A0AA82MFL0_SCHMA Loading...

Mitochondrial carrier protein-related

AlphaFold DB (G4LUL1), UniProt , Accession A0AA82MFL0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 352 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
1M24.9Very low40.7Very low231 Ų231109.1 Ų109.1100%1.13863%0.634SS**  0113.20-64.7-177.2176.500106.5G3M1-G3 PolarHBondContact O-N 3.29Å
2P30.5Very low43.3Very low128 Ų128109.6 Ų109.683%0.83163%0.626SS**  trans-67.4110.3176.328-27.8000106.6
3G27.7Very low45.2Very low62 Ų62107.6 Ų107.664%0.63961%0.611SS**  trans-60.2137.7-178.700000110.5M1 L5M1-G3 PolarHBondContact O-N 3.29Å; G3-L5 PolarHBondContact O-N 3.16Å
4N30.3Very low47.1Very low161 Ų161103.6 Ų103.686%0.86159%0.594SS**  trans-2.569.1161.5-74.4-9.1000115.4G6N4-G6 VanDerWaalsContact C-N 3.29Å; N4-G6 PolarHBondContact O-N 3.16Å
5L36.6Very low48.9Very low112 Ų11298.7 Ų98.759%0.58656%0.563SS**  trans-61.6103.4154.6-87.1148.1000103.2G3 N7 F8G3-L5 PolarHBondContact O-N 3.16Å; L5-N7 PolarHBondContact O-N 3.38Å; L5-F8 HydrophobicContact CB-CD2 4.13Å; L5-F8 HydrophobicContact CB-CE2 4.03Å; L5-F8 HydrophobicContact CD2-CE2 3.81Å
6G36.3Very low50.8Low60 Ų6092.8 Ų92.862%0.61953%0.53SS*.THydrogen-bonded Turntrans-36.4118-173.400000109.5N4 F8N4-G6 VanDerWaalsContact C-N 3.29Å; N4-G6 PolarHBondContact O-N 3.16Å; G6-F8 VanDerWaalsContact C-N 3.28Å; G6-F8 VanDerWaalsContact O-CD2 3.27Å; G6-F8 WeakPolarHBondContact O-CD2 3.47Å; G6-F8 PolarHBondContact O-N 3.3Å
7N38.4Very low52.5Low151 Ų15190.8 Ų90.881%0.80751%0.514SS*.THydrogen-bonded Turntrans-3089-168.2-80.3-22.9000111.8L5 E9L5-N7 PolarHBondContact O-N 3.38Å; N7-E9 PolarHBondContact O-N 3.32Å
8F48Very low54.1Low90 Ų9091.8 Ų91.840%0.39551%0.511SS..  trans-70.394.6172.2-75.3-82000104.2L5 G6 V10 H231L5-F8 HydrophobicContact CB-CD2 4.13Å; L5-F8 HydrophobicContact CB-CE2 4.03Å; L5-F8 HydrophobicContact CD2-CE2 3.81Å; G6-F8 VanDerWaalsContact C-N 3.28Å; G6-F8 VanDerWaalsContact O-CD2 3.27Å; G6-F8 WeakPolarHBondContact O-CD2 3.47Å; G6-F8 PolarHBondContact O-N 3.3Å; F8-V10 WeakPolarHBondContact O-CG2 3.32Å; F8-V10 PolarHBondContact O-N 3.41Å; F8-H231 AromaticContact CZ-CE1 3.9Å
9E51.8Low55.6Low90 Ų9094.8 Ų94.842%0.42152%0.521SS..  trans-55.1107.6-179.8-81.7-167.6151.500107.6N7 R259 K348 F349N7-E9 PolarHBondContact O-N 3.32Å; E9-R259 PolarHBondContact O-NH1 3.35Å; E9-K348 IonicContact OE1-NZ 3.58Å; E9-K348 PolarHBondContact OE1-NZ 3.09Å; E9-F349 HydrophobicContact CB-CE1 3.93Å; E9-F349 HydrophobicContact CB-CZ 4.16Å
10V61.5Low56.9Low88 Ų8893.7 Ų93.753%0.53351%0.513SS..  trans-84.2125.5176179.30000105.7F8 E12F8-V10 WeakPolarHBondContact O-CG2 3.32Å; F8-V10 PolarHBondContact O-N 3.41Å; V10-E12 PolarHBondContact O-N 3.15Å
11I61.5Low58.1Low27 Ų2789.6 Ų89.614%0.13849%0.49CS..  trans-61.6105.5171.3-60.5166.5000107.3L16 K337 L338 L341 F349I11-L16 HydrophobicContact CG2-CD1 3.97Å; I11-L16 HydrophobicContact CG2-CD2 4.26Å; I11-L16 HydrophobicContact CG2-CG 3.96Å; I11-K337 HydrophobicContact CD1-CB 4.2Å; I11-L338 HydrophobicContact CD1-CD2 3.99Å; I11-L341 HydrophobicContact CD1-CD1 3.78Å; I11-L341 HydrophobicContact CG1-CD1 4.31Å; I11-L341 HydrophobicContact CG2-CD1 4.37Å; I11-L341 HydrophobicContact CG2-CD2 4.35Å; I11-L341 HydrophobicContact CG2-CG 4.32Å; I11-F349 HydrophobicContact CD1-CD1 4.45Å; I11-F349 HydrophobicContact CG1-CD1 4.04Å; I11-F349 HydrophobicContact CG1-CD2 4.35Å; I11-F349 HydrophobicContact CG1-CE1 3.76Å; I11-F349 HydrophobicContact CG1-CE2 4.11Å; I11-F349 HydrophobicContact CG1-CG 4.33Å; I11-F349 HydrophobicContact CG1-CZ 3.81Å
12E71.7Confident60.9Low115 Ų11584 Ų8454%0.53746%0.46SS..  trans-77.4154178.1-65.9-172.2173.600111V10 S14 M15V10-E12 PolarHBondContact O-N 3.15Å; E12-S14 WeakPolarHBondContact CB-OG 3.36Å; E12-S14 PolarHBondContact O-N 3.18Å; E12-S14 VanDerWaalsContact O-N 3.1Å; E12-S14 PolarHBondContact OE2-OG 3.26Å; E12-M15 HydrophobicContact CB-CE 4.25Å; E12-M15 HydrophobicContact CB-CG 4.28Å; E12-M15 HydrophobicContact CB-SD 4.38Å; E12-M15 HydrophobicContact CG-CE 4.2Å; E12-M15 WeakPolarHBondContact O-CB 3.42Å; E12-M15 PolarHBondContact O-N 3.1Å
13L68.6Low63.5Low84 Ų8482 Ų8244%0.4445%0.446SS..THydrogen-bonded Turntrans-59.5-23.1176.5-169.465.9000113.1L16 F21 F22L13-L16 HydrophobicContact CD1-CD1 4.44Å; L13-F21 HydrophobicContact CD1-CD1 4.02Å; L13-F21 HydrophobicContact CD1-CE1 3.93Å; L13-F22 HydrophobicContact CD1-CE1 4.48Å; L13-F22 HydrophobicContact CD1-CZ 4.19Å; L13-F22 HydrophobicContact CD2-CZ 4.2Å
14S71.1Confident66.2Low52 Ų5281.9 Ų81.936%0.36443%0.431SS..THydrogen-bonded Turntrans-68.4-31.1175.655.40000112.9E12 L16 K342E12-S14 WeakPolarHBondContact CB-OG 3.36Å; E12-S14 PolarHBondContact O-N 3.18Å; E12-S14 VanDerWaalsContact O-N 3.1Å; E12-S14 PolarHBondContact OE2-OG 3.26Å; S14-L16 VanDerWaalsContact C-N 3.31Å; S14-K342 WeakPolarHBondContact O-CE 3.41Å; S14-K342 PolarHBondContact O-NZ 2.95Å
15M74.8Confident68.7Low29 Ų2975 Ų7514%0.14340%0.395CS..THydrogen-bonded Turntrans-80.3-13.5-178.7-56.2176.6-17800112.6E12 L341 K342 Y345 F349E12-M15 HydrophobicContact CB-CE 4.25Å; E12-M15 HydrophobicContact CB-CG 4.28Å; E12-M15 HydrophobicContact CB-SD 4.38Å; E12-M15 HydrophobicContact CG-CE 4.2Å; E12-M15 WeakPolarHBondContact O-CB 3.42Å; E12-M15 PolarHBondContact O-N 3.1Å; M15-L341 HydrophobicContact CB-CD2 4.19Å; M15-K342 WeakPolarHBondContact O-CB 3.25Å; M15-K342 WeakPolarHBondContact O-CG 3.49Å; M15-K342 PolarHBondContact O-N 3.39Å; M15-Y345 HydrophobicContact CB-CD1 4.28Å; M15-Y345 HydrophobicContact CB-CD2 4.08Å; M15-Y345 HydrophobicContact CB-CE1 4.5Å; M15-Y345 HydrophobicContact CB-CE2 4.28Å; M15-Y345 HydrophobicContact CB-CG 4.06Å; M15-Y345 HydrophobicContact CE-CD1 4.47Å; M15-Y345 HydrophobicContact CE-CE1 4.3Å; M15-Y345 HydrophobicContact CG-CD1 3.85Å; M15-Y345 HydrophobicContact CG-CD2 4.38Å; M15-Y345 HydrophobicContact CG-CE1 3.78Å; M15-Y345 HydrophobicContact CG-CE2 4.31Å; M15-Y345 HydrophobicContact CG-CG 4.15Å; M15-Y345 HydrophobicContact SD-CD1 4.01Å; M15-Y345 HydrophobicContact SD-CE1 4.28Å; M15-F349 HydrophobicContact SD-CE2 3.96Å; M15-F349 HydrophobicContact SD-CZ 4.13Å
16L78.4Confident71Confident4 Ų471 Ų712%0.02138%0.38CS..BIsolated β-bridgetrans-94.3145.2-175.4-71.9153.5000112.1I11 L13 S14 K18 F21 K337 C340I11-L16 HydrophobicContact CG2-CD1 3.97Å; I11-L16 HydrophobicContact CG2-CD2 4.26Å; I11-L16 HydrophobicContact CG2-CG 3.96Å; L13-L16 HydrophobicContact CD1-CD1 4.44Å; S14-L16 VanDerWaalsContact C-N 3.31Å; L16-K18 VanDerWaalsContact C-N 3.32Å; L16-K18 PolarHBondContact O-N 3.18Å; L16-F21 HydrophobicContact CD1-CD2 4.27Å; L16-F21 HydrophobicContact CD1-CE2 4.22Å; L16-F21 HydrophobicContact CD1-CG 4.47Å; L16-F21 HydrophobicContact CD1-CZ 4.37Å; L16-F21 HydrophobicContact CD2-CD2 4.08Å; L16-K337 HydrophobicContact CD1-CG 4.42Å; L16-K337 HydrophobicContact CD2-CB 4.23Å; L16-K337 HydrophobicContact CD2-CG 4.46Å; L16-K337 WeakPolarHBondContact CD2-O 3.38Å; L16-C340 CarbonylContact C-O 3.18Å; L16-C340 WeakPolarHBondContact CA-O 3.35Å; L16-C340 HydrophobicContact CD2-CB 3.7Å
17K80.4Confident73.4Confident60 Ų6073 Ų7326%0.26138%0.377SS..  trans-70.486.1166.8-64.7179.5-174.3177.50108.5H19 M20 F21 C340 K342 D343K17-H19 VanDerWaalsContact C-N 3.28Å; K17-H19 PolarHBondContact O-N 3.04Å; K17-H19 VanDerWaalsContact O-N 3.16Å; K17-M20 HydrophobicContact CB-CB 4.31Å; K17-M20 WeakPolarHBondContact O-CB 3.46Å; K17-M20 PolarHBondContact O-N 2.93Å; K17-F21 PolarHBondContact O-N 3.43Å; K17-C340 WeakPolarHBondContact CB-O 3.31Å; K17-C340 PolarHBondContact N-O 3.43Å; K17-K342 HydrophobicContact CG-CG 3.84Å; K17-D343 IonicContact NZ-OD1 3.64Å; K17-D343 PolarHBondContact NZ-OD1 3.2Å; K17-D343 IonicContact NZ-OD2 3.42Å; K17-D343 PolarHBondContact NZ-OD2 2.95Å
18K81.2Confident75.7Confident108 Ų10866.4 Ų66.447%0.4734%0.344SS..Hα-helixtrans-49.8-41.7-173.6-66.7-179.3-176.6179.10114.4L16 M20 F21 F22L16-K18 VanDerWaalsContact C-N 3.32Å; L16-K18 PolarHBondContact O-N 3.18Å; K18-M20 PolarHBondContact O-N 3.38Å; K18-F21 PolarHBondContact O-N 3.23Å; K18-F22 HydrophobicContact CB-CD2 4.03Å; K18-F22 HydrophobicContact CB-CE2 3.83Å; K18-F22 HydrophobicContact CD-CE2 4.34Å; K18-F22 HydrophobicContact CG-CE2 4.12Å; K18-F22 WeakPolarHBondContact O-CD2 3.37Å; K18-F22 PolarHBondContact O-N 3.45Å
19H81.9Confident77.5Confident149 Ų14966.3 Ų66.369%0.6935%0.347SS*.Hα-helixtrans-63.3-26.6-179.871.3-92000113.1K17 P23K17-H19 VanDerWaalsContact C-N 3.28Å; K17-H19 PolarHBondContact O-N 3.04Å; K17-H19 VanDerWaalsContact O-N 3.16Å; H19-P23 WeakPolarHBondContact O-CD 3.42Å; H19-P23 VanDerWaalsContact O-CG 3.27Å; H19-P23 WeakPolarHBondContact O-CG 3.38Å
20M82.9Confident79.3Confident73 Ų7365.4 Ų65.436%0.3634%0.342SS..Hα-helixtrans-91.9-41.3177.1-158.6-174.8-160.200110.7K17 K18 L24 F339K17-M20 HydrophobicContact CB-CB 4.31Å; K17-M20 WeakPolarHBondContact O-CB 3.46Å; K17-M20 PolarHBondContact O-N 2.93Å; K18-M20 PolarHBondContact O-N 3.38Å; M20-L24 VanDerWaalsContact O-CB 3.25Å; M20-L24 WeakPolarHBondContact O-CB 3.21Å; M20-L24 PolarHBondContact O-N 2.99Å; M20-F339 HydrophobicContact CE-CD1 4.16Å; M20-F339 HydrophobicContact CE-CE1 3.26Å; M20-F339 HydrophobicContact CE-CZ 3.8Å; M20-F339 HydrophobicContact SD-CD1 4.32Å; M20-F339 HydrophobicContact SD-CE1 3.98Å
21F82.3Confident80.7Confident8 Ų863.5 Ų63.54%0.03533%0.331CS..Hα-helixtrans-65.5-46.1-176.1179.7-103000113.5L13 L16 K17 K18 S25 Y333 M336 K337 C340L13-F21 HydrophobicContact CD1-CD1 4.02Å; L13-F21 HydrophobicContact CD1-CE1 3.93Å; L16-F21 HydrophobicContact CD1-CD2 4.27Å; L16-F21 HydrophobicContact CD1-CE2 4.22Å; L16-F21 HydrophobicContact CD1-CG 4.47Å; L16-F21 HydrophobicContact CD1-CZ 4.37Å; L16-F21 HydrophobicContact CD2-CD2 4.08Å; K17-F21 PolarHBondContact O-N 3.43Å; K18-F21 PolarHBondContact O-N 3.23Å; F21-S25 WeakPolarHBondContact CZ-OG 3.21Å; F21-S25 VanDerWaalsContact O-CB 3.23Å; F21-S25 WeakPolarHBondContact O-CB 3.49Å; F21-S25 PolarHBondContact O-N 3.44Å; F21-S25 PolarHBondContact O-OG 3.32Å; F21-Y333 AromaticContact CE2-CE2 3.97Å; F21-Y333 HydrophobicContact CE2-CE2 3.97Å; F21-Y333 AromaticContact CZ-CE2 3.54Å; F21-Y333 HydrophobicContact CZ-CE2 3.54Å; F21-Y333 AromaticContact CZ-CZ 3.83Å; F21-M336 HydrophobicContact CD2-CE 3.98Å; F21-M336 HydrophobicContact CE2-CE 3.59Å; F21-M336 HydrophobicContact CZ-CE 4.3Å; F21-K337 HydrophobicContact CE2-CG 3.72Å; F21-K337 HydrophobicContact CZ-CG 4.38Å; F21-C340 HydrophobicContact CB-CB 4.03Å; F21-C340 HydrophobicContact CD2-CB 4.16Å
22F82.9Confident82.1Confident114 Ų11462.3 Ų62.350%0.533%0.325SS..Hα-helixtrans-65.5-48.7-175.9-72.3-61.1000113.1L13 K18 L24 S25 G26L13-F22 HydrophobicContact CD1-CE1 4.48Å; L13-F22 HydrophobicContact CD1-CZ 4.19Å; L13-F22 HydrophobicContact CD2-CZ 4.2Å; K18-F22 HydrophobicContact CB-CD2 4.03Å; K18-F22 HydrophobicContact CB-CE2 3.83Å; K18-F22 HydrophobicContact CD-CE2 4.34Å; K18-F22 HydrophobicContact CG-CE2 4.12Å; K18-F22 WeakPolarHBondContact O-CD2 3.37Å; K18-F22 PolarHBondContact O-N 3.45Å; F22-L24 PolarHBondContact O-N 2.88Å; F22-S25 PolarHBondContact O-N 3.37Å; F22-G26 PolarHBondContact O-N 3.36Å
23P84.6Confident83Confident84 Ų8459.9 Ų59.955%0.54531%0.313SS..Hα-helixtrans-61.8-42.4176.3-24.335.6000112.7H19 G26 L27H19-P23 WeakPolarHBondContact O-CD 3.42Å; H19-P23 VanDerWaalsContact O-CG 3.27Å; H19-P23 WeakPolarHBondContact O-CG 3.38Å; P23-G26 PolarHBondContact O-N 3.34Å; P23-L27 WeakPolarHBondContact O-CB 3.44Å; P23-L27 PolarHBondContact O-N 3.35Å
24L85.1Confident84.3Confident61 Ų6157.4 Ų57.432%0.31930%0.302SS..Hα-helixtrans-67.1-40.1-179.2-165.159.7000111.6M20 F22 L27 G28 M336 F339M20-L24 VanDerWaalsContact O-CB 3.25Å; M20-L24 WeakPolarHBondContact O-CB 3.21Å; M20-L24 PolarHBondContact O-N 2.99Å; F22-L24 PolarHBondContact O-N 2.88Å; L24-L27 PolarHBondContact O-N 3.29Å; L24-G28 PolarHBondContact O-N 2.97Å; L24-M336 VanDerWaalsContact C-SD 3.52Å; L24-M336 HydrophobicContact CB-CG 4.29Å; L24-M336 HydrophobicContact CB-SD 3.9Å; L24-M336 HydrophobicContact CD2-CG 3.41Å; L24-M336 VanDerWaalsContact CD2-CG 3.41Å; L24-M336 HydrophobicContact CD2-SD 4.04Å; L24-M336 HydrophobicContact CG-CG 3.67Å; L24-M336 HydrophobicContact CG-SD 3.56Å; L24-M336 VanDerWaalsContact CG-SD 3.56Å; L24-F339 HydrophobicContact CD2-CD1 4.16Å
25S82.6Confident85.3Confident17 Ų1759.5 Ų59.512%0.11931%0.309CS..Hα-helixtrans-61.6-43.8172.4-58.10000111.8F21 F22 G28 N29 M336F21-S25 WeakPolarHBondContact CZ-OG 3.21Å; F21-S25 VanDerWaalsContact O-CB 3.23Å; F21-S25 WeakPolarHBondContact O-CB 3.49Å; F21-S25 PolarHBondContact O-N 3.44Å; F21-S25 PolarHBondContact O-OG 3.32Å; F22-S25 PolarHBondContact O-N 3.37Å; S25-G28 PolarHBondContact O-N 3.46Å; S25-N29 WeakPolarHBondContact O-CB 3.48Å; S25-N29 PolarHBondContact O-N 3.48Å; S25-M336 WeakPolarHBondContact OG-CE 3.5Å
26G84.3Confident86.2Confident26 Ų2658.7 Ų58.727%0.26831%0.305SS..Hα-helixtrans-60.7-47.5177.200000111.8F22 P23 N29 F30F22-G26 PolarHBondContact O-N 3.36Å; P23-G26 PolarHBondContact O-N 3.34Å; G26-N29 PolarHBondContact O-N 2.84Å; G26-F30 WeakPolarHBondContact O-CB 3.21Å; G26-F30 PolarHBondContact O-N 3.01Å
27L86.7Confident87.1Confident104 Ų10458.5 Ų58.555%0.54530%0.304SS..Hα-helixtrans-65.5-40.9177.6-174.364.3000112.1P23 L24 F30 T31P23-L27 WeakPolarHBondContact O-CB 3.44Å; P23-L27 PolarHBondContact O-N 3.35Å; L24-L27 PolarHBondContact O-N 3.29Å; L27-F30 PolarHBondContact O-N 3.41Å; L27-T31 WeakPolarHBondContact O-CB 3.42Å; L27-T31 PolarHBondContact O-N 2.8Å; L27-T31 PolarHBondContact O-OG1 3.03Å
28G86.9Confident87.8Confident11 Ų1156.5 Ų56.511%0.11330%0.297CS..Hα-helixtrans-60.9-46.1175.600000112.1L24 S25 T31 A32 W328L24-G28 PolarHBondContact O-N 2.97Å; S25-G28 PolarHBondContact O-N 3.46Å; G28-T31 PolarHBondContact O-N 3Å; G28-A32 PolarHBondContact O-N 3.39Å; G28-W328 PolarHBondContact O-NE1 3.14Å
29N86Confident88.6Confident88 Ų8853.5 Ų53.547%0.47128%0.284SS..Hα-helixtrans-65.1-40.9175.7-78.3-15.3000112.3S25 G26 T31 A32 Q33S25-N29 WeakPolarHBondContact O-CB 3.48Å; S25-N29 PolarHBondContact O-N 3.48Å; G26-N29 PolarHBondContact O-N 2.84Å; N29-T31 VanDerWaalsContact C-N 3.34Å; N29-T31 PolarHBondContact O-N 2.95Å; N29-A32 WeakPolarHBondContact O-CB 3.41Å; N29-A32 PolarHBondContact O-N 2.83Å; N29-Q33 WeakPolarHBondContact O-CB 3.12Å; N29-Q33 WeakPolarHBondContact O-CG 3.5Å; N29-Q33 PolarHBondContact O-N 3.44Å
30F90Very high89.2Confident71 Ų7147 Ų4731%0.31126%0.255SS..Hα-helixtrans-61.4-43.6175.8-179.9-100.8000111.8G26 L27 Q33 T34 Y78 I85G26-F30 WeakPolarHBondContact O-CB 3.21Å; G26-F30 PolarHBondContact O-N 3.01Å; L27-F30 PolarHBondContact O-N 3.41Å; F30-Q33 PolarHBondContact O-N 2.92Å; F30-T34 WeakPolarHBondContact O-CB 3.4Å; F30-T34 PolarHBondContact O-N 3.39Å; F30-T34 PolarHBondContact O-OG1 3.06Å; F30-Y78 WeakPolarHBondContact CZ-OH 3.46Å; F30-I85 HydrophobicContact CB-CD1 3.98Å; F30-I85 HydrophobicContact CD2-CD1 3.94Å; F30-I85 HydrophobicContact CG-CD1 4.24Å
31T91.3Very high89.8Confident49 Ų4943.6 Ų43.630%0.30124%0.238SC..Hα-helixtrans-62.8-46.8177.1-54.40000110.9L27 G28 N29 Q33 T34 L35 W328L27-T31 WeakPolarHBondContact O-CB 3.42Å; L27-T31 PolarHBondContact O-N 2.8Å; L27-T31 PolarHBondContact O-OG1 3.03Å; G28-T31 PolarHBondContact O-N 3Å; N29-T31 VanDerWaalsContact C-N 3.34Å; N29-T31 PolarHBondContact O-N 2.95Å; T31-Q33 VanDerWaalsContact C-N 3.33Å; T31-Q33 PolarHBondContact O-N 3.39Å; T31-T34 WeakPolarHBondContact O-CB 3.36Å; T31-T34 PolarHBondContact O-N 2.67Å; T31-T34 VanDerWaalsContact O-N 3.15Å; T31-L35 HydrophobicContact CG2-CD1 4.16Å; T31-L35 WeakPolarHBondContact O-CG 3.39Å; T31-L35 PolarHBondContact O-N 2.7Å; T31-W328 HydrophobicContact CG2-CH2 3.53Å; T31-W328 HydrophobicContact CG2-CZ2 3.6Å
32A90.5Very high90.4Very high1 Ų143.3 Ų43.31%0.00824%0.237CC..Hα-helixtrans-54.8-49.117500000111.7G28 N29 T34 L35 L36 W328G28-A32 PolarHBondContact O-N 3.39Å; N29-A32 WeakPolarHBondContact O-CB 3.41Å; N29-A32 PolarHBondContact O-N 2.83Å; A32-T34 VanDerWaalsContact C-N 3.27Å; A32-T34 PolarHBondContact O-N 3.13Å; A32-L35 PolarHBondContact O-N 3.07Å; A32-L36 VanDerWaalsContact O-CB 3.29Å; A32-L36 WeakPolarHBondContact O-CB 3.4Å; A32-L36 WeakPolarHBondContact O-CG 3.43Å; A32-L36 PolarHBondContact O-N 3.03Å; A32-W328 HydrophobicContact CB-CD2 4.09Å; A32-W328 HydrophobicContact CB-CG 3.76Å
33Q91Very high91Very high64 Ų6438.7 Ų38.730%0.29922%0.216SC..Hα-helixtrans-64.5-34.2-178.6-69.1-79.54600112N29 F30 T31 Y37N29-Q33 WeakPolarHBondContact O-CB 3.12Å; N29-Q33 WeakPolarHBondContact O-CG 3.5Å; N29-Q33 PolarHBondContact O-N 3.44Å; F30-Q33 PolarHBondContact O-N 2.92Å; T31-Q33 VanDerWaalsContact C-N 3.33Å; T31-Q33 PolarHBondContact O-N 3.39Å; Q33-Y37 WeakPolarHBondContact O-CA 3.49Å; Q33-Y37 WeakPolarHBondContact O-CB 3.43Å; Q33-Y37 PolarHBondContact O-N 3.44Å
34T94.3Very high91.5Very high33 Ų3335 Ų3520%0.20219%0.192CC..Hα-helixtrans-70.3-43.9177.8-55.20000111.8F30 T31 A32 L36 Y75 Y78F30-T34 WeakPolarHBondContact O-CB 3.4Å; F30-T34 PolarHBondContact O-N 3.39Å; F30-T34 PolarHBondContact O-OG1 3.06Å; T31-T34 WeakPolarHBondContact O-CB 3.36Å; T31-T34 PolarHBondContact O-N 2.67Å; T31-T34 VanDerWaalsContact O-N 3.15Å; A32-T34 VanDerWaalsContact C-N 3.27Å; A32-T34 PolarHBondContact O-N 3.13Å; T34-L36 VanDerWaalsContact C-N 3.33Å; T34-Y75 HydrophobicContact CG2-CE1 4.2Å; T34-Y75 VanDerWaalsContact O-CE1 3.28Å; T34-Y75 WeakPolarHBondContact O-CE1 3.48Å; T34-Y75 PolarHBondContact O-OH 3.35Å; T34-Y75 VanDerWaalsContact O-OH 3.08Å; T34-Y78 HydrophobicContact CG2-CE2 4.02Å; T34-Y78 WeakPolarHBondContact CG2-OH 3.18Å; T34-Y78 PolarHBondContact OG1-OH 3.21Å
35L93.5Very high91.9Very high96 Ų9632.1 Ų32.150%0.50318%0.177SC..Hα-helixtrans-67.2-35.9176.6-68.3174.6000112.1T31 A32 P38 W328T31-L35 HydrophobicContact CG2-CD1 4.16Å; T31-L35 WeakPolarHBondContact O-CG 3.39Å; T31-L35 PolarHBondContact O-N 2.7Å; A32-L35 PolarHBondContact O-N 3.07Å; L35-P38 WeakPolarHBondContact O-CD 3.2Å; L35-W328 HydrophobicContact CD1-CE3 4.14Å; L35-W328 HydrophobicContact CD1-CH2 3.84Å; L35-W328 HydrophobicContact CD1-CZ3 3.48Å; L35-W328 VanDerWaalsContact CD1-CZ3 3.48Å
36L94.3Very high92.3Very high11 Ų1131.7 Ų31.76%0.05817%0.173CC..Hα-helixtrans-90-7.7-177.1-61.7174.6000113.9A32 T34 P38 F39 V40 Q321 F324 H325A32-L36 VanDerWaalsContact O-CB 3.29Å; A32-L36 WeakPolarHBondContact O-CB 3.4Å; A32-L36 WeakPolarHBondContact O-CG 3.43Å; A32-L36 PolarHBondContact O-N 3.03Å; T34-L36 VanDerWaalsContact C-N 3.33Å; L36-P38 VanDerWaalsContact C-CD 3.46Å; L36-F39 PolarHBondContact O-N 2.94Å; L36-F39 VanDerWaalsContact O-N 3.16Å; L36-V40 PolarHBondContact O-N 2.99Å; L36-Q321 HydrophobicContact CB-CG 4.27Å; L36-F324 HydrophobicContact CD2-CB 3.55Å; L36-F324 HydrophobicContact CD2-CG 4.48Å; L36-H325 HydrophobicContact CD1-CB 3.66Å
37Y95.7Very high92.8Very high1 Ų130.5 Ų30.50%0.00416%0.16CC..Hα-helixtrans-55.3-42.9-178.8-174.1-88.4000113.8Q33 F39 V40 L41 L74 Y75 S76 G77 Y78 R81 M140Q33-Y37 WeakPolarHBondContact O-CA 3.49Å; Q33-Y37 WeakPolarHBondContact O-CB 3.43Å; Q33-Y37 PolarHBondContact O-N 3.44Å; Y37-F39 PolarHBondContact O-N 3.44Å; Y37-V40 WeakPolarHBondContact O-CA 3.33Å; Y37-V40 WeakPolarHBondContact O-CB 3.23Å; Y37-V40 PolarHBondContact O-N 3.48Å; Y37-L41 HydrophobicContact CE1-CB 4.16Å; Y37-L41 HydrophobicContact CE1-CD1 4.29Å; Y37-L41 PolarHBondContact O-N 2.91Å; Y37-L74 WeakPolarHBondContact CD1-O 3.32Å; Y37-L74 VanDerWaalsContact CE1-O 3.27Å; Y37-L74 WeakPolarHBondContact CE1-O 3.38Å; Y37-Y75 AromaticContact CD1-CD1 3.9Å; Y37-Y75 HydrophobicContact CD1-CD1 3.9Å; Y37-Y75 HydrophobicContact CD1-CE1 4.42Å; Y37-Y75 HydrophobicContact CD1-CG 4.32Å; Y37-Y75 VanDerWaalsContact CE1-CA 3.49Å; Y37-Y75 HydrophobicContact CG-CD1 4.35Å; Y37-S76 PolarHBondContact OH-O 2.7Å; Y37-G77 WeakPolarHBondContact OH-CA 3.38Å; Y37-G77 PolarHBondContact OH-O 3.41Å; Y37-Y78 HydrophobicContact CD1-CD2 4.32Å; Y37-Y78 AromaticContact CD2-CD2 3.61Å; Y37-Y78 HydrophobicContact CD2-CD2 3.61Å; Y37-Y78 HydrophobicContact CD2-CG 4.38Å; Y37-Y78 VanDerWaalsContact CE2-CA 3.45Å; Y37-Y78 HydrophobicContact CE2-CD2 4.12Å; Y37-Y78 AromaticContact CG-CD2 3.72Å; Y37-Y78 HydrophobicContact CG-CD2 3.72Å; Y37-Y78 HydrophobicContact CG-CG 4.44Å; Y37-Y78 VanDerWaalsContact CZ-CA 3.44Å; Y37-Y78 PolarHBondContact OH-N 2.99Å; Y37-R81 HydrophobicContact CE2-CB 3.83Å; Y37-R81 HydrophobicContact CE2-CG 4.19Å; Y37-M140 HydrophobicContact CE2-CE 3.54Å; Y37-M140 WeakPolarHBondContact OH-CE 3.42Å; Y37-M140 WeakPolarHBondContact OH-CG 3.4Å
38P96.8Very high93Very high17 Ų1725.7 Ų25.711%0.1114%0.135CC..Hα-helixtrans-53.3-39.9177.3-30.238.6000113.2L35 L36 V40 L41 L42 L74 Y75L35-P38 WeakPolarHBondContact O-CD 3.2Å; L36-P38 VanDerWaalsContact C-CD 3.46Å; P38-V40 VanDerWaalsContact C-N 3.32Å; P38-V40 PolarHBondContact O-N 3.48Å; P38-L41 PolarHBondContact O-N 3.47Å; P38-L42 WeakPolarHBondContact O-CB 3.46Å; P38-L42 WeakPolarHBondContact O-CD1 3.26Å; P38-L42 WeakPolarHBondContact O-CG 3.49Å; P38-L42 PolarHBondContact O-N 3.24Å; P38-L74 HydrophobicContact CB-CB 4.06Å; P38-L74 HydrophobicContact CB-CD1 4.39Å; P38-L74 HydrophobicContact CB-CD2 4.4Å; P38-L74 HydrophobicContact CG-CB 4.23Å; P38-Y75 HydrophobicContact CG-CE2 3.9Å
39F96.2Very high92.9Very high46 Ų4625.8 Ų25.820%0.20213%0.133CC..Hα-helixtrans-69.1-31177.9-66.9-74.9000112.7L36 Y37 R43 L58 I320 Q321L36-F39 PolarHBondContact O-N 2.94Å; L36-F39 VanDerWaalsContact O-N 3.16Å; Y37-F39 PolarHBondContact O-N 3.44Å; F39-R43 WeakPolarHBondContact O-CB 3.32Å; F39-R43 PolarHBondContact O-N 3.42Å; F39-L58 HydrophobicContact CE1-CD2 4.49Å; F39-I320 HydrophobicContact CD1-CB 4.29Å; F39-I320 HydrophobicContact CD1-CG2 3.95Å; F39-I320 HydrophobicContact CD2-CG2 4.5Å; F39-I320 HydrophobicContact CE1-CB 4.15Å; F39-I320 HydrophobicContact CE1-CD1 4.29Å; F39-I320 HydrophobicContact CE1-CG2 3.47Å; F39-I320 VanDerWaalsContact CE1-CG2 3.47Å; F39-I320 HydrophobicContact CE2-CG2 4.07Å; F39-I320 HydrophobicContact CG-CG2 4.44Å; F39-I320 HydrophobicContact CZ-CG2 3.54Å; F39-Q321 HydrophobicContact CB-CB 3.96Å; F39-Q321 HydrophobicContact CB-CG 4.3Å
40V95.4Very high92.5Very high13 Ų1323 Ų238%0.07912%0.117CC..Hα-helixtrans-65.7-48.5172.5-179.40000110.4L36 Y37 P38 L42 R43 T44 M140L36-V40 PolarHBondContact O-N 2.99Å; Y37-V40 WeakPolarHBondContact O-CA 3.33Å; Y37-V40 WeakPolarHBondContact O-CB 3.23Å; Y37-V40 PolarHBondContact O-N 3.48Å; P38-V40 VanDerWaalsContact C-N 3.32Å; P38-V40 PolarHBondContact O-N 3.48Å; V40-L42 PolarHBondContact O-N 3.22Å; V40-R43 WeakPolarHBondContact O-CB 3.38Å; V40-R43 PolarHBondContact O-N 2.95Å; V40-T44 WeakPolarHBondContact O-CB 3.33Å; V40-T44 PolarHBondContact O-N 3.21Å; V40-T44 PolarHBondContact O-OG1 3.36Å; V40-T44 VanDerWaalsContact O-OG1 3.12Å; V40-M140 HydrophobicContact CG1-CE 3.7Å; V40-M140 HydrophobicContact CG1-SD 4.38Å
41L95.6Very high91.6Very high0 Ų020.9 Ų20.90%012%0.115CC..Hα-helixtrans-60.1-47.5178.2175.8146000111.4Y37 P38 R43 T44 R45 G73 L74 M140Y37-L41 HydrophobicContact CE1-CB 4.16Å; Y37-L41 HydrophobicContact CE1-CD1 4.29Å; Y37-L41 PolarHBondContact O-N 2.91Å; P38-L41 PolarHBondContact O-N 3.47Å; L41-R43 VanDerWaalsContact C-N 3.34Å; L41-R43 PolarHBondContact O-N 3.44Å; L41-T44 PolarHBondContact O-N 3.23Å; L41-R45 WeakPolarHBondContact O-CG 3.48Å; L41-R45 PolarHBondContact O-N 3.02Å; L41-G73 VanDerWaalsContact CD1-O 3.22Å; L41-G73 WeakPolarHBondContact CD1-O 3.35Å; L41-L74 HydrophobicContact CD2-CD2 4.38Å; L41-M140 HydrophobicContact CB-CG 4.3Å; L41-M140 HydrophobicContact CD1-CB 4.26Å; L41-M140 HydrophobicContact CD1-CG 4.21Å; L41-M140 HydrophobicContact CG-CB 4.21Å; L41-M140 HydrophobicContact CG-CG 4.3Å
42L95.2Very high90.6Very high2 Ų221.7 Ų21.71%0.0113%0.127CC..Hα-helixtrans-62.6-42.9178.9-69161.8000111.1P38 V40 R45 L46 L58 A61 I62 V65 L74P38-L42 WeakPolarHBondContact O-CB 3.46Å; P38-L42 WeakPolarHBondContact O-CD1 3.26Å; P38-L42 WeakPolarHBondContact O-CG 3.49Å; P38-L42 PolarHBondContact O-N 3.24Å; V40-L42 PolarHBondContact O-N 3.22Å; L42-R45 PolarHBondContact O-N 3.33Å; L42-L46 WeakPolarHBondContact O-CB 3.31Å; L42-L46 WeakPolarHBondContact O-CG 3.4Å; L42-L46 PolarHBondContact O-N 2.84Å; L42-L58 HydrophobicContact CB-CD1 3.85Å; L42-L58 HydrophobicContact CD1-CD1 3.88Å; L42-L58 HydrophobicContact CG-CD1 4.33Å; L42-A61 HydrophobicContact CD2-CB 3.77Å; L42-I62 HydrophobicContact CD1-CD1 4.17Å; L42-I62 HydrophobicContact CD1-CG1 3.44Å; L42-I62 VanDerWaalsContact CD1-CG1 3.44Å; L42-I62 HydrophobicContact CD2-CG1 4.12Å; L42-I62 HydrophobicContact CG-CG1 4.44Å; L42-V65 HydrophobicContact CD2-CG2 4.42Å; L42-L74 HydrophobicContact CD1-CD2 4.21Å; L42-L74 HydrophobicContact CD2-CD2 4.16Å; L42-L74 HydrophobicContact CG-CD2 4.17Å
43R95Very high89.6Confident18 Ų1824.2 Ų24.27%0.06814%0.138CC..Hα-helixtrans-57.8-51.1174.2-176.9-171.3-171.8-152.12.6111.3F39 V40 L41 R45 L46 Q47 N279 D282 A317F39-R43 WeakPolarHBondContact O-CB 3.32Å; F39-R43 PolarHBondContact O-N 3.42Å; V40-R43 WeakPolarHBondContact O-CB 3.38Å; V40-R43 PolarHBondContact O-N 2.95Å; L41-R43 VanDerWaalsContact C-N 3.34Å; L41-R43 PolarHBondContact O-N 3.44Å; R43-R45 VanDerWaalsContact C-N 3.34Å; R43-R45 PolarHBondContact O-N 3.45Å; R43-L46 CarbonylContact O-C 3.59Å; R43-L46 PolarHBondContact O-N 3.33Å; R43-L46 VanDerWaalsContact O-N 3.16Å; R43-Q47 HydrophobicContact CG-CG 4.23Å; R43-Q47 WeakPolarHBondContact O-CB 3.48Å; R43-Q47 VanDerWaalsContact O-CG 3.26Å; R43-Q47 WeakPolarHBondContact O-CG 3.44Å; R43-Q47 PolarHBondContact O-N 3.06Å; R43-N279 PolarHBondContact NH2-OD1 2.85Å; R43-D282 IonicContact CZ-OD2 2.6Å; R43-D282 IonicContact NE-OD2 3.97Å; R43-D282 IonicContact NH1-OD2 2.85Å; R43-D282 PolarHBondContact NH1-OD2 3.27Å; R43-D282 IonicContact NH2-OD2 3.86Å; R43-D282 PolarHBondContact NH2-OD2 2.92Å; R43-A317 HydrophobicContact CB-CB 3.76Å; R43-A317 HydrophobicContact CG-CB 4.43Å
