A0A087X7Q6_POEFO Loading...

Cannabinoid receptor 2

AlphaFold DB , UniProt , Accession A0A087X7Q6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 378 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
1M38.8Very low31.5Very low256 Ų256170.8 Ų170.8100%1.26189%0.886SS**  0106.50-157144.183.400107
2G32.3Very low31.8Very low77 Ų77165.2 Ų165.279%0.79487%0.872SS**  trans178.1111.2-175.800000109
3E31.4Very low32.9Very low198 Ų198160.8 Ų160.893%0.92586%0.864SS**  trans-71.3145.9-156.5-65.1170.3123.300115.8
4M28.1Very low33.8Very low182 Ų182156.4 Ų156.490%0.89784%0.839SS**  trans-84.3112.8171.6-172.2-178.3-62.800109.1
5K32.5Very low35.2Very low201 Ų201151.9 Ų151.987%0.87482%0.822SS**  trans-92.299.9175.4-159.4168.5-1721720109.4R7K5-R7 PolarHBondContact O-N 3.18Å
6E31.6Very low36.3Very low174 Ų174148.8 Ų148.881%0.81381%0.805SS**  trans-55.8121.9169.3-85.7-179.3136.900110.3
7R29.1Very low37.3Very low239 Ų239142.4 Ų142.490%0.90278%0.777SS**  trans-96.797.8163.3-101.9-175.1-106.3-160.7-4.6107.8K5 C9K5-R7 PolarHBondContact O-N 3.18Å; R7-C9 PolarHBondContact O-N 3.32Å
8T29.4Very low38.5Very low129 Ų129138.8 Ų138.879%0.79176%0.764SS**  trans-60.5110.9163.633.20000109.8S10T8-S10 PolarHBondContact O-N 3.34Å
9C27.7Very low39.7Very low124 Ų124134.1 Ų134.184%0.83874%0.742SS**  trans-75.298166.7-97.70000109.4R7 H11R7-C9 PolarHBondContact O-N 3.32Å; C9-H11 PolarHBondContact O-N 3.02Å
10S29.6Very low40.7Very low112 Ų112134.3 Ų134.378%0.78374%0.737SS**  trans-73.2103.4163.947.50000109.5T8 S12T8-S10 PolarHBondContact O-N 3.34Å; S10-S12 PolarHBondContact O-N 3.16Å
11H35.7Very low41.7Very low187 Ų187133.5 Ų133.587%0.86673%0.731SS**  trans-69.890.2170-108-63.1000109.8C9 S13C9-H11 PolarHBondContact O-N 3.02Å; H11-S13 PolarHBondContact O-N 2.92Å
12S35.7Very low42.7Very low103 Ų103123.8 Ų123.872%0.7269%0.692SS**  trans-76.797.6161160.90000108.1S10 N14S10-S12 PolarHBondContact O-N 3.16Å; S12-N14 PolarHBondContact O-N 3.35Å
13S46.3Very low44.1Very low109 Ų109125 Ų12576%0.76268%0.679SS**  trans-65.8100.7168.437.40000109.1H11 P15H11-S13 PolarHBondContact O-N 2.92Å; S13-P15 WeakPolarHBondContact O-CD 3.3Å
14N45.5Very low45.9Very low98 Ų98119.4 Ų119.452%0.52466%0.656SS.*  trans-73.4109.2179.8-160-3.5000109.3S12 N16 A17S12-N14 PolarHBondContact O-N 3.35Å; N14-N16 PolarHBondContact O-N 3.17Å; N14-N16 VanDerWaalsContact O-N 3.15Å; N14-A17 HydrophobicContact CB-CB 4.46Å; N14-A17 WeakPolarHBondContact O-CB 3.42Å; N14-A17 PolarHBondContact O-N 3.36Å
15P54.3Low47.9Very low89 Ų89111.9 Ų111.958%0.57862%0.618SS**Hα-helixtrans-60.8-28.3-175.423.1-32000112.2S13 A17 S18 S19S13-P15 WeakPolarHBondContact O-CD 3.3Å; P15-A17 VanDerWaalsContact C-N 3.29Å; P15-A17 PolarHBondContact O-N 3.11Å; P15-S18 PolarHBondContact O-N 3.26Å; P15-S18 PolarHBondContact O-OG 3.15Å; P15-S19 PolarHBondContact O-N 3.12Å; P15-S19 PolarHBondContact O-OG 3.35Å
16N52.2Low49.7Very low102 Ų102103.9 Ų103.955%0.54559%0.587SS.*Hα-helixtrans-65-28177.3-71.1-9000113.9N14 S19 Q20N14-N16 PolarHBondContact O-N 3.17Å; N14-N16 VanDerWaalsContact O-N 3.15Å; N16-S19 WeakPolarHBondContact CA-OG 2.8Å; N16-S19 PolarHBondContact O-OG 3.3Å; N16-Q20 WeakPolarHBondContact O-CB 3.34Å; N16-Q20 WeakPolarHBondContact O-CG 3.39Å; N16-Q20 PolarHBondContact O-N 2.63Å
17A53.3Low51.6Low41 Ų41100.1 Ų100.134%0.33957%0.573SS.*Hα-helixtrans-73-39.5177.700000111.2N14 P15 Q20 I21N14-A17 HydrophobicContact CB-CB 4.46Å; N14-A17 WeakPolarHBondContact O-CB 3.42Å; N14-A17 PolarHBondContact O-N 3.36Å; P15-A17 VanDerWaalsContact C-N 3.29Å; P15-A17 PolarHBondContact O-N 3.11Å; A17-Q20 PolarHBondContact O-N 3.41Å; A17-I21 WeakPolarHBondContact O-CD1 3.36Å; A17-I21 WeakPolarHBondContact O-CG1 3.29Å; A17-I21 PolarHBondContact O-N 3.03Å
18S59.2Low53.8Low78 Ų7892.9 Ų92.955%0.54555%0.546SS..Hα-helixtrans-66-38.8176.769.10000112.3P15 A22P15-S18 PolarHBondContact O-N 3.26Å; P15-S18 PolarHBondContact O-OG 3.15Å; S18-A22 WeakPolarHBondContact O-CB 3.31Å; S18-A22 PolarHBondContact O-N 3.04Å
19S60.9Low56Low49 Ų4987 Ų8734%0.34351%0.509SS..Hα-helixtrans-69.7-37.1175.255.40000112.8P15 N16 A22 N23P15-S19 PolarHBondContact O-N 3.12Å; P15-S19 PolarHBondContact O-OG 3.35Å; N16-S19 WeakPolarHBondContact CA-OG 2.8Å; N16-S19 PolarHBondContact O-OG 3.3Å; S19-A22 PolarHBondContact O-N 3.35Å; S19-N23 WeakPolarHBondContact O-CB 3.14Å; S19-N23 PolarHBondContact O-N 3.44Å; S19-N23 PolarHBondContact O-ND2 2.94Å; S19-N23 PolarHBondContact O-OD1 3.34Å
