confident86 Ų8641.1 Ų41.145%0.4523%0.225SC..Hα-helixtrans-65.2-37.6178.7-169.366.6000111.6F103 A340 I341 A346 L347 L348F103-L344 HydrophobicContact CE1-CD2 4.44Å; F103-L344 HydrophobicContact CE2-CB 4.12Å; F103-L344 HydrophobicContact CE2-CD2 4.28Å; F103-L344 HydrophobicContact CE2-CG 4.28Å; F103-L344 HydrophobicContact CZ-CB 3.98Å; F103-L344 HydrophobicContact CZ-CD2 3.79Å; F103-L344 HydrophobicContact CZ-CG 3.68Å; A340-L344 VanDerWaalsContact O-CB 3.27Å; A340-L344 WeakPolarHBondContact O-CB 3.33Å; A340-L344 PolarHBondContact O-N 3.05Å; I341-L344 PolarHBondContact O-N 2.95Å; L344-A346 VanDerWaalsContact C-N 3.35Å; L344-L347 PolarHBondContact O-N 2.92Å; L344-L348 PolarHBondContact O-N 2.97Å
345S91.3Very high85.7Confident0 Ų038.9 Ų38.90%022%0.218CC..Hα-helixtrans-65.6-37.7176.4700000112.3L110 Y293 I341 V342 F343 A349L110-S345 VanDerWaalsContact CD1-OG 3.3Å; L110-S345 WeakPolarHBondContact CD1-OG 3.47Å; Y293-S345 PolarHBondContact OH-OG 3.37Å; I341-S345 WeakPolarHBondContact O-CB 3.3Å; I341-S345 PolarHBondContact O-N 2.95Å; I341-S345 PolarHBondContact O-OG 3.02Å; V342-S345 PolarHBondContact O-N 2.66Å; V342-S345 PolarHBondContact O-OG 2.75Å; F343-S345 VanDerWaalsContact C-N 3.32Å; F343-S345 PolarHBondContact O-N 3.27Å; S345-A349 WeakPolarHBondContact O-CB 3.38Å; S345-A349 PolarHBondContact O-N 3.33Å
346A91Very high85.1Confident0 Ų040.6 Ų40.60%022%0.22CC..Hα-helixtrans-69.6-40.117600000112L110 V141 F142 T145 V342 F343 L344 A349 V350L110-A346 HydrophobicContact CD1-CB 3.99Å; V141-A346 HydrophobicContact CG1-CB 4.3Å; F142-A346 HydrophobicContact CE1-CB 4.36Å; T145-A346 HydrophobicContact CG2-CB 4.04Å; V342-A346 PolarHBondContact O-N 3.23Å; F343-A346 PolarHBondContact O-N 3.45Å; L344-A346 VanDerWaalsContact C-N 3.35Å; A346-A349 PolarHBondContact O-N 2.88Å; A346-V350 WeakPolarHBondContact O-CG2 3.27Å; A346-V350 PolarHBondContact O-N 3.33Å; A346-V350 VanDerWaalsContact O-N 3.1Å
347L88.9Confident84.5Confident76 Ų7637.5 Ų37.540%0.39820%0.198SC..Hα-helixtrans-60-47.3175.8-17762.2000111.1F343 L344 V350 V351F343-L347 PolarHBondContact O-N 3.16Å; L344-L347 PolarHBondContact O-N 2.92Å; L347-V350 PolarHBondContact O-N 3.5Å; L347-V351 WeakPolarHBondContact O-CG2 3.34Å; L347-V351 PolarHBondContact O-N 2.96Å
348L86.6Confident83.9Confident57 Ų5737.6 Ų37.630%0.29820%0.198SC..Hα-helixtrans-67.7-35.6177.7-72.2173.9000113.1F103 V107 L344 V350 V351 S352F103-L348 HydrophobicContact CE1-CD1 3.33Å; F103-L348 HydrophobicContact CZ-CD1 3.64Å; V107-L348 HydrophobicContact CG1-CB 4.08Å; V107-L348 HydrophobicContact CG2-CB 4.01Å; V107-L348 HydrophobicContact CG2-CD1 4.37Å; L344-L348 PolarHBondContact O-N 2.97Å; L348-V350 PolarHBondContact O-N 3.29Å; L348-V351 PolarHBondContact O-N 2.85Å; L348-S352 WeakPolarHBondContact O-CB 3.21Å; L348-S352 PolarHBondContact O-N 3.48Å
349A87.3Confident83.2Confident0 Ų039.3 Ų39.30%021%0.207CC..Hα-helixtrans-64.8-26.6175.600000112.5V107 L110 N111 Y137 V141 S345 A346V107-A349 HydrophobicContact CG1-CB 4Å; L110-A349 HydrophobicContact CB-CB 3.74Å; N111-A349 HydrophobicContact CB-CB 4.4Å; Y137-A349 PolarHBondContact OH-O 3.21Å; V141-A349 HydrophobicContact CG1-CB 4.35Å; S345-A349 WeakPolarHBondContact O-CB 3.38Å; S345-A349 PolarHBondContact O-N 3.33Å; A346-A349 PolarHBondContact O-N 2.88Å
350V86.3Confident82.6Confident18 Ų1833.7 Ų33.711%0.10918%0.184CC..Hα-helixtrans-78.7-42.4174169.10000111.5I133 V138 V141 F142 A346 L347 L348I133-V350 WeakPolarHBondContact CD1-O 3.23Å; V138-V350 HydrophobicContact CB-CG1 4.44Å; V138-V350 HydrophobicContact CG1-CG1 4.14Å; V138-V350 HydrophobicContact CG1-CG2 4.15Å; V138-V350 HydrophobicContact CG2-CG1 3.73Å; V141-V350 HydrophobicContact CB-CG2 4.23Å; V141-V350 HydrophobicContact CG1-CG2 4.16Å; F142-V350 HydrophobicContact CD2-CG2 4.48Å; F142-V350 HydrophobicContact CE2-CG2 4.09Å; A346-V350 WeakPolarHBondContact O-CG2 3.27Å; A346-V350 PolarHBondContact O-N 3.33Å; A346-V350 VanDerWaalsContact O-N 3.1Å; L347-V350 PolarHBondContact O-N 3.5Å; L348-V350 PolarHBondContact O-N 3.29Å
351V81.6Confident81.9Confident48 Ų4831.8 Ų31.829%0.29117%0.167SC..Hα-helixtrans-68.5-38.2179.8174.10000111.6L347 L348 P353L347-V351 WeakPolarHBondContact O-CG2 3.34Å; L347-V351 PolarHBondContact O-N 2.96Å; L348-V351 PolarHBondContact O-N 2.85Å; V351-P353 WeakPolarHBondContact O-CD 3.26Å
352S75.8Confident81.5Confident9 Ų932.5 Ų32.56%0.06317%0.172CC..  trans-117.290.8-175.9-173.70000111.3N111 L348 N354 I358 E587N111-S352 PolarHBondContact ND2-O 2.9Å; L348-S352 WeakPolarHBondContact O-CB 3.21Å; L348-S352 PolarHBondContact O-N 3.48Å; S352-N354 PolarHBondContact O-N 3.35Å; S352-I358 WeakPolarHBondContact O-CD1 3.19Å; S352-I358 WeakPolarHBondContact OG-CD1 3.48Å; S352-I358 WeakPolarHBondContact OG-CG1 3.42Å; S352-E587 VanDerWaalsContact CA-OE1 3.3Å; S352-E587 WeakPolarHBondContact CA-OE1 3.23Å; S352-E587 WeakPolarHBondContact CB-OE1 3.29Å; S352-E587 WeakPolarHBondContact CB-OE2 3.37Å; S352-E587 PolarHBondContact OG-OE1 3.43Å; S352-E587 PolarHBondContact OG-OE2 3.06Å
353P73.2Confident80.9Confident26 Ų2632.5 Ų32.517%0.16917%0.173CC..  trans-79.52.7178.232.2-34.4000113.3N111 V351 V355N111-P353 VanDerWaalsContact ND2-CA 3.26Å; N111-P353 WeakPolarHBondContact ND2-CA 3.38Å; N111-P353 PolarHBondContact ND2-O 2.85Å; N111-P353 PolarHBondContact OD1-O 2.75Å; V351-P353 WeakPolarHBondContact O-CD 3.26Å; P353-V355 PolarHBondContact O-N 3.39Å
354N73.1Confident80.4Confident41 Ų4127.5 Ų27.522%0.21915%0.151CC..  trans-9491.9-179.3-58.7-60000112.1S352 E356 F357 I358 E587S352-N354 PolarHBondContact O-N 3.35Å; N354-E356 VanDerWaalsContact C-N 3.28Å; N354-E356 PolarHBondContact O-N 2.82Å; N354-F357 HydrophobicContact CB-CB 3.9Å; N354-F357 PolarHBondContact O-N 3.35Å; N354-I358 WeakPolarHBondContact O-CG1 3.45Å; N354-I358 PolarHBondContact O-N 3.38Å; N354-E587 PolarHBondContact ND2-OE1 3.17Å
355V72.6Confident80Confident18 Ų1823.8 Ų23.811%0.10913%0.132CC..Hα-helixtrans-56.1-41.7-177.7-177.60000112.1V21 A108 N111 V112 P353 F357 I358 L359V21-V355 HydrophobicContact CG1-CG1 3.68Å; A108-V355 HydrophobicContact CB-CG1 4.09Å; N111-V355 HydrophobicContact CB-CG2 3.94Å; N111-V355 VanDerWaalsContact ND2-CG2 3.26Å; N111-V355 WeakPolarHBondContact ND2-CG2 3.34Å; N111-V355 PolarHBondContact ND2-N 3.4Å; V112-V355 HydrophobicContact CG2-CG1 3.98Å; V112-V355 HydrophobicContact CG2-CG2 3.74Å; P353-V355 PolarHBondContact O-N 3.39Å; V355-F357 PolarHBondContact O-N 3.07Å; V355-I358 PolarHBondContact O-N 3.44Å; V355-L359 HydrophobicContact CG1-CD1 3.71Å; V355-L359 HydrophobicContact CG1-CG 4.22Å; V355-L359 WeakPolarHBondContact O-CB 3.16Å; V355-L359 VanDerWaalsContact O-CG 3.27Å; V355-L359 WeakPolarHBondContact O-CG 3.3Å; V355-L359 PolarHBondContact O-N 3.35Å
356E71.3Confident79.8Confident62 Ų6224 Ų2429%0.2913%0.133SC..Hα-helixtrans-64.4-40.7-178.5-59.3-173.3124.100112.6F28 G266 N354 L359 G360F28-E356 WeakPolarHBondContact CD1-OE1 3.26Å; F28-E356 WeakPolarHBondContact CE1-OE1 3.31Å; F28-E356 WeakPolarHBondContact CG-OE1 3.24Å; G266-E356 WeakPolarHBondContact CA-OE1 3.4Å; N354-E356 VanDerWaalsContact C-N 3.28Å; N354-E356 PolarHBondContact O-N 2.82Å; E356-L359 PolarHBondContact O-N 2.92Å; E356-G360 WeakPolarHBondContact O-CA 3.24Å; E356-G360 PolarHBondContact O-N 2.79Å
357F73.4Confident79.6Confident35 Ų3524 Ų2415%0.15413%0.134CC..Hα-helixtrans-64.7-47.6179.2178.5-108.7000110.6N354 V355 L359 G360 L361 V412 A583N354-F357 HydrophobicContact CB-CB 3.9Å; N354-F357 PolarHBondContact O-N 3.35Å; V355-F357 PolarHBondContact O-N 3.07Å; F357-L359 PolarHBondContact O-N 3.34Å; F357-G360 PolarHBondContact O-N 3Å; F357-L361 VanDerWaalsContact O-CB 3.25Å; F357-L361 WeakPolarHBondContact O-CB 3.15Å; F357-L361 PolarHBondContact O-N 2.92Å; F357-V412 HydrophobicContact CD2-CG1 4.12Å; F357-V412 HydrophobicContact CE2-CG1 3.74Å; F357-A583 HydrophobicContact CE1-CB 3.79Å; F357-A583 HydrophobicContact CZ-CB 3.49Å; F357-A583 VanDerWaalsContact CZ-CB 3.49Å
358I74Confident79.6Confident14 Ų1420.5 Ų20.57%0.07212%0.116CC..Hα-helixtrans-61.5-46.4177.6-59.5172.8000110.6V107 S352 N354 V355 C362V107-I358 HydrophobicContact CB-CG2 4.42Å; V107-I358 HydrophobicContact CG1-CD1 3.61Å; V107-I358 HydrophobicContact CG1-CG2 4.35Å; S352-I358 WeakPolarHBondContact O-CD1 3.19Å; S352-I358 WeakPolarHBondContact OG-CD1 3.48Å; S352-I358 WeakPolarHBondContact OG-CG1 3.42Å; N354-I358 WeakPolarHBondContact O-CG1 3.45Å; N354-I358 PolarHBondContact O-N 3.38Å; V355-I358 PolarHBondContact O-N 3.44Å; I358-C362 WeakPolarHBondContact O-CB 3.38Å; I358-C362 PolarHBondContact O-N 3.26Å; I358-C362 PolarHBondContact O-SG 3.03Å; I358-C362 VanDerWaalsContact O-SG 3.34Å
359L75Confident79.8Confident36 Ų3618 Ų1819%0.18810%0.103CC..Hα-helixtrans-66.2-40178.6-71.6176.7000112.3V21 A108 V355 E356 F357 G363V21-L359 HydrophobicContact CG1-CD1 3.94Å; A108-L359 HydrophobicContact CB-CD1 4.42Å; A108-L359 HydrophobicContact CB-CD2 3.65Å; A108-L359 HydrophobicContact CB-CG 3.91Å; V355-L359 HydrophobicContact CG1-CD1 3.71Å; V355-L359 HydrophobicContact CG1-CG 4.22Å; V355-L359 WeakPolarHBondContact O-CB 3.16Å; V355-L359 VanDerWaalsContact O-CG 3.27Å; V355-L359 WeakPolarHBondContact O-CG 3.3Å; V355-L359 PolarHBondContact O-N 3.35Å; E356-L359 PolarHBondContact O-N 2.92Å; F357-L359 PolarHBondContact O-N 3.34Å; L359-G363 WeakPolarHBondContact O-CA 3.03Å; L359-G363 PolarHBondContact O-N 2.86Å
360G75.6Confident79.9Confident7 Ų718.2 Ų18.27%0.07211%0.105CC..Hα-helixtrans-64.2-47.2176.600000111.8E356 F357 S364E356-G360 WeakPolarHBondContact O-CA 3.24Å; E356-G360 PolarHBondContact O-N 2.79Å; F357-G360 PolarHBondContact O-N 3Å; G360-S364 WeakPolarHBondContact O-CB 3.29Å; G360-S364 PolarHBondContact O-N 2.71Å; G360-S364 PolarHBondContact O-OG 3.43Å
361L77.5Confident80.1Confident13 Ų1317.4 Ų17.47%0.06810%0.099CC..Hα-helixtrans-67.9-50.8178.5-17471.5000112F357 S364 L365 V412 V580 A583F357-L361 VanDerWaalsContact O-CB 3.25Å; F357-L361 WeakPolarHBondContact O-CB 3.15Å; F357-L361 PolarHBondContact O-N 2.92Å; L361-S364 WeakPolarHBondContact CA-OG 3.28Å; L361-S364 PolarHBondContact O-N 3.39Å; L361-S364 PolarHBondContact O-OG 2.94Å; L361-L365 HydrophobicContact CD1-CD1 3.62Å; L361-L365 HydrophobicContact CG-CD1 4.04Å; L361-L365 WeakPolarHBondContact O-CB 3.47Å; L361-L365 PolarHBondContact O-N 3.48Å; L361-V412 HydrophobicContact CB-CG1 4.16Å; L361-V412 HydrophobicContact CD1-CG1 3.9Å; L361-V580 HydrophobicContact CD2-CG2 4.4Å; L361-A583 HydrophobicContact CD1-CB 4.38Å; L361-A583 HydrophobicContact CD2-CB 3.43Å; L361-A583 VanDerWaalsContact CD2-CB 3.43Å
362C82.6Confident80.6Confident27 Ų2715.1 Ų15.118%0.1829%0.086CC..Hα-helixtrans-68-38.5-179.8-67.50000111.8I358 A366 G367I358-C362 WeakPolarHBondContact O-CB 3.38Å; I358-C362 PolarHBondContact O-N 3.26Å; I358-C362 PolarHBondContact O-SG 3.03Å; I358-C362 VanDerWaalsContact O-SG 3.34Å; C362-A366 WeakPolarHBondContact O-CA 3.36Å; C362-A366 WeakPolarHBondContact O-CB 3.35Å; C362-A366 PolarHBondContact O-N 3.41Å; C362-G367 PolarHBondContact O-N 3.44Å
363G79.5Confident81.3Confident4 Ų414.7 Ų14.74%0.0418%0.083CC..Iπ-helixtrans-67.6-40.7176.300000112.7L359 G367 S368L359-G363 WeakPolarHBondContact O-CA 3.03Å; L359-G363 PolarHBondContact O-N 2.86Å; G363-G367 CarbonylContact O-C 3.36Å; G363-G367 VanDerWaalsContact O-CA 3.23Å; G363-G367 WeakPolarHBondContact O-CA 3.3Å; G363-G367 PolarHBondContact O-N 3.14Å; G363-S368 PolarHBondContact O-N 3Å
364S80.3Confident82.1Confident1 Ų113.5 Ų13.51%0.0078%0.075CC..Iπ-helixtrans-68.5-42178.556.80000113.5G360 L361 S368G360-S364 WeakPolarHBondContact O-CB 3.29Å; G360-S364 PolarHBondContact O-N 2.71Å; G360-S364 PolarHBondContact O-OG 3.43Å; L361-S364 WeakPolarHBondContact CA-OG 3.28Å; L361-S364 PolarHBondContact O-N 3.39Å; L361-S364 PolarHBondContact O-OG 2.94Å; S364-S368 WeakPolarHBondContact O-CB 3.49Å; S364-S368 PolarHBondContact O-OG 3.38Å
365L83.6Confident83Confident8 Ų811.6 Ų11.64%0.0427%0.065CC..Iπ-helixtrans-90.9-67.4-175.4-63.6168.9000111.6L361 S368 A369 M405 V575 M576 S579L361-L365 HydrophobicContact CD1-CD1 3.62Å; L361-L365 HydrophobicContact CG-CD1 4.04Å; L361-L365 WeakPolarHBondContact O-CB 3.47Å; L361-L365 PolarHBondContact O-N 3.48Å; L365-S368 PolarHBondContact O-OG 3.47Å; L365-A369 WeakPolarHBondContact O-CB 3.05Å; L365-A369 PolarHBondContact O-N 3.22Å; L365-M405 HydrophobicContact CD2-CG 4.4Å; L365-V575 HydrophobicContact CD2-CG1 4.31Å; L365-M576 HydrophobicContact CB-CE 4.34Å; L365-S579 VanDerWaalsContact CD1-CB 3.47Å
366A86.2Confident83.8Confident3 Ų310.7 Ų10.73%0.0256%0.059CC..Iπ-helixtrans-74.7-42-175.800000111.2C100 F101 C362 A369 V370 M576C100-A366 HydrophobicContact CB-CB 4.17Å; F101-A366 HydrophobicContact CB-CB 3.7Å; C362-A366 WeakPolarHBondContact O-CA 3.36Å; C362-A366 WeakPolarHBondContact O-CB 3.35Å; C362-A366 PolarHBondContact O-N 3.41Å; A366-A369 PolarHBondContact O-N 2.96Å; A366-V370 WeakPolarHBondContact O-CB 3.38Å; A366-V370 VanDerWaalsContact O-CG2 3.29Å; A366-V370 WeakPolarHBondContact O-CG2 3.27Å; A366-V370 PolarHBondContact O-N 2.59Å; A366-M576 HydrophobicContact CB-CE 3.5Å
367G88Confident84.7Confident2 Ų28 Ų82%0.0215%0.047CC..Iπ-helixtrans-66.1-43.4-17800000113.2F101 L215 C362 G363 A369 G371F101-G367 VanDerWaalsContact CD2-CA 3.46Å; L215-G367 WeakPolarHBondContact CD2-O 3.22Å; C362-G367 PolarHBondContact O-N 3.44Å; G363-G367 CarbonylContact O-C 3.36Å; G363-G367 VanDerWaalsContact O-CA 3.23Å; G363-G367 WeakPolarHBondContact O-CA 3.3Å; G363-G367 PolarHBondContact O-N 3.14Å; G367-A369 VanDerWaalsContact C-N 3.32Å; G367-A369 PolarHBondContact O-N 3.31Å; G367-G371 VanDerWaalsContact O-CA 3.23Å; G367-G371 WeakPolarHBondContact O-CA 3.12Å; G367-G371 PolarHBondContact O-N 3.18Å