44T94.8Very high88.5Confident6 Ų621.4 Ų21.44%0.03713%0.126CC..Hα-helixtrans-58.2-45.4180-66.20000111.4V40 L41 Q47 L48 Q137 M140 V141 V286V40-T44 WeakPolarHBondContact O-CB 3.33Å; V40-T44 PolarHBondContact O-N 3.21Å; V40-T44 PolarHBondContact O-OG1 3.36Å; V40-T44 VanDerWaalsContact O-OG1 3.12Å; L41-T44 PolarHBondContact O-N 3.23Å; T44-Q47 PolarHBondContact O-N 2.89Å; T44-L48 HydrophobicContact CG2-CD1 3.75Å; T44-L48 WeakPolarHBondContact O-CB 3.46Å; T44-L48 WeakPolarHBondContact O-CD1 3.28Å; T44-L48 WeakPolarHBondContact O-CG 3.34Å; T44-L48 PolarHBondContact O-N 3.29Å; T44-L48 VanDerWaalsContact O-N 3.07Å; T44-Q137 HydrophobicContact CG2-CB 4.23Å; T44-Q137 HydrophobicContact CG2-CG 4.21Å; T44-M140 HydrophobicContact CG2-CB 4.3Å; T44-M140 HydrophobicContact CG2-SD 4.14Å; T44-V141 HydrophobicContact CG2-CG1 4.08Å; T44-V286 HydrophobicContact CG2-CG1 3.9Å
45R93.3Very high87.9Confident0 Ų019.9 Ų19.90%012%0.116CC..Hα-helixtrans-61.9-44.5175.1-72.3179.7-177-153.35.3112.3L41 L42 R43 Q47 L48 Q49 Y55 E69 M140 V141 L168L41-R45 WeakPolarHBondContact O-CG 3.48Å; L41-R45 PolarHBondContact O-N 3.02Å; L42-R45 PolarHBondContact O-N 3.33Å; R43-R45 VanDerWaalsContact C-N 3.34Å; R43-R45 PolarHBondContact O-N 3.45Å; R45-Q47 VanDerWaalsContact C-N 3.34Å; R45-Q47 PolarHBondContact O-N 3.33Å; R45-L48 PolarHBondContact O-N 3.07Å; R45-Q49 PolarHBondContact O-N 3.35Å; R45-Q49 VanDerWaalsContact O-N 3.07Å; R45-Y55 HydrophobicContact CB-CE2 3.97Å; R45-Y55 PolarHBondContact NH1-OH 3.36Å; R45-E69 IonicContact CZ-OE1 2.76Å; R45-E69 VanDerWaalsContact CZ-OE1 3.23Å; R45-E69 IonicContact CZ-OE2 3.53Å; R45-E69 IonicContact NH1-OE1 3.03Å; R45-E69 PolarHBondContact NH1-OE1 3.27Å; R45-E69 IonicContact NH1-OE2 3.97Å; R45-E69 IonicContact NH2-OE1 2.73Å; R45-E69 PolarHBondContact NH2-OE1 3.47Å; R45-E69 IonicContact NH2-OE2 2.67Å; R45-E69 PolarHBondContact NH2-OE2 2.86Å; R45-M140 VanDerWaalsContact CZ-O 3.27Å; R45-M140 PolarHBondContact NE-O 3.35Å; R45-M140 PolarHBondContact NH2-O 2.95Å; R45-V141 HydrophobicContact CG-CG1 4.01Å; R45-L168 VanDerWaalsContact O-CD2 3.29Å; R45-L168 WeakPolarHBondContact O-CD2 3.33Å
46L92.6Very high87.3Confident8 Ų825.7 Ų25.74%0.04213%0.131CC..Hα-helixtrans-65.5-34.7177.8-72.2173.3000112.5L42 R43 Q49 Y55 L58 A61 K313 A317L42-L46 WeakPolarHBondContact O-CB 3.31Å; L42-L46 WeakPolarHBondContact O-CG 3.4Å; L42-L46 PolarHBondContact O-N 2.84Å; R43-L46 CarbonylContact O-C 3.59Å; R43-L46 PolarHBondContact O-N 3.33Å; R43-L46 VanDerWaalsContact O-N 3.16Å; L46-Q49 VanDerWaalsContact CD2-NE2 3.29Å; L46-Q49 WeakPolarHBondContact O-CG 3.27Å; L46-Y55 HydrophobicContact CD2-CD2 4.41Å; L46-Y55 HydrophobicContact CD2-CG 4.46Å; L46-L58 HydrophobicContact CD1-CB 4.36Å; L46-L58 HydrophobicContact CD1-CD1 4.16Å; L46-A61 HydrophobicContact CD2-CB 4.34Å; L46-K313 WeakPolarHBondContact O-CD 3.43Å; L46-K313 WeakPolarHBondContact O-CE 3.28Å; L46-K313 WeakPolarHBondContact O-CG 3.21Å; L46-A317 HydrophobicContact CD1-CB 4.39Å
47Q93.4Very high87Confident1 Ų126.5 Ų26.51%0.00514%0.143CC..Hα-helixtrans-74.1-29178-71.3173.5-44.300112.7R43 T44 R45 D282 V283 K313R43-Q47 HydrophobicContact CG-CG 4.23Å; R43-Q47 WeakPolarHBondContact O-CB 3.48Å; R43-Q47 VanDerWaalsContact O-CG 3.26Å; R43-Q47 WeakPolarHBondContact O-CG 3.44Å; R43-Q47 PolarHBondContact O-N 3.06Å; T44-Q47 PolarHBondContact O-N 2.89Å; R45-Q47 VanDerWaalsContact C-N 3.34Å; R45-Q47 PolarHBondContact O-N 3.33Å; Q47-D282 PolarHBondContact NE2-OD2 3.15Å; Q47-V283 HydrophobicContact CG-CG2 3.98Å; Q47-K313 WeakPolarHBondContact O-CD 3.32Å; Q47-K313 WeakPolarHBondContact O-CE 3.46Å; Q47-K313 PolarHBondContact O-NZ 3.29Å
48L90.4Very high86.9Confident4 Ų427.3 Ų27.32%0.02115%0.147CC..Hα-helixtrans-88.1-37.2-177.3-75.9165000114.3T44 R45 V141 L168 V286 R287 V290T44-L48 HydrophobicContact CG2-CD1 3.75Å; T44-L48 WeakPolarHBondContact O-CB 3.46Å; T44-L48 WeakPolarHBondContact O-CD1 3.28Å; T44-L48 WeakPolarHBondContact O-CG 3.34Å; T44-L48 PolarHBondContact O-N 3.29Å; T44-L48 VanDerWaalsContact O-N 3.07Å; R45-L48 PolarHBondContact O-N 3.07Å; L48-V141 HydrophobicContact CD1-CG1 3.55Å; L48-L168 HydrophobicContact CB-CD2 3.79Å; L48-V286 HydrophobicContact CD1-CG1 3.79Å; L48-V286 HydrophobicContact CD2-CG1 4.02Å; L48-V286 HydrophobicContact CG-CG1 3.69Å; L48-R287 HydrophobicContact CD2-CB 4.45Å; L48-R287 HydrophobicContact CD2-CG 3.96Å; L48-R287 PolarHBondContact O-NH1 3.32Å; L48-R287 VanDerWaalsContact O-NH1 3.12Å; L48-V290 HydrophobicContact CD1-CB 3.93Å; L48-V290 HydrophobicContact CD1-CG1 3.83Å; L48-V290 HydrophobicContact CD1-CG2 3.88Å; L48-V290 HydrophobicContact CD2-CB 3.84Å; L48-V290 HydrophobicContact CD2-CG1 4.11Å; L48-V290 HydrophobicContact CD2-CG2 4.47Å
49Q86.2Confident86.7Confident12 Ų1232.2 Ų32.26%0.05618%0.176CC..SBendtrans-55.1145.6-179.762170.6-14.900111.7R45 L46 Y55 L168 K313R45-Q49 PolarHBondContact O-N 3.35Å; R45-Q49 VanDerWaalsContact O-N 3.07Å; L46-Q49 VanDerWaalsContact CD2-NE2 3.29Å; L46-Q49 WeakPolarHBondContact O-CG 3.27Å; Q49-Y55 PolarHBondContact NE2-O 2.88Å; Q49-Y55 VanDerWaalsContact NE2-O 3.13Å; Q49-Y55 PolarHBondContact OE1-O 3.1Å; Q49-L168 HydrophobicContact CB-CD2 4.02Å; Q49-L168 HydrophobicContact CB-CG 4.38Å; Q49-K313 WeakPolarHBondContact O-CE 3.21Å; Q49-K313 PolarHBondContact O-NZ 3.31Å
50E77.9Confident86.5Confident31 Ų3133.5 Ų33.515%0.14518%0.183CC..SBendtrans-93.4117.2176.9-60.8-170.9146.200109.4Q53 R287E50-Q53 WeakPolarHBondContact O-CG 3.18Å; E50-R287 IonicContact OE1-CZ 3.23Å; E50-R287 IonicContact OE1-NH1 2.7Å; E50-R287 IonicContact OE1-NH2 2.88Å; E50-R287 PolarHBondContact OE1-NH2 2.85Å
51G71Confident86.3Confident25 Ų2532.9 Ų32.926%0.25818%0.179SC..THydrogen-bonded Turntrans64.9-150.1-172.600000112.9E306G51-E306 PolarHBondContact N-OE1 3.11Å; G51-E306 VanDerWaalsContact N-OE1 3.1Å
52A70.7Confident86.2Confident67 Ų6735.7 Ų35.755%0.55419%0.193SC*.THydrogen-bonded Turntrans-102.929.8-179.200000112.9
53Q68.1Low86.2Confident53 Ų5339.2 Ų39.225%0.24822%0.218CC..SBendtrans-72.7-42.3-168.4-72.8-172.9-0.500113.9E50 R164 F165E50-Q53 WeakPolarHBondContact O-CG 3.18Å; Q53-R164 VanDerWaalsContact CD-O 3.24Å; Q53-R164 PolarHBondContact NE2-O 3.33Å; Q53-R164 PolarHBondContact OE1-O 3.27Å; Q53-F165 HydrophobicContact CB-CD1 4.12Å; Q53-F165 HydrophobicContact CB-CE1 3.56Å; Q53-F165 HydrophobicContact CB-CZ 4.03Å; Q53-F165 HydrophobicContact CG-CE1 4.05Å; Q53-F165 HydrophobicContact CG-CZ 4.08Å
54V69Low85.9Confident6 Ų639 Ų394%0.03622%0.22CC..SBendtrans-94.7-43.4-178.1-175.10000110.1M151 L168V54-M151 HydrophobicContact CG1-CE 3.71Å; V54-L168 HydrophobicContact CG1-CD1 4.38Å; V54-L168 HydrophobicContact CG2-CD1 3.95Å
55Y80.4Confident85.8Confident1 Ų138.8 Ų38.80%0.00422%0.218CC..  trans-131.7124.2-179.2-52-65.7000110.9R45 L46 Q49 G57 A61 V65 C144R45-Y55 HydrophobicContact CB-CE2 3.97Å; R45-Y55 PolarHBondContact NH1-OH 3.36Å; L46-Y55 HydrophobicContact CD2-CD2 4.41Å; L46-Y55 HydrophobicContact CD2-CG 4.46Å; Q49-Y55 PolarHBondContact NE2-O 2.88Å; Q49-Y55 VanDerWaalsContact NE2-O 3.13Å; Q49-Y55 PolarHBondContact OE1-O 3.1Å; Y55-G57 PolarHBondContact O-N 2.84Å; Y55-A61 HydrophobicContact CD1-CB 3.64Å; Y55-A61 HydrophobicContact CD2-CB 4.26Å; Y55-A61 HydrophobicContact CE1-CB 4.09Å; Y55-A61 HydrophobicContact CG-CB 3.69Å; Y55-V65 HydrophobicContact CE1-CG2 4.42Å; Y55-C144 PolarHBondContact OH-SG 3.21Å
56R81.8Confident85.8Confident217 Ų21740.7 Ų40.782%0.81923%0.23SC*.SBendtrans-70.4-20.4174.4-61.2-177.8-177-173.80.9113H60R56-H60 HydrophobicContact CB-CB 4.42Å
57G88.2Confident85.7Confident29 Ų2948.2 Ų48.230%0.29926%0.262SS..SBendtrans173.9-175.9-178.200000111.4Y55 H60 A61Y55-G57 PolarHBondContact O-N 2.84Å; G57-H60 PolarHBondContact O-N 3.38Å; G57-A61 WeakPolarHBondContact O-CB 3.45Å; G57-A61 PolarHBondContact O-N 3.27Å
58L92.3Very high85.4Confident18 Ų1850.2 Ų50.29%0.09427%0.271CS..Hα-helixtrans-63-45-175.1179.359.7000113.2F39 L42 L46 H60 A61 I62 A317 I320F39-L58 HydrophobicContact CE1-CD2 4.49Å; L42-L58 HydrophobicContact CB-CD1 3.85Å; L42-L58 HydrophobicContact CD1-CD1 3.88Å; L42-L58 HydrophobicContact CG-CD1 4.33Å; L46-L58 HydrophobicContact CD1-CB 4.36Å; L46-L58 HydrophobicContact CD1-CD1 4.16Å; L58-H60 VanDerWaalsContact C-N 3.34Å; L58-H60 PolarHBondContact O-N 2.67Å; L58-A61 WeakPolarHBondContact O-CB 3.1Å; L58-A61 PolarHBondContact O-N 3.07Å; L58-A61 VanDerWaalsContact O-N 3.13Å; L58-I62 HydrophobicContact CD1-CD1 4.17Å; L58-I62 HydrophobicContact CD1-CG1 4.29Å; L58-I62 HydrophobicContact CG-CD1 4Å; L58-I62 WeakPolarHBondContact O-CG1 3.33Å; L58-I62 PolarHBondContact O-N 3.48Å; L58-A317 HydrophobicContact CD1-CB 3.97Å; L58-A317 HydrophobicContact CD2-CB 4.36Å; L58-I320 HydrophobicContact CD2-CD1 3.52Å
59V93.6Very high85.4Confident119 Ų11951.3 Ų51.372%0.72128%0.276SS*.Hα-helixtrans-63.2-43-179.4179.30000111A61 I62 S63V59-A61 VanDerWaalsContact C-N 3.33Å; V59-A61 PolarHBondContact O-N 3.21Å; V59-I62 PolarHBondContact O-N 2.93Å; V59-S63 PolarHBondContact O-N 3.36Å
60H91.4Very high85.6Confident73 Ų7352.1 Ų52.134%0.33829%0.288SS..Hα-helixtrans-62.8-41.7173.9-171.4-93.1000110.9R56 G57 L58 I62 S63 S64R56-H60 HydrophobicContact CB-CB 4.42Å; G57-H60 PolarHBondContact O-N 3.38Å; L58-H60 VanDerWaalsContact C-N 3.34Å; L58-H60 PolarHBondContact O-N 2.67Å; H60-I62 PolarHBondContact O-N 3.06Å; H60-S63 PolarHBondContact O-N 3.44Å; H60-S64 PolarHBondContact CE1-OG 2.81Å; H60-S64 VanDerWaalsContact CE1-OG 3.3Å; H60-S64 PolarHBondContact ND1-OG 3.4Å; H60-S64 VanDerWaalsContact O-CB 3.28Å; H60-S64 WeakPolarHBondContact O-CB 3.22Å; H60-S64 PolarHBondContact O-N 3.38Å; H60-S64 PolarHBondContact O-OG 3.48Å
61A91.9Very high86.3Confident0 Ų058 Ų580%031%0.313CS..Hα-helixtrans-60.4-45.7175.800000112.7L42 L46 Y55 G57 L58 V59 V65L42-A61 HydrophobicContact CD2-CB 3.77Å; L46-A61 HydrophobicContact CD2-CB 4.34Å; Y55-A61 HydrophobicContact CD1-CB 3.64Å; Y55-A61 HydrophobicContact CD2-CB 4.26Å; Y55-A61 HydrophobicContact CE1-CB 4.09Å; Y55-A61 HydrophobicContact CG-CB 3.69Å; G57-A61 WeakPolarHBondContact O-CB 3.45Å; G57-A61 PolarHBondContact O-N 3.27Å; L58-A61 WeakPolarHBondContact O-CB 3.1Å; L58-A61 PolarHBondContact O-N 3.07Å; L58-A61 VanDerWaalsContact O-N 3.13Å; V59-A61 VanDerWaalsContact C-N 3.33Å; V59-A61 PolarHBondContact O-N 3.21Å; A61-V65 WeakPolarHBondContact O-CB 3.44Å; A61-V65 WeakPolarHBondContact O-CG2 3.14Å; A61-V65 PolarHBondContact O-N 2.97Å
62I94.2Very high87.2Confident60 Ų6067.8 Ų67.831%0.30834%0.343SS..Hα-helixtrans-58.8-52.6176.5-67.5164000110.3L42 L58 V59 H60 S64 V65 V66L42-I62 HydrophobicContact CD1-CD1 4.17Å; L42-I62 HydrophobicContact CD1-CG1 3.44Å; L42-I62 VanDerWaalsContact CD1-CG1 3.44Å; L42-I62 HydrophobicContact CD2-CG1 4.12Å; L42-I62 HydrophobicContact CG-CG1 4.44Å; L58-I62 HydrophobicContact CD1-CD1 4.17Å; L58-I62 HydrophobicContact CD1-CG1 4.29Å; L58-I62 HydrophobicContact CG-CD1 4Å; L58-I62 WeakPolarHBondContact O-CG1 3.33Å; L58-I62 PolarHBondContact O-N 3.48Å; V59-I62 PolarHBondContact O-N 2.93Å; H60-I62 PolarHBondContact O-N 3.06Å; I62-S64 PolarHBondContact O-N 2.84Å; I62-V65 PolarHBondContact O-N 2.87Å; I62-V66 HydrophobicContact CG2-CG2 4.46Å; I62-V66 WeakPolarHBondContact O-CB 3.5Å; I62-V66 WeakPolarHBondContact O-CG2 3.34Å; I62-V66 PolarHBondContact O-N 3.43Å
63S93.4Very high88.2Confident75 Ų7564.8 Ų64.852%0.52432%0.318SS..Hα-helixtrans-60.7-46.3-178.2-178.70000112.1V59 H60 V65 V66 K67V59-S63 PolarHBondContact O-N 3.36Å; H60-S63 PolarHBondContact O-N 3.44Å; S63-V65 PolarHBondContact O-N 2.89Å; S63-V66 PolarHBondContact O-N 3.44Å; S63-K67 WeakPolarHBondContact O-CB 3.33Å; S63-K67 PolarHBondContact O-N 3.42Å
64S89.9Confident89.4Confident15 Ų1563 Ų6311%0.10531%0.31CS..Hα-helixtrans-63-42.3178.4-63.80000112.6H60 I62 K67 E68H60-S64 PolarHBondContact CE1-OG 2.81Å; H60-S64 VanDerWaalsContact CE1-OG 3.3Å; H60-S64 PolarHBondContact ND1-OG 3.4Å; H60-S64 VanDerWaalsContact O-CB 3.28Å; H60-S64 WeakPolarHBondContact O-CB 3.22Å; H60-S64 PolarHBondContact O-N 3.38Å; H60-S64 PolarHBondContact O-OG 3.48Å; I62-S64 PolarHBondContact O-N 2.84Å; S64-K67 PolarHBondContact O-N 3.46Å; S64-E68 WeakPolarHBondContact O-CB 3.35Å; S64-E68 WeakPolarHBondContact O-CG 3.26Å; S64-E68 PolarHBondContact O-N 3.35Å
65V91.4Very high90.7Very high0 Ų066.8 Ų66.80%032%0.324CS..Hα-helixtrans-68.2-45.2179.2175.70000111.1L42 Y55 A61 I62 S63 K67 E68 E69 G70 L74 I147L42-V65 HydrophobicContact CD2-CG2 4.42Å; Y55-V65 HydrophobicContact CE1-CG2 4.42Å; A61-V65 WeakPolarHBondContact O-CB 3.44Å; A61-V65 WeakPolarHBondContact O-CG2 3.14Å; A61-V65 PolarHBondContact O-N 2.97Å; I62-V65 PolarHBondContact O-N 2.87Å; S63-V65 PolarHBondContact O-N 2.89Å; V65-K67 VanDerWaalsContact C-N 3.3Å; V65-K67 PolarHBondContact O-N 2.88Å; V65-E68 PolarHBondContact O-N 3.3Å; V65-E69 HydrophobicContact CG1-CB 4.36Å; V65-E69 WeakPolarHBondContact O-CA 3.42Å; V65-E69 WeakPolarHBondContact O-CB 3.47Å; V65-E69 PolarHBondContact O-N 2.97Å; V65-G70 PolarHBondContact O-N 3.39Å; V65-L74 HydrophobicContact CB-CD2 4.19Å; V65-L74 HydrophobicContact CG1-CD2 3.74Å; V65-L74 HydrophobicContact CG1-CG 4.08Å; V65-I147 HydrophobicContact CG2-CD1 4.34Å
66V93.7Very high91.3Very high41 Ų4166.9 Ų66.925%0.24833%0.325CS..Hα-helixtrans-63.7-37.8177.8173.50000111.2I62 S63 G70 F71 L74I62-V66 HydrophobicContact CG2-CG2 4.46Å; I62-V66 WeakPolarHBondContact O-CB 3.5Å; I62-V66 WeakPolarHBondContact O-CG2 3.34Å; I62-V66 PolarHBondContact O-N 3.43Å; S63-V66 PolarHBondContact O-N 3.44Å; V66-G70 WeakPolarHBondContact O-CA 3.32Å; V66-G70 PolarHBondContact O-N 3.31Å; V66-G70 VanDerWaalsContact O-N 3.07Å; V66-F71 HydrophobicContact CG1-CD2 4.25Å; V66-F71 HydrophobicContact CG1-CE2 3.95Å; V66-F71 HydrophobicContact CG1-CZ 4.12Å; V66-F71 HydrophobicContact CG2-CD1 4.43Å; V66-F71 HydrophobicContact CG2-CE1 4.34Å; V66-L74 HydrophobicContact CG2-CD1 4.02Å
67K90.7Very high91.8Very high165 Ų16557 Ų5772%0.71729%0.291SS*.Hα-helixtrans-70.2-39179.4-173.9175.3179.6176.30113.6S63 S64 V65S63-K67 WeakPolarHBondContact O-CB 3.33Å; S63-K67 PolarHBondContact O-N 3.42Å; S64-K67 PolarHBondContact O-N 3.46Å; V65-K67 VanDerWaalsContact C-N 3.3Å; V65-K67 PolarHBondContact O-N 2.88Å
68E88Confident92.1Very high44 Ų4457.6 Ų57.621%0.20628%0.284CS..Hα-helixtrans-104.4-21.2-170.2-61-81.5157.900113.8S64 V65 R146 I147 N150 K154S64-E68 WeakPolarHBondContact O-CB 3.35Å; S64-E68 WeakPolarHBondContact O-CG 3.26Å; S64-E68 PolarHBondContact O-N 3.35Å; V65-E68 PolarHBondContact O-N 3.3Å; E68-R146 PolarHBondContact O-NH2 3.44Å; E68-I147 HydrophobicContact CB-CD1 4.16Å; E68-I147 HydrophobicContact CB-CG1 3.88Å; E68-I147 HydrophobicContact CB-CG2 4.39Å; E68-I147 HydrophobicContact CG-CG2 4.22Å; E68-N150 PolarHBondContact OE2-ND2 3.34Å; E68-K154 IonicContact OE1-NZ 3.1Å; E68-K154 PolarHBondContact OE1-NZ 3.45Å; E68-K154 VanDerWaalsContact OE1-NZ 3.1Å
69E88.7Confident92.1Very high26 Ų2662.3 Ų62.312%0.12131%0.309CS..Hα-helixtrans-120.1-8.7176.5-63.4179.6-14400113.6R45 V65 G73 N143 I147R45-E69 IonicContact CZ-OE1 2.76Å; R45-E69 VanDerWaalsContact CZ-OE1 3.23Å; R45-E69 IonicContact CZ-OE2 3.53Å; R45-E69 IonicContact NH1-OE1 3.03Å; R45-E69 PolarHBondContact NH1-OE1 3.27Å; R45-E69 IonicContact NH1-OE2 3.97Å; R45-E69 IonicContact NH2-OE1 2.73Å; R45-E69 PolarHBondContact NH2-OE1 3.47Å; R45-E69 IonicContact NH2-OE2 2.67Å; R45-E69 PolarHBondContact NH2-OE2 2.86Å; V65-E69 HydrophobicContact CG1-CB 4.36Å; V65-E69 WeakPolarHBondContact O-CA 3.42Å; V65-E69 WeakPolarHBondContact O-CB 3.47Å; V65-E69 PolarHBondContact O-N 2.97Å; E69-G73 WeakPolarHBondContact OE2-CA 3.33Å; E69-N143 HydrophobicContact CG-CB 4.11Å; E69-N143 WeakPolarHBondContact OE1-CB 3.12Å; E69-N143 VanDerWaalsContact OE2-CB 3.23Å; E69-N143 WeakPolarHBondContact OE2-CB 3.37Å; E69-N143 PolarHBondContact OE2-ND2 3.42Å; E69-I147 HydrophobicContact CG-CD1 4.02Å; E69-I147 HydrophobicContact CG-CG1 4.33Å; E69-I147 WeakPolarHBondContact OE1-CD1 3.47Å
70G90.7Very high92.2Very high29 Ų2957.5 Ų57.530%0.29928%0.28SS..  trans70.6178.8-170.600000112.8V65 V66 R72 G73V65-G70 PolarHBondContact O-N 3.39Å; V66-G70 WeakPolarHBondContact O-CA 3.32Å; V66-G70 PolarHBondContact O-N 3.31Å; V66-G70 VanDerWaalsContact O-N 3.07Å; G70-R72 PolarHBondContact O-N 3.02Å; G70-G73 PolarHBondContact O-N 2.96Å
71F92.5Very high92.3Very high155 Ų15556 Ų5668%0.6827%0.271SS*.G310 helixtrans-59.5-31.1177.7-80.6-81.5000113.5V66 G73 L74V66-F71 HydrophobicContact CG1-CD2 4.25Å; V66-F71 HydrophobicContact CG1-CE2 3.95Å; V66-F71 HydrophobicContact CG1-CZ 4.12Å; V66-F71 HydrophobicContact CG2-CD1 4.43Å; V66-F71 HydrophobicContact CG2-CE1 4.34Å; F71-G73 PolarHBondContact O-N 3.08Å; F71-L74 HydrophobicContact CD1-CD1 4.46Å; F71-L74 WeakPolarHBondContact O-CB 3.5Å; F71-L74 PolarHBondContact O-N 3.5Å
72R91.3Very high92.3Very high231 Ų23157.3 Ų57.387%0.87228%0.28SS*.G310 helixtrans-65.4-25.7176.4-70.1-179.2173.1177.7-1.9112.7G70 L74 Y75G70-R72 PolarHBondContact O-N 3.02Å; R72-L74 VanDerWaalsContact C-N 3.25Å; R72-L74 PolarHBondContact O-N 2.95Å; R72-Y75 PolarHBondContact O-N 3.19Å; R72-Y75 VanDerWaalsContact O-N 3.07Å
73G90.3Very high92.2Very high3 Ų360.2 Ų60.23%0.03129%0.291CS..G310 helixtrans-60.2-33.9175.400000113.5L41 E69 G70 F71 Y75 S76L41-G73 VanDerWaalsContact CD1-O 3.22Å; L41-G73 WeakPolarHBondContact CD1-O 3.35Å; E69-G73 WeakPolarHBondContact OE2-CA 3.33Å; G70-G73 PolarHBondContact O-N 2.96Å; F71-G73 PolarHBondContact O-N 3.08Å; G73-Y75 PolarHBondContact O-N 3.2Å; G73-Y75 VanDerWaalsContact O-N 3.12Å; G73-S76 WeakPolarHBondContact O-CB 3.32Å; G73-S76 PolarHBondContact O-N 3.16Å; G73-S76 VanDerWaalsContact O-N 3.16Å
74L94.3Very high92.1Very high15 Ų1558.3 Ų58.38%0.07927%0.274CS..G310 helixtrans-65.6-13.3176.5-65.9171.3000113.5Y37 P38 L41 L42 V65 V66 F71 R72Y37-L74 WeakPolarHBondContact CD1-O 3.32Å; Y37-L74 VanDerWaalsContact CE1-O 3.27Å; Y37-L74 WeakPolarHBondContact CE1-O 3.38Å; P38-L74 HydrophobicContact CB-CB 4.06Å; P38-L74 HydrophobicContact CB-CD1 4.39Å; P38-L74 HydrophobicContact CB-CD2 4.4Å; P38-L74 HydrophobicContact CG-CB 4.23Å; L41-L74 HydrophobicContact CD2-CD2 4.38Å; L42-L74 HydrophobicContact CD1-CD2 4.21Å; L42-L74 HydrophobicContact CD2-CD2 4.16Å; L42-L74 HydrophobicContact CG-CD2 4.17Å; V65-L74 HydrophobicContact CB-CD2 4.19Å; V65-L74 HydrophobicContact CG1-CD2 3.74Å; V65-L74 HydrophobicContact CG1-CG 4.08Å; V66-L74 HydrophobicContact CG2-CD1 4.02Å; F71-L74 HydrophobicContact CD1-CD1 4.46Å; F71-L74 WeakPolarHBondContact O-CB 3.5Å; F71-L74 PolarHBondContact O-N 3.5Å; R72-L74 VanDerWaalsContact C-N 3.25Å; R72-L74 PolarHBondContact O-N 2.95Å
75Y95.8Very high92Very high86 Ų8661.4 Ų61.434%0.33729%0.288SS..G310 helixtrans-108.914.9179.1-72-91.8000113.2T34 Y37 P38 R72 G73 G77 Y78T34-Y75 HydrophobicContact CG2-CE1 4.2Å; T34-Y75 VanDerWaalsContact O-CE1 3.28Å; T34-Y75 WeakPolarHBondContact O-CE1 3.48Å; T34-Y75 PolarHBondContact O-OH 3.35Å; T34-Y75 VanDerWaalsContact O-OH 3.08Å; Y37-Y75 AromaticContact CD1-CD1 3.9Å; Y37-Y75 HydrophobicContact CD1-CD1 3.9Å; Y37-Y75 HydrophobicContact CD1-CE1 4.42Å; Y37-Y75 HydrophobicContact CD1-CG 4.32Å; Y37-Y75 VanDerWaalsContact CE1-CA 3.49Å; Y37-Y75 HydrophobicContact CG-CD1 4.35Å; P38-Y75 HydrophobicContact CG-CE2 3.9Å; R72-Y75 PolarHBondContact O-N 3.19Å; R72-Y75 VanDerWaalsContact O-N 3.07Å; G73-Y75 PolarHBondContact O-N 3.2Å; G73-Y75 VanDerWaalsContact O-N 3.12Å; Y75-G77 PolarHBondContact O-N 2.97Å; Y75-G77 VanDerWaalsContact O-N 3.16Å; Y75-Y78 HydrophobicContact CD1-CD2 4.1Å; Y75-Y78 AromaticContact CD1-CG 3.99Å; Y75-Y78 HydrophobicContact CD1-CG 3.99Å; Y75-Y78 WeakPolarHBondContact O-CB 3.42Å; Y75-Y78 PolarHBondContact O-N 2.78Å
76S92.6Very high91.9Very high4 Ų466.6 Ų66.63%0.02831%0.311CS..THydrogen-bonded Turntrans-66.5113.9179.4-167.80000112.2Y37 G73 L139 M140 R184Y37-S76 PolarHBondContact OH-O 2.7Å; G73-S76 WeakPolarHBondContact O-CB 3.32Å; G73-S76 PolarHBondContact O-N 3.16Å; G73-S76 VanDerWaalsContact O-N 3.16Å; S76-L139 WeakPolarHBondContact CB-O 3.45Å; S76-L139 PolarHBondContact OG-O 3.08Å; S76-M140 WeakPolarHBondContact O-CA 3.38Å; S76-M140 VanDerWaalsContact O-CG 3.26Å; S76-M140 WeakPolarHBondContact O-CG 3.16Å; S76-R184 PolarHBondContact OG-NH1 3.44Å
77G92.9Very high91.7Very high10 Ų1066.3 Ų66.310%0.10331%0.311CS..THydrogen-bonded Turntrans95.20.8-174.400000114.3Y37 Y75 L79 V80 R81 S136Y37-G77 WeakPolarHBondContact OH-CA 3.38Å; Y37-G77 PolarHBondContact OH-O 3.41Å; Y75-G77 PolarHBondContact O-N 2.97Å; Y75-G77 VanDerWaalsContact O-N 3.16Å; G77-L79 VanDerWaalsContact C-N 3.33Å; G77-L79 PolarHBondContact O-N 3.41Å; G77-V80 PolarHBondContact O-N 3.39Å; G77-R81 PolarHBondContact O-N 3.12Å; G77-R81 VanDerWaalsContact O-N 3.11Å; G77-S136 PolarHBondContact O-OG 3.16Å
78Y94.6Very high91.4Very high41 Ų4160.7 Ų60.716%0.16130%0.299CS..Hα-helixtrans-60.4-41-176.9168-100.5000112.7F30 T34 Y37 Y75 V80 R81 S82F30-Y78 WeakPolarHBondContact CZ-OH 3.46Å; T34-Y78 HydrophobicContact CG2-CE2 4.02Å; T34-Y78 WeakPolarHBondContact CG2-OH 3.18Å; T34-Y78 PolarHBondContact OG1-OH 3.21Å; Y37-Y78 HydrophobicContact CD1-CD2 4.32Å; Y37-Y78 AromaticContact CD2-CD2 3.61Å; Y37-Y78 HydrophobicContact CD2-CD2 3.61Å; Y37-Y78 HydrophobicContact CD2-CG 4.38Å; Y37-Y78 VanDerWaalsContact CE2-CA 3.45Å; Y37-Y78 HydrophobicContact CE2-CD2 4.12Å; Y37-Y78 AromaticContact CG-CD2 3.72Å; Y37-Y78 HydrophobicContact CG-CD2 3.72Å; Y37-Y78 HydrophobicContact CG-CG 4.44Å; Y37-Y78 VanDerWaalsContact CZ-CA 3.44Å; Y37-Y78 PolarHBondContact OH-N 2.99Å; Y75-Y78 HydrophobicContact CD1-CD2 4.1Å; Y75-Y78 AromaticContact CD1-CG 3.99Å; Y75-Y78 HydrophobicContact CD1-CG 3.99Å; Y75-Y78 WeakPolarHBondContact O-CB 3.42Å; Y75-Y78 PolarHBondContact O-N 2.78Å; Y78-V80 VanDerWaalsContact C-N 3.32Å; Y78-V80 PolarHBondContact O-N 3.02Å; Y78-R81 CarbonylContact O-C 3.58Å; Y78-R81 PolarHBondContact O-N 2.98Å; Y78-S82 WeakPolarHBondContact CE1-OG 3.47Å; Y78-S82 WeakPolarHBondContact O-CB 3.21Å; Y78-S82 PolarHBondContact O-N 2.77Å; Y78-S82 PolarHBondContact O-OG 3.36Å
79L93.1Very high91.4Very high116 Ų11663.3 Ų63.361%0.60732%0.319SS*.Hα-helixtrans-58.4-44.3179.9-66.5175000112G77 S82G77-L79 VanDerWaalsContact C-N 3.33Å; G77-L79 PolarHBondContact O-N 3.41Å; L79-S82 WeakPolarHBondContact O-CB 3.36Å; L79-S82 PolarHBondContact O-N 3.19Å
80V95Very high91.5Very high19 Ų1963.9 Ų63.912%0.11532%0.322CS..Hα-helixtrans-67-44.7177.4179.90000110.3G77 Y78 S82 F83 I132 V135 L139 L185G77-V80 PolarHBondContact O-N 3.39Å; Y78-V80 VanDerWaalsContact C-N 3.32Å; Y78-V80 PolarHBondContact O-N 3.02Å; V80-S82 PolarHBondContact O-N 2.94Å; V80-F83 WeakPolarHBondContact O-CD2 3.37Å; V80-F83 PolarHBondContact O-N 3.45Å; V80-I132 HydrophobicContact CG1-CG2 3.84Å; V80-I132 VanDerWaalsContact O-CG2 3.22Å; V80-I132 WeakPolarHBondContact O-CG2 3.33Å; V80-V135 HydrophobicContact CG1-CB 4.3Å; V80-V135 HydrophobicContact CG1-CG1 4.17Å; V80-V135 HydrophobicContact CG2-CG1 4.33Å; V80-L139 HydrophobicContact CB-CD1 4.46Å; V80-L139 HydrophobicContact CG2-CD1 3.65Å; V80-L185 HydrophobicContact CG2-CD1 3.6Å; V80-L185 HydrophobicContact CG2-CD2 4.45Å
81R92.6Very high91.5Very high40 Ų4066.8 Ų66.815%0.15133%0.325CS..Hα-helixtrans-66-25.5178.9-167.3161.6-177.1-94.4-2.6113.5Y37 G77 Y78 F83 H84Y37-R81 HydrophobicContact CE2-CB 3.83Å; Y37-R81 HydrophobicContact CE2-CG 4.19Å; G77-R81 PolarHBondContact O-N 3.12Å; G77-R81 VanDerWaalsContact O-N 3.11Å; Y78-R81 CarbonylContact O-C 3.58Å; Y78-R81 PolarHBondContact O-N 2.98Å; R81-F83 PolarHBondContact O-N 3.16Å; R81-H84 WeakPolarHBondContact O-CB 3.17Å; R81-H84 PolarHBondContact O-N 2.68Å
82S92.9Very high91.3Very high28 Ų2863.4 Ų63.420%0.19632%0.317CS..Hα-helixtrans-61.5-24.2-178.4-64.60000113Y78 L79 V80 H84 I85Y78-S82 WeakPolarHBondContact CE1-OG 3.47Å; Y78-S82 WeakPolarHBondContact O-CB 3.21Å; Y78-S82 PolarHBondContact O-N 2.77Å; Y78-S82 PolarHBondContact O-OG 3.36Å; L79-S82 WeakPolarHBondContact O-CB 3.36Å; L79-S82 PolarHBondContact O-N 3.19Å; V80-S82 PolarHBondContact O-N 2.94Å; S82-H84 PolarHBondContact O-N 3.32Å; S82-H84 VanDerWaalsContact O-N 3.1Å; S82-I85 WeakPolarHBondContact O-CB 3.36Å; S82-I85 WeakPolarHBondContact O-CG2 3.4Å; S82-I85 PolarHBondContact O-N 3.27Å
83F92.6Very high91.3Very high121 Ų12155.2 Ų55.253%0.53130%0.295SS..G310 helixtrans-61.4-15172.9-76-83.7000114V80 R81 I85 F86 I132V80-F83 WeakPolarHBondContact O-CD2 3.37Å; V80-F83 PolarHBondContact O-N 3.45Å; R81-F83 PolarHBondContact O-N 3.16Å; F83-I85 PolarHBondContact O-N 2.9Å; F83-I85 VanDerWaalsContact O-N 3.1Å; F83-F86 HydrophobicContact CD1-CD2 4.38Å; F83-F86 HydrophobicContact CD1-CE2 4.24Å; F83-F86 WeakPolarHBondContact O-CD2 3.29Å; F83-F86 PolarHBondContact O-N 3.48Å; F83-I132 HydrophobicContact CB-CD1 3.93Å
84H90.9Very high91.5Very high36 Ų3656.2 Ų56.217%0.16730%0.301CS..G310 helixtrans-61.2-12.5169.4-89.1-98.1000113.8R81 S82 F86 S87 F129 D133R81-H84 WeakPolarHBondContact O-CB 3.17Å; R81-H84 PolarHBondContact O-N 2.68Å; S82-H84 PolarHBondContact O-N 3.32Å; S82-H84 VanDerWaalsContact O-N 3.1Å; H84-F86 PolarHBondContact O-N 3.03Å; H84-F86 VanDerWaalsContact O-N 3.15Å; H84-S87 WeakPolarHBondContact O-CB 3.43Å; H84-S87 PolarHBondContact O-N 3.22Å; H84-F129 AromaticContact CE1-CD1 3.73Å; H84-F129 AromaticContact CE1-CG 3.8Å; H84-F129 AromaticContact CG-CD1 4Å; H84-F129 AromaticContact ND1-CD1 3.84Å; H84-F129 AromaticContact NE2-CD1 3.85Å; H84-D133 IonicContact CD2-OD1 3.65Å; H84-D133 IonicContact CE1-OD1 3.97Å; H84-D133 IonicContact NE2-OD1 2.79Å; H84-D133 PolarHBondContact NE2-OD1 2.95Å
85I88.3Confident91.4Very high79 Ų7957.7 Ų57.741%0.40531%0.305SS..G310 helixtrans-54.5-30.1171-164.5172.9000112.3F30 S82 F83 S87F30-I85 HydrophobicContact CB-CD1 3.98Å; F30-I85 HydrophobicContact CD2-CD1 3.94Å; F30-I85 HydrophobicContact CG-CD1 4.24Å; S82-I85 WeakPolarHBondContact O-CB 3.36Å; S82-I85 WeakPolarHBondContact O-CG2 3.4Å; S82-I85 PolarHBondContact O-N 3.27Å; F83-I85 PolarHBondContact O-N 2.9Å; F83-I85 VanDerWaalsContact O-N 3.1Å; I85-S87 VanDerWaalsContact C-N 3.34Å