20Q59.7Low58.4Low137 Ų13785.5 Ų85.564%0.6449%0.49SS*.Hα-helixtrans-67.1-42.2175.8-81.2176.3-23.300112.2N16 A17 A22 N23 D24N16-Q20 WeakPolarHBondContact O-CB 3.34Å; N16-Q20 WeakPolarHBondContact O-CG 3.39Å; N16-Q20 PolarHBondContact O-N 2.63Å; A17-Q20 PolarHBondContact O-N 3.41Å; Q20-A22 VanDerWaalsContact C-N 3.33Å; Q20-A22 PolarHBondContact O-N 2.93Å; Q20-N23 PolarHBondContact O-N 3.05Å; Q20-D24 VanDerWaalsContact O-CB 3.31Å; Q20-D24 WeakPolarHBondContact O-CB 3.45Å; Q20-D24 PolarHBondContact O-N 3.38Å
21I61.7Low60.6Low118 Ų11884.4 Ų84.461%0.60547%0.474SS*.Hα-helixtrans-64-40.3176-67.4164.8000110.9A17 F25A17-I21 WeakPolarHBondContact O-CD1 3.36Å; A17-I21 WeakPolarHBondContact O-CG1 3.29Å; A17-I21 PolarHBondContact O-N 3.03Å; I21-F25 VanDerWaalsContact O-CB 3.23Å; I21-F25 WeakPolarHBondContact O-CB 3.05Å; I21-F25 PolarHBondContact O-N 3.18Å
22A60.5Low62.7Low53 Ų5376.8 Ų76.844%0.43844%0.438SS..Hα-helixtrans-66-41176.700000112.5S18 S19 Q20 F25 C26S18-A22 WeakPolarHBondContact O-CB 3.31Å; S18-A22 PolarHBondContact O-N 3.04Å; S19-A22 PolarHBondContact O-N 3.35Å; Q20-A22 VanDerWaalsContact C-N 3.33Å; Q20-A22 PolarHBondContact O-N 2.93Å; A22-F25 PolarHBondContact O-N 3.16Å; A22-C26 WeakPolarHBondContact O-CB 3.21Å; A22-C26 PolarHBondContact O-N 3.29Å
23N62.2Low64.9Low101 Ų10172.8 Ų72.854%0.5441%0.409SS..Hα-helixtrans-66.8-47.3178-71-14.8000111.8S19 Q20 F25 C26 D27S19-N23 WeakPolarHBondContact O-CB 3.14Å; S19-N23 PolarHBondContact O-N 3.44Å; S19-N23 PolarHBondContact O-ND2 2.94Å; S19-N23 PolarHBondContact O-OD1 3.34Å; Q20-N23 PolarHBondContact O-N 3.05Å; N23-F25 VanDerWaalsContact C-N 3.26Å; N23-F25 PolarHBondContact O-N 3.3Å; N23-C26 PolarHBondContact O-N 3.28Å; N23-C26 VanDerWaalsContact O-N 3.11Å; N23-D27 PolarHBondContact O-N 2.79Å
24D67.9Low66.7Low82 Ų8268.9 Ų68.944%0.43938%0.38SS..Hα-helixtrans-62-34177174.351.4000112.3Q20 R28Q20-D24 VanDerWaalsContact O-CB 3.31Å; Q20-D24 WeakPolarHBondContact O-CB 3.45Å; Q20-D24 PolarHBondContact O-N 3.38Å; D24-R28 WeakPolarHBondContact O-CG 3.31Å; D24-R28 PolarHBondContact O-N 3.05Å; D24-R28 IonicContact OD1-CZ 3.17Å; D24-R28 IonicContact OD1-NH1 2.92Å; D24-R28 PolarHBondContact OD1-NH1 3.23Å; D24-R28 IonicContact OD2-CZ 2.61Å; D24-R28 IonicContact OD2-NH1 2.9Å; D24-R28 PolarHBondContact OD2-NH1 3.47Å; D24-R28 IonicContact OD2-NH2 2.6Å; D24-R28 PolarHBondContact OD2-NH2 3.49Å
25F71.3Confident68.6Low23 Ų2364.6 Ų64.610%0.10136%0.357CS..Hα-helixtrans-68-44.6172.5179.6-93.8000112.6I21 A22 N23 D27 R28 L29 C107 D108 P110 F195I21-F25 VanDerWaalsContact O-CB 3.23Å; I21-F25 WeakPolarHBondContact O-CB 3.05Å; I21-F25 PolarHBondContact O-N 3.18Å; A22-F25 PolarHBondContact O-N 3.16Å; N23-F25 VanDerWaalsContact C-N 3.26Å; N23-F25 PolarHBondContact O-N 3.3Å; F25-D27 VanDerWaalsContact C-N 3.35Å; F25-D27 PolarHBondContact O-N 3.04Å; F25-R28 PolarHBondContact O-N 3.36Å; F25-L29 HydrophobicContact CD1-CD1 3.59Å; F25-L29 HydrophobicContact CE1-CD1 2.98Å; F25-L29 HydrophobicContact CE1-CG 4.42Å; F25-L29 HydrophobicContact CE2-CD1 4.13Å; F25-L29 HydrophobicContact CG-CD1 4.34Å; F25-L29 HydrophobicContact CZ-CD1 3.31Å; F25-L29 PolarHBondContact O-N 3.06Å; F25-C107 HydrophobicContact CD1-CB 4.36Å; F25-D108 WeakPolarHBondContact CE1-O 3.5Å; F25-D108 WeakPolarHBondContact CZ-O 3.41Å; F25-P110 VanDerWaalsContact CE2-CD 3.44Å; F25-P110 HydrophobicContact CE2-CG 3.72Å; F25-P110 HydrophobicContact CZ-CG 4.33Å; F25-F195 HydrophobicContact CD2-CZ 4.36Å; F25-F195 HydrophobicContact CE2-CE1 4.17Å; F25-F195 AromaticContact CE2-CE2 3.98Å; F25-F195 HydrophobicContact CE2-CE2 3.98Å; F25-F195 AromaticContact CE2-CZ 3.32Å; F25-F195 HydrophobicContact CE2-CZ 3.32Å; F25-F195 AromaticContact CZ-CE2 3.91Å; F25-F195 HydrophobicContact CZ-CE2 3.91Å; F25-F195 AromaticContact CZ-CZ 3.74Å; F25-F195 HydrophobicContact CZ-CZ 3.74Å
26C70.4Confident70.3Confident33 Ų3363.1 Ų63.122%0.22335%0.346CS..Hα-helixtrans-64.8-40.1-179.8-160.70000111.8A22 N23 R28 L29 Q30 C107A22-C26 WeakPolarHBondContact O-CB 3.21Å; A22-C26 PolarHBondContact O-N 3.29Å; N23-C26 PolarHBondContact O-N 3.28Å; N23-C26 VanDerWaalsContact O-N 3.11Å; C26-R28 VanDerWaalsContact C-N 3.32Å; C26-R28 PolarHBondContact O-N 2.74Å; C26-L29 PolarHBondContact O-N 2.88Å; C26-L29 VanDerWaalsContact O-N 3.12Å; C26-Q30 WeakPolarHBondContact O-CG 3.3Å; C26-Q30 PolarHBondContact O-N 3.48Å; C26-C107 WeakPolarHBondContact CA-SG 3.26Å; C26-C107 HydrophobicContact CB-CB 3.52Å; C26-C107 WeakPolarHBondContact CB-SG 3.47Å; C26-C107 WeakPolarHBondContact SG-CB 3.38Å; C26-C107 CovalentContact SG-SG 2.04Å; C26-C107 PolarHBondContact SG-SG 3.36Å