368S88.6Confident85.4Confident2 Ų26.3 Ų6.31%0.0144%0.04CC..Hα-helixtrans-64.1-39.5176.371.70000111.8G363 S364 L365 Y372 I373 M405G363-S368 PolarHBondContact O-N 3Å; S364-S368 WeakPolarHBondContact O-CB 3.49Å; S364-S368 PolarHBondContact O-OG 3.38Å; L365-S368 PolarHBondContact O-OG 3.47Å; S368-Y372 PolarHBondContact O-N 3.05Å; S368-I373 PolarHBondContact O-N 2.6Å; S368-M405 WeakPolarHBondContact OG-CB 3.38Å
369A89.4Confident86.1Confident3 Ų35.8 Ų5.83%0.0254%0.036CC..Iπ-helixtrans-67.1-56.3-179.900000111.4L97 L365 A366 G367 G371 I373 L374L97-A369 HydrophobicContact CD1-CB 3.88Å; L365-A369 WeakPolarHBondContact O-CB 3.05Å; L365-A369 PolarHBondContact O-N 3.22Å; A366-A369 PolarHBondContact O-N 2.96Å; G367-A369 VanDerWaalsContact C-N 3.32Å; G367-A369 PolarHBondContact O-N 3.31Å; A369-G371 VanDerWaalsContact C-N 3.29Å; A369-G371 PolarHBondContact O-N 3.41Å; A369-I373 HydrophobicContact CB-CD1 4.44Å; A369-I373 PolarHBondContact O-N 3.22Å; A369-L374 WeakPolarHBondContact O-CB 3.28Å; A369-L374 VanDerWaalsContact O-CG 3.28Å; A369-L374 WeakPolarHBondContact O-CG 3.24Å; A369-L374 PolarHBondContact O-N 2.87Å
370V90.7Very high86.7Confident6 Ų64.7 Ų4.74%0.0363%0.031CC..Iπ-helixtrans-64.3-37.3178.8170.10000111.8L97 N98 L215 P218 A366 L374 P375L97-V370 HydrophobicContact CB-CG2 3.64Å; N98-V370 WeakPolarHBondContact OD1-CG1 3.42Å; N98-V370 VanDerWaalsContact OD1-CG2 3.23Å; N98-V370 WeakPolarHBondContact OD1-CG2 3.42Å; L215-V370 HydrophobicContact CD2-CG1 4.45Å; P218-V370 HydrophobicContact CG-CG1 3.86Å; A366-V370 WeakPolarHBondContact O-CB 3.38Å; A366-V370 VanDerWaalsContact O-CG2 3.29Å; A366-V370 WeakPolarHBondContact O-CG2 3.27Å; A366-V370 PolarHBondContact O-N 2.59Å; V370-L374 HydrophobicContact CG2-CD1 4.17Å; V370-P375 WeakPolarHBondContact O-CD 3.45Å; V370-P375 VanDerWaalsContact O-CG 3.29Å; V370-P375 WeakPolarHBondContact O-CG 3.3Å
371G91.2Very high87.2Confident0 Ų06.4 Ų6.40%04%0.041CC..Iπ-helixtrans-76.9-35.9-17300000114.5S62 Q217 G367 A369S62-G371 VanDerWaalsContact CB-O 3.27Å; S62-G371 WeakPolarHBondContact CB-O 3.46Å; S62-G371 PolarHBondContact OG-O 2.87Å; Q217-G371 PolarHBondContact NE2-O 2.83Å; G367-G371 VanDerWaalsContact O-CA 3.23Å; G367-G371 WeakPolarHBondContact O-CA 3.12Å; G367-G371 PolarHBondContact O-N 3.18Å; A369-G371 VanDerWaalsContact C-N 3.29Å; A369-G371 PolarHBondContact O-N 3.41Å
372Y91.9Very high87.5Confident0 Ų06.9 Ų6.90%05%0.047CC..Iπ-helixtrans-135.5-47.1-168.2-53.6-66.2000113I58 T59 S211 S368 A376 C397 Y400I58-Y372 HydrophobicContact CB-CE1 4.43Å; I58-Y372 HydrophobicContact CG2-CD1 3.73Å; I58-Y372 HydrophobicContact CG2-CE1 3.67Å; T59-Y372 PolarHBondContact OG1-OH 2.69Å; S211-Y372 WeakPolarHBondContact CB-OH 3.05Å; S211-Y372 WeakPolarHBondContact OG-CE2 3.23Å; S211-Y372 PolarHBondContact OG-OH 3.11Å; S368-Y372 PolarHBondContact O-N 3.05Å; Y372-A376 VanDerWaalsContact O-CB 3.22Å; Y372-A376 WeakPolarHBondContact O-CB 3.24Å; Y372-A376 PolarHBondContact O-N 2.96Å; Y372-C397 WeakPolarHBondContact CB-O 3.49Å; Y372-Y400 HydrophobicContact CD1-CD1 4.03Å; Y372-Y400 HydrophobicContact CD1-CE1 4.31Å; Y372-Y400 AromaticContact CD2-CD1 3.96Å; Y372-Y400 HydrophobicContact CD2-CD1 3.96Å; Y372-Y400 AromaticContact CD2-CE1 3.97Å; Y372-Y400 HydrophobicContact CD2-CE1 3.97Å; Y372-Y400 HydrophobicContact CE1-CD1 4.15Å; Y372-Y400 AromaticContact CE1-CE1 3.99Å; Y372-Y400 HydrophobicContact CE1-CE1 3.99Å; Y372-Y400 HydrophobicContact CE2-CD1 4.07Å; Y372-Y400 AromaticContact CE2-CE1 3.61Å; Y372-Y400 HydrophobicContact CE2-CE1 3.61Å; Y372-Y400 AromaticContact CG-CD1 3.93Å; Y372-Y400 HydrophobicContact CG-CD1 3.93Å; Y372-Y400 HydrophobicContact CG-CE1 4.31Å; Y372-Y400 AromaticContact CZ-CE1 3.61Å
373I89.7Confident87.5Confident1 Ų17.5 Ų7.51%0.0055%0.046CC..Iπ-helixtrans-68.3-53.2-174.7-58.1176.7000110.9S368 A369 A376 L377 L398 L402 M405 Y568S368-I373 PolarHBondContact O-N 2.6Å; A369-I373 HydrophobicContact CB-CD1 4.44Å; A369-I373 PolarHBondContact O-N 3.22Å; I373-A376 PolarHBondContact O-N 3.33Å; I373-L377 HydrophobicContact CG2-CD1 3.81Å; I373-L377 HydrophobicContact CG2-CG 4.37Å; I373-L377 WeakPolarHBondContact O-CB 3.39Å; I373-L377 VanDerWaalsContact O-CG 3.29Å; I373-L377 WeakPolarHBondContact O-CG 3.41Å; I373-L377 PolarHBondContact O-N 3.48Å; I373-L398 HydrophobicContact CB-CD1 4.27Å; I373-L398 HydrophobicContact CG2-CD1 3.78Å; I373-L402 HydrophobicContact CD1-CD2 4.46Å; I373-M405 HydrophobicContact CD1-SD 4.31Å; I373-Y568 HydrophobicContact CG2-CE1 3.51Å; I373-Y568 WeakPolarHBondContact CG2-OH 3.22Å
374L90.3Very high87Confident1 Ų112.5 Ų12.51%0.0057%0.072CC..Hα-helixtrans-66.2-47-176.5-62.9169.8000112.3F78 I94 L97 A369 V370 A376 L377 V378 L569F78-L374 HydrophobicContact CE1-CB 4.46Å; I94-L374 HydrophobicContact CB-CD1 4.3Å; I94-L374 HydrophobicContact CG1-CB 4.24Å; I94-L374 HydrophobicContact CG1-CD1 3.57Å; I94-L374 HydrophobicContact CG1-CD2 3.85Å; I94-L374 HydrophobicContact CG1-CG 4.08Å; L97-L374 HydrophobicContact CB-CD1 4.38Å; L97-L374 HydrophobicContact CD1-CD1 3.56Å; L97-L374 HydrophobicContact CD1-CD2 4.42Å; L97-L374 HydrophobicContact CD1-CG 4.34Å; A369-L374 WeakPolarHBondContact O-CB 3.28Å; A369-L374 VanDerWaalsContact O-CG 3.28Å; A369-L374 WeakPolarHBondContact O-CG 3.24Å; A369-L374 PolarHBondContact O-N 2.87Å; V370-L374 HydrophobicContact CG2-CD1 4.17Å; L374-A376 VanDerWaalsContact C-N 3.28Å; L374-A376 PolarHBondContact O-N 3.4Å; L374-L377 PolarHBondContact O-N 3.01Å; L374-V378 WeakPolarHBondContact O-CB 3.3Å; L374-V378 WeakPolarHBondContact O-CG2 3.29Å; L374-V378 PolarHBondContact O-N 3.17Å; L374-L569 HydrophobicContact CD2-CD2 3.37Å
375P91Very high86.5Confident0 Ų015.2 Ų15.20%09%0.094CC..Hα-helixtrans-54.8-43.3173.4-30.139.6000113S62 L65 V66 F78 V370 Y379S62-P375 WeakPolarHBondContact OG-CB 3.47Å; S62-P375 WeakPolarHBondContact OG-CG 3.47Å; L65-P375 HydrophobicContact CB-CB 4.33Å; V66-P375 HydrophobicContact CG2-CB 3.76Å; V66-P375 HydrophobicContact CG2-CG 3.75Å; F78-P375 HydrophobicContact CZ-CB 4.45Å; F78-P375 HydrophobicContact CZ-CG 4.36Å; V370-P375 WeakPolarHBondContact O-CD 3.45Å; V370-P375 VanDerWaalsContact O-CG 3.29Å; V370-P375 WeakPolarHBondContact O-CG 3.3Å; P375-Y379 VanDerWaalsContact O-CB 3.24Å; P375-Y379 WeakPolarHBondContact O-CB 3.27Å; P375-Y379 PolarHBondContact O-N 3.4Å
376A90.3Very high85.6Confident0 Ų025.9 Ų25.90%013%0.134CC..Hα-helixtrans-67.1-45.8178.200000112.6L65 Y372 I373 L374 Y379 L380 A394 C397 L398L65-A376 HydrophobicContact CD1-CB 4.41Å; Y372-A376 VanDerWaalsContact O-CB 3.22Å; Y372-A376 WeakPolarHBondContact O-CB 3.24Å; Y372-A376 PolarHBondContact O-N 2.96Å; I373-A376 PolarHBondContact O-N 3.33Å; L374-A376 VanDerWaalsContact C-N 3.28Å; L374-A376 PolarHBondContact O-N 3.4Å; A376-Y379 PolarHBondContact O-N 3.14Å; A376-L380 WeakPolarHBondContact O-CB 3.18Å; A376-L380 VanDerWaalsContact O-CG 3.23Å; A376-L380 WeakPolarHBondContact O-CG 3.28Å; A376-L380 PolarHBondContact O-N 2.99Å; A376-A394 HydrophobicContact CB-CB 4.48Å; A376-A394 WeakPolarHBondContact CB-O 3.34Å; A376-C397 HydrophobicContact CB-CB 4.2Å; A376-L398 HydrophobicContact CB-CB 3.74Å
377L89.3Confident85.2Confident5 Ų529.3 Ų29.33%0.02615%0.152CC..Hα-helixtrans-61.9-48178.7-73.8175000111.8I373 L374 Y379 L380 C381 L398 L547 Y568I373-L377 HydrophobicContact CG2-CD1 3.81Å; I373-L377 HydrophobicContact CG2-CG 4.37Å; I373-L377 WeakPolarHBondContact O-CB 3.39Å; I373-L377 VanDerWaalsContact O-CG 3.29Å; I373-L377 WeakPolarHBondContact O-CG 3.41Å; I373-L377 PolarHBondContact O-N 3.48Å; L374-L377 PolarHBondContact O-N 3.01Å; L377-Y379 VanDerWaalsContact C-N 3.3Å; L377-Y379 PolarHBondContact O-N 2.87Å; L377-L380 PolarHBondContact O-N 3.35Å; L377-C381 WeakPolarHBondContact O-CB 3.07Å; L377-C381 PolarHBondContact O-N 3.38Å; L377-C381 PolarHBondContact O-SG 3.17Å; L377-L398 HydrophobicContact CD2-CD1 4.16Å; L377-L398 HydrophobicContact CD2-CD2 4.12Å; L377-L398 HydrophobicContact CG-CD1 4.05Å; L377-L547 HydrophobicContact CD2-CD1 4.35Å; L377-Y568 HydrophobicContact CD1-CD1 3.79Å; L377-Y568 HydrophobicContact CD1-CE1 3.68Å
378V88.7Confident84.9Confident0 Ų038.4 Ų38.40%019%0.186CC..Hα-helixtrans-60.6-43178.5173.50000110.3F78 A82 I86 I94 L374 C381 A382F78-V378 HydrophobicContact CE1-CG2 4.34Å; F78-V378 HydrophobicContact CE2-CB 3.82Å; F78-V378 HydrophobicContact CE2-CG1 3.77Å; F78-V378 HydrophobicContact CE2-CG2 4.08Å; F78-V378 HydrophobicContact CZ-CB 3.78Å; F78-V378 HydrophobicContact CZ-CG1 4.18Å; F78-V378 HydrophobicContact CZ-CG2 3.61Å; A82-V378 HydrophobicContact CB-CG2 3.79Å; I86-V378 HydrophobicContact CD1-CG2 3.64Å; I94-V378 HydrophobicContact CD1-CG2 4.16Å; L374-V378 WeakPolarHBondContact O-CB 3.3Å; L374-V378 WeakPolarHBondContact O-CG2 3.29Å; L374-V378 PolarHBondContact O-N 3.17Å; V378-C381 PolarHBondContact O-N 2.82Å; V378-A382 VanDerWaalsContact O-CB 3.23Å; V378-A382 WeakPolarHBondContact O-CB 3.48Å; V378-A382 PolarHBondContact O-N 3.27Å
379Y89.3Confident84.7Confident2 Ų244.4 Ų44.41%0.00821%0.209CC..Hα-helixtrans-63.1-48.3177.5-175.8-87.2000112.3L65 A68 S69 P375 A376 L377 C381 A382 Y383 R390 A394L65-Y379 HydrophobicContact CB-CD2 4.29Å; L65-Y379 HydrophobicContact CB-CG 4.39Å; L65-Y379 HydrophobicContact CD2-CD1 3.93Å; L65-Y379 HydrophobicContact CD2-CD2 3.74Å; L65-Y379 HydrophobicContact CD2-CE1 4.27Å; L65-Y379 HydrophobicContact CD2-CE2 4.06Å; L65-Y379 HydrophobicContact CD2-CG 3.68Å; A68-Y379 HydrophobicContact CB-CD2 4.15Å; A68-Y379 HydrophobicContact CB-CE2 3.78Å; S69-Y379 WeakPolarHBondContact OG-CA 3.31Å; P375-Y379 VanDerWaalsContact O-CB 3.24Å; P375-Y379 WeakPolarHBondContact O-CB 3.27Å; P375-Y379 PolarHBondContact O-N 3.4Å; A376-Y379 PolarHBondContact O-N 3.14Å; L377-Y379 VanDerWaalsContact C-N 3.3Å; L377-Y379 PolarHBondContact O-N 2.87Å; Y379-C381 VanDerWaalsContact C-N 3.25Å; Y379-C381 PolarHBondContact O-N 3.16Å; Y379-A382 PolarHBondContact O-N 3.36Å; Y379-A382 VanDerWaalsContact O-N 3.1Å; Y379-Y383 HydrophobicContact CD1-CD2 4.48Å; Y379-Y383 AromaticContact CD2-CD2 3.69Å; Y379-Y383 HydrophobicContact CD2-CD2 3.69Å; Y379-Y383 AromaticContact CD2-CE2 3.74Å; Y379-Y383 HydrophobicContact CD2-CE2 3.74Å; Y379-Y383 HydrophobicContact CE1-CD2 4.16Å; Y379-Y383 HydrophobicContact CE1-CG 4.1Å; Y379-Y383 HydrophobicContact CE2-CD1 4.36Å; Y379-Y383 AromaticContact CE2-CD2 3.33Å; Y379-Y383 HydrophobicContact CE2-CD2 3.33Å; Y379-Y383 HydrophobicContact CE2-CE1 4.27Å; Y379-Y383 AromaticContact CE2-CE2 3.22Å; Y379-Y383 HydrophobicContact CE2-CE2 3.22Å; Y379-Y383 AromaticContact CE2-CG 3.92Å; Y379-Y383 HydrophobicContact CE2-CG 3.92Å; Y379-Y383 AromaticContact CE2-CZ 3.71Å; Y379-Y383 HydrophobicContact CG-CD2 4.24Å; Y379-Y383 AromaticContact CZ-CD1 3.95Å; Y379-Y383 AromaticContact CZ-CD2 3.55Å; Y379-Y383 AromaticContact CZ-CE2 3.81Å; Y379-Y383 AromaticContact CZ-CG 3.62Å; Y379-Y383 PolarHBondContact O-N 2.89Å; Y379-Y383 WeakPolarHBondContact OH-CD1 3.44Å; Y379-Y383 WeakPolarHBondContact OH-CE1 3.31Å; Y379-R390 HydrophobicContact CE1-CB 4.01Å; Y379-R390 WeakPolarHBondContact OH-CB 3.2Å; Y379-R390 WeakPolarHBondContact OH-CD 3.39Å; Y379-A394 HydrophobicContact CD1-CB 3.62Å; Y379-A394 HydrophobicContact CE1-CB 4.29Å; Y379-A394 HydrophobicContact CG-CB 4.36Å
380L87.7Confident84.4Confident13 Ų1349.5 Ų49.57%0.06823%0.227CC..Hα-helixtrans-64.2-29.2-179.8-72.9170.7000112.9A376 L377 R391 A394 L398A376-L380 WeakPolarHBondContact O-CB 3.18Å; A376-L380 VanDerWaalsContact O-CG 3.23Å; A376-L380 WeakPolarHBondContact O-CG 3.28Å; A376-L380 PolarHBondContact O-N 2.99Å; L377-L380 PolarHBondContact O-N 3.35Å; L380-R391 HydrophobicContact CD2-CB 4.25Å; L380-R391 HydrophobicContact CD2-CG 4.37Å; L380-A394 HydrophobicContact CD1-CB 4.45Å; L380-A394 HydrophobicContact CD2-CB 3.93Å; L380-A394 HydrophobicContact CG-CB 3.89Å; L380-L398 HydrophobicContact CD1-CD2 4.16Å
381C85.6Confident84.1Confident43 Ų4350.4 Ų50.429%0.29123%0.23SC..Hα-helixtrans-81.1-27.5173-66.60000113.3L377 V378 Y379L377-C381 WeakPolarHBondContact O-CB 3.07Å; L377-C381 PolarHBondContact O-N 3.38Å; L377-C381 PolarHBondContact O-SG 3.17Å; V378-C381 PolarHBondContact O-N 2.82Å; Y379-C381 VanDerWaalsContact C-N 3.25Å; Y379-C381 PolarHBondContact O-N 3.16Å
382A84.1Confident83.9Confident23 Ų2356.3 Ų56.319%0.1926%0.256CS..Hα-helixtrans-85.1-32.7-176.700000114.2T73 T85 V378 Y379T73-A382 HydrophobicContact CG2-CB 4.22Å; T85-A382 HydrophobicContact CG2-CB 3.67Å; V378-A382 VanDerWaalsContact O-CB 3.23Å; V378-A382 WeakPolarHBondContact O-CB 3.48Å; V378-A382 PolarHBondContact O-N 3.27Å; Y379-A382 PolarHBondContact O-N 3.36Å; Y379-A382 VanDerWaalsContact O-N 3.1Å
383Y81.4Confident83.8Confident40 Ų4057.3 Ų57.316%0.15726%0.261CS..SBendtrans-98.9140.2-172.5-89.4-102.7000113.4A68 T72 Y379A68-Y383 HydrophobicContact CB-CE2 4.27Å; A68-Y383 PolarHBondContact O-OH 3.47Å; T72-Y383 HydrophobicContact CG2-CD2 4.32Å; T72-Y383 HydrophobicContact CG2-CE2 4.1Å; T72-Y383 WeakPolarHBondContact OG1-CE2 3.42Å; T72-Y383 PolarHBondContact OG1-OH 2.7Å; Y379-Y383 HydrophobicContact CD1-CD2 4.48Å; Y379-Y383 AromaticContact CD2-CD2 3.69Å; Y379-Y383 HydrophobicContact CD2-CD2 3.69Å; Y379-Y383 AromaticContact CD2-CE2 3.74Å; Y379-Y383 HydrophobicContact CD2-CE2 3.74Å; Y379-Y383 HydrophobicContact CE1-CD2 4.16Å; Y379-Y383 HydrophobicContact CE1-CG 4.1Å; Y379-Y383 HydrophobicContact CE2-CD1 4.36Å; Y379-Y383 AromaticContact CE2-CD2 3.33Å; Y379-Y383 HydrophobicContact CE2-CD2 3.33Å; Y379-Y383 HydrophobicContact CE2-CE1 4.27Å; Y379-Y383 AromaticContact CE2-CE2 3.22Å; Y379-Y383 HydrophobicContact CE2-CE2 3.22Å; Y379-Y383 AromaticContact CE2-CG 3.92Å; Y379-Y383 HydrophobicContact CE2-CG 3.92Å; Y379-Y383 AromaticContact CE2-CZ 3.71Å; Y379-Y383 HydrophobicContact CG-CD2 4.24Å; Y379-Y383 AromaticContact CZ-CD1 3.95Å; Y379-Y383 AromaticContact CZ-CD2 3.55Å; Y379-Y383 AromaticContact CZ-CE2 3.81Å; Y379-Y383 AromaticContact CZ-CG 3.62Å; Y379-Y383 PolarHBondContact O-N 2.89Å; Y379-Y383 WeakPolarHBondContact OH-CD1 3.44Å; Y379-Y383 WeakPolarHBondContact OH-CE1 3.31Å
384D70Confident83.8Confident110 Ų11057.3 Ų57.359%0.58826%0.261SS*.  trans-69.4152.7171.5-73.2-35.1000111.8R386D384-R386 PolarHBondContact O-N 3.07Å