86F88.9Confident91.2Very high110 Ų11057.4 Ų57.448%0.48231%0.307SS..G310 helixtrans-84.3-5.5178.1-58.9-67.1000113.9F83 H84 G88 T89 I90F83-F86 HydrophobicContact CD1-CD2 4.38Å; F83-F86 HydrophobicContact CD1-CE2 4.24Å; F83-F86 WeakPolarHBondContact O-CD2 3.29Å; F83-F86 PolarHBondContact O-N 3.48Å; H84-F86 PolarHBondContact O-N 3.03Å; H84-F86 VanDerWaalsContact O-N 3.15Å; F86-G88 PolarHBondContact O-N 3.37Å; F86-T89 PolarHBondContact O-N 3.39Å; F86-I90 HydrophobicContact CB-CD1 4.17Å; F86-I90 WeakPolarHBondContact O-CG1 3.42Å; F86-I90 PolarHBondContact O-N 3.11Å
87S88.7Confident91.2Very high35 Ų3562 Ų6225%0.24534%0.335CS..Hα-helixtrans-60.7-44.8-174.2-169.80000113.2H84 I85 I90 Y91 F129H84-S87 WeakPolarHBondContact O-CB 3.43Å; H84-S87 PolarHBondContact O-N 3.22Å; I85-S87 VanDerWaalsContact C-N 3.34Å; S87-I90 PolarHBondContact O-N 3.28Å; S87-Y91 VanDerWaalsContact O-CB 3.31Å; S87-Y91 WeakPolarHBondContact O-CB 3.34Å; S87-Y91 PolarHBondContact O-N 3.26Å; S87-F129 VanDerWaalsContact CA-CE2 3.46Å; S87-F129 VanDerWaalsContact CB-CZ 3.42Å; S87-F129 VanDerWaalsContact OG-CE2 3.23Å; S87-F129 WeakPolarHBondContact OG-CE2 3.35Å
88G85.7Confident91.2Very high46 Ų4662 Ų6247%0.47433%0.334SS..Hα-helixtrans-60.8-47.5176.500000112.2F86 Y91 V92F86-G88 PolarHBondContact O-N 3.37Å; G88-Y91 PolarHBondContact O-N 3.31Å; G88-V92 WeakPolarHBondContact O-CB 3.48Å; G88-V92 WeakPolarHBondContact O-CG2 3.43Å; G88-V92 PolarHBondContact O-N 2.87Å
89T87.3Confident91Very high99 Ų9964.8 Ų64.861%0.60734%0.344SS*.Hα-helixtrans-63.4-45.6-179.4-540000111.9F86 Y91 S93F86-T89 PolarHBondContact O-N 3.39Å; T89-Y91 VanDerWaalsContact C-N 3.35Å; T89-S93 VanDerWaalsContact O-CB 3.25Å; T89-S93 WeakPolarHBondContact O-CB 3.45Å; T89-S93 PolarHBondContact O-N 3.38Å; T89-S93 PolarHBondContact O-OG 3.24Å
90I91Very high90.9Very high39 Ų3965.9 Ų65.920%0.235%0.346CS..Hα-helixtrans-63.5-42.1178.3-70.1171000110.9F86 S87 S93 T94 V124 F128 F129F86-I90 HydrophobicContact CB-CD1 4.17Å; F86-I90 WeakPolarHBondContact O-CG1 3.42Å; F86-I90 PolarHBondContact O-N 3.11Å; S87-I90 PolarHBondContact O-N 3.28Å; I90-S93 PolarHBondContact O-OG 2.97Å; I90-T94 VanDerWaalsContact O-CB 3.26Å; I90-T94 WeakPolarHBondContact O-CB 3.49Å; I90-T94 PolarHBondContact O-N 3.31Å; I90-T94 PolarHBondContact O-OG1 3.44Å; I90-V124 HydrophobicContact CG2-CG1 4.4Å; I90-F128 HydrophobicContact CD1-CG 4.49Å; I90-F128 HydrophobicContact CG2-CD2 4.4Å; I90-F129 HydrophobicContact CD1-CZ 4.01Å
91Y90Very high90.8Very high89 Ų8967.7 Ų67.735%0.34936%0.363SS..Hα-helixtrans-65-51.6179.2-177.1-88000111.4S87 G88 T89 T94 Y95 A121S87-Y91 VanDerWaalsContact O-CB 3.31Å; S87-Y91 WeakPolarHBondContact O-CB 3.34Å; S87-Y91 PolarHBondContact O-N 3.26Å; G88-Y91 PolarHBondContact O-N 3.31Å; T89-Y91 VanDerWaalsContact C-N 3.35Å; Y91-T94 PolarHBondContact O-N 2.94Å; Y91-Y95 WeakPolarHBondContact O-CB 3.45Å; Y91-Y95 PolarHBondContact O-N 3.09Å; Y91-A121 HydrophobicContact CD2-CB 3.86Å; Y91-A121 HydrophobicContact CE2-CB 3.8Å; Y91-A121 HydrophobicContact CG-CB 4.33Å
92V89Confident90.7Very high84 Ų8466.4 Ų66.451%0.50936%0.36SS..Hα-helixtrans-64.5-43.8-178.1172.90000111.3G88 Y95 E96G88-V92 WeakPolarHBondContact O-CB 3.48Å; G88-V92 WeakPolarHBondContact O-CG2 3.43Å; G88-V92 PolarHBondContact O-N 2.87Å; V92-Y95 PolarHBondContact O-N 3.2Å; V92-E96 PolarHBondContact O-N 2.89Å
93S91.2Very high90.5Very high60 Ų6068.6 Ų68.642%0.4237%0.372SS..Hα-helixtrans-63.1-45178.366.20000111.8T89 I90 Y95 E96 V97T89-S93 VanDerWaalsContact O-CB 3.25Å; T89-S93 WeakPolarHBondContact O-CB 3.45Å; T89-S93 PolarHBondContact O-N 3.38Å; T89-S93 PolarHBondContact O-OG 3.24Å; I90-S93 PolarHBondContact O-OG 2.97Å; S93-Y95 VanDerWaalsContact C-N 3.34Å; S93-Y95 PolarHBondContact O-N 3.46Å; S93-E96 PolarHBondContact O-N 3.27Å; S93-V97 WeakPolarHBondContact O-CB 3.5Å; S93-V97 VanDerWaalsContact O-CG2 3.29Å; S93-V97 WeakPolarHBondContact O-CG2 3.44Å; S93-V97 PolarHBondContact O-N 3.07Å
94T93.2Very high90.4Very high24 Ų2468.1 Ų68.115%0.14738%0.379CS..Hα-helixtrans-66.6-38.7177.8-51.90000111.2I90 Y91 A98 V120 A121 V124I90-T94 VanDerWaalsContact O-CB 3.26Å; I90-T94 WeakPolarHBondContact O-CB 3.49Å; I90-T94 PolarHBondContact O-N 3.31Å; I90-T94 PolarHBondContact O-OG1 3.44Å; Y91-T94 PolarHBondContact O-N 2.94Å; T94-A98 WeakPolarHBondContact O-CB 3.45Å; T94-A98 PolarHBondContact O-N 3.01Å; T94-V120 HydrophobicContact CG2-CG1 4.13Å; T94-A121 HydrophobicContact CG2-CB 4.2Å; T94-V124 HydrophobicContact CG2-CB 3.89Å; T94-V124 HydrophobicContact CG2-CG1 4.21Å; T94-V124 HydrophobicContact CG2-CG2 3.78Å
95Y92.3Very high90.3Very high46 Ų4672.1 Ų72.118%0.1840%0.396CS..Hα-helixtrans-60.2-49.3176.9174.9-92000111.5Y91 V92 S93 A98 R99 S114Y91-Y95 WeakPolarHBondContact O-CB 3.45Å; Y91-Y95 PolarHBondContact O-N 3.09Å; V92-Y95 PolarHBondContact O-N 3.2Å; S93-Y95 VanDerWaalsContact C-N 3.34Å; S93-Y95 PolarHBondContact O-N 3.46Å; Y95-A98 PolarHBondContact O-N 3.43Å; Y95-R99 WeakPolarHBondContact O-CB 3.48Å; Y95-R99 PolarHBondContact O-N 3.39Å; Y95-S114 PolarHBondContact OH-OG 3.36Å
96E91.8Very high90Very high80 Ų8073.7 Ų73.737%0.37441%0.411SS..Hα-helixtrans-66.4-43.2179.9-70.8-58.3153.200111.8V92 S93 A98 R99 Q100V92-E96 PolarHBondContact O-N 2.89Å; S93-E96 PolarHBondContact O-N 3.27Å; E96-A98 PolarHBondContact O-N 2.88Å; E96-R99 PolarHBondContact O-N 3.49Å; E96-R99 IonicContact OE1-NH2 2.95Å; E96-R99 IonicContact OE2-CZ 3.46Å; E96-R99 IonicContact OE2-NE 2.84Å; E96-R99 PolarHBondContact OE2-NE 2.93Å; E96-R99 IonicContact OE2-NH2 3.58Å; E96-R99 PolarHBondContact OE2-NH2 3.27Å; E96-Q100 VanDerWaalsContact O-CB 3.24Å; E96-Q100 WeakPolarHBondContact O-CB 3.32Å; E96-Q100 PolarHBondContact O-N 3.13Å
97V93.9Very high89.9Confident100 Ų10074.7 Ų74.761%0.60643%0.427SS*.Hα-helixtrans-61.5-45.5176.6171.10000111.2S93 Q100 A101S93-V97 WeakPolarHBondContact O-CB 3.5Å; S93-V97 VanDerWaalsContact O-CG2 3.29Å; S93-V97 WeakPolarHBondContact O-CG2 3.44Å; S93-V97 PolarHBondContact O-N 3.07Å; V97-Q100 PolarHBondContact O-N 3.48Å; V97-A101 WeakPolarHBondContact O-CB 3.14Å; V97-A101 PolarHBondContact O-N 3.13Å
98A92.5Very high89.8Confident11 Ų1175.3 Ų75.39%0.09143%0.427CS..Hα-helixtrans-66.9-41.5178.600000111.8T94 Y95 E96 Q100 A101 C102 V120T94-A98 WeakPolarHBondContact O-CB 3.45Å; T94-A98 PolarHBondContact O-N 3.01Å; Y95-A98 PolarHBondContact O-N 3.43Å; E96-A98 PolarHBondContact O-N 2.88Å; A98-Q100 VanDerWaalsContact C-N 3.34Å; A98-Q100 PolarHBondContact O-N 3.36Å; A98-A101 PolarHBondContact O-N 2.72Å; A98-C102 PolarHBondContact O-N 3.41Å; A98-C102 PolarHBondContact O-SG 3.19Å; A98-V120 HydrophobicContact CB-CB 3.98Å; A98-V120 HydrophobicContact CB-CG1 4.02Å
99R90.9Very high90Very high99 Ų9975.4 Ų75.437%0.37442%0.42SS..Hα-helixtrans-63.9-40.7176.8-170.3176.475153.4-0.9111.5Y95 E96 C102 T103 R113Y95-R99 WeakPolarHBondContact O-CB 3.48Å; Y95-R99 PolarHBondContact O-N 3.39Å; E96-R99 PolarHBondContact O-N 3.49Å; E96-R99 IonicContact OE1-NH2 2.95Å; E96-R99 IonicContact OE2-CZ 3.46Å; E96-R99 IonicContact OE2-NE 2.84Å; E96-R99 PolarHBondContact OE2-NE 2.93Å; E96-R99 IonicContact OE2-NH2 3.58Å; E96-R99 PolarHBondContact OE2-NH2 3.27Å; R99-C102 PolarHBondContact O-N 2.89Å; R99-T103 PolarHBondContact O-N 3.16Å; R99-R113 HydrophobicContact CG-CB 4.31Å
100Q91.1Very high90.1Very high138 Ų13875.1 Ų75.165%0.64542%0.42SS*.Hα-helixtrans-67.1-40.9175.2-172.41760.100111.4E96 V97 A98 C102 T103E96-Q100 VanDerWaalsContact O-CB 3.24Å; E96-Q100 WeakPolarHBondContact O-CB 3.32Å; E96-Q100 PolarHBondContact O-N 3.13Å; V97-Q100 PolarHBondContact O-N 3.48Å; A98-Q100 VanDerWaalsContact C-N 3.34Å; A98-Q100 PolarHBondContact O-N 3.36Å; Q100-C102 PolarHBondContact O-N 3.07Å; Q100-T103 PolarHBondContact O-N 2.95Å; Q100-T103 PolarHBondContact O-OG1 3.16Å
101A92.6Very high90Very high57 Ų5779.5 Ų79.547%0.47144%0.443SS..Hα-helixtrans-59.8-36.1173.900000111.9V97 A98 T103 V104V97-A101 WeakPolarHBondContact O-CB 3.14Å; V97-A101 PolarHBondContact O-N 3.13Å; A98-A101 PolarHBondContact O-N 2.72Å; A101-T103 PolarHBondContact O-N 3.35Å; A101-V104 WeakPolarHBondContact O-CB 3.24Å; A101-V104 WeakPolarHBondContact O-CG2 3.43Å; A101-V104 PolarHBondContact O-N 2.95Å
102C90.5Very high89.9Confident13 Ų1380.5 Ų80.59%0.08845%0.45CS..G310 helixtrans-68.9-13.4175.5-66.10000114.4A98 R99 Q100 V104 F105 R113A98-C102 PolarHBondContact O-N 3.41Å; A98-C102 PolarHBondContact O-SG 3.19Å; R99-C102 PolarHBondContact O-N 2.89Å; Q100-C102 PolarHBondContact O-N 3.07Å; C102-V104 PolarHBondContact O-N 3.46Å; C102-F105 PolarHBondContact O-N 2.91Å; C102-R113 HydrophobicContact CB-CB 4.07Å; C102-R113 HydrophobicContact CB-CG 3.84Å; C102-R113 PolarHBondContact O-NE 2.97Å
103T89Confident90Very high74 Ų7478.9 Ų78.945%0.45444%0.435SS..G310 helixtrans-72.2-18.2175.867.20000112.6R99 Q100 A101 F105R99-T103 PolarHBondContact O-N 3.16Å; Q100-T103 PolarHBondContact O-N 2.95Å; Q100-T103 PolarHBondContact O-OG1 3.16Å; A101-T103 PolarHBondContact O-N 3.35Å; T103-F105 PolarHBondContact O-N 3.33Å
104V90.5Very high89.8Confident111 Ų11178 Ų7867%0.67343%0.429SS*.G310 helixtrans-60.8-21.2171.2179.80000111.6A101 C102 P106A101-V104 WeakPolarHBondContact O-CB 3.24Å; A101-V104 WeakPolarHBondContact O-CG2 3.43Å; A101-V104 PolarHBondContact O-N 2.95Å; C102-V104 PolarHBondContact O-N 3.46Å; V104-P106 VanDerWaalsContact O-CD 3.31Å; V104-P106 WeakPolarHBondContact O-CD 3.46Å
105F88.5Confident89.7Confident121 Ų12184.2 Ų84.253%0.53145%0.454SS..  trans-103.998.5175.2-57.5-77.6000110.1C102 T103 T107 L108 R113C102-F105 PolarHBondContact O-N 2.91Å; T103-F105 PolarHBondContact O-N 3.33Å; F105-T107 PolarHBondContact O-N 2.93Å; F105-L108 HydrophobicContact CB-CD1 3.49Å; F105-L108 VanDerWaalsContact CB-CD1 3.49Å; F105-L108 HydrophobicContact CG-CD1 4.18Å; F105-L108 PolarHBondContact O-N 3.04Å; F105-R113 PolarHBondContact O-NH2 3.48Å
106P81.4Confident89.6Confident111 Ų11184.6 Ų84.672%0.72146%0.461SS*.THydrogen-bonded Turntrans-65.2-26.2-175.7-20.634.2000113V104 L108V104-P106 VanDerWaalsContact O-CD 3.31Å; V104-P106 WeakPolarHBondContact O-CD 3.46Å; P106-L108 VanDerWaalsContact C-N 3.3Å; P106-L108 PolarHBondContact O-N 3.3Å
107T87.4Confident89.6Confident131 Ų13180.8 Ų80.880%0.80444%0.443SS*.THydrogen-bonded Turntrans-70.6-20.2-178.854.30000113.8F105 S109F105-T107 PolarHBondContact O-N 2.93Å; T107-S109 PolarHBondContact O-N 3.41Å
108L86.4Confident89.4Confident48 Ų4876.6 Ų76.625%0.25142%0.421SS..SBendtrans-76.8115.5177.5-8992.5000111F105 P106 H112 R113F105-L108 HydrophobicContact CB-CD1 3.49Å; F105-L108 VanDerWaalsContact CB-CD1 3.49Å; F105-L108 HydrophobicContact CG-CD1 4.18Å; F105-L108 PolarHBondContact O-N 3.04Å; P106-L108 VanDerWaalsContact C-N 3.3Å; P106-L108 PolarHBondContact O-N 3.3Å; L108-H112 HydrophobicContact CD2-CB 4.01Å; L108-H112 HydrophobicContact CG-CB 4.42Å; L108-R113 HydrophobicContact CB-CG 3.87Å; L108-R113 VanDerWaalsContact O-CZ 3.31Å; L108-R113 PolarHBondContact O-NE 2.66Å; L108-R113 PolarHBondContact O-NH2 2.99Å
109S90Very high89.3Confident48 Ų4878 Ų7834%0.33643%0.432SS..  trans-58151.1169.3148.30000111.9T107 I111 H112 R113T107-S109 PolarHBondContact O-N 3.41Å; S109-I111 PolarHBondContact O-N 3.37Å; S109-I111 VanDerWaalsContact O-N 3.08Å; S109-H112 PolarHBondContact O-N 3.33Å; S109-R113 PolarHBondContact O-N 2.74Å; S109-R113 VanDerWaalsContact O-N 3.14Å
110P88.8Confident89.4Confident93 Ų9376.2 Ų76.260%0.60443%0.432SS*.Hα-helixtrans-51.9-32.5-179.3-28.735.4000115.3R113 S114P110-R113 PolarHBondContact O-N 2.77Å; P110-S114 WeakPolarHBondContact O-CB 3.49Å; P110-S114 PolarHBondContact O-N 3.36Å; P110-S114 PolarHBondContact O-OG 3.13Å
111I88.3Confident89.5Confident131 Ų13169.7 Ų69.767%0.67240%0.402SS*.Hα-helixtrans-65.4-46.2177.7-63.3170.3000110.2S109 R113 S114 F115S109-I111 PolarHBondContact O-N 3.37Å; S109-I111 VanDerWaalsContact O-N 3.08Å; I111-R113 PolarHBondContact O-N 3.15Å; I111-S114 PolarHBondContact O-N 3.45Å; I111-F115 PolarHBondContact O-N 3.14Å
112H88.6Confident89.4Confident110 Ų11067.9 Ų67.951%0.50939%0.386SS..Hα-helixtrans-65.7-40178.8-56.9106.9000111.6L108 S109 S114 F115 V116L108-H112 HydrophobicContact CD2-CB 4.01Å; L108-H112 HydrophobicContact CG-CB 4.42Å; S109-H112 PolarHBondContact O-N 3.33Å; H112-S114 VanDerWaalsContact C-N 3.31Å; H112-S114 PolarHBondContact O-N 3.35Å; H112-F115 PolarHBondContact O-N 3.48Å; H112-V116 WeakPolarHBondContact O-CG2 3.24Å; H112-V116 PolarHBondContact O-N 2.96Å
113R90.5Very high89.5Confident50 Ų5070.5 Ų70.519%0.18940%0.404CS..Hα-helixtrans-60.3-42.5174.9-60.3-173.2179.1157.42.7111.8R99 C102 F105 L108 S109 P110 I111 G117R99-R113 HydrophobicContact CG-CB 4.31Å; C102-R113 HydrophobicContact CB-CB 4.07Å; C102-R113 HydrophobicContact CB-CG 3.84Å; C102-R113 PolarHBondContact O-NE 2.97Å; F105-R113 PolarHBondContact O-NH2 3.48Å; L108-R113 HydrophobicContact CB-CG 3.87Å; L108-R113 VanDerWaalsContact O-CZ 3.31Å; L108-R113 PolarHBondContact O-NE 2.66Å; L108-R113 PolarHBondContact O-NH2 2.99Å; S109-R113 PolarHBondContact O-N 2.74Å; S109-R113 VanDerWaalsContact O-N 3.14Å; P110-R113 PolarHBondContact O-N 2.77Å; I111-R113 PolarHBondContact O-N 3.15Å; R113-G117 PolarHBondContact O-N 2.88Å
114S88.6Confident89.7Confident41 Ų4169.6 Ų69.629%0.28740%0.398SS..Hα-helixtrans-67.2-38.8177.5-580000112Y95 P110 I111 H112 G118Y95-S114 PolarHBondContact OH-OG 3.36Å; P110-S114 WeakPolarHBondContact O-CB 3.49Å; P110-S114 PolarHBondContact O-N 3.36Å; P110-S114 PolarHBondContact O-OG 3.13Å; I111-S114 PolarHBondContact O-N 3.45Å; H112-S114 VanDerWaalsContact C-N 3.31Å; H112-S114 PolarHBondContact O-N 3.35Å; S114-G118 PolarHBondContact O-N 3.29Å
115F89.4Confident89.7Confident156 Ų15664.5 Ų64.568%0.68437%0.367SS*.Hα-helixtrans-63.3-49.6175.1179.6-96.3000111.8I111 H112 G117 G118 A119I111-F115 PolarHBondContact O-N 3.14Å; H112-F115 PolarHBondContact O-N 3.48Å; F115-G117 PolarHBondContact O-N 2.74Å; F115-G118 PolarHBondContact O-N 3.02Å; F115-A119 WeakPolarHBondContact O-CB 3.05Å; F115-A119 PolarHBondContact O-N 3.17Å
116V90.6Very high89.9Confident53 Ų5359.7 Ų59.732%0.32135%0.346SS..Hα-helixtrans-62.1-44.8177.41750000110.6H112 G118 A119 V120H112-V116 WeakPolarHBondContact O-CG2 3.24Å; H112-V116 PolarHBondContact O-N 2.96Å; V116-G118 VanDerWaalsContact C-N 3.34Å; V116-G118 PolarHBondContact O-N 3.17Å; V116-A119 PolarHBondContact O-N 2.82Å; V116-V120 HydrophobicContact CG1-CG2 4.24Å; V116-V120 WeakPolarHBondContact O-CG2 3.41Å; V116-V120 PolarHBondContact O-N 3.41Å
117G91.8Very high90.4Very high0 Ų055.6 Ų55.60%033%0.325CS..Hα-helixtrans-57.6-45.3175.900000112.7R113 F115 A121R113-G117 PolarHBondContact O-N 2.88Å; F115-G117 PolarHBondContact O-N 2.74Å; G117-A121 WeakPolarHBondContact O-CB 3.33Å; G117-A121 PolarHBondContact O-N 2.83Å
118G90.6Very high90.7Very high13 Ų1355.1 Ų55.113%0.13431%0.312CS..Hα-helixtrans-65.7-39.417600000113.4S114 F115 V116 S122S114-G118 PolarHBondContact O-N 3.29Å; F115-G118 PolarHBondContact O-N 3.02Å; V116-G118 VanDerWaalsContact C-N 3.34Å; V116-G118 PolarHBondContact O-N 3.17Å; G118-S122 VanDerWaalsContact O-CB 3.26Å; G118-S122 WeakPolarHBondContact O-CB 3.14Å; G118-S122 PolarHBondContact O-N 2.8Å; G118-S122 PolarHBondContact O-OG 3.02Å
119A90.8Very high91Very high40 Ų4053.1 Ų53.133%0.33130%0.301SS..Hα-helixtrans-65.2-48.9177.400000111.6F115 V116 S122 C123F115-A119 WeakPolarHBondContact O-CB 3.05Å; F115-A119 PolarHBondContact O-N 3.17Å; V116-A119 PolarHBondContact O-N 2.82Å; A119-S122 PolarHBondContact O-N 3.38Å; A119-C123 PolarHBondContact O-N 2.74Å; A119-C123 PolarHBondContact O-SG 3.41Å; A119-C123 VanDerWaalsContact O-SG 3.33Å
120V93Very high91.3Very high62 Ų6250.8 Ų50.838%0.37629%0.285SS..Hα-helixtrans-63.1-46.7177.3175.50000110.7T94 A98 V116 S122 C123 V124T94-V120 HydrophobicContact CG2-CG1 4.13Å; A98-V120 HydrophobicContact CB-CB 3.98Å; A98-V120 HydrophobicContact CB-CG1 4.02Å; V116-V120 HydrophobicContact CG1-CG2 4.24Å; V116-V120 WeakPolarHBondContact O-CG2 3.41Å; V116-V120 PolarHBondContact O-N 3.41Å; V120-S122 VanDerWaalsContact C-N 3.31Å; V120-S122 PolarHBondContact O-N 3.48Å; V120-C123 PolarHBondContact O-N 3.43Å; V120-V124 HydrophobicContact CG1-CG2 4.36Å; V120-V124 WeakPolarHBondContact O-CG2 3.46Å; V120-V124 PolarHBondContact O-N 3.44Å
121A92.6Very high91.6Very high0 Ų047.5 Ų47.50%026%0.263CS..Hα-helixtrans-59.4-41.217700000112.4Y91 T94 G117 A125Y91-A121 HydrophobicContact CD2-CB 3.86Å; Y91-A121 HydrophobicContact CE2-CB 3.8Å; Y91-A121 HydrophobicContact CG-CB 4.33Å; T94-A121 HydrophobicContact CG2-CB 4.2Å; G117-A121 WeakPolarHBondContact O-CB 3.33Å; G117-A121 PolarHBondContact O-N 2.83Å; A121-A125 WeakPolarHBondContact O-CB 3.35Å; A121-A125 PolarHBondContact O-N 3.32Å
122S90.5Very high92Very high20 Ų2042.9 Ų42.914%0.1424%0.24CC..Hα-helixtrans-63.2-46.7175.3-620000111.4G118 A119 V120 A125 Q126G118-S122 VanDerWaalsContact O-CB 3.26Å; G118-S122 WeakPolarHBondContact O-CB 3.14Å; G118-S122 PolarHBondContact O-N 2.8Å; G118-S122 PolarHBondContact O-OG 3.02Å; A119-S122 PolarHBondContact O-N 3.38Å; V120-S122 VanDerWaalsContact C-N 3.31Å; V120-S122 PolarHBondContact O-N 3.48Å; S122-A125 PolarHBondContact O-N 3.23Å; S122-Q126 WeakPolarHBondContact O-CB 3.46Å; S122-Q126 VanDerWaalsContact O-CG 3.26Å; S122-Q126 WeakPolarHBondContact O-CG 3.45Å; S122-Q126 PolarHBondContact O-N 3.25Å
123C91.8Very high92.3Very high68 Ų6838.2 Ų38.246%0.45922%0.218SC..Hα-helixtrans-59.2-48.3177.4-72.60000112.1A119 V120 Q126 G127 M209A119-C123 PolarHBondContact O-N 2.74Å; A119-C123 PolarHBondContact O-SG 3.41Å; A119-C123 VanDerWaalsContact O-SG 3.33Å; V120-C123 PolarHBondContact O-N 3.43Å; C123-Q126 PolarHBondContact O-N 3.3Å; C123-G127 PolarHBondContact O-N 3.42Å; C123-M209 VanDerWaalsContact SG-CE 3.54Å
124V93.1Very high92.5Very high55 Ų5535.8 Ų35.833%0.33321%0.209SC..Hα-helixtrans-63.7-48179.31730000110.6I90 T94 V120 Q126 G127 F128I90-V124 HydrophobicContact CG2-CG1 4.4Å; T94-V124 HydrophobicContact CG2-CB 3.89Å; T94-V124 HydrophobicContact CG2-CG1 4.21Å; T94-V124 HydrophobicContact CG2-CG2 3.78Å; V120-V124 HydrophobicContact CG1-CG2 4.36Å; V120-V124 WeakPolarHBondContact O-CG2 3.46Å; V120-V124 PolarHBondContact O-N 3.44Å; V124-Q126 VanDerWaalsContact C-N 3.34Å; V124-Q126 PolarHBondContact O-N 3.05Å; V124-G127 WeakPolarHBondContact O-CA 3.47Å; V124-G127 PolarHBondContact O-N 3.33Å; V124-F128 HydrophobicContact CG1-CD2 4.36Å; V124-F128 HydrophobicContact CG1-CE2 4.05Å; V124-F128 WeakPolarHBondContact O-CD2 3.22Å; V124-F128 PolarHBondContact O-N 3.31Å
125A92Very high92.9Very high4 Ų434.4 Ų34.43%0.03320%0.199CC..Hα-helixtrans-58.1-45.7177.600000111.5A121 S122 G127 F128 F129A121-A125 WeakPolarHBondContact O-CB 3.35Å; A121-A125 PolarHBondContact O-N 3.32Å; S122-A125 PolarHBondContact O-N 3.23Å; A125-G127 PolarHBondContact O-N 3.47Å; A125-F128 PolarHBondContact O-N 3.1Å; A125-F128 VanDerWaalsContact O-N 3.09Å; A125-F129 HydrophobicContact CB-CD2 4.07Å; A125-F129 HydrophobicContact CB-CE2 4.17Å; A125-F129 WeakPolarHBondContact O-CD2 3.41Å; A125-F129 PolarHBondContact O-N 3.31Å
126Q91.3Very high93.2Very high19 Ų1927 Ų279%0.08917%0.167CC..Hα-helixtrans-63.7-30.1176.4-67.2-50-58.900112.7S122 C123 V124 F128 F129 V130 M209S122-Q126 WeakPolarHBondContact O-CB 3.46Å; S122-Q126 VanDerWaalsContact O-CG 3.26Å; S122-Q126 WeakPolarHBondContact O-CG 3.45Å; S122-Q126 PolarHBondContact O-N 3.25Å; C123-Q126 PolarHBondContact O-N 3.3Å; V124-Q126 VanDerWaalsContact C-N 3.34Å; V124-Q126 PolarHBondContact O-N 3.05Å; Q126-F128 VanDerWaalsContact C-N 3.25Å; Q126-F128 PolarHBondContact O-N 3.1Å; Q126-F129 PolarHBondContact O-N 2.88Å; Q126-V130 HydrophobicContact CB-CG2 3.94Å; Q126-V130 VanDerWaalsContact O-CB 3.25Å; Q126-V130 WeakPolarHBondContact O-CB 3.48Å; Q126-V130 WeakPolarHBondContact O-CG2 3.18Å; Q126-V130 PolarHBondContact O-N 3.47Å; Q126-V130 VanDerWaalsContact OE1-CG2 3.27Å; Q126-M209 HydrophobicContact CG-CG 3.75Å
127G93.1Very high93.4Very high26 Ų2625 Ų2527%0.26815%0.154SC..Hα-helixtrans-56.2-38.5171.300000113.1C123 V124 A125 P131 Y202C123-G127 PolarHBondContact O-N 3.42Å; V124-G127 WeakPolarHBondContact O-CA 3.47Å; V124-G127 PolarHBondContact O-N 3.33Å; A125-G127 PolarHBondContact O-N 3.47Å; G127-P131 WeakPolarHBondContact O-CD 2.92Å; G127-Y202 WeakPolarHBondContact O-CE1 3.24Å
128F92.6Very high93.6Very high120 Ų12025 Ų2553%0.52615%0.154SC..Hα-helixtrans-84.4-44.6176.4-71.6-85.5000112.9I90 V124 A125 Q126 I132I90-F128 HydrophobicContact CD1-CG 4.49Å; I90-F128 HydrophobicContact CG2-CD2 4.4Å; V124-F128 HydrophobicContact CG1-CD2 4.36Å; V124-F128 HydrophobicContact CG1-CE2 4.05Å; V124-F128 WeakPolarHBondContact O-CD2 3.22Å; V124-F128 PolarHBondContact O-N 3.31Å; A125-F128 PolarHBondContact O-N 3.1Å; A125-F128 VanDerWaalsContact O-N 3.09Å; Q126-F128 VanDerWaalsContact C-N 3.25Å; Q126-F128 PolarHBondContact O-N 3.1Å; F128-I132 WeakPolarHBondContact O-CD1 3.12Å; F128-I132 WeakPolarHBondContact O-CG1 3.03Å
129F93.2Very high93.8Very high6 Ų624.8 Ų24.83%0.02615%0.149CC..Hα-helixtrans-86.9-23.5-167-63.2-59.2000114.5H84 S87 I90 A125 Q126 I132 D133H84-F129 AromaticContact CE1-CD1 3.73Å; H84-F129 AromaticContact CE1-CG 3.8Å; H84-F129 AromaticContact CG-CD1 4Å; H84-F129 AromaticContact ND1-CD1 3.84Å; H84-F129 AromaticContact NE2-CD1 3.85Å; S87-F129 VanDerWaalsContact CA-CE2 3.46Å; S87-F129 VanDerWaalsContact CB-CZ 3.42Å; S87-F129 VanDerWaalsContact OG-CE2 3.23Å; S87-F129 WeakPolarHBondContact OG-CE2 3.35Å; I90-F129 HydrophobicContact CD1-CZ 4.01Å; A125-F129 HydrophobicContact CB-CD2 4.07Å; A125-F129 HydrophobicContact CB-CE2 4.17Å; A125-F129 WeakPolarHBondContact O-CD2 3.41Å; A125-F129 PolarHBondContact O-N 3.31Å; Q126-F129 PolarHBondContact O-N 2.88Å; F129-I132 HydrophobicContact CD1-CD1 4.08Å; F129-I132 HydrophobicContact CE1-CD1 4.4Å; F129-I132 PolarHBondContact O-N 3.34Å; F129-D133 WeakPolarHBondContact O-CB 3.07Å; F129-D133 VanDerWaalsContact O-CG 3.3Å; F129-D133 PolarHBondContact O-N 3.05Å
130V95.3Very high94Very high0 Ų023 Ų230%013%0.134CC..Hα-helixtrans-64.8-47.4177.7174.30000111.6Q126 I132 D133 V134 C205Q126-V130 HydrophobicContact CB-CG2 3.94Å; Q126-V130 VanDerWaalsContact O-CB 3.25Å; Q126-V130 WeakPolarHBondContact O-CB 3.48Å; Q126-V130 WeakPolarHBondContact O-CG2 3.18Å; Q126-V130 PolarHBondContact O-N 3.47Å; Q126-V130 VanDerWaalsContact OE1-CG2 3.27Å; V130-I132 VanDerWaalsContact C-N 3.3Å; V130-I132 PolarHBondContact O-N 2.83Å; V130-D133 PolarHBondContact O-N 2.6Å; V130-V134 HydrophobicContact CG1-CG2 4.31Å; V130-V134 WeakPolarHBondContact O-CG2 3.23Å; V130-V134 PolarHBondContact O-N 3.12Å; V130-C205 HydrophobicContact CG1-CB 4.33Å; V130-C205 HydrophobicContact CG2-CB 4.3Å
131P96.2Very high93.9Very high23 Ų2320 Ų2015%0.14912%0.116CC..Hα-helixtrans-56.7-42.1173.1-28.336.9000113.5G127 V134 V135 F201 Y202G127-P131 WeakPolarHBondContact O-CD 2.92Å; P131-V134 PolarHBondContact O-N 2.89Å; P131-V135 WeakPolarHBondContact O-CG2 3.29Å; P131-V135 PolarHBondContact O-N 3.12Å; P131-F201 VanDerWaalsContact CA-O 3.28Å; P131-F201 WeakPolarHBondContact CA-O 3.42Å; P131-F201 HydrophobicContact CB-CB 4.12Å; P131-F201 HydrophobicContact CG-CB 4.38Å; P131-Y202 HydrophobicContact CG-CD1 4.01Å; P131-Y202 HydrophobicContact CG-CE1 3.55Å; P131-Y202 HydrophobicContact CG-CE2 4.1Å; P131-Y202 HydrophobicContact CG-CG 4.48Å
132I95.7Very high93.8Very high35 Ų3520.6 Ų20.618%0.17912%0.12CC..Hα-helixtrans-62.9-45.4178-65.9175000110.2V80 F83 F128 F129 V130 S136V80-I132 HydrophobicContact CG1-CG2 3.84Å; V80-I132 VanDerWaalsContact O-CG2 3.22Å; V80-I132 WeakPolarHBondContact O-CG2 3.33Å; F83-I132 HydrophobicContact CB-CD1 3.93Å; F128-I132 WeakPolarHBondContact O-CD1 3.12Å; F128-I132 WeakPolarHBondContact O-CG1 3.03Å; F129-I132 HydrophobicContact CD1-CD1 4.08Å; F129-I132 HydrophobicContact CE1-CD1 4.4Å; F129-I132 PolarHBondContact O-N 3.34Å; V130-I132 VanDerWaalsContact C-N 3.3Å; V130-I132 PolarHBondContact O-N 2.83Å; I132-S136 WeakPolarHBondContact O-CB 3.47Å; I132-S136 PolarHBondContact O-N 2.61Å
133D95.1Very high93.6Very high11 Ų1120.3 Ų20.36%0.05912%0.116CC..Hα-helixtrans-65-45178.7-78.1-6.9000111.4H84 F129 V130 V135 S136 Q137 R285H84-D133 IonicContact CD2-OD1 3.65Å; H84-D133 IonicContact CE1-OD1 3.97Å; H84-D133 IonicContact NE2-OD1 2.79Å; H84-D133 PolarHBondContact NE2-OD1 2.95Å; F129-D133 WeakPolarHBondContact O-CB 3.07Å; F129-D133 VanDerWaalsContact O-CG 3.3Å; F129-D133 PolarHBondContact O-N 3.05Å; V130-D133 PolarHBondContact O-N 2.6Å; D133-V135 PolarHBondContact O-N 2.85Å; D133-S136 PolarHBondContact O-N 3.26Å; D133-Q137 VanDerWaalsContact O-CB 3.24Å; D133-Q137 WeakPolarHBondContact O-CB 3.08Å; D133-Q137 WeakPolarHBondContact O-CG 3.49Å; D133-Q137 PolarHBondContact O-N 3.35Å; D133-R285 IonicContact OD2-CZ 2.67Å; D133-R285 IonicContact OD2-NH1 3.55Å; D133-R285 IonicContact OD2-NH2 2.75Å; D133-R285 PolarHBondContact OD2-NH2 3.43Å
134V95.9Very high93.1Very high0 Ų017 Ų170%010%0.095CC..Hα-helixtrans-57.5-52.2177170.40000110V130 P131 Q137 H138 I192 F201 Q289V130-V134 HydrophobicContact CG1-CG2 4.31Å; V130-V134 WeakPolarHBondContact O-CG2 3.23Å; V130-V134 PolarHBondContact O-N 3.12Å; P131-V134 PolarHBondContact O-N 2.89Å; V134-Q137 PolarHBondContact O-N 3.02Å; V134-H138 PolarHBondContact O-N 2.98Å; V134-H138 VanDerWaalsContact O-N 3.13Å; V134-H138 PolarHBondContact O-ND1 3.07Å; V134-I192 HydrophobicContact CG1-CD1 4Å; V134-F201 WeakPolarHBondContact CG2-O 3.18Å; V134-Q289 HydrophobicContact CG2-CB 3.99Å; V134-Q289 HydrophobicContact CG2-CG 3.94Å
135V96.4Very high92.3Very high11 Ų1115.5 Ų15.57%0.0678%0.084CC..Hα-helixtrans-64-46.3179.9174.60000111.2V80 P131 D133 Q137 H138 L139 L185 V188 I189 I192 F201V80-V135 HydrophobicContact CG1-CB 4.3Å; V80-V135 HydrophobicContact CG1-CG1 4.17Å; V80-V135 HydrophobicContact CG2-CG1 4.33Å; P131-V135 WeakPolarHBondContact O-CG2 3.29Å; P131-V135 PolarHBondContact O-N 3.12Å; D133-V135 PolarHBondContact O-N 2.85Å; V135-Q137 VanDerWaalsContact C-N 3.33Å; V135-Q137 PolarHBondContact O-N 3.4Å; V135-H138 PolarHBondContact O-N 3.5Å; V135-L139 HydrophobicContact CG1-CD1 4.07Å; V135-L139 WeakPolarHBondContact O-CG 3.44Å; V135-L139 PolarHBondContact O-N 2.89Å; V135-L185 HydrophobicContact CG1-CD1 3.54Å; V135-V188 HydrophobicContact CG1-CG1 4.32Å; V135-I189 HydrophobicContact CG1-CG1 4.27Å; V135-I189 HydrophobicContact CG2-CG1 4.25Å; V135-I192 HydrophobicContact CG2-CD1 4.15Å; V135-F201 HydrophobicContact CG2-CD1 3.87Å; V135-F201 HydrophobicContact CG2-CE1 3.74Å