27D71.3Confident71.9Confident96 Ų9663.7 Ų63.751%0.51335%0.35SS..Hα-helixtrans-61.5-38.4176.3-72.3-18.9000112.2N23 F25 L29 Q30N23-D27 PolarHBondContact O-N 2.79Å; F25-D27 VanDerWaalsContact C-N 3.35Å; F25-D27 PolarHBondContact O-N 3.04Å; D27-L29 VanDerWaalsContact C-N 3.33Å; D27-L29 PolarHBondContact O-N 3.34Å; D27-Q30 PolarHBondContact O-N 3.11Å
28R74.1Confident73.6Confident86 Ų8668.4 Ų68.433%0.32537%0.368SS..Hα-helixtrans-64.8-32.5174.5-75.5-171.3-74.3-95.2-3.6113.7D24 F25 C26D24-R28 WeakPolarHBondContact O-CG 3.31Å; D24-R28 PolarHBondContact O-N 3.05Å; D24-R28 IonicContact OD1-CZ 3.17Å; D24-R28 IonicContact OD1-NH1 2.92Å; D24-R28 PolarHBondContact OD1-NH1 3.23Å; D24-R28 IonicContact OD2-CZ 2.61Å; D24-R28 IonicContact OD2-NH1 2.9Å; D24-R28 PolarHBondContact OD2-NH1 3.47Å; D24-R28 IonicContact OD2-NH2 2.6Å; D24-R28 PolarHBondContact OD2-NH2 3.49Å; F25-R28 PolarHBondContact O-N 3.36Å; C26-R28 VanDerWaalsContact C-N 3.32Å; C26-R28 PolarHBondContact O-N 2.74Å
29L77.5Confident75.1Confident5 Ų566 Ų663%0.02635%0.348CS..Hα-helixtrans-77.8-22.7179.1-83.6141000113.3F25 C26 D27 I31 Y32 F101 P194 F195F25-L29 HydrophobicContact CD1-CD1 3.59Å; F25-L29 HydrophobicContact CE1-CD1 2.98Å; F25-L29 HydrophobicContact CE1-CG 4.42Å; F25-L29 HydrophobicContact CE2-CD1 4.13Å; F25-L29 HydrophobicContact CG-CD1 4.34Å; F25-L29 HydrophobicContact CZ-CD1 3.31Å; F25-L29 PolarHBondContact O-N 3.06Å; C26-L29 PolarHBondContact O-N 2.88Å; C26-L29 VanDerWaalsContact O-N 3.12Å; D27-L29 VanDerWaalsContact C-N 3.33Å; D27-L29 PolarHBondContact O-N 3.34Å; L29-I31 PolarHBondContact O-N 3.25Å; L29-I31 VanDerWaalsContact O-N 3.12Å; L29-Y32 PolarHBondContact O-N 3.25Å; L29-F101 HydrophobicContact CB-CE2 4.38Å; L29-F101 HydrophobicContact CD2-CE2 3.63Å; L29-F101 HydrophobicContact CD2-CZ 4.23Å; L29-P194 HydrophobicContact CD2-CB 3.86Å; L29-P194 HydrophobicContact CD2-CG 3.61Å; L29-F195 HydrophobicContact CD2-CE2 4.49Å
30Q76.5Confident76.3Confident94 Ų9465.1 Ų65.144%0.43934%0.339SS..Hα-helixtrans-58.5-27178.5-68.7-1735.300112.9C26 D27 Y32 M33C26-Q30 WeakPolarHBondContact O-CG 3.3Å; C26-Q30 PolarHBondContact O-N 3.48Å; D27-Q30 PolarHBondContact O-N 3.11Å; Q30-Y32 PolarHBondContact O-N 3.02Å; Q30-M33 WeakPolarHBondContact O-CB 3.26Å; Q30-M33 PolarHBondContact O-N 3.41Å
31I76.8Confident77.6Confident88 Ų8865.5 Ų65.545%0.45134%0.338SS..THydrogen-bonded Turntrans-61.1-28.5177.3-62.3168.1000111.8L29 V34 L185L29-I31 PolarHBondContact O-N 3.25Å; L29-I31 VanDerWaalsContact O-N 3.12Å; I31-V34 WeakPolarHBondContact O-CG2 3.42Å; I31-L185 HydrophobicContact CD1-CD1 4.02Å; I31-L185 HydrophobicContact CD1-CD2 4.49Å
32Y80.2Confident79Confident27 Ų2762 Ų6211%0.10633%0.326CS..THydrogen-bonded Turntrans-87.1-7.5176.7-65.9-92.2000113.2L29 Q30 V34 V184 S190 C191 P194L29-Y32 PolarHBondContact O-N 3.25Å; Q30-Y32 PolarHBondContact O-N 3.02Å; Y32-V34 PolarHBondContact O-N 2.95Å; Y32-V184 HydrophobicContact CE2-CG1 3.46Å; Y32-V184 VanDerWaalsContact CE2-CG1 3.46Å; Y32-V184 PolarHBondContact OH-O 3.32Å; Y32-S190 PolarHBondContact OH-O 2.92Å; Y32-C191 WeakPolarHBondContact CE1-O 3.46Å; Y32-P194 HydrophobicContact CD1-CG 3.95Å; Y32-P194 HydrophobicContact CD2-CB 4.45Å; Y32-P194 HydrophobicContact CD2-CG 3.68Å; Y32-P194 HydrophobicContact CE1-CG 4.13Å; Y32-P194 HydrophobicContact CE2-CB 4.22Å; Y32-P194 HydrophobicContact CE2-CG 3.89Å; Y32-P194 HydrophobicContact CG-CG 3.7Å
33M81.4Confident80.3Confident20 Ų2059.4 Ų59.410%0.09931%0.305CS..  trans-86.757.5178.3-57.7-173.475.500111.9Q30 L35 F101 R105Q30-M33 WeakPolarHBondContact O-CB 3.26Å; Q30-M33 PolarHBondContact O-N 3.41Å; M33-L35 VanDerWaalsContact C-N 3.32Å; M33-L35 PolarHBondContact O-N 3.28Å; M33-F101 VanDerWaalsContact CE-O 3.25Å; M33-F101 WeakPolarHBondContact CE-O 3.41Å; M33-F101 HydrophobicContact CG-CE1 4.27Å; M33-F101 HydrophobicContact CG-CZ 4.13Å; M33-R105 HydrophobicContact CE-CB 4.02Å; M33-R105 HydrophobicContact CE-CG 3.64Å
34V84.2Confident81.5Confident26 Ų2654.8 Ų54.816%0.15828%0.281CS..  trans-77.4-14.2-166.8-165.30000114.1I31 Y32 R285 Q288 R289I31-V34 WeakPolarHBondContact O-CG2 3.42Å; Y32-V34 PolarHBondContact O-N 2.95Å; V34-R285 HydrophobicContact CG1-CB 3.63Å; V34-R285 HydrophobicContact CG1-CG 3.65Å; V34-Q288 HydrophobicContact CB-CB 4.44Å; V34-Q288 HydrophobicContact CG1-CB 4.45Å; V34-Q288 HydrophobicContact CG2-CB 4.2Å; V34-R289 HydrophobicContact CB-CG 4.3Å; V34-R289 HydrophobicContact CG1-CG 3.86Å