385A69.2Low83.7Confident58 Ų5858.9 Ų58.948%0.47927%0.271SS..THydrogen-bonded Turntrans-62.3-3.1-170.900000116.6R391A385-R391 VanDerWaalsContact CB-NH1 3.31Å
386R66.2Low83.6Confident231 Ų23162.1 Ų62.187%0.87229%0.288SS*.THydrogen-bonded Turntrans-74.4-28.2-170.3-67.1-175.7-178.3-169.80.8114D384 W388D384-R386 PolarHBondContact O-N 3.07Å; R386-W388 PolarHBondContact O-N 2.87Å
387D76.5Confident83.7Confident75 Ų7562.1 Ų62.140%0.40129%0.288SS..  trans-91.972.3-178.4-71.5-15000111.8Y389 R390 R391D387-Y389 PolarHBondContact O-N 3.43Å; D387-Y389 VanDerWaalsContact O-N 3.16Å; D387-R390 HydrophobicContact CB-CB 4.37Å; D387-R390 PolarHBondContact O-N 3.33Å; D387-R390 VanDerWaalsContact O-N 3.17Å; D387-R391 PolarHBondContact O-N 2.96Å; D387-R391 VanDerWaalsContact O-N 3.1Å
388W81.7Confident83.6Confident193 Ų19362 Ų6273%0.73129%0.287SS*.Hα-helixtrans-53.3-39.9-174.778.1-91000113.3R386 R391 F392R386-W388 PolarHBondContact O-N 2.87Å; W388-R391 PolarHBondContact O-N 2.97Å; W388-F392 WeakPolarHBondContact O-CB 3.31Å; W388-F392 PolarHBondContact O-N 3.37Å
389Y84Confident83.5Confident129 Ų12964.4 Ų64.451%0.50630%0.301SS..Hα-helixtrans-63.8-44.4-178.4174.4-90000112.1D387 F392 E393D387-Y389 PolarHBondContact O-N 3.43Å; D387-Y389 VanDerWaalsContact O-N 3.16Å; Y389-F392 WeakPolarHBondContact O-CB 3.46Å; Y389-F392 PolarHBondContact O-N 3.48Å; Y389-E393 HydrophobicContact CE1-CG 3.95Å; Y389-E393 WeakPolarHBondContact CE1-OE1 3.26Å; Y389-E393 PolarHBondContact O-N 3.11Å; Y389-E393 PolarHBondContact OH-OE1 2.85Å
390R83.4Confident83.5Confident109 Ų10965 Ų6541%0.41130%0.304SS..Hα-helixtrans-73.8-31.6-180-63.6-174.5176.1-178.7-0.4112.1Y379 D387 F392 E393 A394Y379-R390 HydrophobicContact CE1-CB 4.01Å; Y379-R390 WeakPolarHBondContact OH-CB 3.2Å; Y379-R390 WeakPolarHBondContact OH-CD 3.39Å; D387-R390 HydrophobicContact CB-CB 4.37Å; D387-R390 PolarHBondContact O-N 3.33Å; D387-R390 VanDerWaalsContact O-N 3.17Å; R390-F392 VanDerWaalsContact C-N 3.33Å; R390-E393 PolarHBondContact O-N 2.76Å; R390-A394 WeakPolarHBondContact O-CB 3.27Å; R390-A394 PolarHBondContact O-N 3.32Å
391R85.2Confident83.5Confident26 Ų2664.3 Ų64.310%0.09830%0.3CS..Hα-helixtrans-65.8-40170.8-64.2-168.388-178.614.6110.7L380 A385 D387 W388 A394 T395 C551 D552L380-R391 HydrophobicContact CD2-CB 4.25Å; L380-R391 HydrophobicContact CD2-CG 4.37Å; A385-R391 VanDerWaalsContact CB-NH1 3.31Å; D387-R391 PolarHBondContact O-N 2.96Å; D387-R391 VanDerWaalsContact O-N 3.1Å; W388-R391 PolarHBondContact O-N 2.97Å; R391-A394 PolarHBondContact O-N 2.83Å; R391-T395 WeakPolarHBondContact O-CB 3.29Å; R391-T395 PolarHBondContact O-N 3.21Å; R391-T395 PolarHBondContact O-OG1 3.42Å; R391-C551 PolarHBondContact NH2-O 3.47Å; R391-D552 IonicContact NH1-OD1 3.43Å; R391-D552 PolarHBondContact NH1-OD1 3.28Å
392F87.3Confident83.4Confident123 Ų12362.6 Ų62.654%0.53929%0.288SS..Hα-helixtrans-59.3-46.7173178.3-97000111.7W388 Y389 R390 A394 T395 L396W388-F392 WeakPolarHBondContact O-CB 3.31Å; W388-F392 PolarHBondContact O-N 3.37Å; Y389-F392 WeakPolarHBondContact O-CB 3.46Å; Y389-F392 PolarHBondContact O-N 3.48Å; R390-F392 VanDerWaalsContact C-N 3.33Å; F392-A394 PolarHBondContact O-N 3.34Å; F392-T395 PolarHBondContact O-N 3.47Å; F392-L396 WeakPolarHBondContact O-CB 3.25Å; F392-L396 PolarHBondContact O-N 3.45Å
393E89.2Confident83.4Confident22 Ų2264.2 Ų64.210%0.10330%0.298CS..Hα-helixtrans-57.9-44.9173.4-77.1-174157.100112.4V61 Y389 R390 L396 C397V61-E393 HydrophobicContact CG1-CB 3.76Å; V61-E393 HydrophobicContact CG1-CG 4.21Å; Y389-E393 HydrophobicContact CE1-CG 3.95Å; Y389-E393 WeakPolarHBondContact CE1-OE1 3.26Å; Y389-E393 PolarHBondContact O-N 3.11Å; Y389-E393 PolarHBondContact OH-OE1 2.85Å; R390-E393 PolarHBondContact O-N 2.76Å; E393-L396 WeakPolarHBondContact O-CB 3.47Å; E393-L396 PolarHBondContact O-N 3.49Å; E393-C397 PolarHBondContact O-N 2.86Å
394A89Confident83.4Confident0 Ų062.5 Ų62.50%029%0.292CS..Hα-helixtrans-65.1-43177.400000112.4L65 A376 Y379 L380 R390 R391 F392 L396 C397 L398L65-A394 HydrophobicContact CD1-CB 3.99Å; L65-A394 HydrophobicContact CD2-CB 3.99Å; A376-A394 HydrophobicContact CB-CB 4.48Å; A376-A394 WeakPolarHBondContact CB-O 3.34Å; Y379-A394 HydrophobicContact CD1-CB 3.62Å; Y379-A394 HydrophobicContact CE1-CB 4.29Å; Y379-A394 HydrophobicContact CG-CB 4.36Å; L380-A394 HydrophobicContact CD1-CB 4.45Å; L380-A394 HydrophobicContact CD2-CB 3.93Å; L380-A394 HydrophobicContact CG-CB 3.89Å; R390-A394 WeakPolarHBondContact O-CB 3.27Å; R390-A394 PolarHBondContact O-N 3.32Å; R391-A394 PolarHBondContact O-N 2.83Å; F392-A394 PolarHBondContact O-N 3.34Å; A394-L396 VanDerWaalsContact C-N 3.32Å; A394-L396 PolarHBondContact O-N 3.33Å; A394-C397 PolarHBondContact O-N 3.32Å; A394-L398 WeakPolarHBondContact O-CB 3.25Å; A394-L398 PolarHBondContact O-N 2.94Å
395T88.6Confident84Confident35 Ų3557.5 Ų57.522%0.21527%0.265CS..Hα-helixtrans-62.4-40.9174.8-60.60000111R391 F392 L398 T399R391-T395 WeakPolarHBondContact O-CB 3.29Å; R391-T395 PolarHBondContact O-N 3.21Å; R391-T395 PolarHBondContact O-OG1 3.42Å; F392-T395 PolarHBondContact O-N 3.47Å; T395-L398 PolarHBondContact O-N 2.91Å; T395-T399 HydrophobicContact CG2-CG2 4.44Å; T395-T399 WeakPolarHBondContact O-CG2 3.48Å; T395-T399 PolarHBondContact O-N 3.45Å; T395-T399 PolarHBondContact O-OG1 3.36Å
396L89.7Confident84.5Confident68 Ų6857.3 Ų57.336%0.35626%0.255SS..Hα-helixtrans-59.9-49.3174.8-173.771.7000111I58 F392 E393 A394 L398 T399 Y400I58-L396 HydrophobicContact CD1-CD2 3.81Å; I58-L396 HydrophobicContact CD1-CG 4.26Å; F392-L396 WeakPolarHBondContact O-CB 3.25Å; F392-L396 PolarHBondContact O-N 3.45Å; E393-L396 WeakPolarHBondContact O-CB 3.47Å; E393-L396 PolarHBondContact O-N 3.49Å; A394-L396 VanDerWaalsContact C-N 3.32Å; A394-L396 PolarHBondContact O-N 3.33Å; L396-L398 VanDerWaalsContact C-N 3.32Å; L396-L398 PolarHBondContact O-N 3.5Å; L396-T399 WeakPolarHBondContact CA-OG1 3.48Å; L396-T399 PolarHBondContact O-N 2.68Å; L396-T399 PolarHBondContact O-OG1 3.22Å; L396-Y400 WeakPolarHBondContact O-CB 3.35Å; L396-Y400 PolarHBondContact O-N 2.92Å
397C90.8Very high84.8Confident0 Ų047.9 Ų47.90%022%0.223CC..Hα-helixtrans-58.3-42.3174.5-76.60000112.4V61 L65 Y372 A376 E393 A394 Y400 G401V61-C397 VanDerWaalsContact CG1-SG 3.54Å; L65-C397 HydrophobicContact CD1-CB 4.04Å; Y372-C397 WeakPolarHBondContact CB-O 3.49Å; A376-C397 HydrophobicContact CB-CB 4.2Å; E393-C397 PolarHBondContact O-N 2.86Å; A394-C397 PolarHBondContact O-N 3.32Å; C397-Y400 PolarHBondContact O-N 3Å; C397-G401 PolarHBondContact O-N 3.24Å
398L88.8Confident84.4Confident3 Ų344.3 Ų44.32%0.01620%0.204CC..Hα-helixtrans-62.5-48.3177.9-177.358.7000111.5I373 A376 L377 L380 A394 T395 L396 Y400 G401 L402 Y544I373-L398 HydrophobicContact CB-CD1 4.27Å; I373-L398 HydrophobicContact CG2-CD1 3.78Å; A376-L398 HydrophobicContact CB-CB 3.74Å; L377-L398 HydrophobicContact CD2-CD1 4.16Å; L377-L398 HydrophobicContact CD2-CD2 4.12Å; L377-L398 HydrophobicContact CG-CD1 4.05Å; L380-L398 HydrophobicContact CD1-CD2 4.16Å; A394-L398 WeakPolarHBondContact O-CB 3.25Å; A394-L398 PolarHBondContact O-N 2.94Å; T395-L398 PolarHBondContact O-N 2.91Å; L396-L398 VanDerWaalsContact C-N 3.32Å; L396-L398 PolarHBondContact O-N 3.5Å; L398-Y400 VanDerWaalsContact C-N 3.34Å; L398-Y400 PolarHBondContact O-N 2.85Å; L398-G401 PolarHBondContact O-N 3.27Å; L398-L402 HydrophobicContact CD1-CD1 4.23Å; L398-L402 HydrophobicContact CD1-CG 4.49Å; L398-L402 HydrophobicContact CG-CD1 4.09Å; L398-L402 WeakPolarHBondContact O-CB 3.33Å; L398-L402 WeakPolarHBondContact O-CG 3.43Å; L398-L402 PolarHBondContact O-N 2.83Å; L398-Y544 HydrophobicContact CD2-CD2 4.23Å; L398-Y544 HydrophobicContact CD2-CE2 3.96Å; L398-Y544 HydrophobicContact CG-CD2 4.45Å; L398-Y544 HydrophobicContact CG-CE2 4.15Å
399T86.4Confident83.9Confident49 Ų4936 Ų3630%0.30118%0.175SC..Hα-helixtrans-61.5-42.5177.954.20000112T395 L396 L402 S403 Y544T395-T399 HydrophobicContact CG2-CG2 4.44Å; T395-T399 WeakPolarHBondContact O-CG2 3.48Å; T395-T399 PolarHBondContact O-N 3.45Å; T395-T399 PolarHBondContact O-OG1 3.36Å; L396-T399 WeakPolarHBondContact CA-OG1 3.48Å; L396-T399 PolarHBondContact O-N 2.68Å; L396-T399 PolarHBondContact O-OG1 3.22Å; T399-L402 PolarHBondContact O-N 3.43Å; T399-S403 WeakPolarHBondContact O-CB 3.29Å; T399-S403 PolarHBondContact O-N 3.48Å; T399-S403 PolarHBondContact O-OG 2.97Å; T399-Y544 HydrophobicContact CG2-CE1 4.49Å; T399-Y544 HydrophobicContact CG2-CE2 3.93Å; T399-Y544 WeakPolarHBondContact CG2-OH 3.48Å
400Y89.4Confident83.4Confident14 Ų1433.8 Ų33.86%0.05517%0.171CC..Hα-helixtrans-62.6-50.7176.6177.7-107.8000111.4F54 C55 I58 L207 S211 Y372 L396 C397 L398 L402 S403 M404F54-Y400 HydrophobicContact CD1-CE2 4.42Å; F54-Y400 AromaticContact CE1-CD2 3.9Å; F54-Y400 HydrophobicContact CE1-CD2 3.9Å; F54-Y400 AromaticContact CE1-CE2 3.6Å; F54-Y400 HydrophobicContact CE1-CE2 3.6Å; F54-Y400 HydrophobicContact CZ-CD2 4.35Å; F54-Y400 HydrophobicContact CZ-CE2 4.48Å; C55-Y400 PolarHBondContact SG-OH 2.96Å; I58-Y400 HydrophobicContact CB-CD1 4.49Å; I58-Y400 HydrophobicContact CG2-CD1 3.62Å; I58-Y400 HydrophobicContact CG2-CE1 4.06Å; I58-Y400 HydrophobicContact CG2-CG 4.2Å; L207-Y400 HydrophobicContact CD2-CE2 4.13Å; L207-Y400 WeakPolarHBondContact CD2-OH 3.24Å; S211-Y400 PolarHBondContact OG-OH 3.2Å; Y372-Y400 HydrophobicContact CD1-CD1 4.03Å; Y372-Y400 HydrophobicContact CD1-CE1 4.31Å; Y372-Y400 AromaticContact CD2-CD1 3.96Å; Y372-Y400 HydrophobicContact CD2-CD1 3.96Å; Y372-Y400 AromaticContact CD2-CE1 3.97Å; Y372-Y400 HydrophobicContact CD2-CE1 3.97Å; Y372-Y400 HydrophobicContact CE1-CD1 4.15Å; Y372-Y400 AromaticContact CE1-CE1 3.99Å; Y372-Y400 HydrophobicContact CE1-CE1 3.99Å; Y372-Y400 HydrophobicContact CE2-CD1 4.07Å; Y372-Y400 AromaticContact CE2-CE1 3.61Å; Y372-Y400 HydrophobicContact CE2-CE1 3.61Å; Y372-Y400 AromaticContact CG-CD1 3.93Å; Y372-Y400 HydrophobicContact CG-CD1 3.93Å; Y372-Y400 HydrophobicContact CG-CE1 4.31Å; Y372-Y400 AromaticContact CZ-CE1 3.61Å; L396-Y400 WeakPolarHBondContact O-CB 3.35Å; L396-Y400 PolarHBondContact O-N 2.92Å; C397-Y400 PolarHBondContact O-N 3Å; L398-Y400 VanDerWaalsContact C-N 3.34Å; L398-Y400 PolarHBondContact O-N 2.85Å; Y400-L402 VanDerWaalsContact C-N 3.29Å; Y400-L402 PolarHBondContact O-N 3.33Å; Y400-S403 WeakPolarHBondContact CA-OG 3.45Å; Y400-S403 PolarHBondContact O-N 3Å; Y400-S403 PolarHBondContact O-OG 2.72Å; Y400-M404 HydrophobicContact CD1-CG 4.01Å; Y400-M404 HydrophobicContact CD2-CG 3.92Å; Y400-M404 HydrophobicContact CD2-SD 4.48Å; Y400-M404 HydrophobicContact CE1-CG 3.72Å; Y400-M404 HydrophobicContact CE1-SD 4.31Å; Y400-M404 HydrophobicContact CE2-CG 3.58Å; Y400-M404 HydrophobicContact CE2-SD 3.64Å; Y400-M404 HydrophobicContact CG-CG 4.13Å; Y400-M404 VanDerWaalsContact CZ-SD 3.56Å; Y400-M404 VanDerWaalsContact O-CB 3.23Å; Y400-M404 WeakPolarHBondContact O-CB 3.11Å; Y400-M404 WeakPolarHBondContact O-CG 3.46Å; Y400-M404 PolarHBondContact O-N 3.47Å; Y400-M404 PolarHBondContact OH-SD 3.1Å
401G86.7Confident82.6Confident0 Ų029.7 Ų29.70%016%0.158CC..Hα-helixtrans-58-42178.300000112.7C397 L398 M405C397-G401 PolarHBondContact O-N 3.24Å; L398-G401 PolarHBondContact O-N 3.27Å; G401-M405 WeakPolarHBondContact O-CB 3.44Å; G401-M405 PolarHBondContact O-N 3.42Å
402L84.9Confident81.7Confident7 Ų728.8 Ų28.84%0.03716%0.155CC..Hα-helixtrans-60.9-54.3173.7-82.8171000111.8I373 L398 T399 Y400 M404 M405 L406 F540 Y544 Y568I373-L402 HydrophobicContact CD1-CD2 4.46Å; L398-L402 HydrophobicContact CD1-CD1 4.23Å; L398-L402 HydrophobicContact CD1-CG 4.49Å; L398-L402 HydrophobicContact CG-CD1 4.09Å; L398-L402 WeakPolarHBondContact O-CB 3.33Å; L398-L402 WeakPolarHBondContact O-CG 3.43Å; L398-L402 PolarHBondContact O-N 2.83Å; T399-L402 PolarHBondContact O-N 3.43Å; Y400-L402 VanDerWaalsContact C-N 3.29Å; Y400-L402 PolarHBondContact O-N 3.33Å; L402-M404 VanDerWaalsContact C-N 3.27Å; L402-M404 PolarHBondContact O-N 3.47Å; L402-M405 PolarHBondContact O-N 3.27Å; L402-L406 PolarHBondContact O-N 2.9Å; L402-F540 VanDerWaalsContact C-CE1 3.48Å; L402-F540 HydrophobicContact CB-CD1 4.22Å; L402-F540 HydrophobicContact CB-CE1 3.56Å; L402-F540 HydrophobicContact CB-CZ 4.3Å; L402-F540 HydrophobicContact CD2-CD1 4.01Å; L402-F540 HydrophobicContact CD2-CE1 3.54Å; L402-F540 HydrophobicContact CD2-CE2 4.38Å; L402-F540 HydrophobicContact CD2-CZ 3.73Å; L402-F540 HydrophobicContact CG-CE1 4.14Å; L402-F540 WeakPolarHBondContact O-CE1 3.1Å; L402-F540 VanDerWaalsContact O-CZ 3.24Å; L402-F540 WeakPolarHBondContact O-CZ 3.24Å; L402-Y544 HydrophobicContact CD1-CD2 3.36Å; L402-Y544 HydrophobicContact CD1-CE2 3.94Å; L402-Y544 HydrophobicContact CD1-CG 4.08Å; L402-Y568 HydrophobicContact CD2-CE2 3.89Å; L402-Y568 WeakPolarHBondContact CD2-OH 3.39Å
403S83.1Confident80.7Confident56 Ų5625.7 Ų25.739%0.39214%0.142SC..Hα-helixtrans-60.1-41.2-179.359.70000111.6T399 Y400 L406 V407T399-S403 WeakPolarHBondContact O-CB 3.29Å; T399-S403 PolarHBondContact O-N 3.48Å; T399-S403 PolarHBondContact O-OG 2.97Å; Y400-S403 WeakPolarHBondContact CA-OG 3.45Å; Y400-S403 PolarHBondContact O-N 3Å; Y400-S403 PolarHBondContact O-OG 2.72Å; S403-L406 PolarHBondContact O-N 2.76Å; S403-V407 VanDerWaalsContact O-CB 3.29Å; S403-V407 WeakPolarHBondContact O-CB 3.26Å; S403-V407 VanDerWaalsContact O-CG2 3.24Å; S403-V407 WeakPolarHBondContact O-CG2 3.45Å; S403-V407 PolarHBondContact O-N 2.99Å