136S95.8Very high91.4Very high1 Ų120.1 Ų20.11%0.00710%0.101CC..Hα-helixtrans-61.4-41.2179.6-179.80000111.9G77 I132 D133 L139 M140G77-S136 PolarHBondContact O-OG 3.16Å; I132-S136 WeakPolarHBondContact O-CB 3.47Å; I132-S136 PolarHBondContact O-N 2.61Å; D133-S136 PolarHBondContact O-N 3.26Å; S136-L139 PolarHBondContact O-N 2.98Å; S136-M140 VanDerWaalsContact O-CG 3.24Å; S136-M140 WeakPolarHBondContact O-CG 3.5Å; S136-M140 PolarHBondContact O-N 3.2Å; S136-M140 WeakPolarHBondContact OG-CE 3.18Å
137Q95.4Very high90.6Very high10 Ų1019.2 Ų19.25%0.04710%0.097CC..Hα-helixtrans-69.5-37.9-178.9-71.9170300111.5T44 D133 V134 V135 L139 M140 V141 Q289 V290T44-Q137 HydrophobicContact CG2-CB 4.23Å; T44-Q137 HydrophobicContact CG2-CG 4.21Å; D133-Q137 VanDerWaalsContact O-CB 3.24Å; D133-Q137 WeakPolarHBondContact O-CB 3.08Å; D133-Q137 WeakPolarHBondContact O-CG 3.49Å; D133-Q137 PolarHBondContact O-N 3.35Å; V134-Q137 PolarHBondContact O-N 3.02Å; V135-Q137 VanDerWaalsContact C-N 3.33Å; V135-Q137 PolarHBondContact O-N 3.4Å; Q137-L139 VanDerWaalsContact C-N 3.32Å; Q137-L139 PolarHBondContact O-N 2.96Å; Q137-M140 HydrophobicContact CG-SD 4.48Å; Q137-M140 WeakPolarHBondContact O-CB 3.49Å; Q137-M140 PolarHBondContact O-N 2.86Å; Q137-V141 WeakPolarHBondContact O-CG2 3.48Å; Q137-V141 PolarHBondContact O-N 3.32Å; Q137-Q289 VanDerWaalsContact OE1-OE1 3.1Å; Q137-V290 HydrophobicContact CB-CG2 3.36Å; Q137-V290 HydrophobicContact CG-CG2 4.39Å
138H94.9Very high89.8Confident1 Ų118.7 Ų18.71%0.0059%0.087CC..Hα-helixtrans-60.5-42.4170.7-76.786.8000111.4V134 V135 M140 V141 V142 V188 Q289 V290 H292V134-H138 PolarHBondContact O-N 2.98Å; V134-H138 VanDerWaalsContact O-N 3.13Å; V134-H138 PolarHBondContact O-ND1 3.07Å; V135-H138 PolarHBondContact O-N 3.5Å; H138-M140 VanDerWaalsContact C-N 3.33Å; H138-M140 PolarHBondContact O-N 3.44Å; H138-V141 VanDerWaalsContact O-CG2 3.32Å; H138-V141 WeakPolarHBondContact O-CG2 3.26Å; H138-V141 PolarHBondContact O-N 2.85Å; H138-V142 WeakPolarHBondContact O-CB 3.37Å; H138-V142 PolarHBondContact O-N 3.34Å; H138-V188 HydrophobicContact CB-CG1 3.5Å; H138-V188 VanDerWaalsContact CB-CG1 3.5Å; H138-V188 HydrophobicContact CB-CG2 4.28Å; H138-Q289 PolarHBondContact CE1-O 3.38Å; H138-Q289 VanDerWaalsContact CE1-O 3.32Å; H138-V290 PolarHBondContact NE2-O 2.88Å; H138-V290 VanDerWaalsContact NE2-O 3.14Å; H138-H292 AromaticContact CE1-CD2 4Å; H138-H292 AromaticContact CE1-NE2 3.43Å; H138-H292 PolarHBondContact CE1-NE2 3.48Å; H138-H292 AromaticContact NE2-CD2 3.9Å; H138-H292 AromaticContact NE2-NE2 3.66Å
139L95Very high88.9Confident8 Ų816.8 Ų16.84%0.0429%0.085CC..Hα-helixtrans-65.7-33175.1-69.3170.3000113.2S76 V80 V135 S136 Q137 V141 R184 L185 V188S76-L139 WeakPolarHBondContact CB-O 3.45Å; S76-L139 PolarHBondContact OG-O 3.08Å; V80-L139 HydrophobicContact CB-CD1 4.46Å; V80-L139 HydrophobicContact CG2-CD1 3.65Å; V135-L139 HydrophobicContact CG1-CD1 4.07Å; V135-L139 WeakPolarHBondContact O-CG 3.44Å; V135-L139 PolarHBondContact O-N 2.89Å; S136-L139 PolarHBondContact O-N 2.98Å; Q137-L139 VanDerWaalsContact C-N 3.32Å; Q137-L139 PolarHBondContact O-N 2.96Å; L139-V141 PolarHBondContact O-N 3.43Å; L139-R184 HydrophobicContact CD2-CB 3.83Å; L139-L185 HydrophobicContact CD1-CD1 3.95Å; L139-V188 HydrophobicContact CD2-CB 4.32Å; L139-V188 HydrophobicContact CD2-CG2 3.8Å; L139-V188 HydrophobicContact CG-CG2 4.33Å
140M94.1Very high88Confident3 Ų319.2 Ų19.22%0.01510%0.099CC..Hα-helixtrans-64.9-26176.9-74.5166.2176.900112.6Y37 V40 L41 T44 R45 S76 S136 Q137 H138Y37-M140 HydrophobicContact CE2-CE 3.54Å; Y37-M140 WeakPolarHBondContact OH-CE 3.42Å; Y37-M140 WeakPolarHBondContact OH-CG 3.4Å; V40-M140 HydrophobicContact CG1-CE 3.7Å; V40-M140 HydrophobicContact CG1-SD 4.38Å; L41-M140 HydrophobicContact CB-CG 4.3Å; L41-M140 HydrophobicContact CD1-CB 4.26Å; L41-M140 HydrophobicContact CD1-CG 4.21Å; L41-M140 HydrophobicContact CG-CB 4.21Å; L41-M140 HydrophobicContact CG-CG 4.3Å; T44-M140 HydrophobicContact CG2-CB 4.3Å; T44-M140 HydrophobicContact CG2-SD 4.14Å; R45-M140 VanDerWaalsContact CZ-O 3.27Å; R45-M140 PolarHBondContact NE-O 3.35Å; R45-M140 PolarHBondContact NH2-O 2.95Å; S76-M140 WeakPolarHBondContact O-CA 3.38Å; S76-M140 VanDerWaalsContact O-CG 3.26Å; S76-M140 WeakPolarHBondContact O-CG 3.16Å; S136-M140 VanDerWaalsContact O-CG 3.24Å; S136-M140 WeakPolarHBondContact O-CG 3.5Å; S136-M140 PolarHBondContact O-N 3.2Å; S136-M140 WeakPolarHBondContact OG-CE 3.18Å; Q137-M140 HydrophobicContact CG-SD 4.48Å; Q137-M140 WeakPolarHBondContact O-CB 3.49Å; Q137-M140 PolarHBondContact O-N 2.86Å; H138-M140 VanDerWaalsContact C-N 3.33Å; H138-M140 PolarHBondContact O-N 3.44Å
141V92.1Very high86.9Confident0 Ų021.3 Ų21.30%011%0.109CC..Hα-helixtrans-112.5-15-174.1-59.60000114.7T44 R45 L48 Q137 H138 L139 N143 C144 T169 V290T44-V141 HydrophobicContact CG2-CG1 4.08Å; R45-V141 HydrophobicContact CG-CG1 4.01Å; L48-V141 HydrophobicContact CD1-CG1 3.55Å; Q137-V141 WeakPolarHBondContact O-CG2 3.48Å; Q137-V141 PolarHBondContact O-N 3.32Å; H138-V141 VanDerWaalsContact O-CG2 3.32Å; H138-V141 WeakPolarHBondContact O-CG2 3.26Å; H138-V141 PolarHBondContact O-N 2.85Å; L139-V141 PolarHBondContact O-N 3.43Å; V141-N143 VanDerWaalsContact C-N 3.3Å; V141-N143 PolarHBondContact O-N 3.41Å; V141-C144 WeakPolarHBondContact O-CA 3.23Å; V141-C144 WeakPolarHBondContact O-CB 3.25Å; V141-C144 PolarHBondContact O-N 2.67Å; V141-T169 HydrophobicContact CB-CG2 4.26Å; V141-T169 HydrophobicContact CG2-CG2 3.16Å; V141-V290 HydrophobicContact CG2-CG1 4.11Å
142V90.5Very high85.8Confident11 Ų1121.9 Ų21.97%0.06711%0.112CC..Hα-helixtrans-56.8-41.9-176.671.80000112.8H138 C144 N145 V171 L173H138-V142 WeakPolarHBondContact O-CB 3.37Å; H138-V142 PolarHBondContact O-N 3.34Å; V142-C144 PolarHBondContact O-N 2.76Å; V142-N145 PolarHBondContact O-N 2.87Å; V142-V171 HydrophobicContact CG2-CG1 4.27Å; V142-L173 HydrophobicContact CG2-CD1 3.66Å; V142-L173 HydrophobicContact CG2-CG 4.04Å
143N85.8Confident84.6Confident14 Ų1429.9 Ų29.98%0.07514%0.142CC..Hα-helixtrans-68.9-23.8177.1-65.9-8.9000112.7E69 V141 N145 R146 I147 R184E69-N143 HydrophobicContact CG-CB 4.11Å; E69-N143 WeakPolarHBondContact OE1-CB 3.12Å; E69-N143 VanDerWaalsContact OE2-CB 3.23Å; E69-N143 WeakPolarHBondContact OE2-CB 3.37Å; E69-N143 PolarHBondContact OE2-ND2 3.42Å; V141-N143 VanDerWaalsContact C-N 3.3Å; V141-N143 PolarHBondContact O-N 3.41Å; N143-N145 PolarHBondContact O-N 2.9Å; N143-R146 WeakPolarHBondContact O-CB 3.35Å; N143-R146 PolarHBondContact O-N 2.92Å; N143-R146 VanDerWaalsContact O-N 3.11Å; N143-I147 PolarHBondContact O-N 3.28Å; N143-R184 PolarHBondContact ND2-NH1 2.94Å; N143-R184 PolarHBondContact OD1-NH1 2.88Å
144C82.3Confident83.6Confident0 Ų035.6 Ų35.60%017%0.166CC..Hα-helixtrans-68.7-24.8-178.5-1610000112Y55 V141 V142 R146 I147 H148 L168Y55-C144 PolarHBondContact OH-SG 3.21Å; V141-C144 WeakPolarHBondContact O-CA 3.23Å; V141-C144 WeakPolarHBondContact O-CB 3.25Å; V141-C144 PolarHBondContact O-N 2.67Å; V142-C144 PolarHBondContact O-N 2.76Å; C144-R146 VanDerWaalsContact C-N 3.27Å; C144-R146 PolarHBondContact O-N 2.84Å; C144-I147 PolarHBondContact O-N 3.26Å; C144-H148 WeakPolarHBondContact O-CB 3.33Å; C144-H148 PolarHBondContact O-N 3.15Å; C144-L168 HydrophobicContact CB-CD1 4.11Å; C144-L168 WeakPolarHBondContact SG-CD1 3.47Å
145N75.1Confident82.5Confident22 Ų2240 Ų4012%0.11819%0.189CC..Hα-helixtrans-60-40.4172-71.5-9.5000110.8V142 N143 H148 T149 T169 V171V142-N145 PolarHBondContact O-N 2.87Å; N143-N145 PolarHBondContact O-N 2.9Å; N145-H148 WeakPolarHBondContact O-CB 3.34Å; N145-H148 PolarHBondContact O-N 3.18Å; N145-T149 WeakPolarHBondContact O-CG2 3.37Å; N145-T149 PolarHBondContact O-N 3.36Å; N145-T149 PolarHBondContact O-OG1 3.04Å; N145-T169 PolarHBondContact ND2-O 3.45Å; N145-T169 PolarHBondContact ND2-OG1 3.38Å; N145-T169 VanDerWaalsContact ND2-OG1 3.1Å; N145-T169 PolarHBondContact OD1-N 3.23Å; N145-T169 PolarHBondContact OD1-O 3.47Å; N145-V171 PolarHBondContact ND2-O 3.31Å
146R73.7Confident80.8Confident101 Ų10143.8 Ų43.838%0.38122%0.217SC..Hα-helixtrans-66.2-41175.8-170.117972.8174.14.7112.5E68 N143 C144 H148 T149 N150E68-R146 PolarHBondContact O-NH2 3.44Å; N143-R146 WeakPolarHBondContact O-CB 3.35Å; N143-R146 PolarHBondContact O-N 2.92Å; N143-R146 VanDerWaalsContact O-N 3.11Å; C144-R146 VanDerWaalsContact C-N 3.27Å; C144-R146 PolarHBondContact O-N 2.84Å; R146-H148 VanDerWaalsContact C-N 3.27Å; R146-H148 PolarHBondContact O-N 3.1Å; R146-T149 WeakPolarHBondContact CA-OG1 3.29Å; R146-T149 PolarHBondContact O-N 2.99Å; R146-T149 PolarHBondContact O-OG1 3.28Å; R146-N150 WeakPolarHBondContact O-CB 3.15Å; R146-N150 PolarHBondContact O-N 3.13Å; R146-N150 PolarHBondContact O-OD1 3.16Å
147I75.1Confident79.2Confident1 Ų150.5 Ų50.51%0.00525%0.252CS..Hα-helixtrans-59.6-45.1174-56.7-176.2000109.6V65 E68 E69 N143 C144 N150 M151V65-I147 HydrophobicContact CG2-CD1 4.34Å; E68-I147 HydrophobicContact CB-CD1 4.16Å; E68-I147 HydrophobicContact CB-CG1 3.88Å; E68-I147 HydrophobicContact CB-CG2 4.39Å; E68-I147 HydrophobicContact CG-CG2 4.22Å; E69-I147 HydrophobicContact CG-CD1 4.02Å; E69-I147 HydrophobicContact CG-CG1 4.33Å; E69-I147 WeakPolarHBondContact OE1-CD1 3.47Å; N143-I147 PolarHBondContact O-N 3.28Å; C144-I147 PolarHBondContact O-N 3.26Å; I147-N150 PolarHBondContact O-N 3.32Å; I147-M151 HydrophobicContact CG2-CE 3.39Å; I147-M151 WeakPolarHBondContact O-CG 3.47Å; I147-M151 PolarHBondContact O-N 3.43Å
148H74.6Confident77.4Confident15 Ų1552.4 Ų52.47%0.06926%0.262CS..Hα-helixtrans-60.8-47.9179.3178.999.7000111.9C144 N145 R146 N150 M151 V152 F165C144-H148 WeakPolarHBondContact O-CB 3.33Å; C144-H148 PolarHBondContact O-N 3.15Å; N145-H148 WeakPolarHBondContact O-CB 3.34Å; N145-H148 PolarHBondContact O-N 3.18Å; R146-H148 VanDerWaalsContact C-N 3.27Å; R146-H148 PolarHBondContact O-N 3.1Å; H148-N150 VanDerWaalsContact C-N 3.34Å; H148-N150 PolarHBondContact O-N 2.94Å; H148-M151 PolarHBondContact O-N 3.28Å; H148-V152 WeakPolarHBondContact O-CG2 3.33Å; H148-V152 PolarHBondContact O-N 3.35Å; H148-F165 AromaticContact CE1-CD1 3.48Å; H148-F165 VanDerWaalsContact CE1-CD1 3.48Å; H148-F165 WeakPolarHBondContact CE1-CD1 3.35Å; H148-F165 AromaticContact CE1-CG 3.99Å
149T73.9Confident75.5Confident79 Ų7955.9 Ų55.949%0.48529%0.287SS..Hα-helixtrans-61.7-41.7176.656.50000112.1N145 R146 M151 V152 Y153N145-T149 WeakPolarHBondContact O-CG2 3.37Å; N145-T149 PolarHBondContact O-N 3.36Å; N145-T149 PolarHBondContact O-OG1 3.04Å; R146-T149 WeakPolarHBondContact CA-OG1 3.29Å; R146-T149 PolarHBondContact O-N 2.99Å; R146-T149 PolarHBondContact O-OG1 3.28Å; T149-M151 VanDerWaalsContact C-N 3.33Å; T149-M151 PolarHBondContact O-N 2.91Å; T149-V152 PolarHBondContact O-N 3.49Å; T149-Y153 WeakPolarHBondContact O-CB 3.27Å; T149-Y153 PolarHBondContact O-N 3.18Å
150N74.9Confident73.7Confident57 Ų5760 Ų6031%0.30532%0.316SS..Hα-helixtrans-62.7-39.1176.8-72.5-4.5000112.3E68 R146 I147 H148 K154E68-N150 PolarHBondContact OE2-ND2 3.34Å; R146-N150 WeakPolarHBondContact O-CB 3.15Å; R146-N150 PolarHBondContact O-N 3.13Å; R146-N150 PolarHBondContact O-OD1 3.16Å; I147-N150 PolarHBondContact O-N 3.32Å; H148-N150 VanDerWaalsContact C-N 3.34Å; H148-N150 PolarHBondContact O-N 2.94Å; N150-K154 WeakPolarHBondContact O-CB 3.12Å; N150-K154 VanDerWaalsContact O-CG 3.32Å; N150-K154 WeakPolarHBondContact O-CG 3.48Å; N150-K154 PolarHBondContact O-N 3.4Å
151M72.3Confident71.7Confident45 Ų4564.6 Ų64.622%0.22234%0.341CS..Hα-helixtrans-69.1-41.4177.5-77.3-160.6-102.800112.6V54 I147 H148 T149 N155V54-M151 HydrophobicContact CG1-CE 3.71Å; I147-M151 HydrophobicContact CG2-CE 3.39Å; I147-M151 WeakPolarHBondContact O-CG 3.47Å; I147-M151 PolarHBondContact O-N 3.43Å; H148-M151 PolarHBondContact O-N 3.28Å; T149-M151 VanDerWaalsContact C-N 3.33Å; T149-M151 PolarHBondContact O-N 2.91Å; M151-N155 PolarHBondContact O-N 3.41Å; M151-N155 VanDerWaalsContact O-N 3.15Å
152V72.1Confident69.8Low34 Ų3468.8 Ų68.821%0.20637%0.368CS..Hα-helixtrans-64-43.2175.5174.50000110.4H148 T149 N155 L158 F165H148-V152 WeakPolarHBondContact O-CG2 3.33Å; H148-V152 PolarHBondContact O-N 3.35Å; T149-V152 PolarHBondContact O-N 3.49Å; V152-N155 CarbonylContact O-C 3.6Å; V152-N155 PolarHBondContact O-N 2.74Å; V152-N155 VanDerWaalsContact O-O 3.05Å; V152-L158 HydrophobicContact CG2-CD2 4.13Å; V152-F165 HydrophobicContact CG2-CB 4.43Å; V152-F165 HydrophobicContact CG2-CD1 4.4Å; V152-F165 HydrophobicContact CG2-CG 4.42Å
153Y72.1Confident67.9Low204 Ų20477.1 Ų77.180%0.841%0.406SS*.Hα-helixtrans-63-43.5177.7-179.1-99.1000112.8T149 N155T149-Y153 WeakPolarHBondContact O-CB 3.27Å; T149-Y153 PolarHBondContact O-N 3.18Å; Y153-N155 VanDerWaalsContact C-N 3.29Å; Y153-N155 PolarHBondContact O-N 3.01Å
154K74Confident66.2Low131 Ų13184.9 Ų84.957%0.5743%0.434SS*.Hα-helixtrans-66.8-29.1178-75173.5-176.7170.60113E68 N150E68-K154 IonicContact OE1-NZ 3.1Å; E68-K154 PolarHBondContact OE1-NZ 3.45Å; E68-K154 VanDerWaalsContact OE1-NZ 3.1Å; N150-K154 WeakPolarHBondContact O-CB 3.12Å; N150-K154 VanDerWaalsContact O-CG 3.32Å; N150-K154 WeakPolarHBondContact O-CG 3.48Å; N150-K154 PolarHBondContact O-N 3.4Å
155N72.2Confident64.9Low91 Ų9186.6 Ų86.649%0.48744%0.442SS..  trans-102.186.8178.8-74.8-29.3000110.5M151 V152 Y153 N157 L158 S159M151-N155 PolarHBondContact O-N 3.41Å; M151-N155 VanDerWaalsContact O-N 3.15Å; V152-N155 CarbonylContact O-C 3.6Å; V152-N155 PolarHBondContact O-N 2.74Å; V152-N155 VanDerWaalsContact O-O 3.05Å; Y153-N155 VanDerWaalsContact C-N 3.29Å; Y153-N155 PolarHBondContact O-N 3.01Å; N155-N157 PolarHBondContact O-N 3.32Å; N155-N157 VanDerWaalsContact O-N 3.13Å; N155-L158 HydrophobicContact CB-CB 3.81Å; N155-L158 HydrophobicContact CB-CD2 4.42Å; N155-L158 WeakPolarHBondContact O-CA 3.46Å; N155-L158 WeakPolarHBondContact O-CB 3.43Å; N155-L158 PolarHBondContact O-N 3.25Å; N155-S159 PolarHBondContact O-N 3.19Å
156S61.3Low64.4Low92 Ų9292.7 Ų92.764%0.64346%0.463SS*.Hα-helixtrans-50.1-38.7176.354.60000113.2L158 S159S156-L158 PolarHBondContact O-N 3.02Å; S156-S159 WeakPolarHBondContact O-CB 3.28Å; S156-S159 PolarHBondContact O-N 2.93Å
157N60.9Low63.9Low141 Ų14190.6 Ų90.675%0.75446%0.462SS*.Hα-helixtrans-60.1-31.5175.5-67-16.4000113.2N155 S160N155-N157 PolarHBondContact O-N 3.32Å; N155-N157 VanDerWaalsContact O-N 3.13Å; N157-S160 PolarHBondContact O-OG 3.48Å
158L59.2Low63.6Low50 Ų5091 Ų9126%0.26247%0.465SS..Hα-helixtrans-76.8-31179.7-143.370.2000112.2V152 N155 S156 S160 N161 F165V152-L158 HydrophobicContact CG2-CD2 4.13Å; N155-L158 HydrophobicContact CB-CB 3.81Å; N155-L158 HydrophobicContact CB-CD2 4.42Å; N155-L158 WeakPolarHBondContact O-CA 3.46Å; N155-L158 WeakPolarHBondContact O-CB 3.43Å; N155-L158 PolarHBondContact O-N 3.25Å; S156-L158 PolarHBondContact O-N 3.02Å; L158-S160 PolarHBondContact O-N 3.01Å; L158-N161 PolarHBondContact O-N 3.27Å; L158-F165 HydrophobicContact CD1-CD2 4.3Å; L158-F165 HydrophobicContact CD1-CE2 3.42Å; L158-F165 VanDerWaalsContact CD1-CE2 3.42Å; L158-F165 HydrophobicContact CD1-CZ 3.71Å; L158-F165 HydrophobicContact CD2-CD1 4.21Å; L158-F165 HydrophobicContact CD2-CD2 4.06Å; L158-F165 HydrophobicContact CD2-CE1 3.78Å; L158-F165 HydrophobicContact CD2-CE2 3.64Å; L158-F165 HydrophobicContact CD2-CG 4.37Å; L158-F165 HydrophobicContact CD2-CZ 3.51Å; L158-F165 HydrophobicContact CG-CD2 3.87Å; L158-F165 HydrophobicContact CG-CE2 3.45Å; L158-F165 VanDerWaalsContact CG-CE2 3.45Å; L158-F165 HydrophobicContact CG-CZ 3.83Å
159S55.1Low63.4Low75 Ų7590.3 Ų90.352%0.52446%0.462SS..Hα-helixtrans-60.9-24176.3-174.50000113N155 S156 N161N155-S159 PolarHBondContact O-N 3.19Å; S156-S159 WeakPolarHBondContact O-CB 3.28Å; S156-S159 PolarHBondContact O-N 2.93Å; S159-N161 PolarHBondContact O-N 3Å
160S55.4Low63.2Low94 Ų9489.7 Ų89.766%0.65746%0.459SS*.THydrogen-bonded Turntrans-63.9-18.1178.368.50000114N157 L158N157-S160 PolarHBondContact O-OG 3.48Å; L158-S160 PolarHBondContact O-N 3.01Å
161N53.7Low63.6Low99 Ų9987.1 Ų87.153%0.52945%0.445SS..  trans-137.867.5-175-126.3-28.1000112.4L158 S159 H163 R164L158-N161 PolarHBondContact O-N 3.27Å; S159-N161 PolarHBondContact O-N 3Å; N161-H163 VanDerWaalsContact C-N 3.25Å; N161-H163 PolarHBondContact O-N 3.5Å; N161-R164 WeakPolarHBondContact O-CB 3.22Å; N161-R164 PolarHBondContact O-N 3.22Å; N161-R164 VanDerWaalsContact O-N 3.08Å
162P51.9Low63.9Low88 Ų8892.5 Ų92.557%0.57147%0.47SS*.G310 helixtrans-62.5-29.2-17124-33.2000113.3R164 F165P162-R164 PolarHBondContact O-N 3.41Å; P162-R164 VanDerWaalsContact O-N 3.16Å; P162-F165 PolarHBondContact O-N 3Å
163H49.5Very low64.7Low186 Ų18692.6 Ų92.686%0.86147%0.468SS*.G310 helixtrans-65.1-17.2177.6-69.3-58.5000114.2N161 F165N161-H163 VanDerWaalsContact C-N 3.25Å; N161-H163 PolarHBondContact O-N 3.5Å; H163-F165 VanDerWaalsContact C-N 3.33Å
164R51.6Low65.4Low178 Ų17886.3 Ų86.367%0.67245%0.451SS*.G310 helixtrans-74.7-26.6178-160.2176-161.3-173.46111.8Q53 N161 P162Q53-R164 VanDerWaalsContact CD-O 3.24Å; Q53-R164 PolarHBondContact NE2-O 3.33Å; Q53-R164 PolarHBondContact OE1-O 3.27Å; N161-R164 WeakPolarHBondContact O-CB 3.22Å; N161-R164 PolarHBondContact O-N 3.22Å; N161-R164 VanDerWaalsContact O-N 3.08Å; P162-R164 PolarHBondContact O-N 3.41Å; P162-R164 VanDerWaalsContact O-N 3.16Å
165F55.2Low66Low36 Ų3687 Ų8716%0.15846%0.457CS..  trans-11195.9-169-86.6-94.2000111.3Q53 H148 V152 L158 P162 H163Q53-F165 HydrophobicContact CB-CD1 4.12Å; Q53-F165 HydrophobicContact CB-CE1 3.56Å; Q53-F165 HydrophobicContact CB-CZ 4.03Å; Q53-F165 HydrophobicContact CG-CE1 4.05Å; Q53-F165 HydrophobicContact CG-CZ 4.08Å; H148-F165 AromaticContact CE1-CD1 3.48Å; H148-F165 VanDerWaalsContact CE1-CD1 3.48Å; H148-F165 WeakPolarHBondContact CE1-CD1 3.35Å; H148-F165 AromaticContact CE1-CG 3.99Å; V152-F165 HydrophobicContact CG2-CB 4.43Å; V152-F165 HydrophobicContact CG2-CD1 4.4Å; V152-F165 HydrophobicContact CG2-CG 4.42Å; L158-F165 HydrophobicContact CD1-CD2 4.3Å; L158-F165 HydrophobicContact CD1-CE2 3.42Å; L158-F165 VanDerWaalsContact CD1-CE2 3.42Å; L158-F165 HydrophobicContact CD1-CZ 3.71Å; L158-F165 HydrophobicContact CD2-CD1 4.21Å; L158-F165 HydrophobicContact CD2-CD2 4.06Å; L158-F165 HydrophobicContact CD2-CE1 3.78Å; L158-F165 HydrophobicContact CD2-CE2 3.64Å; L158-F165 HydrophobicContact CD2-CG 4.37Å; L158-F165 HydrophobicContact CD2-CZ 3.51Å; L158-F165 HydrophobicContact CG-CD2 3.87Å; L158-F165 HydrophobicContact CG-CE2 3.45Å; L158-F165 VanDerWaalsContact CG-CE2 3.45Å; L158-F165 HydrophobicContact CG-CZ 3.83Å; P162-F165 PolarHBondContact O-N 3Å; H163-F165 VanDerWaalsContact C-N 3.33Å
166R63Low66.7Low150 Ų15089 Ų8957%0.56647%0.468SS*.  trans-90.9132.3177.4-154175.7-148.2174.37.3110.2
167P64.1Low68.1Low56 Ų5685.8 Ų85.836%0.36444%0.442SS..  trans-62.5146.1175.226.3-34.3000110.5T169P167-T169 PolarHBondContact O-N 2.96Å
168L68Low69.4Low10 Ų1081.8 Ų81.85%0.05242%0.42CS..SBendtrans-60.9-28.1178.2-73.6101.3000111.7R45 L48 Q49 V54 C144R45-L168 VanDerWaalsContact O-CD2 3.29Å; R45-L168 WeakPolarHBondContact O-CD2 3.33Å; L48-L168 HydrophobicContact CB-CD2 3.79Å; Q49-L168 HydrophobicContact CB-CD2 4.02Å; Q49-L168 HydrophobicContact CB-CG 4.38Å; V54-L168 HydrophobicContact CG1-CD1 4.38Å; V54-L168 HydrophobicContact CG2-CD1 3.95Å; C144-L168 HydrophobicContact CB-CD1 4.11Å; C144-L168 WeakPolarHBondContact SG-CD1 3.47Å
169T70.3Confident70.7Confident1 Ų184.9 Ų84.91%0.00644%0.437CS..  trans-138.6145170.653.60000113V141 N145 P167 V171 V290V141-T169 HydrophobicContact CB-CG2 4.26Å; V141-T169 HydrophobicContact CG2-CG2 3.16Å; N145-T169 PolarHBondContact ND2-O 3.45Å; N145-T169 PolarHBondContact ND2-OG1 3.38Å; N145-T169 VanDerWaalsContact ND2-OG1 3.1Å; N145-T169 PolarHBondContact OD1-N 3.23Å; N145-T169 PolarHBondContact OD1-O 3.47Å; P167-T169 PolarHBondContact O-N 2.96Å; T169-V171 PolarHBondContact O-N 3.32Å; T169-V290 HydrophobicContact CG2-CG1 3.23Å
170P70.6Confident72.3Confident65 Ų6584 Ų8442%0.42243%0.431SS..  trans-77.79.8170.333.3-36.4000113.6H172 Y191P170-H172 PolarHBondContact O-CE1 3.48Å; P170-H172 PolarHBondContact O-N 3.39Å; P170-H172 PolarHBondContact O-ND1 2.97Å; P170-Y191 WeakPolarHBondContact CG-OH 3.45Å
171V82.4Confident74Confident4 Ų484.2 Ų84.22%0.02442%0.424CS..  trans-71.6117.5-180-1750000109.5V142 N145 T169 L173 V188 Y191V142-V171 HydrophobicContact CG2-CG1 4.27Å; N145-V171 PolarHBondContact ND2-O 3.31Å; T169-V171 PolarHBondContact O-N 3.32Å; V171-L173 HydrophobicContact CG1-CD2 3.8Å; V171-L173 HydrophobicContact CG1-CG 3.97Å; V171-V188 HydrophobicContact CG1-CG2 4.39Å; V171-Y191 HydrophobicContact CB-CD1 4.48Å; V171-Y191 HydrophobicContact CG1-CD1 4.39Å; V171-Y191 HydrophobicContact CG1-CG 4.17Å; V171-Y191 HydrophobicContact CG2-CD1 3.62Å; V171-Y191 HydrophobicContact CG2-CE1 3.63Å; V171-Y191 HydrophobicContact CG2-CG 4.15Å
172H80.2Confident75.9Confident158 Ų15888 Ų8873%0.73143%0.431SS*.  trans-108.5113.7172.2-63.280.4000108.1P170P170-H172 PolarHBondContact O-CE1 3.48Å; P170-H172 PolarHBondContact O-N 3.39Å; P170-H172 PolarHBondContact O-ND1 2.97Å
173L87.1Confident77.9Confident35 Ų3584.4 Ų84.418%0.18341%0.411CS..  trans-102.4150.7175.4-62.9-172.6000109.8V142 V171 E177 R184 G187V142-L173 HydrophobicContact CG2-CD1 3.66Å; V142-L173 HydrophobicContact CG2-CG 4.04Å; V171-L173 HydrophobicContact CG1-CD2 3.8Å; V171-L173 HydrophobicContact CG1-CG 3.97Å; L173-E177 HydrophobicContact CB-CB 4.2Å; L173-R184 HydrophobicContact CD1-CB 4.21Å; L173-R184 HydrophobicContact CD1-CG 3.93Å; L173-G187 VanDerWaalsContact CD2-C 3.5Å
174T87.3Confident80Confident72 Ų7277 Ų7744%0.44238%0.375SS..  trans-67.7155.4170.1610000110.3N176 E177 M178T174-N176 PolarHBondContact O-N 2.88Å; T174-E177 PolarHBondContact N-OE2 3.37Å; T174-E177 WeakPolarHBondContact O-CB 3.07Å; T174-E177 PolarHBondContact O-N 3.08Å; T174-E177 WeakPolarHBondContact OG1-CB 3.38Å; T174-E177 WeakPolarHBondContact OG1-CG 3.27Å; T174-E177 PolarHBondContact OG1-N 3.11Å; T174-E177 PolarHBondContact OG1-OE2 3.16Å; T174-M178 PolarHBondContact O-N 3.06Å
175E86.1Confident82.1Confident145 Ų14570 Ų7068%0.67835%0.351SS*.Hα-helixtrans-57-41.2178.7-171.3172.3-174.500111.9E177 M178 N179E175-E177 VanDerWaalsContact C-N 3.33Å; E175-E177 PolarHBondContact O-N 2.71Å; E175-M178 PolarHBondContact O-N 2.79Å; E175-M178 VanDerWaalsContact O-N 3.16Å; E175-N179 VanDerWaalsContact O-CG 3.28Å; E175-N179 PolarHBondContact O-N 2.97Å; E175-N179 VanDerWaalsContact O-N 3.16Å; E175-N179 PolarHBondContact O-ND2 3.28Å
176N88.6Confident84Confident135 Ų13570.8 Ų70.872%0.72236%0.36SS*.Hα-helixtrans-58.8-41.8175-68.8-18.5000112.6T174T174-N176 PolarHBondContact O-N 2.88Å
177E90.2Very high85.6Confident23 Ų2363.7 Ų63.711%0.10733%0.333CS..Hα-helixtrans-68.1-38.5177.2-74.7166.6148.800111.6L173 T174 E175 N179 S180 G183 R184 R190L173-E177 HydrophobicContact CB-CB 4.2Å; T174-E177 PolarHBondContact N-OE2 3.37Å; T174-E177 WeakPolarHBondContact O-CB 3.07Å; T174-E177 PolarHBondContact O-N 3.08Å; T174-E177 WeakPolarHBondContact OG1-CB 3.38Å; T174-E177 WeakPolarHBondContact OG1-CG 3.27Å; T174-E177 PolarHBondContact OG1-N 3.11Å; T174-E177 PolarHBondContact OG1-OE2 3.16Å; E175-E177 VanDerWaalsContact C-N 3.33Å; E175-E177 PolarHBondContact O-N 2.71Å; E177-N179 VanDerWaalsContact C-N 3.28Å; E177-N179 PolarHBondContact O-N 3.41Å; E177-S180 PolarHBondContact O-N 3.01Å; E177-S180 VanDerWaalsContact O-O 3.07Å; E177-G183 CarbonylContact O-C 3.56Å; E177-G183 WeakPolarHBondContact O-CA 3.3Å; E177-R184 WeakPolarHBondContact O-CG 3.28Å; E177-R184 PolarHBondContact O-N 3.39Å; E177-R190 IonicContact OE1-CZ 4Å; E177-R190 IonicContact OE1-NE 2.67Å; E177-R190 IonicContact OE1-NH1 3.01Å; E177-R190 PolarHBondContact OE1-NH1 3.01Å; E177-R190 IonicContact OE1-NH2 2.95Å; E177-R190 PolarHBondContact OE1-NH2 3.4Å; E177-R190 IonicContact OE2-CZ 3.78Å; E177-R190 IonicContact OE2-NH2 3.53Å; E177-R190 PolarHBondContact OE2-NH2 2.94Å
178M87.8Confident87.1Confident57 Ų5761 Ų6128%0.28132%0.316SS..Hα-helixtrans-66.1-30.8-178.4-165.816756.600112.6T174 E175 S180 R184T174-M178 PolarHBondContact O-N 3.06Å; E175-M178 PolarHBondContact O-N 2.79Å; E175-M178 VanDerWaalsContact O-N 3.16Å; M178-S180 VanDerWaalsContact C-N 3.3Å; M178-S180 PolarHBondContact O-N 3.4Å; M178-R184 PolarHBondContact O-NE 2.91Å
179N87.4Confident88.4Confident116 Ų11663.7 Ų63.762%0.6233%0.33SS*.THydrogen-bonded Turntrans-71.6-17.9-177-71.3-22.2000114.4E175 E177E175-N179 VanDerWaalsContact O-CG 3.28Å; E175-N179 PolarHBondContact O-N 2.97Å; E175-N179 VanDerWaalsContact O-N 3.16Å; E175-N179 PolarHBondContact O-ND2 3.28Å; E177-N179 VanDerWaalsContact C-N 3.28Å; E177-N179 PolarHBondContact O-N 3.41Å
180S88.7Confident89.6Confident57 Ų5768.7 Ų68.740%0.39935%0.348SS..SBendtrans-122.9145.1179.5177.70000112.3E177 M178 W182 G183 R184E177-S180 PolarHBondContact O-N 3.01Å; E177-S180 VanDerWaalsContact O-O 3.07Å; M178-S180 VanDerWaalsContact C-N 3.3Å; M178-S180 PolarHBondContact O-N 3.4Å; S180-W182 VanDerWaalsContact C-N 3.26Å; S180-W182 PolarHBondContact O-N 3.33Å; S180-W182 PolarHBondContact OG-N 2.89Å; S180-G183 PolarHBondContact O-N 2.84Å; S180-R184 WeakPolarHBondContact O-CG 3.43Å; S180-R184 PolarHBondContact O-N 3.29Å
181N90.1Very high90.7Very high98 Ų9867.4 Ų67.452%0.52434%0.335SS..Hα-helixtrans-58.8-41171.4-73.7-36.6000111.3R184 L185N181-R184 PolarHBondContact OD1-NH2 2.98Å; N181-L185 PolarHBondContact O-N 3.47Å; N181-L185 VanDerWaalsContact O-N 3.07Å