35L85.8Confident82.5Confident8 Ų854.5 Ų54.54%0.04228%0.283CS..  trans-68.1140.2-177.4-71.8137.4000112.5M33 E39 K40 I43 H102 A292 F293M33-L35 VanDerWaalsContact C-N 3.32Å; M33-L35 PolarHBondContact O-N 3.28Å; L35-E39 HydrophobicContact CB-CB 4.37Å; L35-E39 HydrophobicContact CD2-CB 3.55Å; L35-K40 HydrophobicContact CB-CD 4.46Å; L35-K40 HydrophobicContact CB-CG 3.55Å; L35-K40 WeakPolarHBondContact O-CE 3.33Å; L35-K40 PolarHBondContact O-NZ 3.32Å; L35-I43 HydrophobicContact CD2-CD1 3.52Å; L35-H102 WeakPolarHBondContact CD1-ND1 3.42Å; L35-A292 HydrophobicContact CD1-CB 3.97Å; L35-A292 HydrophobicContact CD2-CB 4.01Å; L35-A292 HydrophobicContact CG-CB 4.23Å; L35-F293 HydrophobicContact CD2-CE2 4.48Å
36T88.4Confident83.4Confident58 Ų5857.3 Ų57.336%0.35630%0.298SS..  trans-71.7162.7168.663.60000111L38 E39 K40T36-L38 VanDerWaalsContact C-N 3.27Å; T36-L38 PolarHBondContact O-N 3.49Å; T36-E39 WeakPolarHBondContact CB-OE2 3.29Å; T36-E39 WeakPolarHBondContact CG2-OE2 3.47Å; T36-E39 PolarHBondContact N-OE2 2.91Å; T36-E39 PolarHBondContact O-N 3.06Å; T36-E39 VanDerWaalsContact O-N 3.15Å; T36-E39 WeakPolarHBondContact OG1-CG 3.36Å; T36-E39 PolarHBondContact OG1-OE2 3.21Å; T36-K40 WeakPolarHBondContact O-CG 3.49Å; T36-K40 PolarHBondContact O-N 2.96Å
37D86.8Confident84.3Confident115 Ų11555.7 Ų55.762%0.61529%0.287SS*.Hα-helixtrans-62.8-33.1-176.5-63.7-32000113.3K40 K41D37-K40 IonicContact OD1-NZ 3.79Å; D37-K41 WeakPolarHBondContact O-CB 3.32Å; D37-K41 VanDerWaalsContact O-CG 3.27Å; D37-K41 WeakPolarHBondContact O-CG 3.41Å; D37-K41 PolarHBondContact O-N 3.47Å; D37-K41 VanDerWaalsContact O-N 3.07Å
38L88.9Confident85.1Confident140 Ų14057.6 Ų57.673%0.73329%0.291SS*.Hα-helixtrans-66.5-46174.4-17665.7000111.2T36 K41 A42T36-L38 VanDerWaalsContact C-N 3.27Å; T36-L38 PolarHBondContact O-N 3.49Å; L38-K41 PolarHBondContact O-N 3.49Å; L38-A42 WeakPolarHBondContact O-CB 3.42Å; L38-A42 PolarHBondContact O-N 3.48Å
39E89.9Confident85.8Confident27 Ų2758.5 Ų58.513%0.12630%0.302CS..Hα-helixtrans-67.3-40.3-179.8-59.8168.4140.200111.5L35 T36 K41 A42 I43 R289 F293L35-E39 HydrophobicContact CB-CB 4.37Å; L35-E39 HydrophobicContact CD2-CB 3.55Å; T36-E39 WeakPolarHBondContact CB-OE2 3.29Å; T36-E39 WeakPolarHBondContact CG2-OE2 3.47Å; T36-E39 PolarHBondContact N-OE2 2.91Å; T36-E39 PolarHBondContact O-N 3.06Å; T36-E39 VanDerWaalsContact O-N 3.15Å; T36-E39 WeakPolarHBondContact OG1-CG 3.36Å; T36-E39 PolarHBondContact OG1-OE2 3.21Å; E39-K41 VanDerWaalsContact C-N 3.35Å; E39-K41 PolarHBondContact O-N 2.9Å; E39-A42 PolarHBondContact O-N 3.12Å; E39-I43 WeakPolarHBondContact O-CG1 3.4Å; E39-I43 PolarHBondContact O-N 3.31Å; E39-R289 IonicContact OE1-CZ 3.03Å; E39-R289 VanDerWaalsContact OE1-CZ 3.25Å; E39-R289 IonicContact OE1-NE 2.82Å; E39-R289 PolarHBondContact OE1-NE 3.21Å; E39-R289 IonicContact OE1-NH2 3.14Å; E39-R289 PolarHBondContact OE1-NH2 3.28Å; E39-R289 IonicContact OE2-CZ 3.25Å; E39-R289 IonicContact OE2-NE 3.05Å; E39-R289 PolarHBondContact OE2-NE 3.46Å; E39-R289 IonicContact OE2-NH2 2.67Å; E39-R289 PolarHBondContact OE2-NH2 2.83Å; E39-F293 HydrophobicContact CB-CE2 4.09Å; E39-F293 HydrophobicContact CB-CZ 3.74Å; E39-F293 HydrophobicContact CG-CE2 3.86Å; E39-F293 HydrophobicContact CG-CZ 3.66Å
40K86.8Confident86.4Confident31 Ų3159.2 Ų59.214%0.13531%0.311CS..Hα-helixtrans-56.8-48.2172.7-73.6174.6-178.2143.50111.2L35 T36 D37 G44L35-K40 HydrophobicContact CB-CD 4.46Å; L35-K40 HydrophobicContact CB-CG 3.55Å; L35-K40 WeakPolarHBondContact O-CE 3.33Å; L35-K40 PolarHBondContact O-NZ 3.32Å; T36-K40 WeakPolarHBondContact O-CG 3.49Å; T36-K40 PolarHBondContact O-N 2.96Å; D37-K40 IonicContact OD1-NZ 3.79Å; K40-G44 WeakPolarHBondContact O-CA 3.43Å; K40-G44 PolarHBondContact O-N 3.28Å
41K87.8Confident87.1Confident144 Ų14454.9 Ų54.963%0.62629%0.291SS*.Hα-helixtrans-63.8-44.1177.9-74.7174.9-177.6-179.40111.6D37 L38 E39 T45D37-K41 WeakPolarHBondContact O-CB 3.32Å; D37-K41 VanDerWaalsContact O-CG 3.27Å; D37-K41 WeakPolarHBondContact O-CG 3.41Å; D37-K41 PolarHBondContact O-N 3.47Å; D37-K41 VanDerWaalsContact O-N 3.07Å; L38-K41 PolarHBondContact O-N 3.49Å; E39-K41 VanDerWaalsContact C-N 3.35Å; E39-K41 PolarHBondContact O-N 2.9Å; K41-T45 WeakPolarHBondContact O-CB 3.25Å; K41-T45 PolarHBondContact O-N 3.3Å; K41-T45 PolarHBondContact O-OG1 2.98Å
42A90Very high87.8Confident44 Ų4454 Ų5436%0.36429%0.291SS..Hα-helixtrans-62.4-55.3179.900000111.6L38 E39 T45 I46L38-A42 WeakPolarHBondContact O-CB 3.42Å; L38-A42 PolarHBondContact O-N 3.48Å; E39-A42 PolarHBondContact O-N 3.12Å; A42-T45 PolarHBondContact O-N 3.01Å; A42-I46 WeakPolarHBondContact O-CG1 3.47Å; A42-I46 PolarHBondContact O-N 2.81Å