404M82.4Confident79.6Confident5 Ų530.7 Ų30.73%0.02517%0.165CC..Hα-helixtrans-58.3-50.5176.5-74.9-67.6-64.200111L207 P208 S211 Y400 L402 L406 S408L207-M404 HydrophobicContact CB-CE 3.82Å; L207-M404 HydrophobicContact CB-SD 3.59Å; L207-M404 VanDerWaalsContact CB-SD 3.59Å; L207-M404 HydrophobicContact CD1-SD 4.07Å; L207-M404 HydrophobicContact CD2-SD 4.01Å; L207-M404 HydrophobicContact CG-SD 4.11Å; L207-M404 WeakPolarHBondContact O-CE 3.44Å; P208-M404 HydrophobicContact CB-CE 4.13Å; S211-M404 WeakPolarHBondContact OG-CE 3.36Å; Y400-M404 HydrophobicContact CD1-CG 4.01Å; Y400-M404 HydrophobicContact CD2-CG 3.92Å; Y400-M404 HydrophobicContact CD2-SD 4.48Å; Y400-M404 HydrophobicContact CE1-CG 3.72Å; Y400-M404 HydrophobicContact CE1-SD 4.31Å; Y400-M404 HydrophobicContact CE2-CG 3.58Å; Y400-M404 HydrophobicContact CE2-SD 3.64Å; Y400-M404 HydrophobicContact CG-CG 4.13Å; Y400-M404 VanDerWaalsContact CZ-SD 3.56Å; Y400-M404 VanDerWaalsContact O-CB 3.23Å; Y400-M404 WeakPolarHBondContact O-CB 3.11Å; Y400-M404 WeakPolarHBondContact O-CG 3.46Å; Y400-M404 PolarHBondContact O-N 3.47Å; Y400-M404 PolarHBondContact OH-SD 3.1Å; L402-M404 VanDerWaalsContact C-N 3.27Å; L402-M404 PolarHBondContact O-N 3.47Å; M404-L406 VanDerWaalsContact C-N 3.33Å; M404-L406 PolarHBondContact O-N 3.42Å; M404-S408 WeakPolarHBondContact O-CB 3.41Å; M404-S408 PolarHBondContact O-N 3.03Å; M404-S408 PolarHBondContact O-OG 3.41Å
405M81.7Confident78Confident5 Ų533.3 Ų33.33%0.02518%0.179CC..Hα-helixtrans-61.3-42.6-179.9-167-172.574.800112.1L365 S368 I373 G401 L402 T409 F540 Q572L365-M405 HydrophobicContact CD2-CG 4.4Å; S368-M405 WeakPolarHBondContact OG-CB 3.38Å; I373-M405 HydrophobicContact CD1-SD 4.31Å; G401-M405 WeakPolarHBondContact O-CB 3.44Å; G401-M405 PolarHBondContact O-N 3.42Å; L402-M405 PolarHBondContact O-N 3.27Å; M405-T409 VanDerWaalsContact O-CB 3.3Å; M405-T409 WeakPolarHBondContact O-CB 3.48Å; M405-T409 PolarHBondContact O-N 2.97Å; M405-T409 VanDerWaalsContact O-N 3.11Å; M405-T409 PolarHBondContact O-OG1 3.37Å; M405-F540 HydrophobicContact CE-CE2 3.6Å; M405-F540 HydrophobicContact CE-CZ 3.54Å; M405-Q572 VanDerWaalsContact CE-OE1 3.29Å; M405-Q572 VanDerWaalsContact SD-CD 3.52Å; M405-Q572 PolarHBondContact SD-NE2 3.49Å; M405-Q572 VanDerWaalsContact SD-NE2 3.4Å; M405-Q572 PolarHBondContact SD-OE1 2.99Å
406L79.1Confident76.1Confident53 Ų5339.8 Ų39.828%0.27721%0.206SC..Hα-helixtrans-66.7-53.9-179.7-174.6138.6000111.5L402 S403 M404 S408 T409 I410 T536 F540L402-L406 PolarHBondContact O-N 2.9Å; S403-L406 PolarHBondContact O-N 2.76Å; M404-L406 VanDerWaalsContact C-N 3.33Å; M404-L406 PolarHBondContact O-N 3.42Å; L406-S408 VanDerWaalsContact C-N 3.35Å; L406-S408 PolarHBondContact O-N 3.02Å; L406-T409 PolarHBondContact O-N 3.49Å; L406-I410 HydrophobicContact CD2-CD1 3.84Å; L406-I410 HydrophobicContact CG-CD1 4.4Å; L406-I410 WeakPolarHBondContact O-CG1 3.29Å; L406-I410 PolarHBondContact O-N 2.85Å; L406-T536 HydrophobicContact CD1-CG2 3.72Å; L406-T536 HydrophobicContact CG-CG2 4.22Å; L406-F540 HydrophobicContact CB-CE1 3.91Å; L406-F540 HydrophobicContact CB-CE2 4.26Å; L406-F540 HydrophobicContact CB-CZ 3.65Å; L406-F540 HydrophobicContact CD1-CD1 4.1Å; L406-F540 HydrophobicContact CD1-CD2 3.97Å; L406-F540 HydrophobicContact CD1-CE1 4.03Å; L406-F540 HydrophobicContact CD1-CE2 3.96Å; L406-F540 HydrophobicContact CD1-CG 4.04Å; L406-F540 HydrophobicContact CD1-CZ 3.99Å; L406-F540 HydrophobicContact CG-CZ 4.45Å
407V73.3Confident73.9Confident33 Ų3339.2 Ų39.220%0.220%0.203CC..Hα-helixtrans-60.8-47.4-178.2167.80000110.6L204 S403 T409 I410 V411L204-V407 HydrophobicContact CB-CG1 3.52Å; L204-V407 HydrophobicContact CD1-CG1 3.99Å; L204-V407 HydrophobicContact CD2-CG1 3.81Å; L204-V407 HydrophobicContact CD2-CG2 4.5Å; L204-V407 HydrophobicContact CG-CG1 3.93Å; S403-V407 VanDerWaalsContact O-CB 3.29Å; S403-V407 WeakPolarHBondContact O-CB 3.26Å; S403-V407 VanDerWaalsContact O-CG2 3.24Å; S403-V407 WeakPolarHBondContact O-CG2 3.45Å; S403-V407 PolarHBondContact O-N 2.99Å; V407-T409 VanDerWaalsContact C-N 3.35Å; V407-T409 PolarHBondContact O-N 3.28Å; V407-I410 WeakPolarHBondContact O-CB 3.49Å; V407-I410 PolarHBondContact O-N 3.36Å; V407-V411 HydrophobicContact CG1-CG2 4.27Å; V407-V411 WeakPolarHBondContact O-CG2 3.44Å; V407-V411 PolarHBondContact O-N 3.41Å
408S68.2Low71.1Confident0 Ų044.7 Ų44.70%024%0.239CC..Hα-helixtrans-72.6-33.1-172.4-50.80000111.6P208 M404 L406 I410 V411 V412P208-S408 VanDerWaalsContact CB-OG 3.23Å; P208-S408 WeakPolarHBondContact CB-OG 3.35Å; P208-S408 WeakPolarHBondContact CD-OG 3.2Å; P208-S408 WeakPolarHBondContact CG-OG 3.31Å; M404-S408 WeakPolarHBondContact O-CB 3.41Å; M404-S408 PolarHBondContact O-N 3.03Å; M404-S408 PolarHBondContact O-OG 3.41Å; L406-S408 VanDerWaalsContact C-N 3.35Å; L406-S408 PolarHBondContact O-N 3.02Å; S408-I410 VanDerWaalsContact C-N 3.3Å; S408-I410 PolarHBondContact O-N 3.37Å; S408-V411 PolarHBondContact O-N 2.99Å; S408-V412 VanDerWaalsContact O-CB 3.24Å; S408-V412 WeakPolarHBondContact O-CB 3.39Å; S408-V412 WeakPolarHBondContact O-CG2 3.34Å; S408-V412 PolarHBondContact O-N 3.32Å
409T71.3Confident68.1Low18 Ų1852.3 Ų52.311%0.1127%0.274CS..Hα-helixtrans-60.6-44171.9-560000110.4M405 L406 V407 F413M405-T409 VanDerWaalsContact O-CB 3.3Å; M405-T409 WeakPolarHBondContact O-CB 3.48Å; M405-T409 PolarHBondContact O-N 2.97Å; M405-T409 VanDerWaalsContact O-N 3.11Å; M405-T409 PolarHBondContact O-OG1 3.37Å; L406-T409 PolarHBondContact O-N 3.49Å; V407-T409 VanDerWaalsContact C-N 3.35Å; V407-T409 PolarHBondContact O-N 3.28Å; T409-F413 HydrophobicContact CG2-CD2 3.73Å; T409-F413 HydrophobicContact CG2-CE2 3.47Å; T409-F413 VanDerWaalsContact CG2-CE2 3.47Å; T409-F413 WeakPolarHBondContact O-CD2 3.49Å; T409-F413 PolarHBondContact O-N 3.14Å
410I72.2Confident65.2Low83 Ų8354.9 Ų54.943%0.42629%0.292SS..Hα-helixtrans-61-51176.3-64.2164.3000110.3L406 V407 S408 V412 F413 E414L406-I410 HydrophobicContact CD2-CD1 3.84Å; L406-I410 HydrophobicContact CG-CD1 4.4Å; L406-I410 WeakPolarHBondContact O-CG1 3.29Å; L406-I410 PolarHBondContact O-N 2.85Å; V407-I410 WeakPolarHBondContact O-CB 3.49Å; V407-I410 PolarHBondContact O-N 3.36Å; S408-I410 VanDerWaalsContact C-N 3.3Å; S408-I410 PolarHBondContact O-N 3.37Å; I410-V412 PolarHBondContact O-N 3.29Å; I410-F413 PolarHBondContact O-N 3.23Å; I410-E414 HydrophobicContact CG2-CG 4.36Å; I410-E414 WeakPolarHBondContact CG2-OE1 3.35Å; I410-E414 WeakPolarHBondContact O-CG 3.32Å; I410-E414 PolarHBondContact O-N 3.4Å
411V67.5Low62.2Low23 Ų2357.4 Ų57.414%0.13932%0.322CS..Hα-helixtrans-63.5-40.3-178.3174.50000112.3L204 F205 V407 S408 F413 E414 L415L204-V411 HydrophobicContact CB-CG2 4.29Å; F205-V411 HydrophobicContact CB-CG1 3.99Å; F205-V411 HydrophobicContact CD2-CG1 3.76Å; F205-V411 HydrophobicContact CG-CG1 4.38Å; V407-V411 HydrophobicContact CG1-CG2 4.27Å; V407-V411 WeakPolarHBondContact O-CG2 3.44Å; V407-V411 PolarHBondContact O-N 3.41Å; S408-V411 PolarHBondContact O-N 2.99Å; V411-F413 VanDerWaalsContact C-N 3.28Å; V411-F413 PolarHBondContact O-N 3.33Å; V411-E414 PolarHBondContact O-N 2.99Å; V411-L415 HydrophobicContact CG1-CD1 4.26Å; V411-L415 WeakPolarHBondContact O-CD1 3.26Å; V411-L415 PolarHBondContact O-N 3.27Å
412V65.7Low59.2Low7 Ų765.5 Ų65.54%0.04236%0.362CS..Hα-helixtrans-63.2-34.8178.4171.20000111.7F357 L361 S408 I410F357-V412 HydrophobicContact CD2-CG1 4.12Å; F357-V412 HydrophobicContact CE2-CG1 3.74Å; L361-V412 HydrophobicContact CB-CG1 4.16Å; L361-V412 HydrophobicContact CD1-CG1 3.9Å; S408-V412 VanDerWaalsContact O-CB 3.24Å; S408-V412 WeakPolarHBondContact O-CB 3.39Å; S408-V412 WeakPolarHBondContact O-CG2 3.34Å; S408-V412 PolarHBondContact O-N 3.32Å; I410-V412 PolarHBondContact O-N 3.29Å
413F67Low56.4Low59 Ų5973.6 Ų73.626%0.25940%0.404SS..Hα-helixtrans-82.9-23.8175.2-71.5-58.2000113.8T409 I410 V411 L415 V582 L586T409-F413 HydrophobicContact CG2-CD2 3.73Å; T409-F413 HydrophobicContact CG2-CE2 3.47Å; T409-F413 VanDerWaalsContact CG2-CE2 3.47Å; T409-F413 WeakPolarHBondContact O-CD2 3.49Å; T409-F413 PolarHBondContact O-N 3.14Å; I410-F413 PolarHBondContact O-N 3.23Å; V411-F413 VanDerWaalsContact C-N 3.28Å; V411-F413 PolarHBondContact O-N 3.33Å; F413-L415 VanDerWaalsContact C-N 3.33Å; F413-V582 HydrophobicContact CD1-CG1 4.21Å; F413-V582 HydrophobicContact CE1-CB 4.05Å; F413-V582 HydrophobicContact CE1-CG1 3.59Å; F413-V582 HydrophobicContact CZ-CB 4.3Å; F413-V582 HydrophobicContact CZ-CG1 4.22Å; F413-L586 HydrophobicContact CD1-CD1 3.9Å; F413-L586 HydrophobicContact CE1-CD1 4.2Å
414E64.8Low53.7Low126 Ų12678.4 Ų78.459%0.58942%0.424SS*.Hα-helixtrans-81.7-10.5173.1-73.7-179.9-179.500113.5I410 V411 E416I410-E414 HydrophobicContact CG2-CG 4.36Å; I410-E414 WeakPolarHBondContact CG2-OE1 3.35Å; I410-E414 WeakPolarHBondContact O-CG 3.32Å; I410-E414 PolarHBondContact O-N 3.4Å; V411-E414 PolarHBondContact O-N 2.99Å; E414-E416 VanDerWaalsContact C-N 3.26Å; E414-E416 PolarHBondContact O-N 2.83Å
415L56.6Low51Low56 Ų5682.9 Ų82.929%0.29346%0.456SS..  trans-68.386.6169.3-85.9143.8000109.3L41 F205 V411 F413 I417L41-L415 HydrophobicContact CD1-CD2 4.43Å; L41-L415 HydrophobicContact CD2-CD2 4.29Å; F205-L415 HydrophobicContact CD2-CD1 3.98Å; F205-L415 HydrophobicContact CE2-CD1 3.68Å; F205-L415 HydrophobicContact CE2-CD2 4.06Å; F205-L415 HydrophobicContact CE2-CG 4.43Å; V411-L415 HydrophobicContact CG1-CD1 4.26Å; V411-L415 WeakPolarHBondContact O-CD1 3.26Å; V411-L415 PolarHBondContact O-N 3.27Å; F413-L415 VanDerWaalsContact C-N 3.33Å; L415-I417 PolarHBondContact O-N 3.11Å; L415-I417 VanDerWaalsContact O-N 3.09Å
416E47.8Very low48.3Very low170 Ų17087.8 Ų87.879%0.79449%0.49SS*.  trans-53.3116.5159.3-80179.2155.100107.8E414 P418E414-E416 VanDerWaalsContact C-N 3.26Å; E414-E416 PolarHBondContact O-N 2.83Å; E416-P418 VanDerWaalsContact O-CD 3.29Å; E416-P418 WeakPolarHBondContact O-CD 3.47Å; E416-P418 VanDerWaalsContact O-N 3.1Å
417I44.5Very low46Very low56 Ų5692 Ų9229%0.28751%0.513SS..  trans-56.2117.5175.4-58.9168.7000106.6L415 Q419L415-I417 PolarHBondContact O-N 3.11Å; L415-I417 VanDerWaalsContact O-N 3.09Å; I417-Q419 PolarHBondContact O-N 2.99Å
418P31.2Very low43.8Very low115 Ų11597.1 Ų97.175%0.74754%0.54SS*.  trans-62.9113.5-176.920.6-28.9000109.7E416 P420E416-P418 VanDerWaalsContact O-CD 3.29Å; E416-P418 WeakPolarHBondContact O-CD 3.47Å; E416-P418 VanDerWaalsContact O-N 3.1Å; P418-P420 WeakPolarHBondContact O-CD 3.4Å
419Q26.2Very low42Very low164 Ų164104 Ų10477%0.76658%0.576SS**  trans-61.5117.2167.8-71.6-79.4-21.900108.7I417 G421I417-Q419 PolarHBondContact O-N 2.99Å; Q419-G421 PolarHBondContact O-N 3.4Å
420P25.9Very low40Very low102 Ų102108.6 Ų108.666%0.66261%0.609SS**  trans-82.989.4179.531.7-28.2000109.1P418P418-P420 WeakPolarHBondContact O-CD 3.4Å
421G26.9Very low37.9Very low67 Ų67108.9 Ų108.969%0.69162%0.624SS**  trans-137.5-10-171.900000118.4Q419Q419-G421 PolarHBondContact O-N 3.4Å
422M23Very low35.9Very low171 Ų171114.5 Ų114.584%0.84266%0.658SS**  trans-120.771.7179.9-67.2-153-49.600112.9
423L26.2Very low34.2Very low176 Ų176119.8 Ų119.892%0.92169%0.691SS**  trans-81.6106.9153-72.5-179.5000108S425L423-S425 PolarHBondContact O-N 2.87Å
424I25.7Very low32.2Very low158 Ų158123.5 Ų123.581%0.8172%0.719SS**  trans-65.1100166.6-62173000106.8S426I424-S426 VanDerWaalsContact C-N 3.35Å; I424-S426 PolarHBondContact O-N 3.33Å
425S26.6Very low30.6Very low98 Ų98124.4 Ų124.469%0.68573%0.726SS**  trans-66.296.8160.6167.50000107.6L423 N427L423-S425 PolarHBondContact O-N 2.87Å; S425-N427 VanDerWaalsContact C-N 3.3Å; S425-N427 PolarHBondContact O-N 2.93Å
426S24.1Very low29.2Very low108 Ų108129 Ų12976%0.75575%0.751SS**  trans-64.896.3155.752.50000107.7I424I424-S426 VanDerWaalsContact C-N 3.35Å; I424-S426 PolarHBondContact O-N 3.33Å
427N31.1Very low28.1Very low142 Ų142125.6 Ų125.676%0.75975%0.752SS**  trans-141.6129.3157-115.2-1.6000109.2S425S425-N427 VanDerWaalsContact C-N 3.3Å; S425-N427 PolarHBondContact O-N 2.93Å
428D27.1Very low27.3Very low141 Ų141129 Ų12975%0.75478%0.777SS**  trans-54.6157.8-178-64.4-53.7000113.8
429N31.6Very low27Very low144 Ų144128 Ų12877%0.7778%0.779SS**  trans102.6100.7158.8-51.1-41.2000117
430S27.9Very low27Very low115 Ų115124.9 Ų124.980%0.80478%0.781SS**  70.2132.4123-47.90000119.6
431A29.6Very low27.2Very low88 Ų88126 Ų12673%0.72779%0.786SS**  trans93.593.6161.200000117.3T433A431-T433 PolarHBondContact O-N 3.1Å
432T25.4Very low27.1Very low141 Ų141129.8 Ų129.887%0.86579%0.79SS**  trans-21.1117.6142.5-19.80000113.8
433T29.3Very low27.5Very low119 Ų119127.8 Ų127.873%0.7378%0.783SS**  trans-157.2113.4149-2.50000110.6A431 I435A431-T433 PolarHBondContact O-N 3.1Å; T433-I435 PolarHBondContact O-N 3.05Å
434T25.2Very low27.7Very low136 Ų136123 Ų12383%0.83477%0.769SS**  trans-67.5114.6169.1430000110.2
435I29.9Very low27.9Very low146 Ų146119.4 Ų119.475%0.74976%0.758SS**  trans-140.4105167.8-55-178.9000110.1T433T433-I435 PolarHBondContact O-N 3.05Å
436N28.3Very low28.1Very low153 Ų153117.9 Ų117.982%0.81874%0.744SS**  trans10.2119.9154.8-56.5-19.5000119.4
437A24.7Very low28.4Very low98 Ų98115.8 Ų115.881%0.8173%0.73SS**PPolyproline II helixtrans-64.8135.2162.800000111.4
438P27.6Very low28.4Very low127 Ų127112 Ų11283%0.82572%0.718SS**PPolyproline II helixtrans-81.1147.4162.624.5-13.5000110.8
439A25.5Very low28.7Very low94 Ų94109.7 Ų109.778%0.77771%0.709SS**PPolyproline II helixtrans-65.1152.6-165.700000115.7
440A26Very low28.7Very low99 Ų99104 Ų10482%0.81868%0.68SS**PPolyproline II helixtrans-56.5132.9170.800000111.5
441V29.6Very low29Very low124 Ų124101.8 Ų101.875%0.75266%0.656SS**PPolyproline II helixtrans-94132.9170.3176.50000107.5D443V441-D443 PolarHBondContact O-N 3.06Å; V441-D443 VanDerWaalsContact O-N 3.11Å
442D25.6Very low29.3Very low147 Ų147100.3 Ų100.379%0.78664%0.644SS**  trans-68.195.7-174-68-54000113.4A444D442-A444 PolarHBondContact O-N 3.4Å
443D31.1Very low29.9Very low129 Ų12999.8 Ų99.869%0.6963%0.629SS**THydrogen-bonded Turntrans-76.86.2177.7-74.9-36.1000115.1V441 S445V441-D443 PolarHBondContact O-N 3.06Å; V441-D443 VanDerWaalsContact O-N 3.11Å; D443-S445 VanDerWaalsContact C-N 3.29Å; D443-S445 PolarHBondContact O-N 3.24Å
444A29.9Very low30.2Very low75 Ų7594.7 Ų94.762%0.6260%0.599SS**Hα-helixtrans-70-23.1-177.600000113.7D442 S447D442-A444 PolarHBondContact O-N 3.4Å; A444-S447 PolarHBondContact O-OG 3.16Å