182W93.1Very high91.3Very high178 Ų17867.2 Ų67.267%0.67433%0.334SS*.Hα-helixtrans-70.8-41.1178.9-172.4-103.9000111.5S180 R184 L185 C186S180-W182 VanDerWaalsContact C-N 3.26Å; S180-W182 PolarHBondContact O-N 3.33Å; S180-W182 PolarHBondContact OG-N 2.89Å; W182-R184 VanDerWaalsContact C-N 3.34Å; W182-R184 PolarHBondContact O-N 3.26Å; W182-L185 HydrophobicContact CE3-CD2 3.89Å; W182-L185 HydrophobicContact CH2-CD2 4.5Å; W182-L185 HydrophobicContact CZ3-CD2 3.76Å; W182-L185 WeakPolarHBondContact O-CB 3.24Å; W182-L185 PolarHBondContact O-N 3.36Å; W182-C186 PolarHBondContact NE1-SG 3.48Å; W182-C186 VanDerWaalsContact NE1-SG 3.39Å; W182-C186 PolarHBondContact O-N 2.88Å; W182-C186 PolarHBondContact O-SG 3.49Å
183G94.3Very high92Very high13 Ų1366 Ų6613%0.13433%0.327CS..Hα-helixtrans-56.4-47.2173.400000111.9E177 S180 L185 C186 G187E177-G183 CarbonylContact O-C 3.56Å; E177-G183 WeakPolarHBondContact O-CA 3.3Å; S180-G183 PolarHBondContact O-N 2.84Å; G183-L185 PolarHBondContact O-N 3.38Å; G183-C186 PolarHBondContact O-N 2.88Å; G183-G187 PolarHBondContact O-N 3.38Å
184R94.3Very high92.4Very high31 Ų3171.2 Ų71.212%0.11735%0.35CS..Hα-helixtrans-61.5-43.6176.1-74.2-174.8-85144.40.4112.4S76 L139 N143 L173 E177 M178 S180 N181 W182 G187 V188S76-R184 PolarHBondContact OG-NH1 3.44Å; L139-R184 HydrophobicContact CD2-CB 3.83Å; N143-R184 PolarHBondContact ND2-NH1 2.94Å; N143-R184 PolarHBondContact OD1-NH1 2.88Å; L173-R184 HydrophobicContact CD1-CB 4.21Å; L173-R184 HydrophobicContact CD1-CG 3.93Å; E177-R184 WeakPolarHBondContact O-CG 3.28Å; E177-R184 PolarHBondContact O-N 3.39Å; M178-R184 PolarHBondContact O-NE 2.91Å; S180-R184 WeakPolarHBondContact O-CG 3.43Å; S180-R184 PolarHBondContact O-N 3.29Å; N181-R184 PolarHBondContact OD1-NH2 2.98Å; W182-R184 VanDerWaalsContact C-N 3.34Å; W182-R184 PolarHBondContact O-N 3.26Å; R184-G187 PolarHBondContact O-N 2.9Å; R184-V188 WeakPolarHBondContact O-CB 3.15Å; R184-V188 VanDerWaalsContact O-CG2 3.31Å; R184-V188 WeakPolarHBondContact O-CG2 3.31Å; R184-V188 PolarHBondContact O-N 3.49Å
185L95.4Very high92.7Very high31 Ų3171.4 Ų71.416%0.16235%0.351CS..Hα-helixtrans-59.7-53.9176.6175.761.6000111.5V80 V135 L139 N181 W182 G183 G187 V188 I189V80-L185 HydrophobicContact CG2-CD1 3.6Å; V80-L185 HydrophobicContact CG2-CD2 4.45Å; V135-L185 HydrophobicContact CG1-CD1 3.54Å; L139-L185 HydrophobicContact CD1-CD1 3.95Å; N181-L185 PolarHBondContact O-N 3.47Å; N181-L185 VanDerWaalsContact O-N 3.07Å; W182-L185 HydrophobicContact CE3-CD2 3.89Å; W182-L185 HydrophobicContact CH2-CD2 4.5Å; W182-L185 HydrophobicContact CZ3-CD2 3.76Å; W182-L185 WeakPolarHBondContact O-CB 3.24Å; W182-L185 PolarHBondContact O-N 3.36Å; G183-L185 PolarHBondContact O-N 3.38Å; L185-G187 VanDerWaalsContact C-N 3.33Å; L185-G187 PolarHBondContact O-N 3.36Å; L185-V188 PolarHBondContact O-N 3.02Å; L185-I189 HydrophobicContact CD1-CD1 3.72Å; L185-I189 HydrophobicContact CD1-CG1 4.25Å; L185-I189 HydrophobicContact CG-CD1 3.94Å; L185-I189 WeakPolarHBondContact O-CG1 3.38Å; L185-I189 PolarHBondContact O-N 2.67Å
186C96Very high93Very high51 Ų5167.8 Ų67.835%0.34533%0.334SS..Hα-helixtrans-61.5-41.8179.3-69.40000111.8W182 G183 I189 R190W182-C186 PolarHBondContact NE1-SG 3.48Å; W182-C186 VanDerWaalsContact NE1-SG 3.39Å; W182-C186 PolarHBondContact O-N 2.88Å; W182-C186 PolarHBondContact O-SG 3.49Å; G183-C186 PolarHBondContact O-N 2.88Å; C186-I189 PolarHBondContact O-N 2.75Å; C186-R190 VanDerWaalsContact O-CB 3.26Å; C186-R190 WeakPolarHBondContact O-CB 3.48Å; C186-R190 PolarHBondContact O-N 2.91Å
187G95.1Very high93.2Very high1 Ų162.7 Ų62.71%0.0131%0.314CS..Hα-helixtrans-62.5-44.4177.700000112.7L173 G183 R184 L185 R190 Y191L173-G187 VanDerWaalsContact CD2-C 3.5Å; G183-G187 PolarHBondContact O-N 3.38Å; R184-G187 PolarHBondContact O-N 2.9Å; L185-G187 VanDerWaalsContact C-N 3.33Å; L185-G187 PolarHBondContact O-N 3.36Å; G187-R190 PolarHBondContact O-N 3.17Å; G187-Y191 WeakPolarHBondContact O-CB 3.34Å; G187-Y191 PolarHBondContact O-N 3.48Å
188V95.2Very high93.4Very high0 Ų067.8 Ų67.80%034%0.341CS..Hα-helixtrans-64-45.4175165.50000111.4V135 H138 L139 V171 R184 L185 R190 Y191 I192V135-V188 HydrophobicContact CG1-CG1 4.32Å; H138-V188 HydrophobicContact CB-CG1 3.5Å; H138-V188 VanDerWaalsContact CB-CG1 3.5Å; H138-V188 HydrophobicContact CB-CG2 4.28Å; L139-V188 HydrophobicContact CD2-CB 4.32Å; L139-V188 HydrophobicContact CD2-CG2 3.8Å; L139-V188 HydrophobicContact CG-CG2 4.33Å; V171-V188 HydrophobicContact CG1-CG2 4.39Å; R184-V188 WeakPolarHBondContact O-CB 3.15Å; R184-V188 VanDerWaalsContact O-CG2 3.31Å; R184-V188 WeakPolarHBondContact O-CG2 3.31Å; R184-V188 PolarHBondContact O-N 3.49Å; L185-V188 PolarHBondContact O-N 3.02Å; V188-R190 VanDerWaalsContact C-N 3.33Å; V188-R190 PolarHBondContact O-N 3.34Å; V188-Y191 WeakPolarHBondContact O-CB 3.43Å; V188-Y191 PolarHBondContact O-N 2.91Å; V188-I192 HydrophobicContact CG1-CD1 3.76Å; V188-I192 HydrophobicContact CG1-CG1 4.46Å; V188-I192 VanDerWaalsContact O-CG1 3.32Å; V188-I192 WeakPolarHBondContact O-CG1 3.45Å; V188-I192 PolarHBondContact O-N 3.47Å
189I96.3Very high93.7Very high66 Ų6674 Ų7434%0.33837%0.366SS..Hα-helixtrans-61.2-44.8177.4-70.9170.8000110.5V135 L185 C186 I192 K193 F201V135-I189 HydrophobicContact CG1-CG1 4.27Å; V135-I189 HydrophobicContact CG2-CG1 4.25Å; L185-I189 HydrophobicContact CD1-CD1 3.72Å; L185-I189 HydrophobicContact CD1-CG1 4.25Å; L185-I189 HydrophobicContact CG-CD1 3.94Å; L185-I189 WeakPolarHBondContact O-CG1 3.38Å; L185-I189 PolarHBondContact O-N 2.67Å; C186-I189 PolarHBondContact O-N 2.75Å; I189-I192 PolarHBondContact O-N 3.41Å; I189-K193 VanDerWaalsContact O-CB 3.32Å; I189-K193 WeakPolarHBondContact O-CB 3.29Å; I189-K193 PolarHBondContact O-N 3.49Å; I189-F201 HydrophobicContact CG1-CE1 4.47Å; I189-F201 HydrophobicContact CG2-CE1 4.45Å; I189-F201 HydrophobicContact CG2-CZ 4.08Å
190R95.6Very high94Very high107 Ų10768.6 Ų68.640%0.40434%0.338SS..Hα-helixtrans-60.7-46.7177.1-175.4-177.868.5-160.3-7.7110.9E177 C186 G187 V188 K193 Q194E177-R190 IonicContact OE1-CZ 4Å; E177-R190 IonicContact OE1-NE 2.67Å; E177-R190 IonicContact OE1-NH1 3.01Å; E177-R190 PolarHBondContact OE1-NH1 3.01Å; E177-R190 IonicContact OE1-NH2 2.95Å; E177-R190 PolarHBondContact OE1-NH2 3.4Å; E177-R190 IonicContact OE2-CZ 3.78Å; E177-R190 IonicContact OE2-NH2 3.53Å; E177-R190 PolarHBondContact OE2-NH2 2.94Å; C186-R190 VanDerWaalsContact O-CB 3.26Å; C186-R190 WeakPolarHBondContact O-CB 3.48Å; C186-R190 PolarHBondContact O-N 2.91Å; G187-R190 PolarHBondContact O-N 3.17Å; V188-R190 VanDerWaalsContact C-N 3.33Å; V188-R190 PolarHBondContact O-N 3.34Å; R190-K193 PolarHBondContact O-N 3.44Å; R190-Q194 HydrophobicContact CG-CG 4.32Å; R190-Q194 WeakPolarHBondContact O-CB 3.3Å; R190-Q194 WeakPolarHBondContact O-CG 3.48Å; R190-Q194 PolarHBondContact O-N 3.16Å
191Y94.4Very high94.3Very high37 Ų3767.2 Ų67.215%0.14533%0.325CS..Hα-helixtrans-56.1-54.3176.2168.9-95.6000111.4P170 V171 G187 V188 K193 Q194 T195P170-Y191 WeakPolarHBondContact CG-OH 3.45Å; V171-Y191 HydrophobicContact CB-CD1 4.48Å; V171-Y191 HydrophobicContact CG1-CD1 4.39Å; V171-Y191 HydrophobicContact CG1-CG 4.17Å; V171-Y191 HydrophobicContact CG2-CD1 3.62Å; V171-Y191 HydrophobicContact CG2-CE1 3.63Å; V171-Y191 HydrophobicContact CG2-CG 4.15Å; G187-Y191 WeakPolarHBondContact O-CB 3.34Å; G187-Y191 PolarHBondContact O-N 3.48Å; V188-Y191 WeakPolarHBondContact O-CB 3.43Å; V188-Y191 PolarHBondContact O-N 2.91Å; Y191-K193 VanDerWaalsContact C-N 3.29Å; Y191-K193 PolarHBondContact O-N 3.49Å; Y191-Q194 PolarHBondContact O-N 2.98Å; Y191-T195 HydrophobicContact CE2-CG2 4.41Å; Y191-T195 WeakPolarHBondContact CE2-OG1 3.15Å; Y191-T195 WeakPolarHBondContact O-CB 3.13Å; Y191-T195 PolarHBondContact O-N 3.3Å; Y191-T195 PolarHBondContact O-OG1 3.47Å; Y191-T195 VanDerWaalsContact O-OG1 3.09Å
192I94.7Very high94.6Very high0 Ų068.5 Ų68.50%032%0.323CS..Hα-helixtrans-59.4-43.8-178.9-64163.3000110.4V134 V135 V188 I189 H196 G197 F201V134-I192 HydrophobicContact CG1-CD1 4Å; V135-I192 HydrophobicContact CG2-CD1 4.15Å; V188-I192 HydrophobicContact CG1-CD1 3.76Å; V188-I192 HydrophobicContact CG1-CG1 4.46Å; V188-I192 VanDerWaalsContact O-CG1 3.32Å; V188-I192 WeakPolarHBondContact O-CG1 3.45Å; V188-I192 PolarHBondContact O-N 3.47Å; I189-I192 PolarHBondContact O-N 3.41Å; I192-H196 WeakPolarHBondContact O-CA 3.3Å; I192-H196 WeakPolarHBondContact O-CB 3.29Å; I192-H196 PolarHBondContact O-N 3.05Å; I192-G197 PolarHBondContact O-N 3.34Å; I192-F201 HydrophobicContact CB-CE1 4.14Å; I192-F201 HydrophobicContact CB-CE2 4.22Å; I192-F201 HydrophobicContact CB-CZ 3.83Å; I192-F201 HydrophobicContact CD1-CD1 4.5Å; I192-F201 HydrophobicContact CD1-CE1 4.09Å; I192-F201 HydrophobicContact CG2-CD1 4.14Å; I192-F201 HydrophobicContact CG2-CD2 3.86Å; I192-F201 HydrophobicContact CG2-CE1 3.95Å; I192-F201 HydrophobicContact CG2-CE2 3.66Å; I192-F201 HydrophobicContact CG2-CG 4.09Å; I192-F201 HydrophobicContact CG2-CZ 3.71Å
193K95.3Very high94.6Very high134 Ų13463.1 Ų63.158%0.58330%0.304SS*.Hα-helixtrans-63.7-42.7179.2-174.1180177.8-177.60112.2I189 R190 Y191 G197 F201I189-K193 VanDerWaalsContact O-CB 3.32Å; I189-K193 WeakPolarHBondContact O-CB 3.29Å; I189-K193 PolarHBondContact O-N 3.49Å; R190-K193 PolarHBondContact O-N 3.44Å; Y191-K193 VanDerWaalsContact C-N 3.29Å; Y191-K193 PolarHBondContact O-N 3.49Å; K193-G197 WeakPolarHBondContact O-CA 3.41Å; K193-G197 PolarHBondContact O-N 2.9Å; K193-F201 HydrophobicContact CB-CE2 4.35Å
194Q94.6Very high94.4Very high144 Ų14462.9 Ų62.967%0.67330%0.302SS*.Hα-helixtrans-75.1-38.5-178.4-73.6176.8-1700112.5R190 Y191R190-Q194 HydrophobicContact CG-CG 4.32Å; R190-Q194 WeakPolarHBondContact O-CB 3.3Å; R190-Q194 WeakPolarHBondContact O-CG 3.48Å; R190-Q194 PolarHBondContact O-N 3.16Å; Y191-Q194 PolarHBondContact O-N 2.98Å
195T93.1Very high94.4Very high75 Ų7563.2 Ų63.246%0.4631%0.309SS..Hα-helixtrans-86.5-35-175.3-51.10000113.1Y191Y191-T195 HydrophobicContact CE2-CG2 4.41Å; Y191-T195 WeakPolarHBondContact CE2-OG1 3.15Å; Y191-T195 WeakPolarHBondContact O-CB 3.13Å; Y191-T195 PolarHBondContact O-N 3.3Å; Y191-T195 PolarHBondContact O-OG1 3.47Å; Y191-T195 VanDerWaalsContact O-OG1 3.09Å
196H92.3Very high94.3Very high69 Ų6967.9 Ų67.932%0.31933%0.333SS..Hα-helixtrans-125.4-4.2-172.8-59.9-54.9000114.3I192 G200 H292I192-H196 WeakPolarHBondContact O-CA 3.3Å; I192-H196 WeakPolarHBondContact O-CB 3.29Å; I192-H196 PolarHBondContact O-N 3.05Å; H196-G200 PolarHBondContact O-N 2.86Å; H196-H292 AromaticContact CD2-CD2 3.3Å; H196-H292 PolarHBondContact CD2-CD2 2.67Å; H196-H292 AromaticContact CD2-CE1 3.6Å; H196-H292 AromaticContact CD2-CG 3.38Å; H196-H292 AromaticContact CD2-ND1 3.56Å; H196-H292 AromaticContact CD2-NE2 3.44Å; H196-H292 PolarHBondContact CD2-NE2 2.93Å; H196-H292 AromaticContact CE1-CG 3.76Å; H196-H292 AromaticContact CG-CG 3.91Å; H196-H292 AromaticContact CG-ND1 3.8Å; H196-H292 WeakPolarHBondContact NE2-CB 3.17Å; H196-H292 AromaticContact NE2-CD2 3.25Å; H196-H292 PolarHBondContact NE2-CD2 3.35Å; H196-H292 VanDerWaalsContact NE2-CD2 3.25Å; H196-H292 AromaticContact NE2-CG 3.27Å; H196-H292 VanDerWaalsContact NE2-CG 3.27Å; H196-H292 AromaticContact NE2-ND1 3.94Å; H196-H292 AromaticContact NE2-NE2 3.92Å
197G94.3Very high94.1Very high28 Ų2866.1 Ų66.129%0.28932%0.32SS..  trans63.3-163.6-173.200000112.7I192 K193 K199 G200I192-G197 PolarHBondContact O-N 3.34Å; K193-G197 WeakPolarHBondContact O-CA 3.41Å; K193-G197 PolarHBondContact O-N 2.9Å; G197-K199 PolarHBondContact O-N 2.89Å; G197-G200 PolarHBondContact O-N 2.93Å; G197-G200 VanDerWaalsContact O-N 3.16Å
198L93.5Very high94Very high130 Ų13066 Ų6668%0.68132%0.32SS*.Hα-helixtrans-65.4-27.6179.5-64.5177.3000113.1G200 F201L198-G200 PolarHBondContact O-N 3.12Å; L198-F201 PolarHBondContact O-N 3.14Å
199K93.6Very high93.7Very high188 Ų18868.3 Ų68.382%0.81733%0.331SS*.Hα-helixtrans-65.9-22.6176.8-67.4-178.2179.2176.70112.4G197 F201 Y202 K203G197-K199 PolarHBondContact O-N 2.89Å; K199-F201 VanDerWaalsContact C-N 3.35Å; K199-F201 PolarHBondContact O-N 3.31Å; K199-Y202 PolarHBondContact O-N 3.33Å; K199-K203 PolarHBondContact O-N 2.67Å
200G93.8Very high93.5Very high2 Ų267.8 Ų67.82%0.02133%0.333CS..Hα-helixtrans-56.5-47174.200000112.3H196 G197 L198 Y202 K203 H292H196-G200 PolarHBondContact O-N 2.86Å; G197-G200 PolarHBondContact O-N 2.93Å; G197-G200 VanDerWaalsContact O-N 3.16Å; L198-G200 PolarHBondContact O-N 3.12Å; G200-Y202 PolarHBondContact O-N 3.37Å; G200-Y202 VanDerWaalsContact O-N 3.13Å; G200-K203 VanDerWaalsContact O-CB 3.22Å; G200-K203 WeakPolarHBondContact O-CB 3.21Å; G200-K203 PolarHBondContact O-N 3.44Å; G200-H292 PolarHBondContact O-CE1 3.45Å; G200-H292 VanDerWaalsContact O-CE1 3.23Å
201F96.1Very high93.3Very high28 Ų2862.9 Ų62.912%0.12331%0.314CS..Hα-helixtrans-63.1-23.6-177.4-64.2-85.5000114P131 V134 V135 I189 I192 K193 L198 K199P131-F201 VanDerWaalsContact CA-O 3.28Å; P131-F201 WeakPolarHBondContact CA-O 3.42Å; P131-F201 HydrophobicContact CB-CB 4.12Å; P131-F201 HydrophobicContact CG-CB 4.38Å; V134-F201 WeakPolarHBondContact CG2-O 3.18Å; V135-F201 HydrophobicContact CG2-CD1 3.87Å; V135-F201 HydrophobicContact CG2-CE1 3.74Å; I189-F201 HydrophobicContact CG1-CE1 4.47Å; I189-F201 HydrophobicContact CG2-CE1 4.45Å; I189-F201 HydrophobicContact CG2-CZ 4.08Å; I192-F201 HydrophobicContact CB-CE1 4.14Å; I192-F201 HydrophobicContact CB-CE2 4.22Å; I192-F201 HydrophobicContact CB-CZ 3.83Å; I192-F201 HydrophobicContact CD1-CD1 4.5Å; I192-F201 HydrophobicContact CD1-CE1 4.09Å; I192-F201 HydrophobicContact CG2-CD1 4.14Å; I192-F201 HydrophobicContact CG2-CD2 3.86Å; I192-F201 HydrophobicContact CG2-CE1 3.95Å; I192-F201 HydrophobicContact CG2-CE2 3.66Å; I192-F201 HydrophobicContact CG2-CG 4.09Å; I192-F201 HydrophobicContact CG2-CZ 3.71Å; K193-F201 HydrophobicContact CB-CE2 4.35Å; L198-F201 PolarHBondContact O-N 3.14Å; K199-F201 VanDerWaalsContact C-N 3.35Å; K199-F201 PolarHBondContact O-N 3.31Å
202Y95.6Very high92.9Very high125 Ų12564.3 Ų64.349%0.4932%0.321SS..THydrogen-bonded Turntrans-103.56.7179.3-65.9-87000112.9G127 P131 K199 G200 G204 C205G127-Y202 WeakPolarHBondContact O-CE1 3.24Å; P131-Y202 HydrophobicContact CG-CD1 4.01Å; P131-Y202 HydrophobicContact CG-CE1 3.55Å; P131-Y202 HydrophobicContact CG-CE2 4.1Å; P131-Y202 HydrophobicContact CG-CG 4.48Å; K199-Y202 PolarHBondContact O-N 3.33Å; G200-Y202 PolarHBondContact O-N 3.37Å; G200-Y202 VanDerWaalsContact O-N 3.13Å; Y202-G204 PolarHBondContact O-N 2.86Å; Y202-C205 WeakPolarHBondContact O-CB 3.34Å; Y202-C205 PolarHBondContact O-N 3.19Å; Y202-C205 VanDerWaalsContact O-N 3.1Å
203K92.9Very high92.6Very high65 Ų6568 Ų6828%0.28334%0.343SS..THydrogen-bonded Turntrans-60.3125.9177.7-174.270.8174.7-1620108.9K199 G200 M288 Q289 H292 I293K199-K203 PolarHBondContact O-N 2.67Å; G200-K203 VanDerWaalsContact O-CB 3.22Å; G200-K203 WeakPolarHBondContact O-CB 3.21Å; G200-K203 PolarHBondContact O-N 3.44Å; K203-M288 WeakPolarHBondContact CG-O 3.44Å; K203-Q289 WeakPolarHBondContact O-CG 3.37Å; K203-H292 WeakPolarHBondContact CE-O 3.46Å; K203-H292 PolarHBondContact NZ-O 3.25Å; K203-I293 WeakPolarHBondContact CE-O 3.39Å
204G91.3Very high92.3Very high8 Ų863.8 Ų63.88%0.08233%0.33CS..THydrogen-bonded Turntrans83.817.7-179.100000115Y202 I207 S208Y202-G204 PolarHBondContact O-N 2.86Å; G204-I207 WeakPolarHBondContact O-CG2 3.27Å; G204-S208 WeakPolarHBondContact O-CB 3.24Å; G204-S208 PolarHBondContact O-N 3.23Å; G204-S208 PolarHBondContact O-OG 2.95Å
205C93.4Very high92.1Very high38 Ų3857.9 Ų57.926%0.25731%0.305SS..Hα-helixtrans-56.9-50.8172.7-175.50000112.3V130 Y202 I207 S208 M209V130-C205 HydrophobicContact CG1-CB 4.33Å; V130-C205 HydrophobicContact CG2-CB 4.3Å; Y202-C205 WeakPolarHBondContact O-CB 3.34Å; Y202-C205 PolarHBondContact O-N 3.19Å; Y202-C205 VanDerWaalsContact O-N 3.1Å; C205-I207 PolarHBondContact O-N 2.71Å; C205-S208 VanDerWaalsContact O-CB 3.29Å; C205-S208 WeakPolarHBondContact O-CB 3.46Å; C205-S208 PolarHBondContact O-N 2.92Å; C205-S208 VanDerWaalsContact O-N 3.11Å; C205-M209 PolarHBondContact O-N 3.36Å
206L92.4Very high91.9Very high129 Ų12957.5 Ų57.568%0.67531%0.305SS*.Hα-helixtrans-60.5-47.9179.2-177.664.5000112.6S208 M209 C210L206-S208 PolarHBondContact O-N 3.21Å; L206-M209 WeakPolarHBondContact O-CB 3.29Å; L206-M209 PolarHBondContact O-N 2.94Å; L206-M209 VanDerWaalsContact O-N 3.13Å; L206-C210 PolarHBondContact O-N 3.28Å; L206-C210 PolarHBondContact O-SG 2.85Å; L206-C210 VanDerWaalsContact O-SG 3.33Å
207I93.7Very high91.8Very high14 Ų1456.8 Ų56.87%0.07231%0.311CS..Hα-helixtrans-65.6-28.6178-171.264.5000111.5G204 C205 C210 T211 L281 R285 M288 F295G204-I207 WeakPolarHBondContact O-CG2 3.27Å; C205-I207 PolarHBondContact O-N 2.71Å; I207-C210 HydrophobicContact CD1-CB 4.39Å; I207-C210 CarbonylContact O-C 3.43Å; I207-C210 PolarHBondContact O-N 3.16Å; I207-T211 WeakPolarHBondContact O-CB 2.96Å; I207-T211 PolarHBondContact O-N 2.95Å; I207-T211 PolarHBondContact O-OG1 2.97Å; I207-L281 HydrophobicContact CD1-CD2 3.97Å; I207-R285 HydrophobicContact CG1-CB 4.04Å; I207-R285 HydrophobicContact CG2-CB 4.15Å; I207-R285 HydrophobicContact CG2-CG 4.17Å; I207-M288 HydrophobicContact CB-SD 4.32Å; I207-M288 HydrophobicContact CG2-CE 4.28Å; I207-M288 HydrophobicContact CG2-SD 3.96Å; I207-F295 HydrophobicContact CD1-CD2 4.24Å; I207-F295 HydrophobicContact CD1-CE2 3.96Å
208S92.1Very high91.7Very high0 Ų057.4 Ų57.40%031%0.308CS..Hα-helixtrans-63.5-45.7171.7-58.90000111.2G204 C205 L206 T211 F212 R285 Q289G204-S208 WeakPolarHBondContact O-CB 3.24Å; G204-S208 PolarHBondContact O-N 3.23Å; G204-S208 PolarHBondContact O-OG 2.95Å; C205-S208 VanDerWaalsContact O-CB 3.29Å; C205-S208 WeakPolarHBondContact O-CB 3.46Å; C205-S208 PolarHBondContact O-N 2.92Å; C205-S208 VanDerWaalsContact O-N 3.11Å; L206-S208 PolarHBondContact O-N 3.21Å; S208-T211 PolarHBondContact O-N 3.04Å; S208-T211 VanDerWaalsContact O-N 3.14Å; S208-F212 WeakPolarHBondContact O-CD2 3.35Å; S208-F212 WeakPolarHBondContact O-CG 3.39Å; S208-F212 PolarHBondContact O-N 3.4Å; S208-R285 PolarHBondContact OG-NE 2.9Å; S208-R285 PolarHBondContact OG-NH2 3.33Å; S208-Q289 PolarHBondContact OG-NE2 2.85Å
209M89.1Confident91.7Very high47 Ų4754.3 Ų54.323%0.23229%0.287CS..Hα-helixtrans-59.9-48173.5-63.9177.470.600111.5C123 Q126 C205 L206 T211 F212 V213C123-M209 VanDerWaalsContact SG-CE 3.54Å; Q126-M209 HydrophobicContact CG-CG 3.75Å; C205-M209 PolarHBondContact O-N 3.36Å; L206-M209 WeakPolarHBondContact O-CB 3.29Å; L206-M209 PolarHBondContact O-N 2.94Å; L206-M209 VanDerWaalsContact O-N 3.13Å; M209-T211 PolarHBondContact O-N 3.42Å; M209-F212 PolarHBondContact O-N 2.91Å; M209-V213 WeakPolarHBondContact O-CB 3.41Å; M209-V213 WeakPolarHBondContact O-CG2 3.42Å; M209-V213 PolarHBondContact O-N 3.38Å
210C90.9Very high91.5Very high56 Ų5652.6 Ų52.638%0.37828%0.275SS..Hα-helixtrans-65.1-16.2177.3-62.30000113.7L206 I207 P214 L281L206-C210 PolarHBondContact O-N 3.28Å; L206-C210 PolarHBondContact O-SG 2.85Å; L206-C210 VanDerWaalsContact O-SG 3.33Å; I207-C210 HydrophobicContact CD1-CB 4.39Å; I207-C210 CarbonylContact O-C 3.43Å; I207-C210 PolarHBondContact O-N 3.16Å; C210-P214 WeakPolarHBondContact O-CD 3.41Å; C210-P214 WeakPolarHBondContact O-CG 3.28Å; C210-L281 WeakPolarHBondContact O-CD1 3.31Å
211T91.3Very high91.4Very high3 Ų355.6 Ų55.62%0.01830%0.296CS..Hα-helixtrans-90.9-48.8175.3-56.90000110.4I207 S208 M209 S215 V278 D282I207-T211 WeakPolarHBondContact O-CB 2.96Å; I207-T211 PolarHBondContact O-N 2.95Å; I207-T211 PolarHBondContact O-OG1 2.97Å; S208-T211 PolarHBondContact O-N 3.04Å; S208-T211 VanDerWaalsContact O-N 3.14Å; M209-T211 PolarHBondContact O-N 3.42Å; T211-S215 WeakPolarHBondContact O-CB 3.41Å; T211-S215 PolarHBondContact O-N 3.5Å; T211-V278 HydrophobicContact CG2-CG1 3.63Å; T211-D282 HydrophobicContact CG2-CB 3.78Å
212F88.1Confident91.4Very high68 Ų6856.6 Ų56.630%0.29830%0.301SS..Hα-helixtrans-75.1-40.9-173.8-66.5-52000113.5S208 M209 S215 S216 R285S208-F212 WeakPolarHBondContact O-CD2 3.35Å; S208-F212 WeakPolarHBondContact O-CG 3.39Å; S208-F212 PolarHBondContact O-N 3.4Å; M209-F212 PolarHBondContact O-N 2.91Å; F212-S215 WeakPolarHBondContact O-CB 3.41Å; F212-S215 PolarHBondContact O-N 3.1Å; F212-S216 PolarHBondContact O-N 2.92Å; F212-S216 PolarHBondContact O-OG 3.32Å; F212-R285 VanDerWaalsContact CE2-NH2 3.28Å; F212-R285 VanDerWaalsContact CZ-NH1 3.34Å
213V87.9Confident91.1Very high76 Ų7652.4 Ų52.446%0.46128%0.284SS..Hα-helixtrans-63.2-51.4-177.7173.40000111.1M209 S215 S216 A217M209-V213 WeakPolarHBondContact O-CB 3.41Å; M209-V213 WeakPolarHBondContact O-CG2 3.42Å; M209-V213 PolarHBondContact O-N 3.38Å; V213-S215 VanDerWaalsContact C-N 3.32Å; V213-S215 PolarHBondContact O-N 2.97Å; V213-S216 PolarHBondContact O-N 2.95Å; V213-A217 PolarHBondContact O-N 3.03Å
214P89.4Confident91Very high47 Ų4754.2 Ų54.231%0.30530%0.297SS..Hα-helixtrans-63.2-37174.1-25.538.6000112.9C210 S216 A217 L218C210-P214 WeakPolarHBondContact O-CD 3.41Å; C210-P214 WeakPolarHBondContact O-CG 3.28Å; P214-S216 VanDerWaalsContact C-N 3.32Å; P214-S216 PolarHBondContact O-N 3.28Å; P214-A217 PolarHBondContact O-N 3.01Å; P214-L218 VanDerWaalsContact O-CB 3.27Å; P214-L218 WeakPolarHBondContact O-CB 3.47Å; P214-L218 VanDerWaalsContact O-CG 3.23Å; P214-L218 WeakPolarHBondContact O-CG 2.94Å; P214-L218 PolarHBondContact O-N 3.35Å
215S90.1Very high91.1Very high20 Ų2061 Ų6114%0.1432%0.324CS..Hα-helixtrans-57.2-45.9176.5-172.40000112T211 F212 V213 W219 S274T211-S215 WeakPolarHBondContact O-CB 3.41Å; T211-S215 PolarHBondContact O-N 3.5Å; F212-S215 WeakPolarHBondContact O-CB 3.41Å; F212-S215 PolarHBondContact O-N 3.1Å; V213-S215 VanDerWaalsContact C-N 3.32Å; V213-S215 PolarHBondContact O-N 2.97Å; S215-W219 WeakPolarHBondContact O-CB 3.43Å; S215-W219 PolarHBondContact O-N 2.86Å; S215-S274 PolarHBondContact O-OG 3.33Å
216S87.7Confident91.1Very high67 Ų6761.1 Ų61.147%0.46932%0.321SS..Hα-helixtrans-66.6-47.5177.9-63.90000111.4F212 V213 P214 L218 W219 W220F212-S216 PolarHBondContact O-N 2.92Å; F212-S216 PolarHBondContact O-OG 3.32Å; V213-S216 PolarHBondContact O-N 2.95Å; P214-S216 VanDerWaalsContact C-N 3.32Å; P214-S216 PolarHBondContact O-N 3.28Å; S216-L218 PolarHBondContact O-N 3.09Å; S216-W219 PolarHBondContact O-N 3.28Å; S216-W220 PolarHBondContact O-N 3.37Å; S216-W220 VanDerWaalsContact O-N 3.13Å
217A90.5Very high91Very high54 Ų5456.2 Ų56.245%0.44630%0.296SS..Hα-helixtrans-60.5-45.1179.900000112.3V213 P214 S221V213-A217 PolarHBondContact O-N 3.03Å; P214-A217 PolarHBondContact O-N 3.01Å; A217-S221 VanDerWaalsContact O-CB 3.27Å; A217-S221 WeakPolarHBondContact O-CB 3.42Å; A217-S221 PolarHBondContact O-N 3.04Å; A217-S221 PolarHBondContact O-OG 3.22Å
218L93.6Very high90.8Very high41 Ų4157.5 Ų57.522%0.21531%0.314CS..Hα-helixtrans-64.9-41.3177.4-72.7168.5000111.7P214 S216 S221 F222 I277 V278P214-L218 VanDerWaalsContact O-CB 3.27Å; P214-L218 WeakPolarHBondContact O-CB 3.47Å; P214-L218 VanDerWaalsContact O-CG 3.23Å; P214-L218 WeakPolarHBondContact O-CG 2.94Å; P214-L218 PolarHBondContact O-N 3.35Å; S216-L218 PolarHBondContact O-N 3.09Å; L218-S221 PolarHBondContact O-N 3.09Å; L218-F222 HydrophobicContact CB-CD2 4.24Å; L218-F222 HydrophobicContact CB-CE2 4.19Å; L218-F222 HydrophobicContact CD2-CE2 3.93Å; L218-F222 HydrophobicContact CD2-CZ 4.38Å; L218-F222 WeakPolarHBondContact O-CB 3.23Å; L218-F222 WeakPolarHBondContact O-CD2 3.38Å; L218-F222 WeakPolarHBondContact O-CG 3.29Å; L218-F222 PolarHBondContact O-N 2.91Å; L218-I277 HydrophobicContact CD1-CB 3.98Å; L218-I277 HydrophobicContact CD1-CD1 4.35Å; L218-I277 HydrophobicContact CD1-CG2 3.61Å; L218-I277 HydrophobicContact CD2-CD1 4.21Å; L218-V278 HydrophobicContact CD1-CG2 3.74Å
219W92Very high90.8Very high65 Ų6561.9 Ų61.925%0.24634%0.336CS..Hα-helixtrans-60.5-52.5179.8-17291.8000111.1S215 S216 S221 F222 Y223 A267S215-W219 WeakPolarHBondContact O-CB 3.43Å; S215-W219 PolarHBondContact O-N 2.86Å; S216-W219 PolarHBondContact O-N 3.28Å; W219-S221 PolarHBondContact O-N 2.97Å; W219-F222 PolarHBondContact O-N 3.14Å; W219-Y223 HydrophobicContact CH2-CD1 4.5Å; W219-Y223 HydrophobicContact CH2-CD2 4.09Å; W219-Y223 HydrophobicContact CH2-CE2 4.49Å; W219-Y223 HydrophobicContact CH2-CG 4.08Å; W219-Y223 HydrophobicContact CZ2-CD2 4.3Å; W219-Y223 HydrophobicContact CZ3-CD1 4.45Å; W219-Y223 HydrophobicContact CZ3-CG 4.19Å; W219-Y223 WeakPolarHBondContact O-CB 3.19Å; W219-Y223 PolarHBondContact O-N 2.92Å; W219-A267 HydrophobicContact CZ2-CB 4.36Å
220W90.1Very high90.8Very high151 Ų15161.2 Ų61.257%0.57233%0.333SS*.Hα-helixtrans-62.4-43.5178.2-70.8110.3000112S216 F222 Y223 D224S216-W220 PolarHBondContact O-N 3.37Å; S216-W220 VanDerWaalsContact O-N 3.13Å; W220-F222 PolarHBondContact O-N 2.92Å; W220-Y223 PolarHBondContact O-N 3.17Å; W220-D224 PolarHBondContact O-N 3.45Å
221S92.2Very high90.6Very high66 Ų6660.4 Ų60.446%0.46232%0.324SS..Hα-helixtrans-61.8-42.3179.2-59.70000112.8A217 L218 W219 K225A217-S221 VanDerWaalsContact O-CB 3.27Å; A217-S221 WeakPolarHBondContact O-CB 3.42Å; A217-S221 PolarHBondContact O-N 3.04Å; A217-S221 PolarHBondContact O-OG 3.22Å; L218-S221 PolarHBondContact O-N 3.09Å; W219-S221 PolarHBondContact O-N 2.97Å; S221-K225 WeakPolarHBondContact O-CB 3.5Å; S221-K225 VanDerWaalsContact O-CG 3.3Å; S221-K225 WeakPolarHBondContact O-CG 3.14Å; S221-K225 PolarHBondContact O-N 3.03Å
222F94.8Very high90.4Very high49 Ų4966.8 Ų66.822%0.21535%0.352CS..Hα-helixtrans-74.3-38.1177.2-74.9-50.5000112.1L218 W219 W220 D224 K225 F226 A270 I277L218-F222 HydrophobicContact CB-CD2 4.24Å; L218-F222 HydrophobicContact CB-CE2 4.19Å; L218-F222 HydrophobicContact CD2-CE2 3.93Å; L218-F222 HydrophobicContact CD2-CZ 4.38Å; L218-F222 WeakPolarHBondContact O-CB 3.23Å; L218-F222 WeakPolarHBondContact O-CD2 3.38Å; L218-F222 WeakPolarHBondContact O-CG 3.29Å; L218-F222 PolarHBondContact O-N 2.91Å; W219-F222 PolarHBondContact O-N 3.14Å; W220-F222 PolarHBondContact O-N 2.92Å; F222-D224 PolarHBondContact O-N 3.39Å; F222-K225 PolarHBondContact O-N 3.48Å; F222-F226 HydrophobicContact CB-CD2 3.99Å; F222-F226 HydrophobicContact CB-CE2 3.77Å; F222-F226 HydrophobicContact CD1-CE2 4.29Å; F222-F226 HydrophobicContact CG-CE2 4.22Å; F222-F226 WeakPolarHBondContact O-CB 3.31Å; F222-F226 WeakPolarHBondContact O-CD2 2.98Å; F222-F226 WeakPolarHBondContact O-CG 3.23Å; F222-F226 PolarHBondContact O-N 3.21Å; F222-A270 HydrophobicContact CB-CB 3.82Å; F222-I277 HydrophobicContact CE2-CD1 3.77Å; F222-I277 HydrophobicContact CZ-CD1 3.77Å