43I88Confident88.4Confident0 Ų056.8 Ų56.80%031%0.307CS..Hα-helixtrans-66.7-41.3-179.8-58175.4000110.9L35 E39 T45 I46 C47 F98 A292 F293 T296L35-I43 HydrophobicContact CD2-CD1 3.52Å; E39-I43 WeakPolarHBondContact O-CG1 3.4Å; E39-I43 PolarHBondContact O-N 3.31Å; I43-T45 VanDerWaalsContact C-N 3.27Å; I43-T45 PolarHBondContact O-N 2.83Å; I43-I46 PolarHBondContact O-N 2.89Å; I43-I46 VanDerWaalsContact O-N 3.13Å; I43-C47 PolarHBondContact O-N 3.23Å; I43-C47 PolarHBondContact O-SG 3.11Å; I43-F98 HydrophobicContact CB-CE1 4.02Å; I43-F98 HydrophobicContact CB-CZ 3.76Å; I43-F98 HydrophobicContact CD1-CZ 4.38Å; I43-F98 HydrophobicContact CG2-CD1 4.3Å; I43-F98 HydrophobicContact CG2-CE1 3.42Å; I43-F98 VanDerWaalsContact CG2-CE1 3.42Å; I43-F98 HydrophobicContact CG2-CE2 3.74Å; I43-F98 HydrophobicContact CG2-CZ 3.09Å; I43-A292 HydrophobicContact CD1-CB 4.16Å; I43-F293 HydrophobicContact CD1-CD1 3.8Å; I43-F293 HydrophobicContact CD1-CD2 4.28Å; I43-F293 HydrophobicContact CD1-CE1 3.8Å; I43-F293 HydrophobicContact CD1-CE2 4.27Å; I43-F293 HydrophobicContact CD1-CG 4.04Å; I43-F293 HydrophobicContact CD1-CZ 4.04Å; I43-F293 HydrophobicContact CG1-CD1 3.85Å; I43-F293 HydrophobicContact CG1-CE1 3.64Å; I43-F293 HydrophobicContact CG1-CZ 4.2Å; I43-T296 HydrophobicContact CB-CG2 4.42Å; I43-T296 HydrophobicContact CG1-CG2 4.37Å; I43-T296 HydrophobicContact CG2-CG2 3.34Å
44G87.7Confident89Confident3 Ų356 Ų563%0.03130%0.303CS..Hα-helixtrans-55.9-42.5175.200000112.1K40 C47 F48K40-G44 WeakPolarHBondContact O-CA 3.43Å; K40-G44 PolarHBondContact O-N 3.28Å; G44-C47 PolarHBondContact O-N 2.85Å; G44-F48 WeakPolarHBondContact O-CB 3.43Å; G44-F48 PolarHBondContact O-N 3.47Å
45T88.8Confident89.4Confident77 Ų7757.4 Ų57.447%0.47231%0.309SS..Hα-helixtrans-65.5-43.3175.9-55.90000111.7K41 A42 I43 C47 F48 L49K41-T45 WeakPolarHBondContact O-CB 3.25Å; K41-T45 PolarHBondContact O-N 3.3Å; K41-T45 PolarHBondContact O-OG1 2.98Å; A42-T45 PolarHBondContact O-N 3.01Å; I43-T45 VanDerWaalsContact C-N 3.27Å; I43-T45 PolarHBondContact O-N 2.83Å; T45-C47 PolarHBondContact O-N 2.81Å; T45-F48 PolarHBondContact O-N 2.64Å; T45-L49 HydrophobicContact CG2-CD1 3.82Å; T45-L49 HydrophobicContact CG2-CG 4.35Å; T45-L49 WeakPolarHBondContact O-CB 3.38Å; T45-L49 WeakPolarHBondContact O-CG 3.34Å; T45-L49 PolarHBondContact O-N 3.22Å
46I89.6Confident89.8Confident81 Ų8163.1 Ų63.142%0.41534%0.338SS..Hα-helixtrans-59.8-47.8176.4-67.4166.2000110.7A42 I43 G50A42-I46 WeakPolarHBondContact O-CG1 3.47Å; A42-I46 PolarHBondContact O-N 2.81Å; I43-I46 PolarHBondContact O-N 2.89Å; I43-I46 VanDerWaalsContact O-N 3.13Å; I46-G50 WeakPolarHBondContact O-CA 3.28Å; I46-G50 PolarHBondContact O-N 3.35Å
47C89.3Confident90Very high0 Ų063 Ų630%033%0.333CS..Hα-helixtrans-66.8-41.3178.6-69.50000112.1I43 G44 T45 G51 T95 F98I43-C47 PolarHBondContact O-N 3.23Å; I43-C47 PolarHBondContact O-SG 3.11Å; G44-C47 PolarHBondContact O-N 2.85Å; T45-C47 PolarHBondContact O-N 2.81Å; C47-G51 WeakPolarHBondContact O-CA 3.36Å; C47-G51 PolarHBondContact O-N 3.24Å; C47-T95 HydrophobicContact CB-CG2 4.39Å; C47-T95 VanDerWaalsContact O-CG2 3.31Å; C47-T95 WeakPolarHBondContact O-CG2 3.27Å; C47-F98 HydrophobicContact CB-CD1 4.29Å
48F88.3Confident90.4Very high136 Ų13657.7 Ų57.760%0.59631%0.305SS*.Hα-helixtrans-66.6-37.4-178.5-175.7-97.9000112.8G44 T45 P52 L99G44-F48 WeakPolarHBondContact O-CB 3.43Å; G44-F48 PolarHBondContact O-N 3.47Å; T45-F48 PolarHBondContact O-N 2.64Å; F48-P52 WeakPolarHBondContact O-CD 3.28Å; F48-P52 VanDerWaalsContact O-CG 3.25Å; F48-P52 WeakPolarHBondContact O-CG 3.45Å; F48-L99 HydrophobicContact CB-CD2 4.48Å; F48-L99 HydrophobicContact CD2-CD1 4.12Å
49L90.1Very high90.7Very high104 Ų10454.6 Ų54.655%0.54529%0.291SS..Hα-helixtrans-86.4-47.1177-63.6177.3000112T45 I53T45-L49 HydrophobicContact CG2-CD1 3.82Å; T45-L49 HydrophobicContact CG2-CG 4.35Å; T45-L49 WeakPolarHBondContact O-CB 3.38Å; T45-L49 WeakPolarHBondContact O-CG 3.34Å; T45-L49 PolarHBondContact O-N 3.22Å; L49-I53 WeakPolarHBondContact O-CD1 3.42Å; L49-I53 VanDerWaalsContact O-CG1 3.29Å; L49-I53 WeakPolarHBondContact O-CG1 3.35Å
50G89.8Confident90.9Very high21 Ų2157.2 Ų57.222%0.21631%0.306CS..Hα-helixtrans-69.5-39.9-175.900000113.1I46 I53 T54I46-G50 WeakPolarHBondContact O-CA 3.28Å; I46-G50 PolarHBondContact O-N 3.35Å; G50-I53 PolarHBondContact O-N 2.94Å; G50-T54 PolarHBondContact O-N 3.28Å; G50-T54 PolarHBondContact O-OG1 2.97Å
51G91Very high91.2Very high3 Ų356 Ų563%0.03130%0.301CS..Hα-helixtrans-56-54.5-178.300000113.8C47 I53 T54 L55 T95C47-G51 WeakPolarHBondContact O-CA 3.36Å; C47-G51 PolarHBondContact O-N 3.24Å; G51-I53 VanDerWaalsContact C-N 3.33Å; G51-I53 PolarHBondContact O-N 3.48Å; G51-T54 PolarHBondContact O-N 2.88Å; G51-L55 WeakPolarHBondContact O-CB 3.47Å; G51-L55 PolarHBondContact O-N 3.48Å; G51-T95 WeakPolarHBondContact CA-OG1 3.24Å