445S29.2Very low31Very low83 Ų8393.3 Ų93.358%0.5858%0.583SS**Hα-helixtrans-76.7-32.2-175.364.70000113.9D443 A448 T449D443-S445 VanDerWaalsContact C-N 3.29Å; D443-S445 PolarHBondContact O-N 3.24Å; S445-A448 PolarHBondContact O-N 3.24Å; S445-T449 PolarHBondContact O-OG1 2.91Å
446T30.9Very low31.7Very low66 Ų6692.8 Ų92.841%0.40558%0.578SS.*Hα-helixtrans-72.3-35.2-177.1-27.20000111.6T449 T450T446-T449 PolarHBondContact O-OG1 3.38Å; T446-T450 PolarHBondContact O-OG1 3.33Å
447S30.8Very low32.2Very low65 Ų6587.4 Ų87.446%0.45556%0.555SS.*Hα-helixtrans-66.4-36.6176.471.60000112.6A444 T449 T450 F451A444-S447 PolarHBondContact O-OG 3.16Å; S447-T449 PolarHBondContact O-N 3Å; S447-T450 WeakPolarHBondContact CA-OG1 3.39Å; S447-T450 PolarHBondContact O-OG1 3.4Å; S447-F451 WeakPolarHBondContact O-CD2 3.38Å; S447-F451 PolarHBondContact O-N 2.86Å
448A31Very low33Very low62 Ų6284.8 Ų84.851%0.51253%0.527SS..Hα-helixtrans-69.9-32.6-178.500000113.1S445 A452S445-A448 PolarHBondContact O-N 3.24Å; A448-A452 PolarHBondContact O-N 3.07Å
449T32.9Very low33.7Very low93 Ų9382.4 Ų82.457%0.57151%0.507SS*.Hα-helixtrans-73.6-40.217941.50000113S445 T446 S447 F451 A452 F453S445-T449 PolarHBondContact O-OG1 2.91Å; T446-T449 PolarHBondContact O-OG1 3.38Å; S447-T449 PolarHBondContact O-N 3Å; T449-F451 VanDerWaalsContact C-N 3.33Å; T449-F451 PolarHBondContact O-N 3.16Å; T449-A452 PolarHBondContact O-N 3.32Å; T449-F453 PolarHBondContact O-N 3.21Å
450T32.3Very low34.5Very low24 Ų2480.2 Ų80.215%0.14749%0.489CS..Hα-helixtrans-59-41.6171.817.60000112T446 S447 F453 A454 E585T446-T450 PolarHBondContact O-OG1 3.33Å; S447-T450 WeakPolarHBondContact CA-OG1 3.39Å; S447-T450 PolarHBondContact O-OG1 3.4Å; T450-F453 PolarHBondContact O-N 3.1Å; T450-A454 PolarHBondContact O-N 3.39Å; T450-A454 VanDerWaalsContact O-N 3.16Å; T450-E585 HydrophobicContact CG2-CB 3.95Å; T450-E585 WeakPolarHBondContact CG2-OE2 3.46Å
451F33.5Very low35.1Very low69 Ų6977.3 Ų77.330%0.30346%0.461SS..Hα-helixtrans-68.7-33.7179-96-80.8000112.9S447 T449 H455 P529 S531 H532S447-F451 WeakPolarHBondContact O-CD2 3.38Å; S447-F451 PolarHBondContact O-N 2.86Å; T449-F451 VanDerWaalsContact C-N 3.33Å; T449-F451 PolarHBondContact O-N 3.16Å; F451-H455 VanDerWaalsContact O-CB 3.27Å; F451-H455 WeakPolarHBondContact O-CB 3.15Å; F451-H455 PolarHBondContact O-N 2.99Å; F451-H455 VanDerWaalsContact O-N 3.11Å; F451-P529 HydrophobicContact CD1-CB 4.39Å; F451-P529 HydrophobicContact CD2-CG 4.44Å; F451-P529 HydrophobicContact CE1-CB 3.88Å; F451-P529 HydrophobicContact CE1-CG 4.32Å; F451-P529 HydrophobicContact CE2-CB 4.32Å; F451-P529 HydrophobicContact CE2-CG 3.87Å; F451-P529 HydrophobicContact CZ-CB 3.84Å; F451-P529 HydrophobicContact CZ-CG 3.79Å; F451-S531 VanDerWaalsContact CD1-OG 3.32Å; F451-S531 WeakPolarHBondContact CD1-OG 3.35Å; F451-S531 WeakPolarHBondContact CE1-OG 3.36Å; F451-H532 AromaticContact CE1-CD2 3.95Å
452A36.2Very low35.6Very low57 Ų5775 Ų7547%0.47144%0.444SS..Hα-helixtrans-68-42176.400000112A448 T449 H455 E456A448-A452 PolarHBondContact O-N 3.07Å; T449-A452 PolarHBondContact O-N 3.32Å; A452-H455 PolarHBondContact O-N 3.26Å; A452-E456 WeakPolarHBondContact O-CB 3.3Å; A452-E456 PolarHBondContact O-N 3.33Å
453F37.9Very low36.3Very low129 Ų12971.1 Ų71.157%0.56643%0.428SS*.Hα-helixtrans-69.1-41.1-179.4-146.7-93000112.3T449 T450 E456 A457T449-F453 PolarHBondContact O-N 3.21Å; T450-F453 PolarHBondContact O-N 3.1Å; F453-E456 PolarHBondContact O-N 3.27Å; F453-A457 PolarHBondContact O-N 3.03Å
454A37.2Very low36.6Very low12 Ų1270 Ų7010%0.09942%0.422CS..Hα-helixtrans-62.6-41.8173.200000112.2T450 E456 A457 I458 V578T450-A454 PolarHBondContact O-N 3.39Å; T450-A454 VanDerWaalsContact O-N 3.16Å; A454-E456 VanDerWaalsContact C-N 3.34Å; A454-E456 PolarHBondContact O-N 2.93Å; A454-A457 PolarHBondContact O-N 3.45Å; A454-I458 WeakPolarHBondContact O-CD1 3Å; A454-I458 VanDerWaalsContact O-CG1 3.24Å; A454-I458 WeakPolarHBondContact O-CG1 3.42Å; A454-I458 PolarHBondContact O-N 3.16Å; A454-V578 HydrophobicContact CB-CG1 3.74Å
455H40.5Very low36.9Very low108 Ų10868.7 Ų68.750%0.540%0.404SS..Hα-helixtrans-64-38.4176.5-173.6-106.1000112F451 A452 N459F451-H455 VanDerWaalsContact O-CB 3.27Å; F451-H455 WeakPolarHBondContact O-CB 3.15Å; F451-H455 PolarHBondContact O-N 2.99Å; F451-H455 VanDerWaalsContact O-N 3.11Å; A452-H455 PolarHBondContact O-N 3.26Å; H455-N459 PolarHBondContact CE1-ND2 2.94Å; H455-N459 PolarHBondContact ND1-ND2 3.17Å; H455-N459 WeakPolarHBondContact O-CB 3.22Å; H455-N459 PolarHBondContact O-N 3.27Å; H455-N459 PolarHBondContact O-ND2 2.81Å
456E45.2Very low37.2Very low135 Ų13572.5 Ų72.563%0.63141%0.406SS*.Hα-helixtrans-70.7-38.2177.3-159.9157.7-159.500112.3A452 F453 A454 N459 A460A452-E456 WeakPolarHBondContact O-CB 3.3Å; A452-E456 PolarHBondContact O-N 3.33Å; F453-E456 PolarHBondContact O-N 3.27Å; A454-E456 VanDerWaalsContact C-N 3.34Å; A454-E456 PolarHBondContact O-N 2.93Å; E456-N459 PolarHBondContact O-N 2.85Å; E456-A460 WeakPolarHBondContact O-CB 3.36Å; E456-A460 PolarHBondContact O-N 3.4Å
457A39.1Very low37.3Very low40 Ų4072.4 Ų72.433%0.33141%0.408SS..Hα-helixtrans-65.5-38.4173.500000113F453 A454 T461 V578F453-A457 PolarHBondContact O-N 3.03Å; A454-A457 PolarHBondContact O-N 3.45Å; A457-T461 WeakPolarHBondContact O-CB 3.38Å; A457-T461 PolarHBondContact O-N 3.22Å; A457-T461 PolarHBondContact O-OG1 3.49Å; A457-V578 HydrophobicContact CB-CG2 4.44Å
458I41.5Very low37.5Very low43 Ų4375.6 Ų75.622%0.22142%0.42CS..Hα-helixtrans-66.2-44.8174.5-69.4164.3000110.3A454 A460 T461 L462 V535 V578A454-I458 WeakPolarHBondContact O-CD1 3Å; A454-I458 VanDerWaalsContact O-CG1 3.24Å; A454-I458 WeakPolarHBondContact O-CG1 3.42Å; A454-I458 PolarHBondContact O-N 3.16Å; I458-A460 PolarHBondContact O-N 3.31Å; I458-T461 PolarHBondContact O-N 3.36Å; I458-L462 HydrophobicContact CG2-CD1 3.85Å; I458-L462 HydrophobicContact CG2-CG 4.38Å; I458-L462 WeakPolarHBondContact O-CB 3.2Å; I458-L462 WeakPolarHBondContact O-CG 3.41Å; I458-L462 PolarHBondContact O-N 3.41Å; I458-V535 HydrophobicContact CD1-CG2 4.34Å; I458-V578 HydrophobicContact CD1-CG2 4.35Å; I458-V578 HydrophobicContact CG1-CG2 3.92Å
459N43Very low37.6Very low76 Ų7680.2 Ų80.241%0.40643%0.428SS..Hα-helixtrans-66-36.8177.1-77.2-27.5000112.6H455 E456 L462 S463H455-N459 PolarHBondContact CE1-ND2 2.94Å; H455-N459 PolarHBondContact ND1-ND2 3.17Å; H455-N459 WeakPolarHBondContact O-CB 3.22Å; H455-N459 PolarHBondContact O-N 3.27Å; H455-N459 PolarHBondContact O-ND2 2.81Å; E456-N459 PolarHBondContact O-N 2.85Å; N459-L462 PolarHBondContact O-N 3.22Å; N459-S463 VanDerWaalsContact O-CB 3.31Å; N459-S463 WeakPolarHBondContact O-CB 3.33Å; N459-S463 PolarHBondContact O-N 2.93Å; N459-S463 PolarHBondContact O-OG 3.19Å
460A41.5Very low37.4Very low48 Ų4880.1 Ų80.140%0.39743%0.431SS..Hα-helixtrans-61.6-44.6171.700000111.4E456 I458 S463 L464E456-A460 WeakPolarHBondContact O-CB 3.36Å; E456-A460 PolarHBondContact O-N 3.4Å; I458-A460 PolarHBondContact O-N 3.31Å; A460-S463 PolarHBondContact O-N 3.37Å; A460-S463 PolarHBondContact O-OG 3.26Å; A460-L464 PolarHBondContact O-N 3.48Å
461T38.9Very low37.2Very low39 Ų3982.1 Ų82.124%0.23946%0.457CS..Hα-helixtrans-66.2-41.2177.7-50.20000111.9A457 I458 S463 L464 L465 I570 A574A457-T461 WeakPolarHBondContact O-CB 3.38Å; A457-T461 PolarHBondContact O-N 3.22Å; A457-T461 PolarHBondContact O-OG1 3.49Å; I458-T461 PolarHBondContact O-N 3.36Å; T461-S463 VanDerWaalsContact C-N 3.35Å; T461-L464 PolarHBondContact O-N 3.17Å; T461-L465 WeakPolarHBondContact O-CG 3.29Å; T461-L465 PolarHBondContact O-N 3.49Å; T461-I570 HydrophobicContact CG2-CG2 4.46Å; T461-A574 HydrophobicContact CG2-CB 4.14Å
462L39.8Very low36.8Very low74 Ų7489.5 Ų89.539%0.38748%0.483SS..Hα-helixtrans-66-35.1174.1-72.7170.6000112.3I458 N459 L465 R466I458-L462 HydrophobicContact CG2-CD1 3.85Å; I458-L462 HydrophobicContact CG2-CG 4.38Å; I458-L462 WeakPolarHBondContact O-CB 3.2Å; I458-L462 WeakPolarHBondContact O-CG 3.41Å; I458-L462 PolarHBondContact O-N 3.41Å; N459-L462 PolarHBondContact O-N 3.22Å; L462-L465 HydrophobicContact CD2-CD1 4.34Å; L462-L465 WeakPolarHBondContact O-CB 3.3Å; L462-L465 PolarHBondContact O-N 2.97Å; L462-R466 PolarHBondContact O-N 3.36Å
463S40.3Very low36.2Very low66 Ų6692.8 Ų92.846%0.46250%0.5SS..Hα-helixtrans-69.3-36.717578.90000112.5N459 A460 T461 L465 R466 S467N459-S463 VanDerWaalsContact O-CB 3.31Å; N459-S463 WeakPolarHBondContact O-CB 3.33Å; N459-S463 PolarHBondContact O-N 2.93Å; N459-S463 PolarHBondContact O-OG 3.19Å; A460-S463 PolarHBondContact O-N 3.37Å; A460-S463 PolarHBondContact O-OG 3.26Å; T461-S463 VanDerWaalsContact C-N 3.35Å; S463-L465 VanDerWaalsContact C-N 3.3Å; S463-L465 PolarHBondContact O-N 2.82Å; S463-R466 PolarHBondContact O-N 3.11Å; S463-S467 WeakPolarHBondContact O-CB 3.4Å; S463-S467 PolarHBondContact O-N 3.42Å; S463-S467 PolarHBondContact O-OG 3.18Å
464L37.3Very low35.7Very low105 Ų10593 Ų9355%0.5551%0.512SS..Hα-helixtrans-67-30.9172.2-80.9165.3000112.4A460 T461 S467 N468A460-L464 PolarHBondContact O-N 3.48Å; T461-L464 PolarHBondContact O-N 3.17Å; L464-S467 PolarHBondContact O-OG 3.47Å; L464-S467 VanDerWaalsContact O-OG 3.13Å; L464-N468 PolarHBondContact O-N 3.47Å; L464-N468 PolarHBondContact O-ND2 3.25Å
465L35.3Very low35.1Very low48 Ų4898.3 Ų98.325%0.25155%0.547SS..Hα-helixtrans-72.7-41.6170.8-70.5163.1000111.6T461 L462 S463 S467 N468 F469 I570T461-L465 WeakPolarHBondContact O-CG 3.29Å; T461-L465 PolarHBondContact O-N 3.49Å; L462-L465 HydrophobicContact CD2-CD1 4.34Å; L462-L465 WeakPolarHBondContact O-CB 3.3Å; L462-L465 PolarHBondContact O-N 2.97Å; S463-L465 VanDerWaalsContact C-N 3.3Å; S463-L465 PolarHBondContact O-N 2.82Å; L465-S467 VanDerWaalsContact C-N 3.33Å; L465-S467 PolarHBondContact O-N 3.45Å; L465-N468 PolarHBondContact O-N 3.43Å; L465-F469 WeakPolarHBondContact O-CD2 3.49Å; L465-F469 PolarHBondContact O-N 3.32Å; L465-I570 HydrophobicContact CD1-CG2 3.57Å; L465-I570 HydrophobicContact CD2-CB 4.46Å; L465-I570 HydrophobicContact CD2-CD1 3.4Å; L465-I570 HydrophobicContact CD2-CG1 4.17Å; L465-I570 HydrophobicContact CD2-CG2 3.82Å; L465-I570 HydrophobicContact CG-CG2 4.08Å
466R36Very low34.4Very low164 Ų16498.6 Ų98.662%0.61956%0.561SS**Hα-helixtrans-62.2-38.2173.7-109.8-177.8-165.7174.39.5112.1L462 S463 F469 S470 E505L462-R466 PolarHBondContact O-N 3.36Å; S463-R466 PolarHBondContact O-N 3.11Å; R466-F469 PolarHBondContact O-N 3.47Å; R466-S470 VanDerWaalsContact O-CB 3.3Å; R466-S470 WeakPolarHBondContact O-CB 3.39Å; R466-S470 PolarHBondContact O-N 3.27Å; R466-S470 VanDerWaalsContact O-N 3.16Å; R466-S470 PolarHBondContact O-OG 3.13Å; R466-S470 VanDerWaalsContact O-OG 3.11Å; R466-E505 IonicContact NH2-OE1 3.5Å; R466-E505 PolarHBondContact NH2-OE1 3.15Å
467S34Very low33.6Very low64 Ų64100.7 Ų100.745%0.44857%0.568SS.*Hα-helixtrans-74.2-33.2-178.673.70000113.1S463 L464 L465 F469 S470S463-S467 WeakPolarHBondContact O-CB 3.4Å; S463-S467 PolarHBondContact O-N 3.42Å; S463-S467 PolarHBondContact O-OG 3.18Å; L464-S467 PolarHBondContact O-OG 3.47Å; L464-S467 VanDerWaalsContact O-OG 3.13Å; L465-S467 VanDerWaalsContact C-N 3.33Å; L465-S467 PolarHBondContact O-N 3.45Å; S467-F469 VanDerWaalsContact C-N 3.32Å; S467-S470 PolarHBondContact O-OG 2.8Å
468N34Very low32.9Very low131 Ų131110 Ų11070%0.70160%0.596SS**Hα-helixtrans-74.7-21172.6-82.1-60.4000113.4L464 L465L464-N468 PolarHBondContact O-N 3.47Å; L464-N468 PolarHBondContact O-ND2 3.25Å; L465-N468 PolarHBondContact O-N 3.43Å
469F33.7Very low32.2Very low159 Ų159118 Ų11870%0.69763%0.625SS**SBendtrans-95.1-4.2175.9-89.4-85.9000114.4L465 R466 S467 T563L465-F469 WeakPolarHBondContact O-CD2 3.49Å; L465-F469 PolarHBondContact O-N 3.32Å; R466-F469 PolarHBondContact O-N 3.47Å; S467-F469 VanDerWaalsContact C-N 3.32Å; F469-T563 HydrophobicContact CZ-CG2 4.48Å
470S29.3Very low31.5Very low91 Ų91118.2 Ų118.264%0.63664%0.638SS**  trans-103.510.2-17663.90000115.5R466 S467 R472R466-S470 VanDerWaalsContact O-CB 3.3Å; R466-S470 WeakPolarHBondContact O-CB 3.39Å; R466-S470 PolarHBondContact O-N 3.27Å; R466-S470 VanDerWaalsContact O-N 3.16Å; R466-S470 PolarHBondContact O-OG 3.13Å; R466-S470 VanDerWaalsContact O-OG 3.11Å; S467-S470 PolarHBondContact O-OG 2.8Å; S470-R472 PolarHBondContact O-N 3.04Å; S470-R472 VanDerWaalsContact O-N 3.17Å
471G27Very low30.8Very low67 Ų67124.6 Ų124.669%0.69166%0.661SS**SBendtrans-79.989.2174.600000114.6
472R24.7Very low30.3Very low224 Ų224126.5 Ų126.585%0.84568%0.681SS**  trans56119.5160.7-68.3-175.6179-1770.3119.2S470 T474S470-R472 PolarHBondContact O-N 3.04Å; S470-R472 VanDerWaalsContact O-N 3.17Å; R472-T474 PolarHBondContact O-N 3.32Å
473P25.2Very low29.6Very low126 Ų126128.6 Ų128.682%0.81870%0.697SS**  trans-76.2109.216332.5-26.7000108.1C475P473-C475 PolarHBondContact O-N 3.09Å
474T25.6Very low29Very low133 Ų133131.1 Ų131.182%0.81672%0.715SS**  trans-82.6112.3160.739.50000108R472 S476R472-T474 PolarHBondContact O-N 3.32Å; T474-S476 PolarHBondContact O-N 3.05Å
475C24.4Very low28.4Very low124 Ų124135.3 Ų135.384%0.83873%0.732SS**SBendtrans-50.598.9173.1-65.80000111.3P473P473-C475 PolarHBondContact O-N 3.09Å
476S26.2Very low27.8Very low113 Ų113138 Ų13879%0.7975%0.754SS**SBendtrans-167.8-1.2158-92.30000116.4T474T474-S476 PolarHBondContact O-N 3.05Å
477F28.2Very low27.4Very low179 Ų179141.7 Ų141.779%0.78577%0.768SS**SBendtrans-114.21.9-174.1-117.4-94000116.6
478Y25.8Very low26.9Very low235 Ų235146.1 Ų146.192%0.92279%0.786SS**SBendtrans-92.81.2-179.1-116.1-92000115
479Y25.6Very low26.7Very low211 Ų211146.2 Ų146.283%0.82779%0.791SS**SBendtrans-115.7-0.5-176.9-116.7-89.3000115.4
480A27.9Very low26.5Very low81 Ų81146.1 Ų146.167%0.66979%0.793SS**SBendtrans-100.64-178.200000114.6
481M28.1Very low26.5Very low182 Ų182147.7 Ų147.790%0.89780%0.801SS**SBendtrans-116.211.4179.4-124.6-178.4-92.500113.2