223Y90.8Very high90.4Very high36 Ų3667.6 Ų67.614%0.14136%0.358CS..Hα-helixtrans-57.6-49.6178.4178.3-103.3000111.4W219 W220 K225 F226 C227 Q263 A267W219-Y223 HydrophobicContact CH2-CD1 4.5Å; W219-Y223 HydrophobicContact CH2-CD2 4.09Å; W219-Y223 HydrophobicContact CH2-CE2 4.49Å; W219-Y223 HydrophobicContact CH2-CG 4.08Å; W219-Y223 HydrophobicContact CZ2-CD2 4.3Å; W219-Y223 HydrophobicContact CZ3-CD1 4.45Å; W219-Y223 HydrophobicContact CZ3-CG 4.19Å; W219-Y223 WeakPolarHBondContact O-CB 3.19Å; W219-Y223 PolarHBondContact O-N 2.92Å; W220-Y223 PolarHBondContact O-N 3.17Å; Y223-K225 PolarHBondContact O-N 3.16Å; Y223-F226 PolarHBondContact O-N 3.15Å; Y223-C227 WeakPolarHBondContact O-CB 3.18Å; Y223-C227 PolarHBondContact O-N 3.48Å; Y223-C227 PolarHBondContact O-SG 2.94Å; Y223-Q263 WeakPolarHBondContact OH-CG 3.38Å; Y223-Q263 PolarHBondContact OH-OE1 2.9Å; Y223-A267 HydrophobicContact CD2-CB 4.15Å; Y223-A267 HydrophobicContact CE2-CB 3.96Å
224D90.6Very high90.2Very high104 Ų10464.7 Ų64.756%0.55634%0.342SS*.Hα-helixtrans-62.6-43.2177.7-70-14.3000111.5W220 F222 C227 G228W220-D224 PolarHBondContact O-N 3.45Å; F222-D224 PolarHBondContact O-N 3.39Å; D224-C227 PolarHBondContact O-N 3.21Å; D224-G228 PolarHBondContact O-N 3.2Å
225K93.1Very high89.9Confident149 Ų14967.7 Ų67.765%0.64835%0.35SS*.Hα-helixtrans-63.6-44.3177.6-76.7-175.3179.4-160.40112.7S221 F222 Y223 G228 L229S221-K225 WeakPolarHBondContact O-CB 3.5Å; S221-K225 VanDerWaalsContact O-CG 3.3Å; S221-K225 WeakPolarHBondContact O-CG 3.14Å; S221-K225 PolarHBondContact O-N 3.03Å; F222-K225 PolarHBondContact O-N 3.48Å; Y223-K225 PolarHBondContact O-N 3.16Å; K225-G228 PolarHBondContact O-N 3Å; K225-L229 VanDerWaalsContact O-CB 3.29Å; K225-L229 WeakPolarHBondContact O-CB 3.46Å; K225-L229 PolarHBondContact O-N 3.14Å
226F93.9Very high89.6Confident42 Ų4272.1 Ų72.118%0.18437%0.366CS..Hα-helixtrans-69.2-39.4179-71.2-50.5000111.7F222 Y223 G228 L229 I230 L269 A270F222-F226 HydrophobicContact CB-CD2 3.99Å; F222-F226 HydrophobicContact CB-CE2 3.77Å; F222-F226 HydrophobicContact CD1-CE2 4.29Å; F222-F226 HydrophobicContact CG-CE2 4.22Å; F222-F226 WeakPolarHBondContact O-CB 3.31Å; F222-F226 WeakPolarHBondContact O-CD2 2.98Å; F222-F226 WeakPolarHBondContact O-CG 3.23Å; F222-F226 PolarHBondContact O-N 3.21Å; Y223-F226 PolarHBondContact O-N 3.15Å; F226-G228 PolarHBondContact O-N 2.83Å; F226-L229 PolarHBondContact O-N 3.25Å; F226-I230 WeakPolarHBondContact O-CB 3.41Å; F226-I230 VanDerWaalsContact O-CG1 3.32Å; F226-I230 WeakPolarHBondContact O-CG1 3.17Å; F226-I230 PolarHBondContact O-N 3.46Å; F226-L269 HydrophobicContact CD1-CB 4.42Å; F226-L269 HydrophobicContact CD1-CD1 4.31Å; F226-L269 HydrophobicContact CD2-CB 3.69Å; F226-L269 HydrophobicContact CE1-CB 4.46Å; F226-L269 VanDerWaalsContact CE2-C 3.45Å; F226-L269 HydrophobicContact CE2-CB 3.73Å; F226-L269 HydrophobicContact CG-CB 4.07Å; F226-L269 HydrophobicContact CG-CD1 4.48Å; F226-L269 HydrophobicContact CZ-CB 4.14Å; F226-A270 HydrophobicContact CD2-CB 4.09Å; F226-A270 HydrophobicContact CE2-CB 4.48Å
227C90Very high89.2Confident25 Ų2574.7 Ų74.717%0.16937%0.373CS..Hα-helixtrans-59.6-47.9173.6-70.60000111Y223 D224 H231 I262 S266Y223-C227 WeakPolarHBondContact O-CB 3.18Å; Y223-C227 PolarHBondContact O-N 3.48Å; Y223-C227 PolarHBondContact O-SG 2.94Å; D224-C227 PolarHBondContact O-N 3.21Å; C227-H231 WeakPolarHBondContact O-CB 3.25Å; C227-H231 PolarHBondContact O-N 3.14Å; C227-I262 HydrophobicContact CB-CG2 4.3Å; C227-S266 WeakPolarHBondContact CA-OG 3.35Å; C227-S266 PolarHBondContact N-OG 2.78Å; C227-S266 WeakPolarHBondContact SG-CB 3.4Å; C227-S266 PolarHBondContact SG-OG 3.33Å
228G89.5Confident88.5Confident42 Ų4274.6 Ų74.643%0.43337%0.368SS..Hα-helixtrans-62.1-43.2177.300000113D224 K225 F226 F232D224-G228 PolarHBondContact O-N 3.2Å; K225-G228 PolarHBondContact O-N 3Å; F226-G228 PolarHBondContact O-N 2.83Å; G228-F232 VanDerWaalsContact O-CB 3.31Å; G228-F232 WeakPolarHBondContact O-CB 3.25Å; G228-F232 PolarHBondContact O-N 2.66Å
229L91.1Very high87.4Confident91 Ų9179.1 Ų79.148%0.47639%0.386SS..Hα-helixtrans-64.9-47.9178.4179.762.7000112K225 F226 F232 I233K225-L229 VanDerWaalsContact O-CB 3.29Å; K225-L229 WeakPolarHBondContact O-CB 3.46Å; K225-L229 PolarHBondContact O-N 3.14Å; F226-L229 PolarHBondContact O-N 3.25Å; L229-F232 PolarHBondContact O-N 3.01Å; L229-I233 HydrophobicContact CD1-CD1 3.94Å; L229-I233 HydrophobicContact CD1-CG1 4.34Å; L229-I233 HydrophobicContact CG-CD1 3.88Å; L229-I233 VanDerWaalsContact O-CG1 3.28Å; L229-I233 WeakPolarHBondContact O-CG1 3.41Å; L229-I233 PolarHBondContact O-N 3.42Å
230I89.3Confident86.4Confident33 Ų3380.9 Ų80.917%0.16940%0.397CS..Hα-helixtrans-67.5-40.3-179.3-69.9163.5000110.5F226 F232 I233 S234 I262 I265 S266 L269F226-I230 WeakPolarHBondContact O-CB 3.41Å; F226-I230 VanDerWaalsContact O-CG1 3.32Å; F226-I230 WeakPolarHBondContact O-CG1 3.17Å; F226-I230 PolarHBondContact O-N 3.46Å; I230-F232 VanDerWaalsContact C-N 3.35Å; I230-F232 PolarHBondContact O-N 3.38Å; I230-I233 PolarHBondContact O-N 2.89Å; I230-S234 WeakPolarHBondContact O-CB 3.34Å; I230-S234 PolarHBondContact O-N 3.41Å; I230-I262 HydrophobicContact CB-CG2 4.2Å; I230-I262 HydrophobicContact CG2-CB 4.39Å; I230-I262 HydrophobicContact CG2-CG1 4.11Å; I230-I262 HydrophobicContact CG2-CG2 4.01Å; I230-I265 HydrophobicContact CD1-CB 3.98Å; I230-I265 HydrophobicContact CD1-CG2 3.59Å; I230-S266 WeakPolarHBondContact CD1-OG 3.17Å; I230-L269 HydrophobicContact CD1-CD1 4.4Å
231H86.4Confident85.1Confident40 Ų4080.3 Ų80.319%0.18540%0.4CS..Hα-helixtrans-61.3-43.4173.9-176.772.9000111.7F8 C227 S234 K235 I262F8-H231 AromaticContact CZ-CE1 3.9Å; C227-H231 WeakPolarHBondContact O-CB 3.25Å; C227-H231 PolarHBondContact O-N 3.14Å; H231-S234 PolarHBondContact O-N 2.95Å; H231-K235 WeakPolarHBondContact O-CB 3.14Å; H231-K235 PolarHBondContact O-N 3.13Å; H231-I262 HydrophobicContact CB-CD1 4.2Å
232F87.5Confident83.6Confident136 Ų13681.4 Ų81.460%0.59640%0.404SS*.Hα-helixtrans-61.7-47.6175.7177-96.4000112.2G228 L229 I230 K235 K236G228-F232 VanDerWaalsContact O-CB 3.31Å; G228-F232 WeakPolarHBondContact O-CB 3.25Å; G228-F232 PolarHBondContact O-N 2.66Å; L229-F232 PolarHBondContact O-N 3.01Å; I230-F232 VanDerWaalsContact C-N 3.35Å; I230-F232 PolarHBondContact O-N 3.38Å; F232-K235 PolarHBondContact O-N 3.11Å; F232-K236 WeakPolarHBondContact O-CB 3.14Å; F232-K236 PolarHBondContact O-N 3.32Å
233I88Confident81.8Confident85 Ų8586.9 Ų86.944%0.43643%0.431SS..Hα-helixtrans-61.5-45.8177.9-68.6167.1000110.5L229 I230 K235 K236 M237L229-I233 HydrophobicContact CD1-CD1 3.94Å; L229-I233 HydrophobicContact CD1-CG1 4.34Å; L229-I233 HydrophobicContact CG-CD1 3.88Å; L229-I233 VanDerWaalsContact O-CG1 3.28Å; L229-I233 WeakPolarHBondContact O-CG1 3.41Å; L229-I233 PolarHBondContact O-N 3.42Å; I230-I233 PolarHBondContact O-N 2.89Å; I233-K235 PolarHBondContact O-N 2.89Å; I233-K236 PolarHBondContact O-N 3.17Å; I233-M237 HydrophobicContact CG2-CG 4.28Å; I233-M237 VanDerWaalsContact O-CG 3.28Å; I233-M237 WeakPolarHBondContact O-CG 3.23Å; I233-M237 PolarHBondContact O-N 3.46Å
234S84.5Confident80.2Confident16 Ų1692 Ų9211%0.11246%0.46CS..Hα-helixtrans-57.7-48.4177161.40000112.1I230 H231 K236 M237 C238 V257I230-S234 WeakPolarHBondContact O-CB 3.34Å; I230-S234 PolarHBondContact O-N 3.41Å; H231-S234 PolarHBondContact O-N 2.95Å; S234-K236 VanDerWaalsContact C-N 3.31Å; S234-K236 PolarHBondContact O-N 3.07Å; S234-M237 PolarHBondContact O-N 3.33Å; S234-C238 WeakPolarHBondContact O-CB 3.44Å; S234-C238 PolarHBondContact O-N 2.79Å; S234-V257 WeakPolarHBondContact OG-CB 3.45Å; S234-V257 WeakPolarHBondContact OG-CG2 3.46Å
235K82.9Confident78.3Confident109 Ų10990.4 Ų90.447%0.47446%0.457SS..Hα-helixtrans-63-38.1178-172171.5-174.6167.50112H231 F232 I233 K239H231-K235 WeakPolarHBondContact O-CB 3.14Å; H231-K235 PolarHBondContact O-N 3.13Å; F232-K235 PolarHBondContact O-N 3.11Å; I233-K235 PolarHBondContact O-N 2.89Å; K235-K239 WeakPolarHBondContact O-CG 3.28Å; K235-K239 PolarHBondContact O-N 2.91Å; K235-K239 VanDerWaalsContact O-N 3.12Å
236K83.2Confident76.1Confident113 Ų11389.2 Ų89.249%0.49146%0.462SS..Hα-helixtrans-65.5-50.7177.5-172.7-177.7172.8-1710111.6F232 I233 S234 C238 K239 E240F232-K236 WeakPolarHBondContact O-CB 3.14Å; F232-K236 PolarHBondContact O-N 3.32Å; I233-K236 PolarHBondContact O-N 3.17Å; S234-K236 VanDerWaalsContact C-N 3.31Å; S234-K236 PolarHBondContact O-N 3.07Å; K236-C238 VanDerWaalsContact C-N 3.28Å; K236-C238 PolarHBondContact O-N 3.42Å; K236-K239 PolarHBondContact O-N 2.77Å; K236-E240 WeakPolarHBondContact CE-OE1 3.45Å; K236-E240 IonicContact NZ-OE1 3.81Å; K236-E240 PolarHBondContact O-N 2.96Å
237M79.4Confident73.9Confident122 Ų12294.5 Ų94.560%0.60149%0.492SS*.Hα-helixtrans-58.1-40.7178.3-69.2-72.6-64.800111.9I233 S234 H241I233-M237 HydrophobicContact CG2-CG 4.28Å; I233-M237 VanDerWaalsContact O-CG 3.28Å; I233-M237 WeakPolarHBondContact O-CG 3.23Å; I233-M237 PolarHBondContact O-N 3.46Å; S234-M237 PolarHBondContact O-N 3.33Å; M237-H241 WeakPolarHBondContact O-CB 3Å; M237-H241 PolarHBondContact O-N 3.33Å
238C74.7Confident71.6Confident51 Ų51100.8 Ų100.835%0.34552%0.523SS..Hα-helixtrans-69.3-39.1179.7-153.10000112.2S234 K236 H241 V242 P256S234-C238 WeakPolarHBondContact O-CB 3.44Å; S234-C238 PolarHBondContact O-N 2.79Å; K236-C238 VanDerWaalsContact C-N 3.28Å; K236-C238 PolarHBondContact O-N 3.42Å; C238-H241 PolarHBondContact O-N 2.92Å; C238-V242 VanDerWaalsContact O-CG2 3.25Å; C238-V242 WeakPolarHBondContact O-CG2 3.38Å; C238-V242 PolarHBondContact O-N 3.42Å; C238-P256 HydrophobicContact CB-CB 3.86Å; C238-P256 HydrophobicContact CB-CG 4.07Å; C238-P256 VanDerWaalsContact SG-CB 3.53Å
239K71.6Confident69.5Low136 Ų136104.7 Ų104.759%0.59154%0.54SS*.Hα-helixtrans-64.4-42.4175.1-78.2-175.3174.3-164.50112.6K235 K236 H241 V242 Q243K235-K239 WeakPolarHBondContact O-CG 3.28Å; K235-K239 PolarHBondContact O-N 2.91Å; K235-K239 VanDerWaalsContact O-N 3.12Å; K236-K239 PolarHBondContact O-N 2.77Å; K239-H241 VanDerWaalsContact C-N 3.32Å; K239-V242 PolarHBondContact O-N 2.69Å; K239-Q243 PolarHBondContact O-N 3.05Å
240E70.4Confident67.2Low103 Ų103105.2 Ų105.248%0.48155%0.551SS.*Hα-helixtrans-62.5-41.7176.3-75.3173.3176.200110.8K236 Q243K236-E240 WeakPolarHBondContact CE-OE1 3.45Å; K236-E240 IonicContact NZ-OE1 3.81Å; K236-E240 PolarHBondContact O-N 2.96Å; E240-Q243 PolarHBondContact O-N 2.98Å
241H63.2Low65Low138 Ų138111.5 Ų111.564%0.63959%0.585SS**Hα-helixtrans-68.2-39.5178.3-157.457.5000113.5M237 C238 K239 Q243 D244 S245M237-H241 WeakPolarHBondContact O-CB 3Å; M237-H241 PolarHBondContact O-N 3.33Å; C238-H241 PolarHBondContact O-N 2.92Å; K239-H241 VanDerWaalsContact C-N 3.32Å; H241-Q243 VanDerWaalsContact C-N 3.31Å; H241-Q243 PolarHBondContact O-N 3.36Å; H241-D244 PolarHBondContact O-N 2.84Å; H241-S245 PolarHBondContact O-N 3.45Å; H241-S245 PolarHBondContact O-OG 2.92Å
242V61Low62.9Low90 Ų90115 Ų11555%0.54561%0.606SS.*Hα-helixtrans-66.5-32.7178.5170.30000111.9C238 K239 D244 S245C238-V242 VanDerWaalsContact O-CG2 3.25Å; C238-V242 WeakPolarHBondContact O-CG2 3.38Å; C238-V242 PolarHBondContact O-N 3.42Å; K239-V242 PolarHBondContact O-N 2.69Å; V242-D244 PolarHBondContact O-N 3.14Å; V242-S245 CarbonylContact O-C 3.52Å; V242-S245 PolarHBondContact O-N 2.89Å; V242-S245 PolarHBondContact O-OG 3.19Å
243Q56.8Low61.2Low164 Ų164116.5 Ų116.577%0.76662%0.62SS**Hα-helixtrans-63.2-31.3177.7-162.593.513.100112.1K239 E240 H241K239-Q243 PolarHBondContact O-N 3.05Å; E240-Q243 PolarHBondContact O-N 2.98Å; H241-Q243 VanDerWaalsContact C-N 3.31Å; H241-Q243 PolarHBondContact O-N 3.36Å
244D57.7Low59.4Low143 Ų143115.9 Ų115.977%0.76562%0.623SS**Hα-helixtrans-79.5-26.8177.9-70.4-24.1000112.7H241 V242H241-D244 PolarHBondContact O-N 2.84Å; V242-D244 PolarHBondContact O-N 3.14Å
245S50.2Low57.9Low70 Ų70117.5 Ų117.549%0.4964%0.638SS.*SBendtrans-101.382179.5530000111.5H241 V242 L247H241-S245 PolarHBondContact O-N 3.45Å; H241-S245 PolarHBondContact O-OG 2.92Å; V242-S245 CarbonylContact O-C 3.52Å; V242-S245 PolarHBondContact O-N 2.89Å; V242-S245 PolarHBondContact O-OG 3.19Å; S245-L247 PolarHBondContact O-N 2.97Å; S245-L247 VanDerWaalsContact O-N 3.09Å
246V47.2Very low56.9Low125 Ų125115.4 Ų115.476%0.75864%0.635SS**  trans-64103.2170175.80000109.8
247L46.7Very low56.2Low153 Ų153111.7 Ų111.780%0.80162%0.622SS**SBendtrans159.8125.7141.5-89.1149.5000110.8S245S245-L247 PolarHBondContact O-N 2.97Å; S245-L247 VanDerWaalsContact O-N 3.09Å
248L43Very low56.1Low157 Ų157110 Ų11082%0.82262%0.619SS**  trans95.8100.1169.8-55.5169.8000116.6S250L248-S250 PolarHBondContact O-N 3.34Å
249P43.9Very low56.2Low123 Ų123111.6 Ų111.680%0.79962%0.619SS**  trans-81.390.7168.432.7-27.8000109.2N251P249-N251 PolarHBondContact O-N 3.37Å
250S44Very low56.6Low102 Ų102108.4 Ų108.471%0.71361%0.608SS**  trans-77.3111.7159.452.70000107.9L248 D252L248-S250 PolarHBondContact O-N 3.34Å; S250-D252 PolarHBondContact O-N 2.9Å
251N42.1Very low57.3Low165 Ų165107.5 Ų107.588%0.88261%0.606SS**  trans-62.530.5169.6-85.3-17.9000113.4P249 D253P249-N251 PolarHBondContact O-N 3.37Å; N251-D253 PolarHBondContact O-N 3.46Å
252D43.9Very low58.4Low114 Ų114101.7 Ų101.761%0.6158%0.579SS**  trans-84.296.7174.7-162.919.8000107.7S250 S254S250-D252 PolarHBondContact O-N 2.9Å; D252-S254 PolarHBondContact O-N 3.04Å; D252-S254 WeakPolarHBondContact OD2-CB 3.24Å; D252-S254 PolarHBondContact OD2-OG 2.9Å
253D50.4Low59.6Low168 Ų16898.3 Ų98.390%0.89856%0.557SS**  trans-63.811.3170.6-90.6-29.6000112.6N251 A255N251-D253 PolarHBondContact O-N 3.46Å; D253-A255 PolarHBondContact O-N 3.37Å; D253-A255 VanDerWaalsContact O-N 3.13Å
254S49.9Very low61.1Low71 Ų7192.3 Ų92.350%0.49753%0.53SS..  trans-53.7118.4172.457.90000109.5D252D252-S254 PolarHBondContact O-N 3.04Å; D252-S254 WeakPolarHBondContact OD2-CB 3.24Å; D252-S254 PolarHBondContact OD2-OG 2.9Å
255A53.9Low62.7Low51 Ų5189.2 Ų89.242%0.42151%0.513SS..  trans-55.1128.7-175.500000109.4D253 V257D253-A255 PolarHBondContact O-N 3.37Å; D253-A255 VanDerWaalsContact O-N 3.13Å; A255-V257 PolarHBondContact O-N 3.29Å
256P60.7Low64.7Low65 Ų6585.9 Ų85.942%0.42249%0.489SS..SBendtrans-66.6-10.6-166.422.7-33.2000114.4C238C238-P256 HydrophobicContact CB-CB 3.86Å; C238-P256 HydrophobicContact CB-CG 4.07Å; C238-P256 VanDerWaalsContact SG-CB 3.53Å
257V69Low66.8Low35 Ų3580.1 Ų80.121%0.21246%0.455CS..SBendtrans-128.6131.5176171.60000109.3S234 A255 R259 L261 I262S234-V257 WeakPolarHBondContact OG-CB 3.45Å; S234-V257 WeakPolarHBondContact OG-CG2 3.46Å; A255-V257 PolarHBondContact O-N 3.29Å; V257-R259 PolarHBondContact O-N 3.49Å; V257-L261 HydrophobicContact CG1-CB 4.01Å; V257-L261 HydrophobicContact CG1-CD2 3.73Å; V257-L261 HydrophobicContact CG1-CG 4.3Å; V257-I262 HydrophobicContact CG1-CD1 4.41Å; V257-I262 HydrophobicContact CG1-CG1 3.88Å
258P78.2Confident69Low85 Ų8573.3 Ų73.355%0.55242%0.42SS*.  trans-54132.1177.7-25.533000111.3L260 L261 I262P258-L260 PolarHBondContact O-N 2.86Å; P258-L260 VanDerWaalsContact O-N 3.13Å; P258-L261 WeakPolarHBondContact O-CB 3.26Å; P258-L261 PolarHBondContact O-N 3.03Å; P258-I262 PolarHBondContact O-N 3.5Å
259R75.4Confident71.5Confident86 Ų8669.1 Ų69.133%0.32540%0.398SS..Hα-helixtrans-52-39.5-179.8-175.3-168.7172.3158.15111.9E9 V257 L261 I262 Q263E9-R259 PolarHBondContact O-NH1 3.35Å; V257-R259 PolarHBondContact O-N 3.49Å; R259-L261 VanDerWaalsContact C-N 3.29Å; R259-L261 PolarHBondContact O-N 3.2Å; R259-I262 PolarHBondContact O-N 2.89Å; R259-Q263 WeakPolarHBondContact O-CG 3.49Å; R259-Q263 PolarHBondContact O-N 3.24Å
260L80.6Confident73.9Confident69 Ų6963.2 Ų63.236%0.36136%0.36SS..Hα-helixtrans-56-42176.8-177.467.3000111.7P258 Q263 L264 V330 E334P258-L260 PolarHBondContact O-N 2.86Å; P258-L260 VanDerWaalsContact O-N 3.13Å; L260-Q263 PolarHBondContact O-N 3.27Å; L260-L264 VanDerWaalsContact O-CB 3.26Å; L260-L264 WeakPolarHBondContact O-CB 3.39Å; L260-L264 PolarHBondContact O-N 3.38Å; L260-V330 HydrophobicContact CD1-CG1 3.44Å; L260-V330 VanDerWaalsContact CD1-CG1 3.44Å; L260-V330 HydrophobicContact CG-CG1 4.45Å; L260-E334 HydrophobicContact CD1-CB 4.17Å; L260-E334 HydrophobicContact CD1-CG 4.26Å; L260-E334 WeakPolarHBondContact CD1-OE2 3.5Å
261L84.5Confident76.2Confident84 Ų8458.5 Ų58.544%0.4433%0.327SS..Hα-helixtrans-66.8-41.6-180-170.768.5000111.7V257 P258 R259 Q263 L264 I265V257-L261 HydrophobicContact CG1-CB 4.01Å; V257-L261 HydrophobicContact CG1-CD2 3.73Å; V257-L261 HydrophobicContact CG1-CG 4.3Å; P258-L261 WeakPolarHBondContact O-CB 3.26Å; P258-L261 PolarHBondContact O-N 3.03Å; R259-L261 VanDerWaalsContact C-N 3.29Å; R259-L261 PolarHBondContact O-N 3.2Å; L261-Q263 VanDerWaalsContact C-N 3.34Å; L261-Q263 PolarHBondContact O-N 3.39Å; L261-L264 PolarHBondContact O-N 3.16Å; L261-I265 HydrophobicContact CG-CD1 4.39Å; L261-I265 WeakPolarHBondContact O-CG1 2.83Å; L261-I265 PolarHBondContact O-N 3.34Å
262I86.6Confident78.7Confident15 Ų1553 Ų538%0.07730%0.297CS..Hα-helixtrans-61.2-45.9176.1-58.7-179000109.9C227 I230 H231 V257 P258 R259 L264 I265 S266C227-I262 HydrophobicContact CB-CG2 4.3Å; I230-I262 HydrophobicContact CB-CG2 4.2Å; I230-I262 HydrophobicContact CG2-CB 4.39Å; I230-I262 HydrophobicContact CG2-CG1 4.11Å; I230-I262 HydrophobicContact CG2-CG2 4.01Å; H231-I262 HydrophobicContact CB-CD1 4.2Å; V257-I262 HydrophobicContact CG1-CD1 4.41Å; V257-I262 HydrophobicContact CG1-CG1 3.88Å; P258-I262 PolarHBondContact O-N 3.5Å; R259-I262 PolarHBondContact O-N 2.89Å; I262-L264 PolarHBondContact O-N 2.82Å; I262-I265 PolarHBondContact O-N 2.95Å; I262-S266 WeakPolarHBondContact O-CB 3.22Å; I262-S266 PolarHBondContact O-N 2.94Å; I262-S266 PolarHBondContact O-OG 3.32Å
263Q87.2Confident81.2Confident20 Ų2049 Ų499%0.09328%0.278CS..Hα-helixtrans-63.5-40.8177.3-65.9-174.35000112Y223 R259 L260 L261 I265 S266 A267 V330 E334Y223-Q263 WeakPolarHBondContact OH-CG 3.38Å; Y223-Q263 PolarHBondContact OH-OE1 2.9Å; R259-Q263 WeakPolarHBondContact O-CG 3.49Å; R259-Q263 PolarHBondContact O-N 3.24Å; L260-Q263 PolarHBondContact O-N 3.27Å; L261-Q263 VanDerWaalsContact C-N 3.34Å; L261-Q263 PolarHBondContact O-N 3.39Å; Q263-I265 PolarHBondContact O-N 3.43Å; Q263-S266 PolarHBondContact O-N 3.45Å; Q263-A267 VanDerWaalsContact O-CB 3.3Å; Q263-A267 WeakPolarHBondContact O-CB 3.49Å; Q263-A267 PolarHBondContact O-N 2.92Å; Q263-V330 HydrophobicContact CB-CG1 4.12Å; Q263-V330 HydrophobicContact CB-CG2 4.16Å; Q263-E334 PolarHBondContact NE2-OE1 3.43Å; Q263-E334 PolarHBondContact NE2-OE2 3.29Å; Q263-E334 PolarHBondContact OE1-OE2 3.44Å
264L88.6Confident83.3Confident38 Ų3841.1 Ų41.120%0.19924%0.236CC..Hα-helixtrans-62.3-28.9-178.9-16172000112.9L260 L261 I262 P268 F327 V330 L331L260-L264 VanDerWaalsContact O-CB 3.26Å; L260-L264 WeakPolarHBondContact O-CB 3.39Å; L260-L264 PolarHBondContact O-N 3.38Å; L261-L264 PolarHBondContact O-N 3.16Å; I262-L264 PolarHBondContact O-N 2.82Å; L264-P268 WeakPolarHBondContact O-CD 3.32Å; L264-P268 WeakPolarHBondContact O-CG 3.43Å; L264-F327 HydrophobicContact CD1-CD1 3.45Å; L264-F327 VanDerWaalsContact CD1-CD1 3.45Å; L264-F327 HydrophobicContact CD1-CE1 3.75Å; L264-F327 HydrophobicContact CD2-CE1 4.11Å; L264-F327 HydrophobicContact CG-CD1 3.91Å; L264-F327 HydrophobicContact CG-CE1 3.63Å; L264-V330 HydrophobicContact CB-CG1 4.33Å; L264-V330 HydrophobicContact CD1-CB 4.09Å; L264-V330 HydrophobicContact CD1-CG1 3.81Å; L264-L331 HydrophobicContact CD1-CD2 4.03Å; L264-L331 HydrophobicContact CD1-CG 4.01Å
265I90.7Very high85.4Confident77 Ų7737.9 Ų37.940%0.39521%0.214SC..Hα-helixtrans-91.8-43.1176-59.4170.1000110.6I230 L261 I262 Q263 P268 L269I230-I265 HydrophobicContact CD1-CB 3.98Å; I230-I265 HydrophobicContact CD1-CG2 3.59Å; L261-I265 HydrophobicContact CG-CD1 4.39Å; L261-I265 WeakPolarHBondContact O-CG1 2.83Å; L261-I265 PolarHBondContact O-N 3.34Å; I262-I265 PolarHBondContact O-N 2.95Å; Q263-I265 PolarHBondContact O-N 3.43Å; I265-P268 WeakPolarHBondContact O-CD 3.46Å; I265-L269 HydrophobicContact CG2-CD1 3.81Å; I265-L269 HydrophobicContact CG2-CG 4.45Å; I265-L269 VanDerWaalsContact O-CG 3.31Å; I265-L269 WeakPolarHBondContact O-CG 3.48Å; I265-L269 PolarHBondContact O-N 3.23Å
266S91.5Very high87.4Confident0 Ų039.8 Ų39.80%022%0.216CC..Hα-helixtrans-66.9-42.1-174.7-56.50000112.6C227 I230 I262 Q263 L269 A270C227-S266 WeakPolarHBondContact CA-OG 3.35Å; C227-S266 PolarHBondContact N-OG 2.78Å; C227-S266 WeakPolarHBondContact SG-CB 3.4Å; C227-S266 PolarHBondContact SG-OG 3.33Å; I230-S266 WeakPolarHBondContact CD1-OG 3.17Å; I262-S266 WeakPolarHBondContact O-CB 3.22Å; I262-S266 PolarHBondContact O-N 2.94Å; I262-S266 PolarHBondContact O-OG 3.32Å; Q263-S266 PolarHBondContact O-N 3.45Å; S266-L269 PolarHBondContact O-N 3.45Å; S266-A270 VanDerWaalsContact O-CB 3.3Å; S266-A270 WeakPolarHBondContact O-CB 3.33Å; S266-A270 PolarHBondContact O-N 3.4Å
267A91.6Very high89.1Confident4 Ų441 Ų413%0.03322%0.218CC..Hα-helixtrans-66.1-45-177.400000113W219 Y223 Q263 G271 S326 V330W219-A267 HydrophobicContact CZ2-CB 4.36Å; Y223-A267 HydrophobicContact CD2-CB 4.15Å; Y223-A267 HydrophobicContact CE2-CB 3.96Å; Q263-A267 VanDerWaalsContact O-CB 3.3Å; Q263-A267 WeakPolarHBondContact O-CB 3.49Å; Q263-A267 PolarHBondContact O-N 2.92Å; A267-G271 PolarHBondContact O-N 2.93Å; A267-S326 PolarHBondContact O-OG 3.28Å; A267-S326 VanDerWaalsContact O-OG 3.04Å; A267-V330 HydrophobicContact CB-CG2 4.09Å
268P93.5Very high90.3Very high11 Ų1139.7 Ų39.77%0.07121%0.21CC..Hα-helixtrans-60.6-45.5170.4-27.636.7000113.3L264 I265 A270 G271 I272 T323 F327L264-P268 WeakPolarHBondContact O-CD 3.32Å; L264-P268 WeakPolarHBondContact O-CG 3.43Å; I265-P268 WeakPolarHBondContact O-CD 3.46Å; P268-A270 PolarHBondContact O-N 3.49Å; P268-G271 CarbonylContact O-C 3.58Å; P268-G271 WeakPolarHBondContact O-CA 3.09Å; P268-G271 PolarHBondContact O-N 3.46Å; P268-G271 VanDerWaalsContact O-N 3.16Å; P268-I272 WeakPolarHBondContact O-CB 3.46Å; P268-I272 VanDerWaalsContact O-CG1 3.28Å; P268-I272 WeakPolarHBondContact O-CG1 3.2Å; P268-I272 PolarHBondContact O-N 3.47Å; P268-T323 HydrophobicContact CB-CG2 4.4Å; P268-F327 HydrophobicContact CG-CD2 4.46Å; P268-F327 HydrophobicContact CG-CE2 4.19Å; P268-F327 HydrophobicContact CG-CZ 4.33Å
269L94.7Very high91.1Very high68 Ų6835.7 Ų35.736%0.35618%0.184SC..Hα-helixtrans-61.3-42.6179.8-72.4176.3000112.4F226 I230 I265 S266 I272 S273F226-L269 HydrophobicContact CD1-CB 4.42Å; F226-L269 HydrophobicContact CD1-CD1 4.31Å; F226-L269 HydrophobicContact CD2-CB 3.69Å; F226-L269 HydrophobicContact CE1-CB 4.46Å; F226-L269 VanDerWaalsContact CE2-C 3.45Å; F226-L269 HydrophobicContact CE2-CB 3.73Å; F226-L269 HydrophobicContact CG-CB 4.07Å; F226-L269 HydrophobicContact CG-CD1 4.48Å; F226-L269 HydrophobicContact CZ-CB 4.14Å; I230-L269 HydrophobicContact CD1-CD1 4.4Å; I265-L269 HydrophobicContact CG2-CD1 3.81Å; I265-L269 HydrophobicContact CG2-CG 4.45Å; I265-L269 VanDerWaalsContact O-CG 3.31Å; I265-L269 WeakPolarHBondContact O-CG 3.48Å; I265-L269 PolarHBondContact O-N 3.23Å; S266-L269 PolarHBondContact O-N 3.45Å; L269-I272 PolarHBondContact O-N 3.04Å; L269-S273 WeakPolarHBondContact O-CB 3.32Å; L269-S273 PolarHBondContact O-N 3.03Å; L269-S273 PolarHBondContact O-OG 3.48Å
270A94.1Very high92.1Very high0 Ų032.5 Ų32.50%017%0.174CC..Hα-helixtrans-61.7-44.9173.800000111.6F222 F226 S266 P268 S273 S274F222-A270 HydrophobicContact CB-CB 3.82Å; F226-A270 HydrophobicContact CD2-CB 4.09Å; F226-A270 HydrophobicContact CE2-CB 4.48Å; S266-A270 VanDerWaalsContact O-CB 3.3Å; S266-A270 WeakPolarHBondContact O-CB 3.33Å; S266-A270 PolarHBondContact O-N 3.4Å; P268-A270 PolarHBondContact O-N 3.49Å; A270-S273 PolarHBondContact O-N 3.27Å; A270-S274 VanDerWaalsContact O-CB 3.31Å; A270-S274 WeakPolarHBondContact O-CB 3.2Å; A270-S274 PolarHBondContact O-N 3.04Å
271G93.2Very high92.7Very high2 Ų232 Ų322%0.02117%0.171CC..Hα-helixtrans-59.2-46.4175.800000113.8A267 P268 A275A267-G271 PolarHBondContact O-N 2.93Å; P268-G271 CarbonylContact O-C 3.58Å; P268-G271 WeakPolarHBondContact O-CA 3.09Å; P268-G271 PolarHBondContact O-N 3.46Å; P268-G271 VanDerWaalsContact O-N 3.16Å; G271-A275 WeakPolarHBondContact O-CB 3.26Å; G271-A275 PolarHBondContact O-N 2.99Å
272I95.4Very high93.2Very high50 Ų5028.3 Ų28.326%0.25615%0.152SC..Hα-helixtrans-63.9-48.4177.7-70.5166.9000110.1P268 L269 A275 I276 L319P268-I272 WeakPolarHBondContact O-CB 3.46Å; P268-I272 VanDerWaalsContact O-CG1 3.28Å; P268-I272 WeakPolarHBondContact O-CG1 3.2Å; P268-I272 PolarHBondContact O-N 3.47Å; L269-I272 PolarHBondContact O-N 3.04Å; I272-A275 PolarHBondContact O-N 2.92Å; I272-I276 HydrophobicContact CG2-CD1 3.83Å; I272-I276 WeakPolarHBondContact O-CG1 3.26Å; I272-I276 PolarHBondContact O-N 2.97Å; I272-L319 HydrophobicContact CB-CD2 4.19Å; I272-L319 HydrophobicContact CG1-CD2 4.12Å; I272-L319 HydrophobicContact CG2-CD2 3.88Å
273S96Very high93.6Very high30 Ų3027.6 Ų27.621%0.2115%0.149CC..Hα-helixtrans-62.3-46.7-178.5-57.60000111.8L269 A270 I276 I277L269-S273 WeakPolarHBondContact O-CB 3.32Å; L269-S273 PolarHBondContact O-N 3.03Å; L269-S273 PolarHBondContact O-OG 3.48Å; A270-S273 PolarHBondContact O-N 3.27Å; S273-I276 PolarHBondContact O-N 3.32Å; S273-I277 WeakPolarHBondContact O-CG1 3.45Å; S273-I277 PolarHBondContact O-N 3.4Å
274S94.8Very high94Very high3 Ų326.8 Ų26.82%0.02115%0.145CC..Hα-helixtrans-62.7-42.8174.5179.30000111.6S215 A270 I276 I277 V278S215-S274 PolarHBondContact O-OG 3.33Å; A270-S274 VanDerWaalsContact O-CB 3.31Å; A270-S274 WeakPolarHBondContact O-CB 3.2Å; A270-S274 PolarHBondContact O-N 3.04Å; S274-I276 PolarHBondContact O-N 2.94Å; S274-I277 PolarHBondContact O-N 3.42Å; S274-V278 WeakPolarHBondContact O-CB 3.4Å; S274-V278 WeakPolarHBondContact O-CG2 3.49Å; S274-V278 PolarHBondContact O-N 3.04Å