52P91.8Very high91.6Very high70 Ų7051.4 Ų51.446%0.45528%0.283SS..Hα-helixtrans-62-36.3177.4-26.336.1000113.8F48 L55 M56F48-P52 WeakPolarHBondContact O-CD 3.28Å; F48-P52 VanDerWaalsContact O-CG 3.25Å; F48-P52 WeakPolarHBondContact O-CG 3.45Å; P52-L55 PolarHBondContact O-N 3.42Å; P52-M56 WeakPolarHBondContact O-CB 3.45Å; P52-M56 PolarHBondContact O-N 2.98Å
53I92.5Very high91.7Very high85 Ų8550.9 Ų50.944%0.43628%0.282SS..Hα-helixtrans-64.1-52.5176.7-65.4169.1000109.6L49 G50 G51 L55 M56 E57L49-I53 WeakPolarHBondContact O-CD1 3.42Å; L49-I53 VanDerWaalsContact O-CG1 3.29Å; L49-I53 WeakPolarHBondContact O-CG1 3.35Å; G50-I53 PolarHBondContact O-N 2.94Å; G51-I53 VanDerWaalsContact C-N 3.33Å; G51-I53 PolarHBondContact O-N 3.48Å; I53-L55 VanDerWaalsContact C-N 3.27Å; I53-L55 PolarHBondContact O-N 2.96Å; I53-M56 PolarHBondContact O-N 3.24Å; I53-M56 VanDerWaalsContact O-N 3.13Å; I53-E57 HydrophobicContact CG2-CG 4.44Å; I53-E57 WeakPolarHBondContact O-CG 3.39Å; I53-E57 PolarHBondContact O-N 2.89Å
54T92.7Very high91.9Very high2 Ų251 Ų511%0.01228%0.282CS..Hα-helixtrans-58.4-40.2178-55.30000111.8G50 G51 N58 S91 L299 A303G50-T54 PolarHBondContact O-N 3.28Å; G50-T54 PolarHBondContact O-OG1 2.97Å; G51-T54 PolarHBondContact O-N 2.88Å; T54-N58 WeakPolarHBondContact O-CB 3.41Å; T54-N58 PolarHBondContact O-N 3.35Å; T54-N58 VanDerWaalsContact O-N 3.11Å; T54-N58 PolarHBondContact O-ND2 3.34Å; T54-S91 VanDerWaalsContact CG2-OG 3.29Å; T54-S91 WeakPolarHBondContact CG2-OG 3.35Å; T54-L299 HydrophobicContact CG2-CD1 4.47Å; T54-A303 HydrophobicContact CG2-CB 4.35Å; T54-A303 WeakPolarHBondContact OG1-CB 3.31Å
55L94.4Very high92.2Very high56 Ų5651.3 Ų51.329%0.29328%0.283SS..Hα-helixtrans-60.8-51.6175177.363.4000111.1G51 P52 I53 E57 N58 V59 V88G51-L55 WeakPolarHBondContact O-CB 3.47Å; G51-L55 PolarHBondContact O-N 3.48Å; P52-L55 PolarHBondContact O-N 3.42Å; I53-L55 VanDerWaalsContact C-N 3.27Å; I53-L55 PolarHBondContact O-N 2.96Å; L55-E57 PolarHBondContact O-N 3.35Å; L55-N58 PolarHBondContact O-N 3.48Å; L55-V59 HydrophobicContact CD1-CG2 4.04Å; L55-V59 HydrophobicContact CG-CG2 4.45Å; L55-V59 WeakPolarHBondContact O-CB 3.34Å; L55-V59 VanDerWaalsContact O-CG2 3.24Å; L55-V59 WeakPolarHBondContact O-CG2 3.24Å; L55-V59 PolarHBondContact O-N 3.39Å; L55-V88 HydrophobicContact CD1-CB 4.24Å; L55-V88 HydrophobicContact CD1-CG1 3.73Å; L55-V88 HydrophobicContact CD1-CG2 4.16Å
56M93.9Very high92.4Very high128 Ų12850.4 Ų50.463%0.63128%0.283SS*.Hα-helixtrans-60.4-45.1-178.2-177.6179.265.300111.8P52 I53 V59 L60P52-M56 WeakPolarHBondContact O-CB 3.45Å; P52-M56 PolarHBondContact O-N 2.98Å; I53-M56 PolarHBondContact O-N 3.24Å; I53-M56 VanDerWaalsContact O-N 3.13Å; M56-V59 PolarHBondContact O-N 3.35Å; M56-L60 WeakPolarHBondContact O-CB 3.4Å; M56-L60 PolarHBondContact O-N 3.03Å
57E92.9Very high92.4Very high57 Ų5751 Ų5127%0.26629%0.291SS..Hα-helixtrans-63.7-45.4179.7-69.4177.6156.900111.8I53 L55 L60 I61 P306I53-E57 HydrophobicContact CG2-CG 4.44Å; I53-E57 WeakPolarHBondContact O-CG 3.39Å; I53-E57 PolarHBondContact O-N 2.89Å; L55-E57 PolarHBondContact O-N 3.35Å; E57-L60 WeakPolarHBondContact O-CB 3.36Å; E57-L60 PolarHBondContact O-N 3.23Å; E57-I61 WeakPolarHBondContact O-CG1 3.46Å; E57-I61 PolarHBondContact O-N 3.05Å; E57-P306 HydrophobicContact CB-CB 4.2Å; E57-P306 HydrophobicContact CB-CG 4.03Å
58N94.9Very high92.5Very high3 Ų352.3 Ų52.32%0.01630%0.3CS..Hα-helixtrans-71.6-35.3179.9-77.4-74.3000112.7T54 L55 L60 I61 L62 A84 D87 V88 S302 P306T54-N58 WeakPolarHBondContact O-CB 3.41Å; T54-N58 PolarHBondContact O-N 3.35Å; T54-N58 VanDerWaalsContact O-N 3.11Å; T54-N58 PolarHBondContact O-ND2 3.34Å; L55-N58 PolarHBondContact O-N 3.48Å; N58-L60 VanDerWaalsContact C-N 3.32Å; N58-L60 PolarHBondContact O-N 3.3Å; N58-I61 PolarHBondContact O-N 2.85Å; N58-L62 WeakPolarHBondContact O-CG 3.49Å; N58-L62 PolarHBondContact O-N 3.42Å; N58-A84 HydrophobicContact CB-CB 4.39Å; N58-D87 HydrophobicContact CB-CB 4.33Å; N58-V88 HydrophobicContact CB-CG2 3.8Å; N58-S302 PolarHBondContact ND2-O 3.15Å; N58-P306 WeakPolarHBondContact OD1-CG 3.32Å
59V95.4Very high92.5Very high75 Ų7548.1 Ų48.146%0.45529%0.291SS..Hα-helixtrans-62.1-40.4170.4169.20000111L55 M56 L62 G63 V88L55-V59 HydrophobicContact CD1-CG2 4.04Å; L55-V59 HydrophobicContact CG-CG2 4.45Å; L55-V59 WeakPolarHBondContact O-CB 3.34Å; L55-V59 VanDerWaalsContact O-CG2 3.24Å; L55-V59 WeakPolarHBondContact O-CG2 3.24Å; L55-V59 PolarHBondContact O-N 3.39Å; M56-V59 PolarHBondContact O-N 3.35Å; V59-L62 WeakPolarHBondContact O-CB 3.31Å; V59-L62 PolarHBondContact O-N 3.08Å; V59-G63 PolarHBondContact O-N 3.43Å; V59-V88 HydrophobicContact CG2-CG2 3.75Å