482A27.9Very low26.7Very low79 Ų79151.4 Ų151.465%0.65380%0.798SS**SBendtrans-100.40.5-179.600000114.2
483T25Very low27.2Very low118 Ų118145.4 Ų145.472%0.72479%0.788SS**SBendtrans-14479.3-176.453.50000112.2
484S27.2Very low27.5Very low120 Ų120145.4 Ų145.484%0.83978%0.781SS**  trans-175.1119.9137.339.30000109.9C486S484-C486 PolarHBondContact O-N 3.11Å
485Q24.5Very low27.8Very low192 Ų192149.3 Ų149.390%0.89778%0.781SS**  trans-60.4123.6171-66.1164.9-38.600109.5
486C23.6Very low28.3Very low106 Ų106147.3 Ų147.372%0.71676%0.76SS**  trans165141.8132.9-86.30000109.7S484S484-C486 PolarHBondContact O-N 3.11Å
487W27.7Very low28.5Very low241 Ų241145.6 Ų145.691%0.91375%0.748SS**  trans91.177.1172.5-50.5100000116.1V489W487-V489 PolarHBondContact O-N 3.29Å
488D23.8Very low28.7Very low157 Ų157144.1 Ų144.184%0.8474%0.743SS**  trans-35.8124.9143.8-67.8-61.8000111.9
489V29.4Very low28.9Very low133 Ų133140.7 Ų140.781%0.80673%0.733SS**  trans177.5100.2133.3171.40000108.3W487W487-V489 PolarHBondContact O-N 3.29Å
490H29.1Very low29.2Very low156 Ų156135.1 Ų135.172%0.72272%0.717SS**  trans45.6119.3155.8-78.7-85.1000122.5
491P30.2Very low29.5Very low124 Ų124136.5 Ų136.581%0.80571%0.708SS**  trans-9999.4168.635.2-23.9000110.7
492F31.1Very low29.7Very low145 Ų145131.9 Ų131.964%0.63669%0.69SS**  trans-129.71.9-173.8-115.3-91.4000121.2I496F492-I496 HydrophobicContact CD1-CD1 3.68Å; F492-I496 HydrophobicContact CE1-CD1 3.74Å
493P34.9Very low29.8Very low98 Ų98137.6 Ų137.664%0.63670%0.695SS**SBendtrans-100.8-30.4172.7-5.525.1000116.7
494L32.3Very low30.2Very low126 Ų126137.3 Ų137.366%0.6669%0.688SS**Hα-helixtrans-84.9-29.6-165.6-97.689.1000116.1
495R30.8Very low30.4Very low216 Ų216136.4 Ų136.482%0.81567%0.671SS**Hα-helixtrans-82.1-16.3-179.7-80.1-175.4179.4-176.60.6113.8K499R495-K499 PolarHBondContact O-N 2.93Å
496I35.6Very low30.7Very low81 Ų81132.7 Ų132.742%0.41566%0.656SS.*Hα-helixtrans-81.7-40.5176.5-65176.6000110.1F492 Q498 K499 L500F492-I496 HydrophobicContact CD1-CD1 3.68Å; F492-I496 HydrophobicContact CE1-CD1 3.74Å; I496-Q498 PolarHBondContact O-N 2.91Å; I496-K499 PolarHBondContact O-N 3.22Å; I496-L500 HydrophobicContact CG2-CD1 3.95Å; I496-L500 PolarHBondContact O-N 3.21Å
497C30.8Very low31.1Very low77 Ų77132 Ų13252%0.5265%0.653SS.*Hα-helixtrans-60.6-41.7175.1-70.30000112.6F501C497-F501 WeakPolarHBondContact O-CB 3.21Å; C497-F501 PolarHBondContact O-N 3.27Å
498Q31Very low31.2Very low148 Ų148124.4 Ų124.469%0.69264%0.642SS**Hα-helixtrans-69.4-35.8176.1-88.8-179.2-28.300113.5I496 V502I496-Q498 PolarHBondContact O-N 2.91Å; Q498-V502 WeakPolarHBondContact O-CG2 3.36Å
499K30.2Very low31.4Very low164 Ų164121.4 Ų121.471%0.71363%0.631SS**Hα-helixtrans-79.5-24.7179.9-79.1-172.3173.6-171.80113.9R495 I496R495-K499 PolarHBondContact O-N 2.93Å; I496-K499 PolarHBondContact O-N 3.22Å
500L32.7Very low31.3Very low94 Ų94121.7 Ų121.749%0.49263%0.629SS.*Hα-helixtrans-82-35.2173.7-107.283.6000112.8I496 V502 R503 L504I496-L500 HydrophobicContact CG2-CD1 3.95Å; I496-L500 PolarHBondContact O-N 3.21Å; L500-V502 VanDerWaalsContact C-N 3.31Å; L500-V502 PolarHBondContact O-N 3.32Å; L500-R503 PolarHBondContact O-N 3.22Å; L500-R503 VanDerWaalsContact O-N 3.13Å; L500-L504 PolarHBondContact O-N 3.41Å; L500-L504 VanDerWaalsContact O-N 3.11Å
501F33.2Very low31.4Very low110 Ų110120.8 Ų120.848%0.48263%0.634SS.*Hα-helixtrans-64.2-37178.6-142.8-92.5000112C497 E505C497-F501 WeakPolarHBondContact O-CB 3.21Å; C497-F501 PolarHBondContact O-N 3.27Å; F501-E505 PolarHBondContact O-N 3.01Å
502V32.9Very low31.2Very low85 Ų85119.2 Ų119.252%0.51563%0.626SS.*Hα-helixtrans-72.8-26.5174.5175.60000112.4Q498 L500Q498-V502 WeakPolarHBondContact O-CG2 3.36Å; L500-V502 VanDerWaalsContact C-N 3.31Å; L500-V502 PolarHBondContact O-N 3.32Å
503R29.8Very low30.9Very low199 Ų199118.7 Ų118.775%0.75164%0.635SS**Hα-helixtrans-78.1-25175.8-99.6-177174.6-171.8-3113.5L500L500-R503 PolarHBondContact O-N 3.22Å; L500-R503 VanDerWaalsContact O-N 3.13Å
504L32.8Very low30.6Very low112 Ų112120 Ų12059%0.58665%0.646SS**Hα-helixtrans-79.7-33.6174.9-81.2156.3000112.3L500 L506 S507 A508L500-L504 PolarHBondContact O-N 3.41Å; L500-L504 VanDerWaalsContact O-N 3.11Å; L504-L506 PolarHBondContact O-N 3.41Å; L504-S507 PolarHBondContact O-N 3Å; L504-A508 PolarHBondContact O-N 3.49Å
505E32.7Very low30.3Very low101 Ų101118.2 Ų118.247%0.47265%0.65SS.*Hα-helixtrans-63.4-27.9170.8-89.1-178.416700112.7R466 F501R466-E505 IonicContact NH2-OE1 3.5Å; R466-E505 PolarHBondContact NH2-OE1 3.15Å; F501-E505 PolarHBondContact O-N 3.01Å
506L31.2Very low30.1Very low113 Ų113116.9 Ų116.959%0.59265%0.653SS**Hα-helixtrans-82.3-26.7178.7-77.3160.5000113.5L504L504-L506 PolarHBondContact O-N 3.41Å
507S30.6Very low29.7Very low92 Ų92118 Ų11864%0.64367%0.668SS**Hα-helixtrans-84.2-15.6179.8-1650000113.7L504L504-S507 PolarHBondContact O-N 3Å
508A30.5Very low29.5Very low82 Ų82120.3 Ų120.368%0.67868%0.679SS**SBendtrans-90.6-12.2176.200000113.2L504L504-A508 PolarHBondContact O-N 3.49Å
509C27.8Very low29.2Very low93 Ų93121.6 Ų121.663%0.62869%0.685SS**SBendtrans-98.80.2-178.1-80.30000114.6
510D28Very low29Very low140 Ų140118.5 Ų118.575%0.74968%0.684SS**  trans-98.212.7-177.3-86.5-22.9000114.6
511V29.6Very low28.7Very low136 Ų136123.6 Ų123.682%0.82470%0.703SS**SBendtrans-105.543.2178.3-166.10000111.6
512S26.3Very low28.3Very low91 Ų91121.8 Ų121.864%0.63672%0.715SS**SBendtrans-155.248177.568.50000114.3
513T25.8Very low28Very low135 Ų135123.7 Ų123.783%0.82873%0.727SS**  trans-176.496.8160.237.20000111.4
514S28.6Very low27.8Very low124 Ų124118.4 Ų118.487%0.86773%0.726SS**  trans-177.5112.3143.851.10000109.9
515A26.2Very low27.4Very low90 Ų90120.4 Ų120.474%0.74474%0.737SS**  trans-77.7165.717400000111.9
516E26.3Very low27Very low187 Ų187126.2 Ų126.287%0.87476%0.756SS**  trans87.4131.1154.5-65.8177.4149.100120.6
517S26.5Very low26.8Very low105 Ų105127 Ų12773%0.73477%0.77SS**  trans98.398.5152.374.10000119.8
518T26.6Very low26.7Very low125 Ų125128.5 Ų128.577%0.76778%0.775SS**  60.1119126.744.60000122.6
519E26Very low26.8Very low175 Ų175127.9 Ų127.982%0.81876%0.764SS**  trans75.5118.3133.6-66.4-169.115400121.8
520S24.7Very low26.9Very low99 Ų99127.1 Ų127.169%0.69277%0.765SS**  trans61.6107.514068.80000119.2
521F27.3Very low27.4Very low202 Ų202122.8 Ų122.889%0.88675%0.745SS**  179129.7108.7-116.1-100000109.2
522G24.3Very low27.8Very low71 Ų71119.8 Ų119.873%0.73272%0.722SS**  trans-80.1122-176.800000113
523T27Very low28.1Very low125 Ų125122 Ų12277%0.76772%0.722SS**  trans-154105.2147.742.50000106.1D525T523-D525 PolarHBondContact O-N 3.36Å; T523-D525 VanDerWaalsContact O-N 3.16Å
524A25.6Very low28.7Very low88 Ų88118 Ų11873%0.72770%0.7SS**  trans-78.993.5177.800000109.5
525D24.9Very low29.4Very low154 Ų154114.3 Ų114.382%0.82467%0.672SS**  trans-75.3115.3160.1-83.3-34.3000108.3T523 C527T523-D525 PolarHBondContact O-N 3.36Å; T523-D525 VanDerWaalsContact O-N 3.16Å; D525-C527 PolarHBondContact O-N 3.38Å
526Y24.3Very low30Very low223 Ų223111.9 Ų111.988%0.87565%0.648SS**  trans-70.3111.7176.6-77-94.7000110.1
527C25.1Very low30.8Very low130 Ų130109.4 Ų109.488%0.87864%0.636SS**  trans-92.5111176.6-134.50000109.7D525D525-C527 PolarHBondContact O-N 3.38Å
528V30.3Very low31.6Very low123 Ų123108.2 Ų108.275%0.74562%0.621SS**  trans-72.1137.1172.9179.30000109.4A530V528-A530 PolarHBondContact O-N 2.97Å
529P31.1Very low32.7Very low70 Ų70102.5 Ų102.546%0.45559%0.586SS.*  trans-68.9124.3-174.3-13.728.1000112.5F451 S531F451-P529 HydrophobicContact CD1-CB 4.39Å; F451-P529 HydrophobicContact CD2-CG 4.44Å; F451-P529 HydrophobicContact CE1-CB 3.88Å; F451-P529 HydrophobicContact CE1-CG 4.32Å; F451-P529 HydrophobicContact CE2-CB 4.32Å; F451-P529 HydrophobicContact CE2-CG 3.87Å; F451-P529 HydrophobicContact CZ-CB 3.84Å; F451-P529 HydrophobicContact CZ-CG 3.79Å; P529-S531 PolarHBondContact O-N 3.04Å; P529-S531 VanDerWaalsContact O-N 3.11Å
530A31.3Very low33.7Very low77 Ų7796.1 Ų96.164%0.63656%0.556SS**THydrogen-bonded Turntrans-69.9-0.8-171.800000116.8V528 S534V528-A530 PolarHBondContact O-N 2.97Å; A530-S534 PolarHBondContact O-OG 2.84Å
531S38.1Very low34.7Very low49 Ų4993.6 Ų93.634%0.34355%0.546SS..Hα-helixtrans-83.1-28.4-171.253.70000114.3F451 P529 S534F451-S531 VanDerWaalsContact CD1-OG 3.32Å; F451-S531 WeakPolarHBondContact CD1-OG 3.35Å; F451-S531 WeakPolarHBondContact CE1-OG 3.36Å; P529-S531 PolarHBondContact O-N 3.04Å; P529-S531 VanDerWaalsContact O-N 3.11Å; S531-S534 PolarHBondContact O-OG 3.38Å
532H37.1Very low35.7Very low73 Ų7390.3 Ų90.334%0.33853%0.531SS..Hα-helixtrans-78.6-33.3177.4-112.7-96.2000112.6F451 S534 T536F451-H532 AromaticContact CE1-CD2 3.95Å; H532-S534 VanDerWaalsContact C-N 3.33Å; H532-S534 PolarHBondContact O-N 3.43Å; H532-T536 PolarHBondContact O-OG1 2.97Å
533Q34Very low37.1Very low137 Ų13787.7 Ų87.764%0.6450%0.5SS*.Hα-helixtrans-67.6-32.2177.8-81.7-175.1-1200113.1Q537Q533-Q537 VanDerWaalsContact O-CB 3.3Å; Q533-Q537 WeakPolarHBondContact O-CB 3.45Å; Q533-Q537 WeakPolarHBondContact O-CG 3.33Å; Q533-Q537 PolarHBondContact O-N 3.45Å
534S38.6Very low38.3Very low50 Ų5084.4 Ų84.435%0.3547%0.474SS..Hα-helixtrans-74.3-38.3-171.627.30000112.5A530 S531 H532 I538A530-S534 PolarHBondContact O-OG 2.84Å; S531-S534 PolarHBondContact O-OG 3.38Å; H532-S534 VanDerWaalsContact C-N 3.33Å; H532-S534 PolarHBondContact O-N 3.43Å; S534-I538 WeakPolarHBondContact O-CD1 3.47Å; S534-I538 WeakPolarHBondContact O-CG1 3.16Å; S534-I538 PolarHBondContact O-N 3.28Å
535V42.4Very low39.8Very low47 Ų4783.4 Ų83.429%0.28546%0.46SS..Hα-helixtrans-70.2-40178.7-179.40000112I458 I538 S539 V575I458-V535 HydrophobicContact CD1-CG2 4.34Å; V535-I538 PolarHBondContact O-N 3.48Å; V535-S539 PolarHBondContact O-N 3.36Å; V535-S539 VanDerWaalsContact O-N 3.14Å; V535-S539 PolarHBondContact O-OG 3.35Å; V535-V575 HydrophobicContact CG1-CG2 4.19Å
536T39.9Very low41.2Very low39 Ų3977.6 Ų77.624%0.23943%0.434CS..Hα-helixtrans-69.5-41.7175.7-10.50000110.6L406 H532 I538 S539 F540L406-T536 HydrophobicContact CD1-CG2 3.72Å; L406-T536 HydrophobicContact CG-CG2 4.22Å; H532-T536 PolarHBondContact O-OG1 2.97Å; T536-I538 PolarHBondContact O-N 2.6Å; T536-S539 PolarHBondContact O-N 2.88Å; T536-F540 HydrophobicContact CG2-CD2 3.95Å; T536-F540 HydrophobicContact CG2-CE2 3.79Å; T536-F540 WeakPolarHBondContact O-CB 3.21Å; T536-F540 WeakPolarHBondContact O-CD2 3.49Å; T536-F540 PolarHBondContact O-N 3.45Å
537Q41.2Very low42.6Very low136 Ų13667.5 Ų67.564%0.63640%0.395SS*.Hα-helixtrans-61.7-38.8174-85.1-165.6-12.900113.3Q533 G541Q533-Q537 VanDerWaalsContact O-CB 3.3Å; Q533-Q537 WeakPolarHBondContact O-CB 3.45Å; Q533-Q537 WeakPolarHBondContact O-CG 3.33Å; Q533-Q537 PolarHBondContact O-N 3.45Å; Q537-G541 WeakPolarHBondContact O-CA 3.03Å; Q537-G541 PolarHBondContact O-N 2.97Å
538I43.9Very low44.1Very low79 Ų7963.6 Ų63.641%0.40537%0.367SS..Hα-helixtrans-65.7-43.9177.9-69.4162.9000110.8S534 V535 T536S534-I538 WeakPolarHBondContact O-CD1 3.47Å; S534-I538 WeakPolarHBondContact O-CG1 3.16Å; S534-I538 PolarHBondContact O-N 3.28Å; V535-I538 PolarHBondContact O-N 3.48Å; T536-I538 PolarHBondContact O-N 2.6Å
539S49.6Very low45.2Very low5 Ų564.3 Ų64.34%0.03536%0.357CS..Iπ-helixtrans-67.2-38.4-178.9-56.80000112.5V535 T536 I543V535-S539 PolarHBondContact O-N 3.36Å; V535-S539 VanDerWaalsContact O-N 3.14Å; V535-S539 PolarHBondContact O-OG 3.35Å; T536-S539 PolarHBondContact O-N 2.88Å; S539-I543 WeakPolarHBondContact O-CB 3.44Å
540F47Very low46.2Very low41 Ų4161.8 Ų61.818%0.1834%0.34CS..Iπ-helixtrans-94.3-39.4-174.3-77.2-103.4000114L402 M405 L406 T536L402-F540 VanDerWaalsContact C-CE1 3.48Å; L402-F540 HydrophobicContact CB-CD1 4.22Å; L402-F540 HydrophobicContact CB-CE1 3.56Å; L402-F540 HydrophobicContact CB-CZ 4.3Å; L402-F540 HydrophobicContact CD2-CD1 4.01Å; L402-F540 HydrophobicContact CD2-CE1 3.54Å; L402-F540 HydrophobicContact CD2-CE2 4.38Å; L402-F540 HydrophobicContact CD2-CZ 3.73Å; L402-F540 HydrophobicContact CG-CE1 4.14Å; L402-F540 WeakPolarHBondContact O-CE1 3.1Å; L402-F540 VanDerWaalsContact O-CZ 3.24Å; L402-F540 WeakPolarHBondContact O-CZ 3.24Å; M405-F540 HydrophobicContact CE-CE2 3.6Å; M405-F540 HydrophobicContact CE-CZ 3.54Å; L406-F540 HydrophobicContact CB-CE1 3.91Å; L406-F540 HydrophobicContact CB-CE2 4.26Å; L406-F540 HydrophobicContact CB-CZ 3.65Å; L406-F540 HydrophobicContact CD1-CD1 4.1Å; L406-F540 HydrophobicContact CD1-CD2 3.97Å; L406-F540 HydrophobicContact CD1-CE1 4.03Å; L406-F540 HydrophobicContact CD1-CE2 3.96Å; L406-F540 HydrophobicContact CD1-CG 4.04Å; L406-F540 HydrophobicContact CD1-CZ 3.99Å; L406-F540 HydrophobicContact CG-CZ 4.45Å; T536-F540 HydrophobicContact CG2-CD2 3.95Å; T536-F540 HydrophobicContact CG2-CE2 3.79Å; T536-F540 WeakPolarHBondContact O-CB 3.21Å; T536-F540 WeakPolarHBondContact O-CD2 3.49Å; T536-F540 PolarHBondContact O-N 3.45Å
541G45.3Very low47.2Very low47 Ų4758.8 Ų58.849%0.48531%0.314SS..Iπ-helixtrans-79.2-28.1-172.300000114.8Q537Q537-G541 WeakPolarHBondContact O-CA 3.03Å; Q537-G541 PolarHBondContact O-N 2.97Å
542F49Very low47.9Very low133 Ų13361.9 Ų61.958%0.58333%0.327SS*.Iπ-helixtrans-117.4-40.7-174.2-71.9-83000113.7A546F542-A546 VanDerWaalsContact O-CB 3.23Å; F542-A546 WeakPolarHBondContact O-CB 3Å; F542-A546 PolarHBondContact O-N 2.84Å
543I54.4Low48.7Very low16 Ų1666.3 Ų66.38%0.08234%0.34CS..Iπ-helixtrans-77.8-36.2-173.3-55.8179000111.3S539 A546 L547 L564 V567 Y568S539-I543 WeakPolarHBondContact O-CB 3.44Å; I543-A546 PolarHBondContact O-N 2.78Å; I543-L547 HydrophobicContact CG2-CD1 3.84Å; I543-L547 HydrophobicContact CG2-CG 4.21Å; I543-L547 WeakPolarHBondContact O-CB 3.4Å; I543-L547 WeakPolarHBondContact O-CG 2.81Å; I543-L547 PolarHBondContact O-N 3.14Å; I543-L564 HydrophobicContact CG2-CD1 4.14Å; I543-L564 HydrophobicContact CG2-CG 4.18Å; I543-V567 HydrophobicContact CD1-CG1 4.08Å; I543-Y568 HydrophobicContact CG2-CD2 4.02Å; I543-Y568 HydrophobicContact CG2-CG 4.42Å