275A94.1Very high94.3Very high3 Ų325.5 Ų25.53%0.02514%0.138CC..Hα-helixtrans-61.5-43.2178.900000112.8G271 I272 I277 V278 N279 R318 L319G271-A275 WeakPolarHBondContact O-CB 3.26Å; G271-A275 PolarHBondContact O-N 2.99Å; I272-A275 PolarHBondContact O-N 2.92Å; A275-I277 VanDerWaalsContact C-N 3.33Å; A275-I277 PolarHBondContact O-N 3.28Å; A275-V278 PolarHBondContact O-N 3.13Å; A275-N279 VanDerWaalsContact O-CB 3.23Å; A275-N279 WeakPolarHBondContact O-CB 3.29Å; A275-N279 PolarHBondContact O-N 3.45Å; A275-R318 HydrophobicContact CB-CG 3.81Å; A275-L319 HydrophobicContact CB-CD2 4.15Å
276I95.8Very high94.5Very high90 Ų9022 Ų2246%0.46212%0.12SC..Hα-helixtrans-60.2-44.7178.5-70.1166.4000110.7I272 S273 S274 L315 L319I272-I276 HydrophobicContact CG2-CD1 3.83Å; I272-I276 WeakPolarHBondContact O-CG1 3.26Å; I272-I276 PolarHBondContact O-N 2.97Å; S273-I276 PolarHBondContact O-N 3.32Å; S274-I276 PolarHBondContact O-N 2.94Å; I276-L315 HydrophobicContact CG1-CD1 4.3Å; I276-L315 HydrophobicContact CG1-CD2 4.42Å; I276-L319 HydrophobicContact CG1-CD2 4.35Å
277I95.4Very high94.6Very high92 Ų9222.1 Ų22.147%0.47212%0.12SC..Hα-helixtrans-70.2-41.7-177.7-64.1174.8000111.6L218 F222 S273 S274 A275 P280L218-I277 HydrophobicContact CD1-CB 3.98Å; L218-I277 HydrophobicContact CD1-CD1 4.35Å; L218-I277 HydrophobicContact CD1-CG2 3.61Å; L218-I277 HydrophobicContact CD2-CD1 4.21Å; F222-I277 HydrophobicContact CE2-CD1 3.77Å; F222-I277 HydrophobicContact CZ-CD1 3.77Å; S273-I277 WeakPolarHBondContact O-CG1 3.45Å; S273-I277 PolarHBondContact O-N 3.4Å; S274-I277 PolarHBondContact O-N 3.42Å; A275-I277 VanDerWaalsContact C-N 3.33Å; A275-I277 PolarHBondContact O-N 3.28Å; I277-P280 WeakPolarHBondContact O-CD 3.47Å
278V94.7Very high94.8Very high6 Ų623 Ų234%0.03612%0.124CC..Hα-helixtrans-86.3-18.2-173.8177.60000113T211 L218 S274 A275 P280 L281 D282T211-V278 HydrophobicContact CG2-CG1 3.63Å; L218-V278 HydrophobicContact CD1-CG2 3.74Å; S274-V278 WeakPolarHBondContact O-CB 3.4Å; S274-V278 WeakPolarHBondContact O-CG2 3.49Å; S274-V278 PolarHBondContact O-N 3.04Å; A275-V278 PolarHBondContact O-N 3.13Å; V278-P280 VanDerWaalsContact C-N 3.33Å; V278-P280 VanDerWaalsContact O-N 3.15Å; V278-L281 PolarHBondContact O-N 3.31Å; V278-D282 PolarHBondContact O-N 3.18Å; V278-D282 VanDerWaalsContact O-N 3.16Å
279N95.3Very high94.8Very high1 Ų122.4 Ų22.41%0.00512%0.12CC..Hα-helixtrans-50.6-43.3-174.4-16763000114.3R43 A275 L281 D282 V283 F311 K313 L315R43-N279 PolarHBondContact NH2-OD1 2.85Å; A275-N279 VanDerWaalsContact O-CB 3.23Å; A275-N279 WeakPolarHBondContact O-CB 3.29Å; A275-N279 PolarHBondContact O-N 3.45Å; N279-L281 PolarHBondContact O-N 3.34Å; N279-D282 PolarHBondContact O-N 3.41Å; N279-V283 VanDerWaalsContact O-CG2 3.27Å; N279-V283 WeakPolarHBondContact O-CG2 3.38Å; N279-V283 PolarHBondContact O-N 2.98Å; N279-F311 PolarHBondContact ND2-O 3.31Å; N279-K313 PolarHBondContact ND2-O 3.01Å; N279-L315 HydrophobicContact CB-CD1 4.07Å
280P94.9Very high94.7Very high19 Ų1919.2 Ų19.212%0.12310%0.104CC..Hα-helixtrans-59-43.2178.6-24.836.3000113.2I277 V278 D282 V283 V284 W310 F311I277-P280 WeakPolarHBondContact O-CD 3.47Å; V278-P280 VanDerWaalsContact C-N 3.33Å; V278-P280 VanDerWaalsContact O-N 3.15Å; P280-D282 VanDerWaalsContact C-N 3.31Å; P280-D282 PolarHBondContact O-N 3.08Å; P280-V283 PolarHBondContact O-N 3.16Å; P280-V284 WeakPolarHBondContact O-CG2 3.02Å; P280-V284 PolarHBondContact O-N 3.1Å; P280-W310 HydrophobicContact CB-CE3 4.5Å; P280-W310 HydrophobicContact CB-CH2 3.74Å; P280-W310 HydrophobicContact CB-CZ3 3.6Å; P280-F311 HydrophobicContact CB-CD1 3.92Å; P280-F311 HydrophobicContact CB-CE1 4.13Å; P280-F311 HydrophobicContact CG-CB 4.4Å; P280-F311 HydrophobicContact CG-CD1 3.34Å; P280-F311 HydrophobicContact CG-CE1 3.91Å; P280-F311 HydrophobicContact CG-CG 4.19Å
281L94.6Very high94.6Very high58 Ų5821.1 Ų21.130%0.30412%0.117SC..Hα-helixtrans-64-39.8177.6-70.7173.5000111.2I207 C210 V278 N279 V284 R285I207-L281 HydrophobicContact CD1-CD2 3.97Å; C210-L281 WeakPolarHBondContact O-CD1 3.31Å; V278-L281 PolarHBondContact O-N 3.31Å; N279-L281 PolarHBondContact O-N 3.34Å; L281-V284 PolarHBondContact O-N 2.73Å; L281-R285 WeakPolarHBondContact O-CB 3.3Å; L281-R285 PolarHBondContact O-N 2.92Å
282D94.8Very high94.5Very high8 Ų822 Ų224%0.04312%0.12CC..Hα-helixtrans-70.7-35.3179.1-166.467000112.9R43 Q47 T211 V278 N279 P280 V284 R285 V286R43-D282 IonicContact CZ-OD2 2.6Å; R43-D282 IonicContact NE-OD2 3.97Å; R43-D282 IonicContact NH1-OD2 2.85Å; R43-D282 PolarHBondContact NH1-OD2 3.27Å; R43-D282 IonicContact NH2-OD2 3.86Å; R43-D282 PolarHBondContact NH2-OD2 2.92Å; Q47-D282 PolarHBondContact NE2-OD2 3.15Å; T211-D282 HydrophobicContact CG2-CB 3.78Å; V278-D282 PolarHBondContact O-N 3.18Å; V278-D282 VanDerWaalsContact O-N 3.16Å; N279-D282 PolarHBondContact O-N 3.41Å; P280-D282 VanDerWaalsContact C-N 3.31Å; P280-D282 PolarHBondContact O-N 3.08Å; D282-V284 VanDerWaalsContact C-N 3.31Å; D282-V284 PolarHBondContact O-N 2.82Å; D282-R285 WeakPolarHBondContact O-CB 3.49Å; D282-R285 PolarHBondContact O-N 3.2Å; D282-V286 WeakPolarHBondContact O-CG2 3.32Å; D282-V286 PolarHBondContact O-N 2.97Å
283V95.3Very high94.3Very high0 Ų020.9 Ų20.90%012%0.115CC..Hα-helixtrans-58.4-46.4171.9175.10000110.2Q47 N279 P280 R287 L302 W310 K313Q47-V283 HydrophobicContact CG-CG2 3.98Å; N279-V283 VanDerWaalsContact O-CG2 3.27Å; N279-V283 WeakPolarHBondContact O-CG2 3.38Å; N279-V283 PolarHBondContact O-N 2.98Å; P280-V283 PolarHBondContact O-N 3.16Å; V283-R287 WeakPolarHBondContact O-CG 3.32Å; V283-R287 PolarHBondContact O-N 3.01Å; V283-R287 VanDerWaalsContact O-N 3.16Å; V283-L302 HydrophobicContact CG1-CD1 3.83Å; V283-L302 HydrophobicContact CG1-CD2 4.04Å; V283-W310 HydrophobicContact CB-CE3 4.48Å; V283-W310 HydrophobicContact CG1-CE3 4.31Å; V283-K313 HydrophobicContact CG1-CD 4.14Å; V283-K313 HydrophobicContact CG2-CB 4.14Å; V283-K313 WeakPolarHBondContact CG2-O 3.43Å
284V95.2Very high94.1Very high3 Ų322.4 Ų22.42%0.01812%0.123CC..Hα-helixtrans-66.8-41.9178.5177.70000111P280 L281 D282 V286 R287 M288 F295 V299 L302 W310P280-V284 WeakPolarHBondContact O-CG2 3.02Å; P280-V284 PolarHBondContact O-N 3.1Å; L281-V284 PolarHBondContact O-N 2.73Å; D282-V284 VanDerWaalsContact C-N 3.31Å; D282-V284 PolarHBondContact O-N 2.82Å; V284-V286 PolarHBondContact O-N 3.22Å; V284-R287 PolarHBondContact O-N 2.95Å; V284-M288 HydrophobicContact CG1-CG 4.12Å; V284-M288 HydrophobicContact CG1-SD 3.83Å; V284-M288 WeakPolarHBondContact O-CB 3.26Å; V284-M288 VanDerWaalsContact O-CG 3.28Å; V284-M288 WeakPolarHBondContact O-CG 3.43Å; V284-M288 PolarHBondContact O-N 3.36Å; V284-F295 HydrophobicContact CB-CE2 4.44Å; V284-F295 HydrophobicContact CG1-CD2 3.48Å; V284-F295 VanDerWaalsContact CG1-CD2 3.48Å; V284-F295 HydrophobicContact CG1-CE2 3.66Å; V284-F295 HydrophobicContact CG1-CG 4.39Å; V284-V299 HydrophobicContact CG2-CG2 4.06Å; V284-L302 HydrophobicContact CG2-CD1 4Å; V284-W310 HydrophobicContact CG2-CH2 4.37Å; V284-W310 HydrophobicContact CG2-CZ3 4.09Å
285R95.2Very high94.1Very high11 Ų1127.1 Ų27.14%0.04214%0.144CC..Hα-helixtrans-53.1-54.8175.3177.4-169.8-173.8-119.4-7.1111.4D133 I207 S208 F212 L281 D282 R287 M288 Q289D133-R285 IonicContact OD2-CZ 2.67Å; D133-R285 IonicContact OD2-NH1 3.55Å; D133-R285 IonicContact OD2-NH2 2.75Å; D133-R285 PolarHBondContact OD2-NH2 3.43Å; I207-R285 HydrophobicContact CG1-CB 4.04Å; I207-R285 HydrophobicContact CG2-CB 4.15Å; I207-R285 HydrophobicContact CG2-CG 4.17Å; S208-R285 PolarHBondContact OG-NE 2.9Å; S208-R285 PolarHBondContact OG-NH2 3.33Å; F212-R285 VanDerWaalsContact CE2-NH2 3.28Å; F212-R285 VanDerWaalsContact CZ-NH1 3.34Å; L281-R285 WeakPolarHBondContact O-CB 3.3Å; L281-R285 PolarHBondContact O-N 2.92Å; D282-R285 WeakPolarHBondContact O-CB 3.49Å; D282-R285 PolarHBondContact O-N 3.2Å; R285-R287 PolarHBondContact O-N 3.46Å; R285-M288 PolarHBondContact O-N 3.48Å; R285-Q289 HydrophobicContact CG-CG 4.49Å; R285-Q289 WeakPolarHBondContact O-CB 3.49Å; R285-Q289 WeakPolarHBondContact O-CG 3.3Å; R285-Q289 PolarHBondContact O-N 3.49Å
286V95Very high94.1Very high2 Ų234.5 Ų34.51%0.01218%0.175CC..Hα-helixtrans-63-41.6-177174.90000111.1T44 L48 D282 V284 Q289 V290T44-V286 HydrophobicContact CG2-CG1 3.9Å; L48-V286 HydrophobicContact CD1-CG1 3.79Å; L48-V286 HydrophobicContact CD2-CG1 4.02Å; L48-V286 HydrophobicContact CG-CG1 3.69Å; D282-V286 WeakPolarHBondContact O-CG2 3.32Å; D282-V286 PolarHBondContact O-N 2.97Å; V284-V286 PolarHBondContact O-N 3.22Å; V286-Q289 PolarHBondContact O-N 2.89Å; V286-V290 WeakPolarHBondContact O-CB 3.31Å; V286-V290 PolarHBondContact O-N 3.46Å
287R93.4Very high94Very high4 Ų434.3 Ų34.32%0.01517%0.173CC..Hα-helixtrans-63.7-40.7174.7-74.1178.875.689.9-2.9112.7L48 E50 V283 V284 R285 S291 I293 S298L48-R287 HydrophobicContact CD2-CB 4.45Å; L48-R287 HydrophobicContact CD2-CG 3.96Å; L48-R287 PolarHBondContact O-NH1 3.32Å; L48-R287 VanDerWaalsContact O-NH1 3.12Å; E50-R287 IonicContact OE1-CZ 3.23Å; E50-R287 IonicContact OE1-NH1 2.7Å; E50-R287 IonicContact OE1-NH2 2.88Å; E50-R287 PolarHBondContact OE1-NH2 2.85Å; V283-R287 WeakPolarHBondContact O-CG 3.32Å; V283-R287 PolarHBondContact O-N 3.01Å; V283-R287 VanDerWaalsContact O-N 3.16Å; V284-R287 PolarHBondContact O-N 2.95Å; R285-R287 PolarHBondContact O-N 3.46Å; R287-S291 WeakPolarHBondContact O-CA 3.41Å; R287-S291 VanDerWaalsContact O-CB 3.23Å; R287-S291 WeakPolarHBondContact O-CB 3.46Å; R287-S291 PolarHBondContact O-N 3.34Å; R287-I293 HydrophobicContact CB-CD1 4.49Å; R287-S298 WeakPolarHBondContact CB-OG 3.17Å
288M94.7Very high93.9Very high21 Ų2130 Ų3010%0.10315%0.15CC..Hα-helixtrans-66.7-37.6176-73.1-177.963.300112.2K203 I207 V284 R285 H292 I293 F295K203-M288 WeakPolarHBondContact CG-O 3.44Å; I207-M288 HydrophobicContact CB-SD 4.32Å; I207-M288 HydrophobicContact CG2-CE 4.28Å; I207-M288 HydrophobicContact CG2-SD 3.96Å; V284-M288 HydrophobicContact CG1-CG 4.12Å; V284-M288 HydrophobicContact CG1-SD 3.83Å; V284-M288 WeakPolarHBondContact O-CB 3.26Å; V284-M288 VanDerWaalsContact O-CG 3.28Å; V284-M288 WeakPolarHBondContact O-CG 3.43Å; V284-M288 PolarHBondContact O-N 3.36Å; R285-M288 PolarHBondContact O-N 3.48Å; M288-H292 VanDerWaalsContact O-CA 3.29Å; M288-H292 WeakPolarHBondContact O-CA 3.32Å; M288-H292 PolarHBondContact O-N 3.39Å; M288-I293 WeakPolarHBondContact CG-O 3.38Å; M288-F295 HydrophobicContact CE-CB 4.2Å; M288-F295 HydrophobicContact SD-CB 3.78Å; M288-F295 HydrophobicContact SD-CD2 3.95Å; M288-F295 HydrophobicContact SD-CG 4.37Å
289Q94.5Very high93.9Very high0 Ų031.8 Ų31.80%016%0.161CC..Hα-helixtrans-73.1-37.8-178.9-78.4-179.3-41.200112.7V134 Q137 H138 K203 S208 R285 V286V134-Q289 HydrophobicContact CG2-CB 3.99Å; V134-Q289 HydrophobicContact CG2-CG 3.94Å; Q137-Q289 VanDerWaalsContact OE1-OE1 3.1Å; H138-Q289 PolarHBondContact CE1-O 3.38Å; H138-Q289 VanDerWaalsContact CE1-O 3.32Å; K203-Q289 WeakPolarHBondContact O-CG 3.37Å; S208-Q289 PolarHBondContact OG-NE2 2.85Å; R285-Q289 HydrophobicContact CG-CG 4.49Å; R285-Q289 WeakPolarHBondContact O-CB 3.49Å; R285-Q289 WeakPolarHBondContact O-CG 3.3Å; R285-Q289 PolarHBondContact O-N 3.49Å; V286-Q289 PolarHBondContact O-N 2.89Å
290V93.3Very high93.8Very high1 Ų135 Ų351%0.00618%0.178CC..Hα-helixtrans-97-44.6-175.8174.50000113.3L48 Q137 H138 V141 T169 V286 H292L48-V290 HydrophobicContact CD1-CB 3.93Å; L48-V290 HydrophobicContact CD1-CG1 3.83Å; L48-V290 HydrophobicContact CD1-CG2 3.88Å; L48-V290 HydrophobicContact CD2-CB 3.84Å; L48-V290 HydrophobicContact CD2-CG1 4.11Å; L48-V290 HydrophobicContact CD2-CG2 4.47Å; Q137-V290 HydrophobicContact CB-CG2 3.36Å; Q137-V290 HydrophobicContact CG-CG2 4.39Å; H138-V290 PolarHBondContact NE2-O 2.88Å; H138-V290 VanDerWaalsContact NE2-O 3.14Å; V141-V290 HydrophobicContact CG2-CG1 4.11Å; T169-V290 HydrophobicContact CG2-CG1 3.23Å; V286-V290 WeakPolarHBondContact O-CB 3.31Å; V286-V290 PolarHBondContact O-N 3.46Å; V290-H292 VanDerWaalsContact C-N 3.31Å; V290-H292 PolarHBondContact O-CD2 2.87Å
291S90.3Very high93.5Very high39 Ų3935.4 Ų35.427%0.27318%0.178SC..SBendtrans-87.7-3.4-179.5-480000112.6R287 I293R287-S291 WeakPolarHBondContact O-CA 3.41Å; R287-S291 VanDerWaalsContact O-CB 3.23Å; R287-S291 WeakPolarHBondContact O-CB 3.46Å; R287-S291 PolarHBondContact O-N 3.34Å; S291-I293 PolarHBondContact O-N 3.13Å
292H91.5Very high93.4Very high20 Ų2032.7 Ų32.79%0.09316%0.164CC..  trans54.915.9-179.9-71.3-89.6000116.2H138 H196 G200 K203 M288 V290H138-H292 AromaticContact CE1-CD2 4Å; H138-H292 AromaticContact CE1-NE2 3.43Å; H138-H292 PolarHBondContact CE1-NE2 3.48Å; H138-H292 AromaticContact NE2-CD2 3.9Å; H138-H292 AromaticContact NE2-NE2 3.66Å; H196-H292 AromaticContact CD2-CD2 3.3Å; H196-H292 PolarHBondContact CD2-CD2 2.67Å; H196-H292 AromaticContact CD2-CE1 3.6Å; H196-H292 AromaticContact CD2-CG 3.38Å; H196-H292 AromaticContact CD2-ND1 3.56Å; H196-H292 AromaticContact CD2-NE2 3.44Å; H196-H292 PolarHBondContact CD2-NE2 2.93Å; H196-H292 AromaticContact CE1-CG 3.76Å; H196-H292 AromaticContact CG-CG 3.91Å; H196-H292 AromaticContact CG-ND1 3.8Å; H196-H292 WeakPolarHBondContact NE2-CB 3.17Å; H196-H292 AromaticContact NE2-CD2 3.25Å; H196-H292 PolarHBondContact NE2-CD2 3.35Å; H196-H292 VanDerWaalsContact NE2-CD2 3.25Å; H196-H292 AromaticContact NE2-CG 3.27Å; H196-H292 VanDerWaalsContact NE2-CG 3.27Å; H196-H292 AromaticContact NE2-ND1 3.94Å; H196-H292 AromaticContact NE2-NE2 3.92Å; G200-H292 PolarHBondContact O-CE1 3.45Å; G200-H292 VanDerWaalsContact O-CE1 3.23Å; K203-H292 WeakPolarHBondContact CE-O 3.46Å; K203-H292 PolarHBondContact NZ-O 3.25Å; M288-H292 VanDerWaalsContact O-CA 3.29Å; M288-H292 WeakPolarHBondContact O-CA 3.32Å; M288-H292 PolarHBondContact O-N 3.39Å; V290-H292 VanDerWaalsContact C-N 3.31Å; V290-H292 PolarHBondContact O-CD2 2.87Å
293I91Very high93.3Very high28 Ų2839.5 Ų39.514%0.14419%0.189CC..  trans-76.4152.5178.557.6179.6000112.3K203 R287 M288 S291K203-I293 WeakPolarHBondContact CE-O 3.39Å; R287-I293 HydrophobicContact CB-CD1 4.49Å; M288-I293 WeakPolarHBondContact CG-O 3.38Å; S291-I293 PolarHBondContact O-N 3.13Å
294P93.2Very high92.9Very high61 Ų6145.9 Ų45.940%0.39622%0.219SC..  trans-71.5156.8174.328.9-32.7000111.8K296 Q297 S298P294-K296 PolarHBondContact O-N 3.4Å; P294-Q297 HydrophobicContact CG-CB 3.75Å; P294-Q297 PolarHBondContact O-N 3.27Å; P294-Q297 VanDerWaalsContact O-N 3.14Å; P294-S298 PolarHBondContact O-N 3.48Å
295F94.2Very high92.5Very high102 Ų10251.3 Ų51.345%0.44724%0.242SC..Hα-helixtrans-50.9-53-177179.6-90000112.7I207 V284 M288 Q297 S298 V299I207-F295 HydrophobicContact CD1-CD2 4.24Å; I207-F295 HydrophobicContact CD1-CE2 3.96Å; V284-F295 HydrophobicContact CB-CE2 4.44Å; V284-F295 HydrophobicContact CG1-CD2 3.48Å; V284-F295 VanDerWaalsContact CG1-CD2 3.48Å; V284-F295 HydrophobicContact CG1-CE2 3.66Å; V284-F295 HydrophobicContact CG1-CG 4.39Å; M288-F295 HydrophobicContact CE-CB 4.2Å; M288-F295 HydrophobicContact SD-CB 3.78Å; M288-F295 HydrophobicContact SD-CD2 3.95Å; M288-F295 HydrophobicContact SD-CG 4.37Å; F295-Q297 VanDerWaalsContact C-N 3.31Å; F295-Q297 PolarHBondContact O-N 3.22Å; F295-S298 WeakPolarHBondContact O-CB 3.5Å; F295-S298 PolarHBondContact O-N 3.05Å; F295-S298 VanDerWaalsContact O-N 3.12Å; F295-V299 HydrophobicContact CD1-CG2 4.31Å; F295-V299 HydrophobicContact CE1-CG2 3.9Å; F295-V299 HydrophobicContact CE2-CG2 4.47Å; F295-V299 HydrophobicContact CZ-CG2 3.99Å; F295-V299 WeakPolarHBondContact O-CG2 3.11Å; F295-V299 PolarHBondContact O-N 2.85Å
296K94.5Very high92Very high159 Ų15952.3 Ų52.369%0.69125%0.247SC*.Hα-helixtrans-55.3-46-179.6-176.2179.1179.1-178.90111.7P294 V299 I300P294-K296 PolarHBondContact O-N 3.4Å; K296-V299 PolarHBondContact O-N 3.3Å; K296-I300 HydrophobicContact CG-CD1 3.85Å; K296-I300 VanDerWaalsContact O-CG1 3.26Å; K296-I300 WeakPolarHBondContact O-CG1 3.46Å; K296-I300 PolarHBondContact O-N 3.47Å
297Q93.5Very high91.8Very high86 Ų8653.3 Ų53.340%0.40226%0.259SS..Hα-helixtrans-70.3-36.2-179.7-170.8163.38.200112.3P294 F295 V299 I300 H301P294-Q297 HydrophobicContact CG-CB 3.75Å; P294-Q297 PolarHBondContact O-N 3.27Å; P294-Q297 VanDerWaalsContact O-N 3.14Å; F295-Q297 VanDerWaalsContact C-N 3.31Å; F295-Q297 PolarHBondContact O-N 3.22Å; Q297-V299 VanDerWaalsContact C-N 3.34Å; Q297-V299 PolarHBondContact O-N 3.28Å; Q297-I300 PolarHBondContact O-N 3.47Å; Q297-H301 WeakPolarHBondContact CG-NE2 3.4Å; Q297-H301 PolarHBondContact NE2-NE2 3.43Å; Q297-H301 WeakPolarHBondContact O-CB 3.37Å; Q297-H301 PolarHBondContact O-CD2 3.42Å; Q297-H301 PolarHBondContact O-N 3.4Å
298S92.5Very high91.6Very high0 Ų058.9 Ų58.90%029%0.287CS..Hα-helixtrans-59-46.1173.3-172.80000111.7R287 P294 F295 L302R287-S298 WeakPolarHBondContact CB-OG 3.17Å; P294-S298 PolarHBondContact O-N 3.48Å; F295-S298 WeakPolarHBondContact O-CB 3.5Å; F295-S298 PolarHBondContact O-N 3.05Å; F295-S298 VanDerWaalsContact O-N 3.12Å; S298-L302 WeakPolarHBondContact O-CB 3.38Å; S298-L302 VanDerWaalsContact O-CG 3.24Å; S298-L302 WeakPolarHBondContact O-CG 3.36Å; S298-L302 PolarHBondContact O-N 3.21Å
299V94.6Very high91.3Very high44 Ų4467.2 Ų67.227%0.26732%0.318SS..Hα-helixtrans-66.1-44.8178.9175.60000111.2V284 F295 K296 Q297 H301 L302 W303V284-V299 HydrophobicContact CG2-CG2 4.06Å; F295-V299 HydrophobicContact CD1-CG2 4.31Å; F295-V299 HydrophobicContact CE1-CG2 3.9Å; F295-V299 HydrophobicContact CE2-CG2 4.47Å; F295-V299 HydrophobicContact CZ-CG2 3.99Å; F295-V299 WeakPolarHBondContact O-CG2 3.11Å; F295-V299 PolarHBondContact O-N 2.85Å; K296-V299 PolarHBondContact O-N 3.3Å; Q297-V299 VanDerWaalsContact C-N 3.34Å; Q297-V299 PolarHBondContact O-N 3.28Å; V299-H301 PolarHBondContact O-N 2.89Å; V299-L302 PolarHBondContact O-N 3.17Å; V299-W303 WeakPolarHBondContact O-CB 3.43Å; V299-W303 PolarHBondContact O-N 2.72Å
300I93.5Very high91.1Very high69 Ų6968 Ų6835%0.35432%0.321SS..Hα-helixtrans-59.9-47.6177.8-69.6167.2000110.8K296 Q297 L302 W303 Q304K296-I300 HydrophobicContact CG-CD1 3.85Å; K296-I300 VanDerWaalsContact O-CG1 3.26Å; K296-I300 WeakPolarHBondContact O-CG1 3.46Å; K296-I300 PolarHBondContact O-N 3.47Å; Q297-I300 PolarHBondContact O-N 3.47Å; I300-L302 PolarHBondContact O-N 3Å; I300-W303 PolarHBondContact O-N 2.9Å; I300-Q304 HydrophobicContact CG2-CG 4.24Å; I300-Q304 WeakPolarHBondContact O-CB 3.48Å; I300-Q304 VanDerWaalsContact O-CG 3.3Å; I300-Q304 WeakPolarHBondContact O-CG 3.49Å; I300-Q304 PolarHBondContact O-N 3.46Å
301H89.4Confident91Very high28 Ų2872.3 Ų72.313%0.1334%0.339CS..Hα-helixtrans-61.5-44.8178-74.7-162.2000111.3Q297 V299 W303 Q304 F305Q297-H301 WeakPolarHBondContact CG-NE2 3.4Å; Q297-H301 PolarHBondContact NE2-NE2 3.43Å; Q297-H301 WeakPolarHBondContact O-CB 3.37Å; Q297-H301 PolarHBondContact O-CD2 3.42Å; Q297-H301 PolarHBondContact O-N 3.4Å; V299-H301 PolarHBondContact O-N 2.89Å; H301-W303 VanDerWaalsContact C-N 3.32Å; H301-W303 PolarHBondContact O-N 3.2Å; H301-Q304 PolarHBondContact O-N 2.93Å; H301-F305 HydrophobicContact CB-CD2 4.38Å; H301-F305 VanDerWaalsContact O-CD2 3.23Å; H301-F305 WeakPolarHBondContact O-CD2 3.16Å; H301-F305 PolarHBondContact O-N 3.42Å
302L91.4Very high91.2Very high1 Ų173.7 Ų73.71%0.00535%0.349CS..Hα-helixtrans-59.7-43.6177.1-75.1169.2000111.8V283 V284 S298 V299 I300 E306 W310 K313V283-L302 HydrophobicContact CG1-CD1 3.83Å; V283-L302 HydrophobicContact CG1-CD2 4.04Å; V284-L302 HydrophobicContact CG2-CD1 4Å; S298-L302 WeakPolarHBondContact O-CB 3.38Å; S298-L302 VanDerWaalsContact O-CG 3.24Å; S298-L302 WeakPolarHBondContact O-CG 3.36Å; S298-L302 PolarHBondContact O-N 3.21Å; V299-L302 PolarHBondContact O-N 3.17Å; I300-L302 PolarHBondContact O-N 3Å; L302-E306 WeakPolarHBondContact O-CB 3.24Å; L302-E306 PolarHBondContact O-N 3.3Å; L302-W310 HydrophobicContact CB-CB 4.07Å; L302-W310 HydrophobicContact CB-CD2 4.08Å; L302-W310 HydrophobicContact CB-CE3 4.48Å; L302-W310 HydrophobicContact CB-CG 3.86Å; L302-W310 HydrophobicContact CD1-CD2 4.17Å; L302-W310 HydrophobicContact CD1-CE3 3.73Å; L302-W310 HydrophobicContact CD1-CZ3 4.04Å; L302-W310 HydrophobicContact CD2-CB 4.08Å; L302-K313 HydrophobicContact CD2-CD 4.45Å
303W92.2Very high91.1Very high150 Ų15073.4 Ų73.457%0.56835%0.348SS*.Hα-helixtrans-65-44.4177.8-170.3-95.4000112.4V299 I300 H301 G307 W310V299-W303 WeakPolarHBondContact O-CB 3.43Å; V299-W303 PolarHBondContact O-N 2.72Å; I300-W303 PolarHBondContact O-N 2.9Å; H301-W303 VanDerWaalsContact C-N 3.32Å; H301-W303 PolarHBondContact O-N 3.2Å; W303-G307 VanDerWaalsContact O-CA 3.27Å; W303-G307 WeakPolarHBondContact O-CA 3.26Å; W303-G307 PolarHBondContact O-N 2.92Å; W303-W310 AromaticContact CE3-NE1 3.81Å
304Q88.9Confident91.2Very high135 Ų13572.4 Ų72.463%0.63134%0.344SS*.Hα-helixtrans-66.8-42-178.5-75176.2-20.600112.9I300 H301I300-Q304 HydrophobicContact CG2-CG 4.24Å; I300-Q304 WeakPolarHBondContact O-CB 3.48Å; I300-Q304 VanDerWaalsContact O-CG 3.3Å; I300-Q304 WeakPolarHBondContact O-CG 3.49Å; I300-Q304 PolarHBondContact O-N 3.46Å; H301-Q304 PolarHBondContact O-N 2.93Å
305F85.4Confident91.3Very high116 Ų11670.9 Ų70.951%0.50933%0.332SS..Hα-helixtrans-88.1-26.5-175.6-73-72.9000113.9H301H301-F305 HydrophobicContact CB-CD2 4.38Å; H301-F305 VanDerWaalsContact O-CD2 3.23Å; H301-F305 WeakPolarHBondContact O-CD2 3.16Å; H301-F305 PolarHBondContact O-N 3.42Å
306E86Confident91.3Very high32 Ų3268.7 Ų68.715%0.1533%0.329CS..Hα-helixtrans-125.1-14.4-172.4-64.8-178.6-164.700114.8G51 L302 I308 R309 W310 K313G51-E306 PolarHBondContact N-OE1 3.11Å; G51-E306 VanDerWaalsContact N-OE1 3.1Å; L302-E306 WeakPolarHBondContact O-CB 3.24Å; L302-E306 PolarHBondContact O-N 3.3Å; E306-I308 PolarHBondContact O-N 2.89Å; E306-R309 PolarHBondContact O-N 3.49Å; E306-W310 HydrophobicContact CB-CB 3.96Å; E306-W310 VanDerWaalsContact OE2-CA 3.29Å; E306-W310 WeakPolarHBondContact OE2-CA 3.21Å; E306-W310 VanDerWaalsContact OE2-CB 3.3Å; E306-W310 WeakPolarHBondContact OE2-CB 3.17Å; E306-K313 WeakPolarHBondContact OE1-CE 3.44Å; E306-K313 IonicContact OE1-NZ 3.98Å; E306-K313 PolarHBondContact OE1-NZ 3.27Å; E306-K313 WeakPolarHBondContact OE2-CD 3.38Å; E306-K313 IonicContact OE2-NZ 3.06Å
307G89.5Confident91.3Very high24 Ų2461.1 Ų61.125%0.24730%0.296CS..G310 helixtrans54.9-138.4-174.500000111.3W303 R309W303-G307 VanDerWaalsContact O-CA 3.27Å; W303-G307 WeakPolarHBondContact O-CA 3.26Å; W303-G307 PolarHBondContact O-N 2.92Å; G307-R309 PolarHBondContact O-N 3.26Å; G307-R309 VanDerWaalsContact O-N 3.09Å
308I89.5Confident91.3Very high120 Ų12059.5 Ų59.562%0.61529%0.287SS*.G310 helixtrans-64.6-18.7-177-163.159.3000114.4E306 W310 F311E306-I308 PolarHBondContact O-N 2.89Å; I308-W310 PolarHBondContact O-N 3.49Å; I308-F311 HydrophobicContact CD1-CD2 4.01Å; I308-F311 HydrophobicContact CD1-CE2 4.07Å
309R88.1Confident91.5Very high197 Ų19761.8 Ų61.874%0.74330%0.299SS*.G310 helixtrans-69.5-20.6-173.4-67.4179.6175.3163.2-0.9113.3E306 G307 F311 S312E306-R309 PolarHBondContact O-N 3.49Å; G307-R309 PolarHBondContact O-N 3.26Å; G307-R309 VanDerWaalsContact O-N 3.09Å; R309-F311 PolarHBondContact O-N 2.91Å; R309-S312 PolarHBondContact O-N 3.44Å; R309-S312 PolarHBondContact O-OG 3.31Å
310W90.2Very high91.5Very high17 Ų1762.6 Ų62.66%0.06430%0.301CS..G310 helixtrans-63.2-26.4-177.577.2-105.1000113.4P280 V283 V284 L302 W303 E306 I308 S312 K313P280-W310 HydrophobicContact CB-CE3 4.5Å; P280-W310 HydrophobicContact CB-CH2 3.74Å; P280-W310 HydrophobicContact CB-CZ3 3.6Å; V283-W310 HydrophobicContact CB-CE3 4.48Å; V283-W310 HydrophobicContact CG1-CE3 4.31Å; V284-W310 HydrophobicContact CG2-CH2 4.37Å; V284-W310 HydrophobicContact CG2-CZ3 4.09Å; L302-W310 HydrophobicContact CB-CB 4.07Å; L302-W310 HydrophobicContact CB-CD2 4.08Å; L302-W310 HydrophobicContact CB-CE3 4.48Å; L302-W310 HydrophobicContact CB-CG 3.86Å; L302-W310 HydrophobicContact CD1-CD2 4.17Å; L302-W310 HydrophobicContact CD1-CE3 3.73Å; L302-W310 HydrophobicContact CD1-CZ3 4.04Å; L302-W310 HydrophobicContact CD2-CB 4.08Å; W303-W310 AromaticContact CE3-NE1 3.81Å; E306-W310 HydrophobicContact CB-CB 3.96Å; E306-W310 VanDerWaalsContact OE2-CA 3.29Å; E306-W310 WeakPolarHBondContact OE2-CA 3.21Å; E306-W310 VanDerWaalsContact OE2-CB 3.3Å; E306-W310 WeakPolarHBondContact OE2-CB 3.17Å; I308-W310 PolarHBondContact O-N 3.49Å; W310-S312 PolarHBondContact O-N 3.49Å; W310-K313 WeakPolarHBondContact O-CB 2.95Å; W310-K313 PolarHBondContact O-N 2.76Å
311F92.4Very high91.5Very high90 Ų9059.9 Ų59.940%0.39529%0.287SS..G310 helixtrans-59-30.6174.8-77.2-98.8000112.5N279 P280 I308 R309N279-F311 PolarHBondContact ND2-O 3.31Å; P280-F311 HydrophobicContact CB-CD1 3.92Å; P280-F311 HydrophobicContact CB-CE1 4.13Å; P280-F311 HydrophobicContact CG-CB 4.4Å; P280-F311 HydrophobicContact CG-CD1 3.34Å; P280-F311 HydrophobicContact CG-CE1 3.91Å; P280-F311 HydrophobicContact CG-CG 4.19Å; I308-F311 HydrophobicContact CD1-CD2 4.01Å; I308-F311 HydrophobicContact CD1-CE2 4.07Å; R309-F311 PolarHBondContact O-N 2.91Å
312S92.5Very high91.6Very high68 Ų6859.3 Ų59.348%0.47629%0.285SS..G310 helixtrans-93.62.1179.570.70000113.8R309 W310 G314 L315R309-S312 PolarHBondContact O-N 3.44Å; R309-S312 PolarHBondContact O-OG 3.31Å; W310-S312 PolarHBondContact O-N 3.49Å; S312-G314 PolarHBondContact O-N 3.33Å; S312-L315 WeakPolarHBondContact O-CB 3.42Å; S312-L315 PolarHBondContact O-N 3.05Å