60L93.5Very high92.5Very high82 Ų8248 Ų4843%0.42929%0.289SS..Hα-helixtrans-61.6-44.7175.7177.663.1000111.5M56 E57 N58 L62 G63 V64 L320M56-L60 WeakPolarHBondContact O-CB 3.4Å; M56-L60 PolarHBondContact O-N 3.03Å; E57-L60 WeakPolarHBondContact O-CB 3.36Å; E57-L60 PolarHBondContact O-N 3.23Å; N58-L60 VanDerWaalsContact C-N 3.32Å; N58-L60 PolarHBondContact O-N 3.3Å; L60-L62 VanDerWaalsContact C-N 3.34Å; L60-L62 PolarHBondContact O-N 2.89Å; L60-G63 PolarHBondContact O-N 3.24Å; L60-V64 HydrophobicContact CD1-CG2 4.27Å; L60-V64 WeakPolarHBondContact O-CG2 3.49Å; L60-V64 PolarHBondContact O-N 2.97Å; L60-L320 HydrophobicContact CD2-CD1 3.94Å; L60-L320 HydrophobicContact CG-CD1 4.22Å
61I93.8Very high92.4Very high5 Ų547 Ų473%0.02628%0.279CS..Hα-helixtrans-59-46.1175.5-64.1-52.8000111E57 N58 G63 V64 I65 I80 A84 P306 L316 L320E57-I61 WeakPolarHBondContact O-CG1 3.46Å; E57-I61 PolarHBondContact O-N 3.05Å; N58-I61 PolarHBondContact O-N 2.85Å; I61-G63 PolarHBondContact O-N 3.13Å; I61-V64 PolarHBondContact O-N 2.91Å; I61-I65 HydrophobicContact CG2-CD1 3.79Å; I61-I65 WeakPolarHBondContact O-CG1 3.49Å; I61-I65 PolarHBondContact O-N 3.4Å; I61-I80 HydrophobicContact CG2-CG2 4.23Å; I61-A84 HydrophobicContact CB-CB 4.27Å; I61-A84 HydrophobicContact CG2-CB 4.01Å; I61-P306 HydrophobicContact CD1-CB 4.28Å; I61-P306 HydrophobicContact CG1-CB 3.82Å; I61-P306 HydrophobicContact CG1-CG 4.2Å; I61-L316 HydrophobicContact CD1-CD2 4.27Å; I61-L320 HydrophobicContact CD1-CD1 4.4Å
62L94.7Very high92.4Very high47 Ų4751.3 Ų51.325%0.24629%0.294CS..Hα-helixtrans-58.7-46.1174.9-73.4174.2000111.7N58 V59 L60 V64 I65 A66 G81 A84 L85 V88N58-L62 WeakPolarHBondContact O-CG 3.49Å; N58-L62 PolarHBondContact O-N 3.42Å; V59-L62 WeakPolarHBondContact O-CB 3.31Å; V59-L62 PolarHBondContact O-N 3.08Å; L60-L62 VanDerWaalsContact C-N 3.34Å; L60-L62 PolarHBondContact O-N 2.89Å; L62-V64 PolarHBondContact O-N 2.91Å; L62-I65 PolarHBondContact O-N 3.45Å; L62-A66 WeakPolarHBondContact O-CB 3.48Å; L62-A66 PolarHBondContact O-N 3.11Å; L62-G81 VanDerWaalsContact CD2-O 3.25Å; L62-G81 WeakPolarHBondContact CD2-O 2.97Å; L62-A84 HydrophobicContact CD2-CB 4.02Å; L62-A84 HydrophobicContact CG-CB 3.9Å; L62-L85 HydrophobicContact CD1-CB 4.36Å; L62-L85 HydrophobicContact CD1-CD1 4.29Å; L62-L85 HydrophobicContact CD2-CB 4.3Å; L62-V88 HydrophobicContact CD1-CG2 4.02Å
63G93.5Very high92.3Very high33 Ų3356.8 Ų56.834%0.3431%0.305SS..Hα-helixtrans-60-43.8178.200000112.8V59 L60 I61 A66 T67V59-G63 PolarHBondContact O-N 3.43Å; L60-G63 PolarHBondContact O-N 3.24Å; I61-G63 PolarHBondContact O-N 3.13Å; G63-A66 PolarHBondContact O-N 2.96Å; G63-T67 WeakPolarHBondContact O-CB 3.42Å; G63-T67 VanDerWaalsContact O-CG2 3.3Å; G63-T67 WeakPolarHBondContact O-CG2 3.47Å; G63-T67 PolarHBondContact O-N 2.88Å; G63-T67 PolarHBondContact O-OG1 3.19Å
64V92.2Very high92.2Very high2 Ų256.2 Ų56.21%0.01230%0.3CS..Hα-helixtrans-64.5-43.4177.7172.90000111.5L60 I61 L62 T67 S68 L316 A319 L320 C323L60-V64 HydrophobicContact CD1-CG2 4.27Å; L60-V64 WeakPolarHBondContact O-CG2 3.49Å; L60-V64 PolarHBondContact O-N 2.97Å; I61-V64 PolarHBondContact O-N 2.91Å; L62-V64 PolarHBondContact O-N 2.91Å; V64-T67 PolarHBondContact O-OG1 2.8Å; V64-S68 VanDerWaalsContact O-CB 3.31Å; V64-S68 WeakPolarHBondContact O-CB 3.28Å; V64-S68 PolarHBondContact O-N 3.36Å; V64-L316 HydrophobicContact CG1-CD1 3.88Å; V64-A319 HydrophobicContact CG1-CB 3.59Å; V64-L320 HydrophobicContact CG2-CB 4.35Å; V64-L320 HydrophobicContact CG2-CD1 4.42Å; V64-C323 HydrophobicContact CG2-CB 4.48Å
65I93.1Very high92.1Very high10 Ų1057.2 Ų57.25%0.05131%0.306CS..Hα-helixtrans-67.8-40176.8-64.8168.4000110.7I61 L62 L71 I80 L316I61-I65 HydrophobicContact CG2-CD1 3.79Å; I61-I65 WeakPolarHBondContact O-CG1 3.49Å; I61-I65 PolarHBondContact O-N 3.4Å; L62-I65 PolarHBondContact O-N 3.45Å; I65-L71 HydrophobicContact CG1-CD2 4.39Å; I65-I80 HydrophobicContact CD1-CB 4.45Å; I65-I80 HydrophobicContact CD1-CG2 4.07Å; I65-L316 HydrophobicContact CG1-CD1 4.29Å
66A92.3Very high92Very high58 Ų5855.3 Ų55.348%0.47930%0.298SS..Hα-helixtrans-68-36.8-179.900000112L62 G63 R72L62-A66 WeakPolarHBondContact O-CB 3.48Å; L62-A66 PolarHBondContact O-N 3.11Å; G63-A66 PolarHBondContact O-N 2.96Å; A66-R72 PolarHBondContact O-NE 3.5Å; A66-R72 VanDerWaalsContact O-NE 3.17Å; A66-R72 PolarHBondContact O-NH2 3.33Å