544Y52.4Low49.5Very low56 Ų5665.9 Ų65.922%0.2234%0.342CS..Hα-helixtrans-64.7-53.2178.8169.8-96.5000113.4L398 T399 L402 A546 L547 V548L398-Y544 HydrophobicContact CD2-CD2 4.23Å; L398-Y544 HydrophobicContact CD2-CE2 3.96Å; L398-Y544 HydrophobicContact CG-CD2 4.45Å; L398-Y544 HydrophobicContact CG-CE2 4.15Å; T399-Y544 HydrophobicContact CG2-CE1 4.49Å; T399-Y544 HydrophobicContact CG2-CE2 3.93Å; T399-Y544 WeakPolarHBondContact CG2-OH 3.48Å; L402-Y544 HydrophobicContact CD1-CD2 3.36Å; L402-Y544 HydrophobicContact CD1-CE2 3.94Å; L402-Y544 HydrophobicContact CD1-CG 4.08Å; Y544-A546 PolarHBondContact O-N 3.01Å; Y544-L547 PolarHBondContact O-N 2.98Å; Y544-V548 HydrophobicContact CD2-CG2 4.14Å; Y544-V548 HydrophobicContact CE1-CG2 4.32Å; Y544-V548 HydrophobicContact CE2-CG2 3.68Å; Y544-V548 WeakPolarHBondContact O-CG2 3.18Å; Y544-V548 PolarHBondContact O-N 2.77Å
545P56Low50.2Low66 Ų6667.6 Ų67.643%0.42935%0.348SS..Hα-helixtrans-61.1-36.7176.6-20.231.9000111.5Y549P545-Y549 WeakPolarHBondContact O-CB 3.32Å; P545-Y549 PolarHBondContact O-N 3.08Å
546A53.8Low50.5Low33 Ų3370.6 Ų70.627%0.27337%0.371SS..Hα-helixtrans-64.9-45.1176.200000112F542 I543 Y544 Y549 L550 L564F542-A546 VanDerWaalsContact O-CB 3.23Å; F542-A546 WeakPolarHBondContact O-CB 3Å; F542-A546 PolarHBondContact O-N 2.84Å; I543-A546 PolarHBondContact O-N 2.78Å; Y544-A546 PolarHBondContact O-N 3.01Å; A546-Y549 PolarHBondContact O-N 3.19Å; A546-L550 HydrophobicContact CB-CD1 4.49Å; A546-L550 WeakPolarHBondContact O-CB 3.44Å; A546-L550 WeakPolarHBondContact O-CD1 3.48Å; A546-L550 WeakPolarHBondContact O-CG 3.44Å; A546-L550 PolarHBondContact O-N 2.87Å; A546-L564 HydrophobicContact CB-CD2 3.66Å
547L54.4Low51.2Low11 Ų1172.8 Ų72.86%0.05838%0.378CS..Hα-helixtrans-62.1-45.9177.4-85.5168.8000111.6L377 I543 Y544 C551 L564 A565 Y568L377-L547 HydrophobicContact CD2-CD1 4.35Å; I543-L547 HydrophobicContact CG2-CD1 3.84Å; I543-L547 HydrophobicContact CG2-CG 4.21Å; I543-L547 WeakPolarHBondContact O-CB 3.4Å; I543-L547 WeakPolarHBondContact O-CG 2.81Å; I543-L547 PolarHBondContact O-N 3.14Å; Y544-L547 PolarHBondContact O-N 2.98Å; L547-C551 VanDerWaalsContact O-CB 3.25Å; L547-C551 WeakPolarHBondContact O-CB 3.01Å; L547-C551 PolarHBondContact O-N 3.09Å; L547-C551 PolarHBondContact O-SG 2.89Å; L547-L564 HydrophobicContact CB-CD2 4.19Å; L547-L564 HydrophobicContact CD2-CB 3.98Å; L547-L564 HydrophobicContact CD2-CD2 3.74Å; L547-L564 HydrophobicContact CD2-CG 3.81Å; L547-L564 HydrophobicContact CG-CD2 3.57Å; L547-L564 HydrophobicContact CG-CG 3.83Å; L547-A565 HydrophobicContact CD2-CB 4.42Å; L547-Y568 HydrophobicContact CD1-CD2 4.15Å; L547-Y568 HydrophobicContact CD1-CG 3.95Å
548V55.5Low52Low47 Ų4772.2 Ų72.229%0.28537%0.374SS..Hα-helixtrans-65.4-48.5178.9175.30000110.7Y544 L550 C551 D552Y544-V548 HydrophobicContact CD2-CG2 4.14Å; Y544-V548 HydrophobicContact CE1-CG2 4.32Å; Y544-V548 HydrophobicContact CE2-CG2 3.68Å; Y544-V548 WeakPolarHBondContact O-CG2 3.18Å; Y544-V548 PolarHBondContact O-N 2.77Å; V548-L550 PolarHBondContact O-N 3.27Å; V548-C551 PolarHBondContact O-N 2.97Å; V548-D552 PolarHBondContact O-N 3.46Å
549Y53.8Low52.7Low139 Ų13973 Ų7355%0.54539%0.386SS..Hα-helixtrans-61.5-41.2179.5-178.9-99.8000112.5P545 A546 D552P545-Y549 WeakPolarHBondContact O-CB 3.32Å; P545-Y549 PolarHBondContact O-N 3.08Å; A546-Y549 PolarHBondContact O-N 3.19Å; Y549-D552 PolarHBondContact O-N 3.24Å
550L52.2Low53.2Low17 Ų1776.6 Ų76.69%0.08940%0.401CS..Hα-helixtrans-75.7-34.4179.8-66164.5000112A546 V548 D552 R553 F560 K561 L564A546-L550 HydrophobicContact CB-CD1 4.49Å; A546-L550 WeakPolarHBondContact O-CB 3.44Å; A546-L550 WeakPolarHBondContact O-CD1 3.48Å; A546-L550 WeakPolarHBondContact O-CG 3.44Å; A546-L550 PolarHBondContact O-N 2.87Å; V548-L550 PolarHBondContact O-N 3.27Å; L550-D552 PolarHBondContact O-N 2.96Å; L550-R553 PolarHBondContact O-N 3.26Å; L550-F560 HydrophobicContact CD1-CD1 3.5Å; L550-F560 HydrophobicContact CD1-CE1 3.13Å; L550-F560 HydrophobicContact CD1-CZ 4.08Å; L550-F560 HydrophobicContact CD2-CD1 3.69Å; L550-F560 HydrophobicContact CD2-CE1 3.54Å; L550-F560 HydrophobicContact CG-CD1 4.15Å; L550-F560 HydrophobicContact CG-CE1 3.92Å; L550-K561 WeakPolarHBondContact O-CE 3.24Å; L550-K561 PolarHBondContact O-NZ 3.31Å; L550-L564 HydrophobicContact CD1-CD2 3.51Å
551C53.1Low53.8Low14 Ų1476.4 Ų76.410%0.09540%0.4CS..Hα-helixtrans-61.1-27.4172.3-770000112R391 L547 V548R391-C551 PolarHBondContact NH2-O 3.47Å; L547-C551 VanDerWaalsContact O-CB 3.25Å; L547-C551 WeakPolarHBondContact O-CB 3.01Å; L547-C551 PolarHBondContact O-N 3.09Å; L547-C551 PolarHBondContact O-SG 2.89Å; V548-C551 PolarHBondContact O-N 2.97Å
552D53.2Low54.7Low114 Ų11476.8 Ų76.861%0.6139%0.389SS*.Hα-helixtrans-77.2-23.9178.2-156.141000113.9R391 V548 Y549 L550R391-D552 IonicContact NH1-OD1 3.43Å; R391-D552 PolarHBondContact NH1-OD1 3.28Å; V548-D552 PolarHBondContact O-N 3.46Å; Y549-D552 PolarHBondContact O-N 3.24Å; L550-D552 PolarHBondContact O-N 2.96Å
553R52.1Low55.4Low165 Ų16572.9 Ų72.962%0.62338%0.377SS*.SBendtrans-92.6155.9178.4-95.5-169.3170.9-175.5-0.9114.6L550 K561L550-R553 PolarHBondContact O-N 3.26Å; R553-K561 WeakPolarHBondContact O-CE 3.34Å; R553-K561 PolarHBondContact O-NZ 3.46Å
554D51.9Low55.8Low128 Ų12873.3 Ų73.368%0.68438%0.379SS*.  trans-40.6157.7-168.2-145.2-12.1000117.4S556D554-S556 PolarHBondContact O-N 2.84Å
555N52.6Low56.3Low87 Ų8770.7 Ų70.747%0.46537%0.369SS..G310 helixtrans-63.5-6.1-175.1-109.4-34.9000114.6Q557 K558N555-Q557 VanDerWaalsContact C-N 3.3Å; N555-Q557 PolarHBondContact O-N 3.05Å; N555-K558 VanDerWaalsContact OD1-CE 3.24Å; N555-K558 WeakPolarHBondContact OD1-CE 3.38Å
556S48.4Very low56.8Low110 Ų11072.5 Ų72.577%0.76937%0.367SS*.G310 helixtrans-74.7-15.7-178.178.30000114.1D554D554-S556 PolarHBondContact O-N 2.84Å
557Q55.6Low57.4Low85 Ų8573.5 Ų73.540%0.39737%0.37SS..G310 helixtrans-104.328.7-177.7-75.4-158.1-17.400115.2N555 S559 F560 K561N555-Q557 VanDerWaalsContact C-N 3.3Å; N555-Q557 PolarHBondContact O-N 3.05Å; Q557-S559 VanDerWaalsContact C-N 3.28Å; Q557-S559 PolarHBondContact O-N 3.44Å; Q557-F560 HydrophobicContact CB-CB 4.32Å; Q557-F560 PolarHBondContact O-N 2.71Å; Q557-K561 PolarHBondContact O-N 3.13Å; Q557-K561 VanDerWaalsContact O-N 3.07Å
558K57.8Low58Low123 Ų12373 Ų7354%0.53537%0.367SS..Hα-helixtrans-48.6-48178.5-74.9-179.7-177.9-174.80112.8N555 F560 K561 H562N555-K558 VanDerWaalsContact OD1-CE 3.24Å; N555-K558 WeakPolarHBondContact OD1-CE 3.38Å; K558-F560 VanDerWaalsContact C-N 3.29Å; K558-F560 PolarHBondContact O-N 3.18Å; K558-K561 PolarHBondContact O-N 3.11Å; K558-H562 PolarHBondContact O-CD2 3.37Å; K558-H562 PolarHBondContact O-N 3.22Å
559S59.4Low58.5Low95 Ų9571 Ų7166%0.66435%0.354SS*.Hα-helixtrans-57.4-38.9179.7-173.80000113.3Q557 T563Q557-S559 VanDerWaalsContact C-N 3.28Å; Q557-S559 PolarHBondContact O-N 3.44Å; S559-T563 PolarHBondContact O-N 3.48Å; S559-T563 PolarHBondContact O-OG1 3.26Å
560F59.1Low59.1Low82 Ų8265.6 Ų65.636%0.3634%0.335SS..Hα-helixtrans-73.9-39.6179.6-168.8-121.5000112.1L550 Q557 K558 H562 T563 L564L550-F560 HydrophobicContact CD1-CD1 3.5Å; L550-F560 HydrophobicContact CD1-CE1 3.13Å; L550-F560 HydrophobicContact CD1-CZ 4.08Å; L550-F560 HydrophobicContact CD2-CD1 3.69Å; L550-F560 HydrophobicContact CD2-CE1 3.54Å; L550-F560 HydrophobicContact CG-CD1 4.15Å; L550-F560 HydrophobicContact CG-CE1 3.92Å; Q557-F560 HydrophobicContact CB-CB 4.32Å; Q557-F560 PolarHBondContact O-N 2.71Å; K558-F560 VanDerWaalsContact C-N 3.29Å; K558-F560 PolarHBondContact O-N 3.18Å; F560-H562 PolarHBondContact O-N 2.86Å; F560-T563 PolarHBondContact O-N 2.97Å; F560-L564 PolarHBondContact O-N 2.87Å
561K60.4Low59.6Low37 Ų3766.3 Ų66.316%0.16134%0.341CS..Hα-helixtrans-58.1-47.1172-65.5-178.6-174.6-169.20111.4L550 R553 Q557 K558 T563 L564 A565L550-K561 WeakPolarHBondContact O-CE 3.24Å; L550-K561 PolarHBondContact O-NZ 3.31Å; R553-K561 WeakPolarHBondContact O-CE 3.34Å; R553-K561 PolarHBondContact O-NZ 3.46Å; Q557-K561 PolarHBondContact O-N 3.13Å; Q557-K561 VanDerWaalsContact O-N 3.07Å; K558-K561 PolarHBondContact O-N 3.11Å; K561-T563 PolarHBondContact O-N 3.17Å; K561-L564 PolarHBondContact O-N 2.93Å; K561-A565 WeakPolarHBondContact O-CB 3.26Å; K561-A565 PolarHBondContact O-N 3.44Å
562H62.5Low60.1Low54 Ų5466.2 Ų66.225%0.2534%0.339CS..Hα-helixtrans-58.5-47.8174.9-75-74000111.5T85 I86 K558 F560 L564 A565 R566T85-H562 PolarHBondContact O-CE1 3.23Å; T85-H562 PolarHBondContact O-ND1 2.9Å; I86-H562 VanDerWaalsContact C-ND1 3.29Å; I86-H562 PolarHBondContact O-ND1 3.39Å; K558-H562 PolarHBondContact O-CD2 3.37Å; K558-H562 PolarHBondContact O-N 3.22Å; F560-H562 PolarHBondContact O-N 2.86Å; H562-L564 PolarHBondContact O-N 3.01Å; H562-A565 PolarHBondContact O-N 3.23Å; H562-R566 WeakPolarHBondContact O-CB 3.4Å; H562-R566 WeakPolarHBondContact O-CG 3.43Å; H562-R566 PolarHBondContact O-N 3.14Å
563T64.3Low60.6Low52 Ų5262.1 Ų62.132%0.31932%0.317SS..Hα-helixtrans-61.3-45.6-177.9-55.90000111.5F469 S559 F560 K561 R566 V567F469-T563 HydrophobicContact CZ-CG2 4.48Å; S559-T563 PolarHBondContact O-N 3.48Å; S559-T563 PolarHBondContact O-OG1 3.26Å; F560-T563 PolarHBondContact O-N 2.97Å; K561-T563 PolarHBondContact O-N 3.17Å; T563-R566 WeakPolarHBondContact O-CB 3.36Å; T563-R566 PolarHBondContact O-N 3.11Å; T563-V567 WeakPolarHBondContact O-CG2 3.34Å; T563-V567 PolarHBondContact O-N 3.11Å
564L63.7Low61.2Low25 Ų2555.1 Ų55.113%0.13129%0.294CS..Hα-helixtrans-68.3-39.6-179.5-164.569.8000112.3I543 A546 L547 L550 F560 K561 H562 R566 V567 Y568I543-L564 HydrophobicContact CG2-CD1 4.14Å; I543-L564 HydrophobicContact CG2-CG 4.18Å; A546-L564 HydrophobicContact CB-CD2 3.66Å; L547-L564 HydrophobicContact CB-CD2 4.19Å; L547-L564 HydrophobicContact CD2-CB 3.98Å; L547-L564 HydrophobicContact CD2-CD2 3.74Å; L547-L564 HydrophobicContact CD2-CG 3.81Å; L547-L564 HydrophobicContact CG-CD2 3.57Å; L547-L564 HydrophobicContact CG-CG 3.83Å; L550-L564 HydrophobicContact CD1-CD2 3.51Å; F560-L564 PolarHBondContact O-N 2.87Å; K561-L564 PolarHBondContact O-N 2.93Å; H562-L564 PolarHBondContact O-N 3.01Å; L564-R566 VanDerWaalsContact C-N 3.31Å; L564-R566 PolarHBondContact O-N 3.22Å; L564-V567 PolarHBondContact O-N 3.41Å; L564-Y568 WeakPolarHBondContact O-CB 3.47Å; L564-Y568 PolarHBondContact O-N 2.94Å
565A62.2Low61.7Low1 Ų150.2 Ų50.21%0.00827%0.269CS..Hα-helixtrans-61.6-40.4173.300000111.4I86 L547 K561 H562 Y568 L569I86-A565 HydrophobicContact CG2-CB 4.12Å; L547-A565 HydrophobicContact CD2-CB 4.42Å; K561-A565 WeakPolarHBondContact O-CB 3.26Å; K561-A565 PolarHBondContact O-N 3.44Å; H562-A565 PolarHBondContact O-N 3.23Å; A565-Y568 PolarHBondContact O-N 3.37Å; A565-L569 WeakPolarHBondContact O-CB 3.33Å; A565-L569 WeakPolarHBondContact O-CD1 3.31Å; A565-L569 WeakPolarHBondContact O-CG 3.47Å; A565-L569 PolarHBondContact O-N 3.06Å
566R65.8Low62.2Low104 Ų10446.8 Ų46.839%0.39225%0.25SS..Hα-helixtrans-62.5-48.6174.8-69.6178.1179.6-171.2-0.3111.8F89 H562 T563 L564 Y568 L569 I570F89-R566 HydrophobicContact CB-CG 4.47Å; F89-R566 HydrophobicContact CD1-CB 3.93Å; F89-R566 HydrophobicContact CD1-CG 3.66Å; F89-R566 HydrophobicContact CE1-CB 4.11Å; F89-R566 HydrophobicContact CE1-CG 4.35Å; F89-R566 HydrophobicContact CG-CG 4.42Å; H562-R566 WeakPolarHBondContact O-CB 3.4Å; H562-R566 WeakPolarHBondContact O-CG 3.43Å; H562-R566 PolarHBondContact O-N 3.14Å; T563-R566 WeakPolarHBondContact O-CB 3.36Å; T563-R566 PolarHBondContact O-N 3.11Å; L564-R566 VanDerWaalsContact C-N 3.31Å; L564-R566 PolarHBondContact O-N 3.22Å; R566-Y568 VanDerWaalsContact C-N 3.31Å; R566-Y568 PolarHBondContact O-N 3.22Å; R566-L569 PolarHBondContact O-N 3.46Å; R566-I570 WeakPolarHBondContact O-CD1 3.49Å; R566-I570 VanDerWaalsContact O-CG1 3.28Å; R566-I570 WeakPolarHBondContact O-CG1 3.26Å; R566-I570 PolarHBondContact O-N 3.09Å
567V66.6Low62.9Low53 Ų5347 Ų4732%0.32124%0.242SC..Hα-helixtrans-57.7-46.8178.5172.80000110.4I543 T563 L564 L569 I570 C571I543-V567 HydrophobicContact CD1-CG1 4.08Å; T563-V567 WeakPolarHBondContact O-CG2 3.34Å; T563-V567 PolarHBondContact O-N 3.11Å; L564-V567 PolarHBondContact O-N 3.41Å; V567-L569 PolarHBondContact O-N 2.84Å; V567-I570 PolarHBondContact O-N 3.16Å; V567-C571 PolarHBondContact O-N 3.48Å; V567-C571 PolarHBondContact O-SG 3Å; V567-C571 VanDerWaalsContact O-SG 3.36Å
568Y66.7Low63.1Low2 Ų243.5 Ų43.51%0.00823%0.227CC..Hα-helixtrans-56.2-50.5175.6176.2-97.4000112I373 L377 L402 I543 L547 L564 A565 R566 I570 C571 Q572I373-Y568 HydrophobicContact CG2-CE1 3.51Å; I373-Y568 WeakPolarHBondContact CG2-OH 3.22Å; L377-Y568 HydrophobicContact CD1-CD1 3.79Å; L377-Y568 HydrophobicContact CD1-CE1 3.68Å; L402-Y568 HydrophobicContact CD2-CE2 3.89Å; L402-Y568 WeakPolarHBondContact CD2-OH 3.39Å; I543-Y568 HydrophobicContact CG2-CD2 4.02Å; I543-Y568 HydrophobicContact CG2-CG 4.42Å; L547-Y568 HydrophobicContact CD1-CD2 4.15Å; L547-Y568 HydrophobicContact CD1-CG 3.95Å; L564-Y568 WeakPolarHBondContact O-CB 3.47Å; L564-Y568 PolarHBondContact O-N 2.94Å; A565-Y568 PolarHBondContact O-N 3.37Å; R566-Y568 VanDerWaalsContact C-N 3.31Å; R566-Y568 PolarHBondContact O-N 3.22Å; Y568-I570 VanDerWaalsContact C-N 3.28Å; Y568-I570 PolarHBondContact O-N 3.44Å; Y568-C571 PolarHBondContact O-N 2.94Å; Y568-Q572 HydrophobicContact CD1-CG 4.18Å; Y568-Q572 HydrophobicContact CE1-CG 3.75Å; Y568-Q572 HydrophobicContact CE2-CG 4.34Å; Y568-Q572 VanDerWaalsContact CZ-NE2 3.29Å; Y568-Q572 VanDerWaalsContact O-CG 3.25Å; Y568-Q572 WeakPolarHBondContact O-CG 3.41Å; Y568-Q572 PolarHBondContact O-N 2.93Å; Y568-Q572 PolarHBondContact OH-NE2 3.29Å