313K91.3Very high91.7Very high15 Ų1560.7 Ų60.77%0.06529%0.293CS..THydrogen-bonded Turntrans-68.5126.1-171.9-164-174.9-167.4170.30111.7L46 Q47 Q49 N279 V283 L302 E306 W310 L315L46-K313 WeakPolarHBondContact O-CD 3.43Å; L46-K313 WeakPolarHBondContact O-CE 3.28Å; L46-K313 WeakPolarHBondContact O-CG 3.21Å; Q47-K313 WeakPolarHBondContact O-CD 3.32Å; Q47-K313 WeakPolarHBondContact O-CE 3.46Å; Q47-K313 PolarHBondContact O-NZ 3.29Å; Q49-K313 WeakPolarHBondContact O-CE 3.21Å; Q49-K313 PolarHBondContact O-NZ 3.31Å; N279-K313 PolarHBondContact ND2-O 3.01Å; V283-K313 HydrophobicContact CG1-CD 4.14Å; V283-K313 HydrophobicContact CG2-CB 4.14Å; V283-K313 WeakPolarHBondContact CG2-O 3.43Å; L302-K313 HydrophobicContact CD2-CD 4.45Å; E306-K313 WeakPolarHBondContact OE1-CE 3.44Å; E306-K313 IonicContact OE1-NZ 3.98Å; E306-K313 PolarHBondContact OE1-NZ 3.27Å; E306-K313 WeakPolarHBondContact OE2-CD 3.38Å; E306-K313 IonicContact OE2-NZ 3.06Å; W310-K313 WeakPolarHBondContact O-CB 2.95Å; W310-K313 PolarHBondContact O-N 2.76Å; K313-L315 PolarHBondContact O-N 3.42Å; K313-L315 VanDerWaalsContact O-N 3.16Å
314G92.5Very high91.7Very high6 Ų659.3 Ų59.36%0.06229%0.292CS..THydrogen-bonded Turntrans67.44-173.700000114.6S312 S316 A317 R318S312-G314 PolarHBondContact O-N 3.33Å; G314-S316 VanDerWaalsContact C-N 3.34Å; G314-S316 PolarHBondContact O-N 2.85Å; G314-A317 PolarHBondContact O-N 3.39Å; G314-R318 PolarHBondContact O-N 2.91Å; G314-R318 VanDerWaalsContact O-N 3.11Å
315L94.3Very high91.7Very high30 Ų3056.3 Ų56.316%0.15728%0.278CS..Hα-helixtrans-63-39.9-176.8-176.661.3000111.3I276 N279 S312 K313 A317 R318 L319I276-L315 HydrophobicContact CG1-CD1 4.3Å; I276-L315 HydrophobicContact CG1-CD2 4.42Å; N279-L315 HydrophobicContact CB-CD1 4.07Å; S312-L315 WeakPolarHBondContact O-CB 3.42Å; S312-L315 PolarHBondContact O-N 3.05Å; K313-L315 PolarHBondContact O-N 3.42Å; K313-L315 VanDerWaalsContact O-N 3.16Å; L315-A317 PolarHBondContact O-N 3.5Å; L315-R318 CarbonylContact O-C 3.6Å; L315-R318 WeakPolarHBondContact O-CA 3.39Å; L315-R318 WeakPolarHBondContact O-CB 3.41Å; L315-R318 PolarHBondContact O-N 3.3Å; L315-R318 VanDerWaalsContact O-N 3.08Å; L315-L319 HydrophobicContact CD1-CD1 4.42Å; L315-L319 HydrophobicContact CD1-CD2 4.03Å; L315-L319 HydrophobicContact CD1-CG 3.97Å; L315-L319 HydrophobicContact CG-CD1 4.01Å; L315-L319 HydrophobicContact CG-CG 4Å; L315-L319 VanDerWaalsContact O-CG 3.29Å; L315-L319 WeakPolarHBondContact O-CG 3.35Å; L315-L319 PolarHBondContact O-N 3.13Å
316S94.6Very high91.8Very high55 Ų5551 Ų5139%0.38526%0.255SS..Hα-helixtrans-56.6-48.3178.152.60000112.9G314 R318 L319 I320G314-S316 VanDerWaalsContact C-N 3.34Å; G314-S316 PolarHBondContact O-N 2.85Å; S316-R318 VanDerWaalsContact C-N 3.31Å; S316-R318 PolarHBondContact O-N 3.45Å; S316-L319 PolarHBondContact O-N 3.23Å; S316-I320 WeakPolarHBondContact O-CG1 3.18Å; S316-I320 PolarHBondContact O-N 3.48Å
317A94.9Very high91.9Very high0 Ų053.1 Ų53.10%026%0.264CS..Hα-helixtrans-62.9-39.6175.700000111.5R43 L46 L58 G314 L315 Q321R43-A317 HydrophobicContact CB-CB 3.76Å; R43-A317 HydrophobicContact CG-CB 4.43Å; L46-A317 HydrophobicContact CD1-CB 4.39Å; L58-A317 HydrophobicContact CD1-CB 3.97Å; L58-A317 HydrophobicContact CD2-CB 4.36Å; G314-A317 PolarHBondContact O-N 3.39Å; L315-A317 PolarHBondContact O-N 3.5Å; A317-Q321 VanDerWaalsContact O-CB 3.24Å; A317-Q321 WeakPolarHBondContact O-CB 3.06Å; A317-Q321 PolarHBondContact O-N 2.9Å
318R94.1Very high91.8Very high53 Ų5355.4 Ų55.420%0.227%0.265CS..Hα-helixtrans-64.7-43.8177.4-177.754.5163.8-178.22.6112.5A275 G314 L315 S316 Q321 T322A275-R318 HydrophobicContact CB-CG 3.81Å; G314-R318 PolarHBondContact O-N 2.91Å; G314-R318 VanDerWaalsContact O-N 3.11Å; L315-R318 CarbonylContact O-C 3.6Å; L315-R318 WeakPolarHBondContact O-CA 3.39Å; L315-R318 WeakPolarHBondContact O-CB 3.41Å; L315-R318 PolarHBondContact O-N 3.3Å; L315-R318 VanDerWaalsContact O-N 3.08Å; S316-R318 VanDerWaalsContact C-N 3.31Å; S316-R318 PolarHBondContact O-N 3.45Å; R318-Q321 PolarHBondContact O-N 2.94Å; R318-T322 WeakPolarHBondContact O-CB 3.44Å; R318-T322 PolarHBondContact O-N 2.66Å; R318-T322 PolarHBondContact O-OG1 2.93Å
319L95.8Very high91.4Very high48 Ų4852 Ų5225%0.25125%0.249SC..Hα-helixtrans-65.2-45-178.8-68.7-178.4000111.2I272 A275 I276 L315 S316 T322 T323I272-L319 HydrophobicContact CB-CD2 4.19Å; I272-L319 HydrophobicContact CG1-CD2 4.12Å; I272-L319 HydrophobicContact CG2-CD2 3.88Å; A275-L319 HydrophobicContact CB-CD2 4.15Å; I276-L319 HydrophobicContact CG1-CD2 4.35Å; L315-L319 HydrophobicContact CD1-CD1 4.42Å; L315-L319 HydrophobicContact CD1-CD2 4.03Å; L315-L319 HydrophobicContact CD1-CG 3.97Å; L315-L319 HydrophobicContact CG-CD1 4.01Å; L315-L319 HydrophobicContact CG-CG 4Å; L315-L319 VanDerWaalsContact O-CG 3.29Å; L315-L319 WeakPolarHBondContact O-CG 3.35Å; L315-L319 PolarHBondContact O-N 3.13Å; S316-L319 PolarHBondContact O-N 3.23Å; L319-T322 PolarHBondContact O-N 2.93Å; L319-T323 VanDerWaalsContact O-CB 3.28Å; L319-T323 WeakPolarHBondContact O-CB 3.1Å; L319-T323 PolarHBondContact O-N 3.49Å; L319-T323 PolarHBondContact O-OG1 2.86Å
320I94.8Very high91Very high60 Ų6042.9 Ų42.931%0.30822%0.216SC..Hα-helixtrans-60.8-51.7174.8-66.3169.7000109.3F39 L58 S316 T322 T323 F324F39-I320 HydrophobicContact CD1-CB 4.29Å; F39-I320 HydrophobicContact CD1-CG2 3.95Å; F39-I320 HydrophobicContact CD2-CG2 4.5Å; F39-I320 HydrophobicContact CE1-CB 4.15Å; F39-I320 HydrophobicContact CE1-CD1 4.29Å; F39-I320 HydrophobicContact CE1-CG2 3.47Å; F39-I320 VanDerWaalsContact CE1-CG2 3.47Å; F39-I320 HydrophobicContact CE2-CG2 4.07Å; F39-I320 HydrophobicContact CG-CG2 4.44Å; F39-I320 HydrophobicContact CZ-CG2 3.54Å; L58-I320 HydrophobicContact CD2-CD1 3.52Å; S316-I320 WeakPolarHBondContact O-CG1 3.18Å; S316-I320 PolarHBondContact O-N 3.48Å; I320-T322 PolarHBondContact O-N 3.35Å; I320-T323 PolarHBondContact O-N 2.81Å; I320-F324 HydrophobicContact CG2-CD2 3.66Å; I320-F324 HydrophobicContact CG2-CE2 3.75Å; I320-F324 VanDerWaalsContact O-CD2 3.31Å; I320-F324 WeakPolarHBondContact O-CD2 3.45Å; I320-F324 PolarHBondContact O-N 3.32Å
321Q94.1Very high90.5Very high13 Ų1346.4 Ų46.46%0.06124%0.235CC..Hα-helixtrans-52.5-52.2179-171.8-161.813.700112.2L36 F39 A317 R318 F324 H325L36-Q321 HydrophobicContact CB-CG 4.27Å; F39-Q321 HydrophobicContact CB-CB 3.96Å; F39-Q321 HydrophobicContact CB-CG 4.3Å; A317-Q321 VanDerWaalsContact O-CB 3.24Å; A317-Q321 WeakPolarHBondContact O-CB 3.06Å; A317-Q321 PolarHBondContact O-N 2.9Å; R318-Q321 PolarHBondContact O-N 2.94Å; Q321-F324 PolarHBondContact O-N 2.85Å; Q321-H325 VanDerWaalsContact O-CB 3.29Å; Q321-H325 WeakPolarHBondContact O-CB 3.36Å; Q321-H325 PolarHBondContact O-N 2.68Å
322T91.7Very high89.9Confident15 Ų1544.4 Ų44.49%0.09223%0.231CC..Hα-helixtrans-67.4-37.9-176.1-56.50000111.7R318 L319 I320 H325 S326R318-T322 WeakPolarHBondContact O-CB 3.44Å; R318-T322 PolarHBondContact O-N 2.66Å; R318-T322 PolarHBondContact O-OG1 2.93Å; L319-T322 PolarHBondContact O-N 2.93Å; I320-T322 PolarHBondContact O-N 3.35Å; T322-H325 PolarHBondContact O-N 2.84Å; T322-S326 PolarHBondContact O-N 2.87Å; T322-S326 PolarHBondContact O-OG 3.05Å; T322-S326 VanDerWaalsContact O-OG 3.14Å
323T92Very high89.1Confident30 Ų3045.9 Ų45.918%0.18423%0.226CC..Hα-helixtrans-61-52.7177-59.70000110.6P268 L319 I320 H325 S326 F327P268-T323 HydrophobicContact CB-CG2 4.4Å; L319-T323 VanDerWaalsContact O-CB 3.28Å; L319-T323 WeakPolarHBondContact O-CB 3.1Å; L319-T323 PolarHBondContact O-N 3.49Å; L319-T323 PolarHBondContact O-OG1 2.86Å; I320-T323 PolarHBondContact O-N 2.81Å; T323-H325 VanDerWaalsContact C-N 3.31Å; T323-H325 PolarHBondContact O-N 3.38Å; T323-S326 PolarHBondContact O-N 3.46Å; T323-F327 HydrophobicContact CG2-CD2 3.78Å; T323-F327 HydrophobicContact CG2-CE2 3.5Å; T323-F327 WeakPolarHBondContact O-CD2 3.27Å; T323-F327 PolarHBondContact O-N 2.98Å
324F92.1Very high88.3Confident122 Ų12246.1 Ų46.154%0.53523%0.228SC..Hα-helixtrans-65.1-34.8177.8-81.6-88.7000112.7L36 I320 Q321 F327 W328L36-F324 HydrophobicContact CD2-CB 3.55Å; L36-F324 HydrophobicContact CD2-CG 4.48Å; I320-F324 HydrophobicContact CG2-CD2 3.66Å; I320-F324 HydrophobicContact CG2-CE2 3.75Å; I320-F324 VanDerWaalsContact O-CD2 3.31Å; I320-F324 WeakPolarHBondContact O-CD2 3.45Å; I320-F324 PolarHBondContact O-N 3.32Å; Q321-F324 PolarHBondContact O-N 2.85Å; F324-F327 PolarHBondContact O-N 2.84Å; F324-W328 WeakPolarHBondContact O-CB 3.27Å; F324-W328 PolarHBondContact O-N 3.5Å
325H90.6Very high87.5Confident72 Ų7249 Ų4933%0.33325%0.245SC..Hα-helixtrans-60.9-46.7173.2-174.761.5000111.6L36 Q321 T322 T323 W328 V329L36-H325 HydrophobicContact CD1-CB 3.66Å; Q321-H325 VanDerWaalsContact O-CB 3.29Å; Q321-H325 WeakPolarHBondContact O-CB 3.36Å; Q321-H325 PolarHBondContact O-N 2.68Å; T322-H325 PolarHBondContact O-N 2.84Å; T323-H325 VanDerWaalsContact C-N 3.31Å; T323-H325 PolarHBondContact O-N 3.38Å; H325-W328 PolarHBondContact O-N 3.49Å; H325-V329 WeakPolarHBondContact O-CG2 3.23Å; H325-V329 PolarHBondContact O-N 2.94Å
326S87.2Confident86.7Confident4 Ų448.2 Ų48.23%0.02824%0.241CC..Hα-helixtrans-62.2-43.7177.5-66.20000111.9A267 T322 T323 W328 V329 V330A267-S326 PolarHBondContact O-OG 3.28Å; A267-S326 VanDerWaalsContact O-OG 3.04Å; T322-S326 PolarHBondContact O-N 2.87Å; T322-S326 PolarHBondContact O-OG 3.05Å; T322-S326 VanDerWaalsContact O-OG 3.14Å; T323-S326 PolarHBondContact O-N 3.46Å; S326-W328 PolarHBondContact O-N 3.04Å; S326-V329 PolarHBondContact O-N 3.29Å; S326-V330 WeakPolarHBondContact O-CG2 3.35Å; S326-V330 PolarHBondContact O-N 3.23Å
327F87.2Confident85.9Confident76 Ų7646.8 Ų46.833%0.33323%0.228SC..Hα-helixtrans-59.1-46173.5-81.2-68.3000111.9L264 P268 T323 F324 V330 L331L264-F327 HydrophobicContact CD1-CD1 3.45Å; L264-F327 VanDerWaalsContact CD1-CD1 3.45Å; L264-F327 HydrophobicContact CD1-CE1 3.75Å; L264-F327 HydrophobicContact CD2-CE1 4.11Å; L264-F327 HydrophobicContact CG-CD1 3.91Å; L264-F327 HydrophobicContact CG-CE1 3.63Å; P268-F327 HydrophobicContact CG-CD2 4.46Å; P268-F327 HydrophobicContact CG-CE2 4.19Å; P268-F327 HydrophobicContact CG-CZ 4.33Å; T323-F327 HydrophobicContact CG2-CD2 3.78Å; T323-F327 HydrophobicContact CG2-CE2 3.5Å; T323-F327 WeakPolarHBondContact O-CD2 3.27Å; T323-F327 PolarHBondContact O-N 2.98Å; F324-F327 PolarHBondContact O-N 2.84Å; F327-V330 PolarHBondContact O-N 3.43Å; F327-L331 VanDerWaalsContact O-CB 3.24Å; F327-L331 WeakPolarHBondContact O-CB 3.42Å; F327-L331 VanDerWaalsContact O-CG 3.3Å; F327-L331 WeakPolarHBondContact O-CG 3.45Å; F327-L331 PolarHBondContact O-N 2.99Å
328W87.5Confident85.1Confident72 Ų7249.7 Ų49.727%0.27324%0.243SC..Hα-helixtrans-61.7-46.5178.2-174.3-81.5000111.9G28 T31 A32 L35 F324 H325 S326 V330 V332G28-W328 PolarHBondContact O-NE1 3.14Å; T31-W328 HydrophobicContact CG2-CH2 3.53Å; T31-W328 HydrophobicContact CG2-CZ2 3.6Å; A32-W328 HydrophobicContact CB-CD2 4.09Å; A32-W328 HydrophobicContact CB-CG 3.76Å; L35-W328 HydrophobicContact CD1-CE3 4.14Å; L35-W328 HydrophobicContact CD1-CH2 3.84Å; L35-W328 HydrophobicContact CD1-CZ3 3.48Å; L35-W328 VanDerWaalsContact CD1-CZ3 3.48Å; F324-W328 WeakPolarHBondContact O-CB 3.27Å; F324-W328 PolarHBondContact O-N 3.5Å; H325-W328 PolarHBondContact O-N 3.49Å; S326-W328 PolarHBondContact O-N 3.04Å; W328-V330 PolarHBondContact O-N 3.36Å; W328-V332 HydrophobicContact CD2-CG2 3.8Å; W328-V332 HydrophobicContact CE3-CG2 4.25Å; W328-V332 HydrophobicContact CG-CG2 4.14Å; W328-V332 HydrophobicContact CH2-CG2 4.41Å; W328-V332 HydrophobicContact CZ2-CG2 3.98Å; W328-V332 WeakPolarHBondContact O-CB 3.36Å; W328-V332 WeakPolarHBondContact O-CG2 3.21Å; W328-V332 PolarHBondContact O-N 3.22Å
329V81Confident84.4Confident48 Ų4852.9 Ų52.929%0.29126%0.259SS..Iπ-helixtrans-58.1-51.5177.3170.30000109.3H325 S326 Y333H325-V329 WeakPolarHBondContact O-CG2 3.23Å; H325-V329 PolarHBondContact O-N 2.94Å; S326-V329 PolarHBondContact O-N 3.29Å; V329-Y333 WeakPolarHBondContact O-CA 3.28Å; V329-Y333 WeakPolarHBondContact O-CB 3.33Å; V329-Y333 PolarHBondContact O-N 3.22Å
330V79.8Confident83.8Confident6 Ų650.6 Ų50.64%0.03625%0.247CC..Iπ-helixtrans-65.6-49.8-177.9176.90000111.9L260 Q263 L264 A267 S326 F327 W328 V332 E334L260-V330 HydrophobicContact CD1-CG1 3.44Å; L260-V330 VanDerWaalsContact CD1-CG1 3.44Å; L260-V330 HydrophobicContact CG-CG1 4.45Å; Q263-V330 HydrophobicContact CB-CG1 4.12Å; Q263-V330 HydrophobicContact CB-CG2 4.16Å; L264-V330 HydrophobicContact CB-CG1 4.33Å; L264-V330 HydrophobicContact CD1-CB 4.09Å; L264-V330 HydrophobicContact CD1-CG1 3.81Å; A267-V330 HydrophobicContact CB-CG2 4.09Å; S326-V330 WeakPolarHBondContact O-CG2 3.35Å; S326-V330 PolarHBondContact O-N 3.23Å; F327-V330 PolarHBondContact O-N 3.43Å; W328-V330 PolarHBondContact O-N 3.36Å; V330-V332 PolarHBondContact O-N 3.4Å; V330-E334 VanDerWaalsContact O-CB 3.24Å; V330-E334 WeakPolarHBondContact O-CB 3.41Å; V330-E334 PolarHBondContact O-N 3.2Å
331L80.2Confident83.2Confident91 Ų9148 Ų4848%0.47623%0.233SC..Iπ-helixtrans-73.9-26.7-174-67.4175.1000114.4L264 F327 P335L264-L331 HydrophobicContact CD1-CD2 4.03Å; L264-L331 HydrophobicContact CD1-CG 4.01Å; F327-L331 VanDerWaalsContact O-CB 3.24Å; F327-L331 WeakPolarHBondContact O-CB 3.42Å; F327-L331 VanDerWaalsContact O-CG 3.3Å; F327-L331 WeakPolarHBondContact O-CG 3.45Å; F327-L331 PolarHBondContact O-N 2.99Å; L331-P335 WeakPolarHBondContact O-CD 3.28Å; L331-P335 WeakPolarHBondContact O-CG 3.42Å
332V79.5Confident82.6Confident49 Ų4951.1 Ų51.130%0.29725%0.247SC..Iπ-helixtrans-98.5-45.8179.5-178.60000110.4W328 V330 E334 M336W328-V332 HydrophobicContact CD2-CG2 3.8Å; W328-V332 HydrophobicContact CE3-CG2 4.25Å; W328-V332 HydrophobicContact CG-CG2 4.14Å; W328-V332 HydrophobicContact CH2-CG2 4.41Å; W328-V332 HydrophobicContact CZ2-CG2 3.98Å; W328-V332 WeakPolarHBondContact O-CB 3.36Å; W328-V332 WeakPolarHBondContact O-CG2 3.21Å; W328-V332 PolarHBondContact O-N 3.22Å; V330-V332 PolarHBondContact O-N 3.4Å; V332-E334 PolarHBondContact O-N 3.42Å; V332-M336 WeakPolarHBondContact O-CB 3.3Å; V332-M336 PolarHBondContact O-N 2.97Å
333Y76.9Confident82Confident98 Ų9855 Ų5538%0.38427%0.267SS..Iπ-helixtrans-68.8-37.7-174.8-171.4-110.3000112.7F21 V329 M336 K337F21-Y333 AromaticContact CE2-CE2 3.97Å; F21-Y333 HydrophobicContact CE2-CE2 3.97Å; F21-Y333 AromaticContact CZ-CE2 3.54Å; F21-Y333 HydrophobicContact CZ-CE2 3.54Å; F21-Y333 AromaticContact CZ-CZ 3.83Å; V329-Y333 WeakPolarHBondContact O-CA 3.28Å; V329-Y333 WeakPolarHBondContact O-CB 3.33Å; V329-Y333 PolarHBondContact O-N 3.22Å; Y333-M336 HydrophobicContact CD2-CE 3.69Å; Y333-M336 HydrophobicContact CE2-CE 4.13Å; Y333-M336 PolarHBondContact O-N 3.39Å; Y333-K337 HydrophobicContact CD1-CD 3.94Å; Y333-K337 HydrophobicContact CD1-CG 4.41Å; Y333-K337 HydrophobicContact CE1-CD 3.49Å; Y333-K337 VanDerWaalsContact CE1-CD 3.49Å; Y333-K337 VanDerWaalsContact CE1-CE 3.41Å; Y333-K337 HydrophobicContact CE1-CG 4.17Å; Y333-K337 WeakPolarHBondContact O-CE 3.31Å; Y333-K337 WeakPolarHBondContact O-CG 3.18Å; Y333-K337 PolarHBondContact O-N 3.43Å
334E73.6Confident81.2Confident20 Ų2060.3 Ų60.39%0.09329%0.294CS..Hα-helixtrans-71.3-50-176.3-164.1153.3-148.900112.3L260 Q263 V330 V332 M336 K337 L338L260-E334 HydrophobicContact CD1-CB 4.17Å; L260-E334 HydrophobicContact CD1-CG 4.26Å; L260-E334 WeakPolarHBondContact CD1-OE2 3.5Å; Q263-E334 PolarHBondContact NE2-OE1 3.43Å; Q263-E334 PolarHBondContact NE2-OE2 3.29Å; Q263-E334 PolarHBondContact OE1-OE2 3.44Å; V330-E334 VanDerWaalsContact O-CB 3.24Å; V330-E334 WeakPolarHBondContact O-CB 3.41Å; V330-E334 PolarHBondContact O-N 3.2Å; V332-E334 PolarHBondContact O-N 3.42Å; E334-M336 VanDerWaalsContact C-N 3.27Å; E334-M336 PolarHBondContact O-N 3.06Å; E334-K337 PolarHBondContact O-N 3.24Å; E334-L338 PolarHBondContact O-N 3.04Å; E334-L338 VanDerWaalsContact O-N 3.15Å
335P75.5Confident80.4Confident66 Ų6658 Ų5843%0.42928%0.283SS..Hα-helixtrans-61.9-34.9171.1-25.938.5000112.9L331 K337 L338 F339L331-P335 WeakPolarHBondContact O-CD 3.28Å; L331-P335 WeakPolarHBondContact O-CG 3.42Å; P335-K337 PolarHBondContact O-N 3.45Å; P335-L338 WeakPolarHBondContact O-CB 3.27Å; P335-L338 PolarHBondContact O-N 3.12Å; P335-F339 WeakPolarHBondContact O-CB 3.29Å; P335-F339 PolarHBondContact O-N 3.47Å
336M78.6Confident79.3Confident14 Ų1461.2 Ų61.27%0.06929%0.292CS..Hα-helixtrans-65.6-36.6177.3-173.6-172.878.400112.6F21 L24 S25 V332 Y333 E334 F339 C340F21-M336 HydrophobicContact CD2-CE 3.98Å; F21-M336 HydrophobicContact CE2-CE 3.59Å; F21-M336 HydrophobicContact CZ-CE 4.3Å; L24-M336 VanDerWaalsContact C-SD 3.52Å; L24-M336 HydrophobicContact CB-CG 4.29Å; L24-M336 HydrophobicContact CB-SD 3.9Å; L24-M336 HydrophobicContact CD2-CG 3.41Å; L24-M336 VanDerWaalsContact CD2-CG 3.41Å; L24-M336 HydrophobicContact CD2-SD 4.04Å; L24-M336 HydrophobicContact CG-CG 3.67Å; L24-M336 HydrophobicContact CG-SD 3.56Å; L24-M336 VanDerWaalsContact CG-SD 3.56Å; S25-M336 WeakPolarHBondContact OG-CE 3.5Å; V332-M336 WeakPolarHBondContact O-CB 3.3Å; V332-M336 PolarHBondContact O-N 2.97Å; Y333-M336 HydrophobicContact CD2-CE 3.69Å; Y333-M336 HydrophobicContact CE2-CE 4.13Å; Y333-M336 PolarHBondContact O-N 3.39Å; E334-M336 VanDerWaalsContact C-N 3.27Å; E334-M336 PolarHBondContact O-N 3.06Å; M336-F339 PolarHBondContact O-N 3.22Å; M336-C340 WeakPolarHBondContact O-CB 3.49Å; M336-C340 PolarHBondContact O-N 3.35Å; M336-C340 PolarHBondContact O-SG 3.2Å; M336-C340 VanDerWaalsContact O-SG 3.37Å
337K77.8Confident78.2Confident26 Ų2667.9 Ų67.911%0.11333%0.327CS..Hα-helixtrans-63.3-45.2170.8-77.8179.5-67.51760111.1I11 L16 F21 Y333 E334 P335 F339 C340 L341I11-K337 HydrophobicContact CD1-CB 4.2Å; L16-K337 HydrophobicContact CD1-CG 4.42Å; L16-K337 HydrophobicContact CD2-CB 4.23Å; L16-K337 HydrophobicContact CD2-CG 4.46Å; L16-K337 WeakPolarHBondContact CD2-O 3.38Å; F21-K337 HydrophobicContact CE2-CG 3.72Å; F21-K337 HydrophobicContact CZ-CG 4.38Å; Y333-K337 HydrophobicContact CD1-CD 3.94Å; Y333-K337 HydrophobicContact CD1-CG 4.41Å; Y333-K337 HydrophobicContact CE1-CD 3.49Å; Y333-K337 VanDerWaalsContact CE1-CD 3.49Å; Y333-K337 VanDerWaalsContact CE1-CE 3.41Å; Y333-K337 HydrophobicContact CE1-CG 4.17Å; Y333-K337 WeakPolarHBondContact O-CE 3.31Å; Y333-K337 WeakPolarHBondContact O-CG 3.18Å; Y333-K337 PolarHBondContact O-N 3.43Å; E334-K337 PolarHBondContact O-N 3.24Å; P335-K337 PolarHBondContact O-N 3.45Å; K337-F339 VanDerWaalsContact C-N 3.29Å; K337-F339 PolarHBondContact O-N 3.04Å; K337-C340 PolarHBondContact O-N 2.95Å; K337-L341 PolarHBondContact O-N 2.99Å; K337-L341 VanDerWaalsContact O-N 3.14Å
338L76.6Confident77.1Confident61 Ų6170.2 Ų70.232%0.31934%0.337SS..Hα-helixtrans-60.1-39.2176.6-67.9173.2000112.4I11 E334 P335 L341 F349I11-L338 HydrophobicContact CD1-CD2 3.99Å; E334-L338 PolarHBondContact O-N 3.04Å; E334-L338 VanDerWaalsContact O-N 3.15Å; P335-L338 WeakPolarHBondContact O-CB 3.27Å; P335-L338 PolarHBondContact O-N 3.12Å; L338-L341 HydrophobicContact CD2-CD1 3.8Å; L338-F349 HydrophobicContact CD2-CB 4.04Å
339F81Confident76.1Confident120 Ų12067.5 Ų67.553%0.52633%0.327SS..Hα-helixtrans-69.7-37.1177.2-176.2-109.7000113M20 L24 P335 M336 K337 L341M20-F339 HydrophobicContact CE-CD1 4.16Å; M20-F339 HydrophobicContact CE-CE1 3.26Å; M20-F339 HydrophobicContact CE-CZ 3.8Å; M20-F339 HydrophobicContact SD-CD1 4.32Å; M20-F339 HydrophobicContact SD-CE1 3.98Å; L24-F339 HydrophobicContact CD2-CD1 4.16Å; P335-F339 WeakPolarHBondContact O-CB 3.29Å; P335-F339 PolarHBondContact O-N 3.47Å; M336-F339 PolarHBondContact O-N 3.22Å; K337-F339 VanDerWaalsContact C-N 3.29Å; K337-F339 PolarHBondContact O-N 3.04Å; F339-L341 VanDerWaalsContact C-N 3.33Å
340C81.9Confident74.8Confident0 Ų069.3 Ų69.30%034%0.342CS..THydrogen-bonded Turntrans-86.63.9-179.4-70.80000113.9L16 K17 F21 M336 K337L16-C340 CarbonylContact C-O 3.18Å; L16-C340 WeakPolarHBondContact CA-O 3.35Å; L16-C340 HydrophobicContact CD2-CB 3.7Å; K17-C340 WeakPolarHBondContact CB-O 3.31Å; K17-C340 PolarHBondContact N-O 3.43Å; F21-C340 HydrophobicContact CB-CB 4.03Å; F21-C340 HydrophobicContact CD2-CB 4.16Å; M336-C340 WeakPolarHBondContact O-CB 3.49Å; M336-C340 PolarHBondContact O-N 3.35Å; M336-C340 PolarHBondContact O-SG 3.2Å; M336-C340 VanDerWaalsContact O-SG 3.37Å; K337-C340 PolarHBondContact O-N 2.95Å
341L81.9Confident73.2Confident4 Ų476.6 Ų76.62%0.02138%0.381CS..BIsolated β-bridgetrans-63.6141.5178.4-99.2139.9000111I11 M15 K337 L338 F339 Y345 F349I11-L341 HydrophobicContact CD1-CD1 3.78Å; I11-L341 HydrophobicContact CG1-CD1 4.31Å; I11-L341 HydrophobicContact CG2-CD1 4.37Å; I11-L341 HydrophobicContact CG2-CD2 4.35Å; I11-L341 HydrophobicContact CG2-CG 4.32Å; M15-L341 HydrophobicContact CB-CD2 4.19Å; K337-L341 PolarHBondContact O-N 2.99Å; K337-L341 VanDerWaalsContact O-N 3.14Å; L338-L341 HydrophobicContact CD2-CD1 3.8Å; F339-L341 VanDerWaalsContact C-N 3.33Å; L341-Y345 VanDerWaalsContact CD2-CB 3.46Å; L341-Y345 HydrophobicContact CD2-CG 4.42Å; L341-F349 HydrophobicContact CD1-CB 4.36Å; L341-F349 HydrophobicContact CD1-CD2 4.11Å; L341-F349 HydrophobicContact CD1-CG 4.41Å; L341-F349 HydrophobicContact CD2-CD2 3.74Å; L341-F349 HydrophobicContact CD2-CE2 4.02Å
342K81.7Confident71.6Confident79 Ų7978.6 Ų78.634%0.34340%0.396SS..  trans-66.1145.4169.1-71.3170.4179.1175.10109.4S14 M15 K17 D344 Y345 R346S14-K342 WeakPolarHBondContact O-CE 3.41Å; S14-K342 PolarHBondContact O-NZ 2.95Å; M15-K342 WeakPolarHBondContact O-CB 3.25Å; M15-K342 WeakPolarHBondContact O-CG 3.49Å; M15-K342 PolarHBondContact O-N 3.39Å; K17-K342 HydrophobicContact CG-CG 3.84Å; K342-D344 PolarHBondContact O-N 2.79Å; K342-D344 VanDerWaalsContact O-N 3.16Å; K342-Y345 HydrophobicContact CB-CD2 3.92Å; K342-Y345 HydrophobicContact CB-CE2 4.39Å; K342-Y345 HydrophobicContact CD-CE2 4.37Å; K342-Y345 PolarHBondContact O-N 3.06Å; K342-R346 PolarHBondContact O-N 3.08Å
343D78.9Confident71.2Confident97 Ų9780.1 Ų80.152%0.51940%0.401SS..Hα-helixtrans-59.5-34-170.4-57.6-60.6000111.8K17 Y345 R346K17-D343 IonicContact NZ-OD1 3.64Å; K17-D343 PolarHBondContact NZ-OD1 3.2Å; K17-D343 IonicContact NZ-OD2 3.42Å; K17-D343 PolarHBondContact NZ-OD2 2.95Å; D343-Y345 PolarHBondContact O-N 2.98Å; D343-Y345 VanDerWaalsContact O-N 3.15Å; D343-R346 WeakPolarHBondContact O-CB 3.04Å; D343-R346 PolarHBondContact O-N 3.32Å
344D76.8Confident70.9Confident141 Ų14179.2 Ų79.275%0.75440%0.402SS*.Hα-helixtrans-57.8-27.5175.8-50.2-32000114.4K342K342-D344 PolarHBondContact O-N 2.79Å; K342-D344 VanDerWaalsContact O-N 3.16Å
345Y73.9Confident70.8Confident75 Ų7582.4 Ų82.429%0.29442%0.419SS..Hα-helixtrans-103.1-9.2-176.8-61.6-87.4000112.8M15 L341 K342 D343 N347 K348 F349M15-Y345 HydrophobicContact CB-CD1 4.28Å; M15-Y345 HydrophobicContact CB-CD2 4.08Å; M15-Y345 HydrophobicContact CB-CE1 4.5Å; M15-Y345 HydrophobicContact CB-CE2 4.28Å; M15-Y345 HydrophobicContact CB-CG 4.06Å; M15-Y345 HydrophobicContact CE-CD1 4.47Å; M15-Y345 HydrophobicContact CE-CE1 4.3Å; M15-Y345 HydrophobicContact CG-CD1 3.85Å; M15-Y345 HydrophobicContact CG-CD2 4.38Å; M15-Y345 HydrophobicContact CG-CE1 3.78Å; M15-Y345 HydrophobicContact CG-CE2 4.31Å; M15-Y345 HydrophobicContact CG-CG 4.15Å; M15-Y345 HydrophobicContact SD-CD1 4.01Å; M15-Y345 HydrophobicContact SD-CE1 4.28Å; L341-Y345 VanDerWaalsContact CD2-CB 3.46Å; L341-Y345 HydrophobicContact CD2-CG 4.42Å; K342-Y345 HydrophobicContact CB-CD2 3.92Å; K342-Y345 HydrophobicContact CB-CE2 4.39Å; K342-Y345 HydrophobicContact CD-CE2 4.37Å; K342-Y345 PolarHBondContact O-N 3.06Å; D343-Y345 PolarHBondContact O-N 2.98Å; D343-Y345 VanDerWaalsContact O-N 3.15Å; Y345-N347 VanDerWaalsContact C-N 3.28Å; Y345-N347 PolarHBondContact O-N 3.4Å; Y345-K348 WeakPolarHBondContact O-CB 3.48Å; Y345-K348 PolarHBondContact O-N 2.69Å; Y345-K348 VanDerWaalsContact O-N 3.08Å; Y345-F349 WeakPolarHBondContact O-CD2 3.43Å
346R67.6Low70.5Confident139 Ų13983.4 Ų83.453%0.52542%0.419SS..Hα-helixtrans-62.2-38.2-173.7-150.7176.1-164.8-160.31.1111.9K342 D343 K348 F349 S350K342-R346 PolarHBondContact O-N 3.08Å; D343-R346 WeakPolarHBondContact O-CB 3.04Å; D343-R346 PolarHBondContact O-N 3.32Å; R346-K348 VanDerWaalsContact C-N 3.27Å; R346-K348 PolarHBondContact O-N 3.35Å; R346-F349 PolarHBondContact O-N 3.35Å; R346-S350 PolarHBondContact O-N 3.18Å
347N65Low70Confident144 Ų14487.8 Ų87.877%0.7744%0.441SS*.Hα-helixtrans-65.6-27.6177.9-65.9-17.8000113.1Y345Y345-N347 VanDerWaalsContact C-N 3.28Å; Y345-N347 PolarHBondContact O-N 3.4Å
348K64.6Low69.5Low124 Ų12491.9 Ų91.954%0.53946%0.463SS..Hα-helixtrans-72-31.3175.8-84.3-170.4162.7-152.90113E9 Y345 R346E9-K348 IonicContact OE1-NZ 3.58Å; E9-K348 PolarHBondContact OE1-NZ 3.09Å; Y345-K348 WeakPolarHBondContact O-CB 3.48Å; Y345-K348 PolarHBondContact O-N 2.69Å; Y345-K348 VanDerWaalsContact O-N 3.08Å; R346-K348 VanDerWaalsContact C-N 3.27Å; R346-K348 PolarHBondContact O-N 3.35Å
349F64.7Low69Low15 Ų1594.1 Ų94.17%0.06647%0.473CS..Hα-helixtrans-109-1.6-172.5-64.5-74000114.3E9 I11 M15 L338 L341 Y345 R346 N351 V352E9-F349 HydrophobicContact CB-CE1 3.93Å; E9-F349 HydrophobicContact CB-CZ 4.16Å; I11-F349 HydrophobicContact CD1-CD1 4.45Å; I11-F349 HydrophobicContact CG1-CD1 4.04Å; I11-F349 HydrophobicContact CG1-CD2 4.35Å; I11-F349 HydrophobicContact CG1-CE1 3.76Å; I11-F349 HydrophobicContact CG1-CE2 4.11Å; I11-F349 HydrophobicContact CG1-CG 4.33Å; I11-F349 HydrophobicContact CG1-CZ 3.81Å; M15-F349 HydrophobicContact SD-CE2 3.96Å; M15-F349 HydrophobicContact SD-CZ 4.13Å; L338-F349 HydrophobicContact CD2-CB 4.04Å; L341-F349 HydrophobicContact CD1-CB 4.36Å; L341-F349 HydrophobicContact CD1-CD2 4.11Å; L341-F349 HydrophobicContact CD1-CG 4.41Å; L341-F349 HydrophobicContact CD2-CD2 3.74Å; L341-F349 HydrophobicContact CD2-CE2 4.02Å; Y345-F349 WeakPolarHBondContact O-CD2 3.43Å; R346-F349 PolarHBondContact O-N 3.35Å; F349-N351 PolarHBondContact O-N 3.39Å; F349-V352 PolarHBondContact O-N 3.03Å
350S54Low68Low86 Ų8692.1 Ų92.160%0.60147%0.469SS*.THydrogen-bonded Turntrans-70-13.8-178.2-170.40000114.5R346R346-S350 PolarHBondContact O-N 3.18Å
351N46.2Very low66.9Low160 Ų16099.8 Ų99.886%0.85651%0.508SS*.THydrogen-bonded Turntrans-99.613.5179.5-72.5-6.4000113.5F349F349-N351 PolarHBondContact O-N 3.39Å
352V47.4Very low65.5Low133 Ų133108.5 Ų108.581%0.80655%0.552SS**  trans-102.70171-174.60000109F349F349-V352 PolarHBondContact O-N 3.03Å

Retrieved 352 of 352 residues in 100.8 ms (Link to these results)

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