569L66.5Low63.1Low3 Ų337.7 Ų37.72%0.01620%0.202CC..Hα-helixtrans-65.4-30.2-179.1-68.7166000113.2I86 I93 L374 A565 R566 V567 Q572 L573I86-L569 HydrophobicContact CG2-CD1 4.11Å; I93-L569 HydrophobicContact CB-CB 4.42Å; I93-L569 HydrophobicContact CB-CD2 4.47Å; I93-L569 HydrophobicContact CD1-CB 3.28Å; I93-L569 HydrophobicContact CD1-CD1 3.9Å; I93-L569 HydrophobicContact CD1-CG 4.11Å; I93-L569 HydrophobicContact CG1-CB 4.14Å; I93-L569 HydrophobicContact CG2-CB 4.09Å; I93-L569 HydrophobicContact CG2-CD2 3.74Å; I93-L569 HydrophobicContact CG2-CG 4.38Å; L374-L569 HydrophobicContact CD2-CD2 3.37Å; A565-L569 WeakPolarHBondContact O-CB 3.33Å; A565-L569 WeakPolarHBondContact O-CD1 3.31Å; A565-L569 WeakPolarHBondContact O-CG 3.47Å; A565-L569 PolarHBondContact O-N 3.06Å; R566-L569 PolarHBondContact O-N 3.46Å; V567-L569 PolarHBondContact O-N 2.84Å; L569-Q572 WeakPolarHBondContact O-CB 3.42Å; L569-Q572 PolarHBondContact O-N 3.43Å; L569-L573 PolarHBondContact O-N 3.29Å
570I66.8Low63.1Low27 Ų2736.3 Ų36.314%0.13819%0.189CC..Hα-helixtrans-67.9-48.6172.9-71.5152.9000111F89 T461 L465 R566 V567 Y568 Q572 L573 A574F89-I570 HydrophobicContact CE1-CD1 3.78Å; F89-I570 HydrophobicContact CE1-CG1 3.52Å; F89-I570 HydrophobicContact CZ-CD1 3.77Å; F89-I570 HydrophobicContact CZ-CG1 3.34Å; T461-I570 HydrophobicContact CG2-CG2 4.46Å; L465-I570 HydrophobicContact CD1-CG2 3.57Å; L465-I570 HydrophobicContact CD2-CB 4.46Å; L465-I570 HydrophobicContact CD2-CD1 3.4Å; L465-I570 HydrophobicContact CD2-CG1 4.17Å; L465-I570 HydrophobicContact CD2-CG2 3.82Å; L465-I570 HydrophobicContact CG-CG2 4.08Å; R566-I570 WeakPolarHBondContact O-CD1 3.49Å; R566-I570 VanDerWaalsContact O-CG1 3.28Å; R566-I570 WeakPolarHBondContact O-CG1 3.26Å; R566-I570 PolarHBondContact O-N 3.09Å; V567-I570 PolarHBondContact O-N 3.16Å; Y568-I570 VanDerWaalsContact C-N 3.28Å; Y568-I570 PolarHBondContact O-N 3.44Å; I570-Q572 PolarHBondContact O-N 2.92Å; I570-L573 PolarHBondContact O-N 2.88Å; I570-A574 PolarHBondContact O-N 3.22Å
571C63.9Low63Low32 Ų3234.4 Ų34.422%0.21619%0.188CC..Hα-helixtrans-56-38.7176.1-68.50000110.5V567 Y568 A574 V575V567-C571 PolarHBondContact O-N 3.48Å; V567-C571 PolarHBondContact O-SG 3Å; V567-C571 VanDerWaalsContact O-SG 3.36Å; Y568-C571 PolarHBondContact O-N 2.94Å; C571-A574 PolarHBondContact O-N 3.22Å; C571-V575 VanDerWaalsContact O-CG2 3.31Å; C571-V575 WeakPolarHBondContact O-CG2 3.27Å; C571-V575 PolarHBondContact O-N 3.33Å
572Q63.6Low63Low11 Ų1133.5 Ų33.55%0.05119%0.186CC..Hα-helixtrans-63.1-49.4176.5-72.2-66.5-4.200113.6M405 Y568 L569 I570 A574 V575 M576M405-Q572 VanDerWaalsContact CE-OE1 3.29Å; M405-Q572 VanDerWaalsContact SD-CD 3.52Å; M405-Q572 PolarHBondContact SD-NE2 3.49Å; M405-Q572 VanDerWaalsContact SD-NE2 3.4Å; M405-Q572 PolarHBondContact SD-OE1 2.99Å; Y568-Q572 HydrophobicContact CD1-CG 4.18Å; Y568-Q572 HydrophobicContact CE1-CG 3.75Å; Y568-Q572 HydrophobicContact CE2-CG 4.34Å; Y568-Q572 VanDerWaalsContact CZ-NE2 3.29Å; Y568-Q572 VanDerWaalsContact O-CG 3.25Å; Y568-Q572 WeakPolarHBondContact O-CG 3.41Å; Y568-Q572 PolarHBondContact O-N 2.93Å; Y568-Q572 PolarHBondContact OH-NE2 3.29Å; L569-Q572 WeakPolarHBondContact O-CB 3.42Å; L569-Q572 PolarHBondContact O-N 3.43Å; I570-Q572 PolarHBondContact O-N 2.92Å; Q572-A574 VanDerWaalsContact C-N 3.29Å; Q572-A574 PolarHBondContact O-N 3.35Å; Q572-V575 PolarHBondContact O-N 3.28Å; Q572-M576 PolarHBondContact O-N 3.25Å
573L63.7Low62.6Low29 Ų2931 Ų3115%0.15218%0.175CC..Hα-helixtrans-59-41.6174.5-82.2172.4000112I93 I96 L97 L569 I570 M576 L577I93-L573 HydrophobicContact CD1-CD1 4.36Å; I93-L573 HydrophobicContact CG1-CD1 3.5Å; I93-L573 VanDerWaalsContact CG1-CD1 3.5Å; I93-L573 HydrophobicContact CG1-CG 4.23Å; I93-L573 HydrophobicContact CG2-CD1 4.5Å; I93-L573 HydrophobicContact CG2-CG 4.36Å; I96-L573 HydrophobicContact CB-CD2 4.43Å; I96-L573 HydrophobicContact CG2-CD2 3.78Å; L97-L573 HydrophobicContact CD2-CD2 4.3Å; L569-L573 PolarHBondContact O-N 3.29Å; I570-L573 PolarHBondContact O-N 2.88Å; L573-M576 PolarHBondContact O-N 3.36Å; L573-L577 WeakPolarHBondContact O-CG 3.46Å; L573-L577 PolarHBondContact O-N 2.98Å
574A63Low62.2Low17 Ų1731.2 Ų31.214%0.1418%0.176CC..Hα-helixtrans-62.5-47.217900000111.6T461 I570 C571 Q572 M576 L577 V578T461-A574 HydrophobicContact CG2-CB 4.14Å; I570-A574 PolarHBondContact O-N 3.22Å; C571-A574 PolarHBondContact O-N 3.22Å; Q572-A574 VanDerWaalsContact C-N 3.29Å; Q572-A574 PolarHBondContact O-N 3.35Å; A574-M576 VanDerWaalsContact C-N 3.31Å; A574-M576 PolarHBondContact O-N 3.34Å; A574-L577 PolarHBondContact O-N 3.31Å; A574-V578 WeakPolarHBondContact O-CB 3.39Å; A574-V578 VanDerWaalsContact O-CG2 3.29Å; A574-V578 WeakPolarHBondContact O-CG2 3.19Å; A574-V578 PolarHBondContact O-N 2.82Å
575V63.3Low62.1Low26 Ų2632.8 Ų32.816%0.15818%0.183CC..Hα-helixtrans-60-42.7176.3170.70000110.8L365 V535 C571 Q572 S579L365-V575 HydrophobicContact CD2-CG1 4.31Å; V535-V575 HydrophobicContact CG1-CG2 4.19Å; C571-V575 VanDerWaalsContact O-CG2 3.31Å; C571-V575 WeakPolarHBondContact O-CG2 3.27Å; C571-V575 PolarHBondContact O-N 3.33Å; Q572-V575 PolarHBondContact O-N 3.28Å; V575-S579 VanDerWaalsContact O-CB 3.25Å; V575-S579 WeakPolarHBondContact O-CB 3.32Å; V575-S579 PolarHBondContact O-N 3.49Å; V575-S579 PolarHBondContact O-OG 3.18Å
576M63.9Low61.9Low14 Ų1436 Ų367%0.06920%0.199CC..Hα-helixtrans-60.4-51.9176.2175.9-172.4-75.500112L97 C100 L365 A366 Q572 L573 A574 V578 S579 V580L97-M576 HydrophobicContact CD2-CE 3.1Å; L97-M576 HydrophobicContact CD2-SD 3.95Å; L97-M576 HydrophobicContact CG-CE 4.49Å; C100-M576 HydrophobicContact CB-CE 4.34Å; C100-M576 HydrophobicContact CB-SD 4.05Å; L365-M576 HydrophobicContact CB-CE 4.34Å; A366-M576 HydrophobicContact CB-CE 3.5Å; Q572-M576 PolarHBondContact O-N 3.25Å; L573-M576 PolarHBondContact O-N 3.36Å; A574-M576 VanDerWaalsContact C-N 3.31Å; A574-M576 PolarHBondContact O-N 3.34Å; M576-V578 VanDerWaalsContact C-N 3.34Å; M576-V578 PolarHBondContact O-N 3Å; M576-S579 PolarHBondContact O-N 3.33Å; M576-V580 HydrophobicContact CG-CG2 4.35Å; M576-V580 WeakPolarHBondContact O-CG2 3.49Å; M576-V580 PolarHBondContact O-N 2.84Å
577L62.8Low61.4Low115 Ų11531.6 Ų31.660%0.60218%0.183SC*.Hα-helixtrans-61.8-43.5-176.3-72.8170.9000111.7L573 A574 A581L573-L577 WeakPolarHBondContact O-CG 3.46Å; L573-L577 PolarHBondContact O-N 2.98Å; A574-L577 PolarHBondContact O-N 3.31Å; L577-A581 WeakPolarHBondContact O-CB 3.3Å; L577-A581 PolarHBondContact O-N 3.5Å
578V59.9Low60.9Low11 Ų1134.5 Ų34.57%0.06719%0.193CC..Hα-helixtrans-62.2-46.5175.2172.20000110.4A454 A457 I458 A574 M576 V580 A581 V582A454-V578 HydrophobicContact CB-CG1 3.74Å; A457-V578 HydrophobicContact CB-CG2 4.44Å; I458-V578 HydrophobicContact CD1-CG2 4.35Å; I458-V578 HydrophobicContact CG1-CG2 3.92Å; A574-V578 WeakPolarHBondContact O-CB 3.39Å; A574-V578 VanDerWaalsContact O-CG2 3.29Å; A574-V578 WeakPolarHBondContact O-CG2 3.19Å; A574-V578 PolarHBondContact O-N 2.82Å; M576-V578 VanDerWaalsContact C-N 3.34Å; M576-V578 PolarHBondContact O-N 3Å; V578-V580 VanDerWaalsContact C-N 3.34Å; V578-V580 PolarHBondContact O-N 2.74Å; V578-A581 PolarHBondContact O-N 2.72Å; V578-V582 HydrophobicContact CG1-CG2 4.31Å; V578-V582 VanDerWaalsContact O-CG2 3.32Å; V578-V582 WeakPolarHBondContact O-CG2 3.45Å; V578-V582 PolarHBondContact O-N 3.44Å
579S58.1Low60.3Low2 Ų237.8 Ų37.81%0.01422%0.217CC..Hα-helixtrans-65.2-38.2-177.2-57.20000112.5L365 V575 M576 A583L365-S579 VanDerWaalsContact CD1-CB 3.47Å; V575-S579 VanDerWaalsContact O-CB 3.25Å; V575-S579 WeakPolarHBondContact O-CB 3.32Å; V575-S579 PolarHBondContact O-N 3.49Å; V575-S579 PolarHBondContact O-OG 3.18Å; M576-S579 PolarHBondContact O-N 3.33Å; S579-A583 WeakPolarHBondContact O-CB 3.29Å; S579-A583 PolarHBondContact O-N 3.23Å
580V57.7Low59.3Low65 Ų6539.8 Ų39.839%0.39423%0.231SC..Hα-helixtrans-67.4-41.6174.8172.60000111.2L361 M576 V578 A583 V584L361-V580 HydrophobicContact CD2-CG2 4.4Å; M576-V580 HydrophobicContact CG-CG2 4.35Å; M576-V580 WeakPolarHBondContact O-CG2 3.49Å; M576-V580 PolarHBondContact O-N 2.84Å; V578-V580 VanDerWaalsContact C-N 3.34Å; V578-V580 PolarHBondContact O-N 2.74Å; V580-A583 PolarHBondContact O-N 2.92Å; V580-V584 WeakPolarHBondContact O-CG2 3.39Å; V580-V584 PolarHBondContact O-N 3.28Å
581A58.1Low58Low42 Ų4244.7 Ų44.735%0.34726%0.256SS..Hα-helixtrans-61.3-48.6176.900000111.4L577 V578 A583 V584 E585L577-A581 WeakPolarHBondContact O-CB 3.3Å; L577-A581 PolarHBondContact O-N 3.5Å; V578-A581 PolarHBondContact O-N 2.72Å; A581-A583 VanDerWaalsContact C-N 3.34Å; A581-A583 PolarHBondContact O-N 2.9Å; A581-V584 PolarHBondContact O-N 3.23Å; A581-E585 PolarHBondContact O-N 3.12Å
582V59.3Low57.7Low19 Ų1945.3 Ų45.312%0.11526%0.258CS..Hα-helixtrans-61.7-42.2176.4175.10000111F413 V578 V584 E585 L586F413-V582 HydrophobicContact CD1-CG1 4.21Å; F413-V582 HydrophobicContact CE1-CB 4.05Å; F413-V582 HydrophobicContact CE1-CG1 3.59Å; F413-V582 HydrophobicContact CZ-CB 4.3Å; F413-V582 HydrophobicContact CZ-CG1 4.22Å; V578-V582 HydrophobicContact CG1-CG2 4.31Å; V578-V582 VanDerWaalsContact O-CG2 3.32Å; V578-V582 WeakPolarHBondContact O-CG2 3.45Å; V578-V582 PolarHBondContact O-N 3.44Å; V582-V584 PolarHBondContact O-N 3.45Å; V582-E585 PolarHBondContact O-N 3.46Å; V582-L586 HydrophobicContact CG1-CD1 3.8Å; V582-L586 HydrophobicContact CG1-CG 4.12Å; V582-L586 WeakPolarHBondContact O-CB 3.48Å; V582-L586 VanDerWaalsContact O-CG 3.29Å; V582-L586 WeakPolarHBondContact O-CG 3.37Å; V582-L586 PolarHBondContact O-N 3.48Å
583A54.7Low57.4Low2 Ų247.1 Ų47.12%0.01727%0.269CS..Hα-helixtrans-60-43.6177.100000112.7F357 L361 S579 V580 A581 E587F357-A583 HydrophobicContact CE1-CB 3.79Å; F357-A583 HydrophobicContact CZ-CB 3.49Å; F357-A583 VanDerWaalsContact CZ-CB 3.49Å; L361-A583 HydrophobicContact CD1-CB 4.38Å; L361-A583 HydrophobicContact CD2-CB 3.43Å; L361-A583 VanDerWaalsContact CD2-CB 3.43Å; S579-A583 WeakPolarHBondContact O-CB 3.29Å; S579-A583 PolarHBondContact O-N 3.23Å; V580-A583 PolarHBondContact O-N 2.92Å; A581-A583 VanDerWaalsContact C-N 3.34Å; A581-A583 PolarHBondContact O-N 2.9Å; A583-E587 WeakPolarHBondContact O-CB 3.46Å; A583-E587 PolarHBondContact O-N 3.26Å
584V57.1Low57Low55 Ų5548.1 Ų48.133%0.33328%0.276SS..Hα-helixtrans-66.3-41.3176.6171.50000111.1V580 A581 V582 Q588V580-V584 WeakPolarHBondContact O-CG2 3.39Å; V580-V584 PolarHBondContact O-N 3.28Å; A581-V584 PolarHBondContact O-N 3.23Å; V582-V584 PolarHBondContact O-N 3.45Å; V584-Q588 WeakPolarHBondContact O-CB 3.36Å; V584-Q588 WeakPolarHBondContact O-CG 3.44Å; V584-Q588 PolarHBondContact O-N 3.25Å
585E60.7Low56.7Low59 Ų5949.9 Ų49.928%0.27628%0.284SS..Hα-helixtrans-65.4-44.3176.8-77.1-178.8163.500112.3T450 A581 V582 E587 Q588 S589T450-E585 HydrophobicContact CG2-CB 3.95Å; T450-E585 WeakPolarHBondContact CG2-OE2 3.46Å; A581-E585 PolarHBondContact O-N 3.12Å; V582-E585 PolarHBondContact O-N 3.46Å; E585-E587 VanDerWaalsContact C-N 3.34Å; E585-E587 PolarHBondContact O-N 3.07Å; E585-Q588 PolarHBondContact O-N 2.98Å; E585-S589 PolarHBondContact O-N 3.49Å; E585-S589 PolarHBondContact O-OG 3.11Å
586L57.8Low56.3Low68 Ų6851.4 Ų51.436%0.35629%0.292SS..Hα-helixtrans-60.9-44.2176.8-74.5173.1000111.3F413 V582 S589 S590F413-L586 HydrophobicContact CD1-CD1 3.9Å; F413-L586 HydrophobicContact CE1-CD1 4.2Å; V582-L586 HydrophobicContact CG1-CD1 3.8Å; V582-L586 HydrophobicContact CG1-CG 4.12Å; V582-L586 WeakPolarHBondContact O-CB 3.48Å; V582-L586 VanDerWaalsContact O-CG 3.29Å; V582-L586 WeakPolarHBondContact O-CG 3.37Å; V582-L586 PolarHBondContact O-N 3.48Å; L586-S589 WeakPolarHBondContact CA-OG 2.97Å; L586-S589 PolarHBondContact O-N 3.36Å; L586-S589 PolarHBondContact O-OG 3.16Å; L586-S590 PolarHBondContact O-N 2.72Å; L586-S590 VanDerWaalsContact O-N 3.12Å
587E55Low55.8Low11 Ų1153.9 Ų53.95%0.05131%0.307CS..Hα-helixtrans-67.1-38.1178.5-165.3161.4-153.300111.8S352 N354 A583 E585 S589 S590 L591S352-E587 VanDerWaalsContact CA-OE1 3.3Å; S352-E587 WeakPolarHBondContact CA-OE1 3.23Å; S352-E587 WeakPolarHBondContact CB-OE1 3.29Å; S352-E587 WeakPolarHBondContact CB-OE2 3.37Å; S352-E587 PolarHBondContact OG-OE1 3.43Å; S352-E587 PolarHBondContact OG-OE2 3.06Å; N354-E587 PolarHBondContact ND2-OE1 3.17Å; A583-E587 WeakPolarHBondContact O-CB 3.46Å; A583-E587 PolarHBondContact O-N 3.26Å; E585-E587 VanDerWaalsContact C-N 3.34Å; E585-E587 PolarHBondContact O-N 3.07Å; E587-S589 VanDerWaalsContact C-N 3.34Å; E587-S589 PolarHBondContact O-N 3.03Å; E587-S590 PolarHBondContact O-N 3.34Å; E587-S590 PolarHBondContact O-OG 3.42Å; E587-L591 PolarHBondContact O-N 3.44Å
588Q55.7Low55.2Low114 Ų11449.6 Ų49.653%0.53329%0.285SS..Hα-helixtrans-64.6-34.9172.1-78.2-175.1-11.100113.4V584 E585 S590 L591V584-Q588 WeakPolarHBondContact O-CB 3.36Å; V584-Q588 WeakPolarHBondContact O-CG 3.44Å; V584-Q588 PolarHBondContact O-N 3.25Å; E585-Q588 PolarHBondContact O-N 2.98Å; Q588-S590 VanDerWaalsContact C-N 3.26Å; Q588-S590 PolarHBondContact O-N 3.02Å; Q588-L591 PolarHBondContact O-N 3.5Å
589S54.3Low54.9Low72 Ų7252.5 Ų52.550%0.50330%0.302SS..Hα-helixtrans-73-20.2176.669.30000113.5E585 L586 E587E585-S589 PolarHBondContact O-N 3.49Å; E585-S589 PolarHBondContact O-OG 3.11Å; L586-S589 WeakPolarHBondContact CA-OG 2.97Å; L586-S589 PolarHBondContact O-N 3.36Å; L586-S589 PolarHBondContact O-OG 3.16Å; E587-S589 VanDerWaalsContact C-N 3.34Å; E587-S589 PolarHBondContact O-N 3.03Å
590S46.2Very low54.6Low45 Ų4556.8 Ų56.832%0.31533%0.326SS..Hα-helixtrans-88-16.1177.176.20000114.2L586 E587 Q588L586-S590 PolarHBondContact O-N 2.72Å; L586-S590 VanDerWaalsContact O-N 3.12Å; E587-S590 PolarHBondContact O-N 3.34Å; E587-S590 PolarHBondContact O-OG 3.42Å; Q588-S590 VanDerWaalsContact C-N 3.26Å; Q588-S590 PolarHBondContact O-N 3.02Å
591L39Very low54.3Low129 Ų12956 Ų5668%0.67532%0.32SS*.  trans-87.50173.6-76.7164.9000110.1I133 E587 Q588I133-L591 HydrophobicContact CD1-CD2 4.1Å; I133-L591 HydrophobicContact CG1-CD2 4.34Å; E587-L591 PolarHBondContact O-N 3.44Å; Q588-L591 PolarHBondContact O-N 3.5Å

Retrieved 591 of 591 residues in 760.6 ms (Link to these results)

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