67T90.5Very high91.9Very high95 Ų9550 Ų5058%0.58327%0.271SS*.Hα-helixtrans-81.5-32.8179.850.80000112.8G63 V64 A69G63-T67 WeakPolarHBondContact O-CB 3.42Å; G63-T67 VanDerWaalsContact O-CG2 3.3Å; G63-T67 WeakPolarHBondContact O-CG2 3.47Å; G63-T67 PolarHBondContact O-N 2.88Å; G63-T67 PolarHBondContact O-OG1 3.19Å; V64-T67 PolarHBondContact O-OG1 2.8Å; T67-A69 PolarHBondContact O-N 3.36Å
68S90.6Very high92Very high26 Ų2648.3 Ų48.318%0.18226%0.263CS..  trans-85.2107.4-179-175.90000113.3V64 M70 L71 R72V64-S68 VanDerWaalsContact O-CB 3.31Å; V64-S68 WeakPolarHBondContact O-CB 3.28Å; V64-S68 PolarHBondContact O-N 3.36Å; S68-M70 PolarHBondContact O-N 3.07Å; S68-L71 PolarHBondContact O-N 3.35Å; S68-L71 WeakPolarHBondContact OG-CD1 3.49Å; S68-L71 PolarHBondContact OG-N 3.11Å; S68-R72 PolarHBondContact O-N 2.95Å
69A88.4Confident92Very high49 Ų4948.4 Ų48.441%0.40526%0.264SS..Hα-helixtrans-60-30.7175.300000113T67 R73T67-A69 PolarHBondContact O-N 3.36Å; A69-R73 VanDerWaalsContact O-CG 3.31Å; A69-R73 WeakPolarHBondContact O-CG 3.37Å; A69-R73 PolarHBondContact O-N 3.34Å
70M89.5Confident91.9Very high102 Ų10244.9 Ų44.950%0.50224%0.242SC..Hα-helixtrans-66.9-47.4177.2-177.2-174.269.900111.4S68 E315S68-M70 PolarHBondContact O-N 3.07Å; M70-E315 HydrophobicContact CE-CB 4.17Å
71L89.3Confident92Very high0 Ų041.5 Ų41.50%023%0.227CC..Hα-helixtrans-67.7-46.7179.6-80.692.1000111I65 S68 R73 K74 Y77 L316 A319I65-L71 HydrophobicContact CG1-CD2 4.39Å; S68-L71 PolarHBondContact O-N 3.35Å; S68-L71 WeakPolarHBondContact OG-CD1 3.49Å; S68-L71 PolarHBondContact OG-N 3.11Å; L71-R73 PolarHBondContact O-N 3.33Å; L71-R73 VanDerWaalsContact O-N 3.11Å; L71-K74 PolarHBondContact O-N 2.92Å; L71-Y77 HydrophobicContact CB-CD2 4.11Å; L71-Y77 HydrophobicContact CB-CG 4.15Å; L71-Y77 HydrophobicContact CD2-CD1 3.63Å; L71-Y77 HydrophobicContact CD2-CD2 4.27Å; L71-Y77 HydrophobicContact CD2-CE1 3.59Å; L71-Y77 HydrophobicContact CD2-CE2 4.23Å; L71-Y77 HydrophobicContact CD2-CG 4Å; L71-Y77 HydrophobicContact CG-CD1 4.34Å; L71-Y77 HydrophobicContact CG-CD2 4.1Å; L71-Y77 HydrophobicContact CG-CE1 4.32Å; L71-Y77 HydrophobicContact CG-CE2 4.07Å; L71-Y77 HydrophobicContact CG-CG 4.24Å; L71-L316 HydrophobicContact CD2-CB 4.25Å; L71-L316 HydrophobicContact CD2-CD1 3.62Å; L71-A319 HydrophobicContact CD1-CB 3.75Å
72R91.1Very high92.1Very high92 Ų9241.6 Ų41.635%0.34723%0.228SC..Hα-helixtrans-63.3-20.8-176.5-150.5-170.2-40.4119.411.6114.4A66 S68 R154A66-R72 PolarHBondContact O-NE 3.5Å; A66-R72 VanDerWaalsContact O-NE 3.17Å; A66-R72 PolarHBondContact O-NH2 3.33Å; S68-R72 PolarHBondContact O-N 2.95Å; R72-R154 PolarHBondContact O-NH1 3.37Å
73R89.1Confident92.2Very high185 Ų18539.3 Ų39.370%0.69822%0.216SC*.Hα-helixtrans-78.4-22.5176.3-79.5-180178.5162.21.2113.1A69 L71A69-R73 VanDerWaalsContact O-CG 3.31Å; A69-R73 WeakPolarHBondContact O-CG 3.37Å; A69-R73 PolarHBondContact O-N 3.34Å; L71-R73 PolarHBondContact O-N 3.33Å; L71-R73 VanDerWaalsContact O-N 3.11Å
74K90.3Very high92.3Very high74 Ų7437.9 Ų37.932%0.32220%0.201SC..SBendtrans-89.6126.3-177.2-72.9-179.8-177.3-169.50110.6L71 S76 Y77 E315L71-K74 PolarHBondContact O-N 2.92Å; K74-S76 VanDerWaalsContact C-N 3.33Å; K74-S76 PolarHBondContact O-N 3.38Å; K74-Y77 HydrophobicContact CB-CD2 3.81Å; K74-Y77 HydrophobicContact CB-CE2 4.4Å; K74-Y77 HydrophobicContact CD-CD2 4.09Å; K74-Y77 HydrophobicContact CD-CE2 3.85Å; K74-Y77 PolarHBondContact O-N 2.95Å; K74-E315 IonicContact NZ-OE1 3.74Å; K74-E315 PolarHBondContact NZ-OE1 2.98Å; K74-E315 IonicContact NZ-OE2 2.66Å; K74-E315 PolarHBondContact NZ-OE2 3.23Å
75P91.6Very high92.5Very high23 Ų2340.9 Ų40.915%0.14922%0.216CC..Hα-helixtrans-55.6-40.7-177.3-27.635.3000114.5Y77 L78 F79 L152 A157P75-Y77 VanDerWaalsContact C-N 3.26Å; P75-Y77 PolarHBondContact O-N 3.31Å; P75-L78 VanDerWaalsContact O-CB 3.28Å; P75-L78 WeakPolarHBondContact O-CB 3.43Å; P75-L78 PolarHBondContact O-N 3.27Å; P75-F79 PolarHBondContact O-N 2.93Å; P75-L152 HydrophobicContact CB-CD1 4.44Å; P75-L152 HydrophobicContact CB-CD2 3.78Å; P75-L152 HydrophobicContact CB-CG 3.76Å; P75-L152 HydrophobicContact CG-CD2 4.43Å; P75-L152 HydrophobicContact CG-CG 4.23Å; P75-A157 HydrophobicContact CB-CB 3.85Å
76S90.9Very high92.7Very high16 Ų1640.4 Ų40.411%0.11221%0.214CC..Hα-helixtrans-61.2-31.8-177.3-40.60000113.4K74 L78 F79 I80 D137 Y148K74-S76 VanDerWaalsContact C-N 3.33Å; K74-S76 PolarHBondContact O-N 3.38Å; S76-L78 VanDerWaalsContact C-N 3.31Å; S76-F79 PolarHBondContact O-N 3.35Å; S76-I80 PolarHBondContact O-N 2.86Å; S76-D137 WeakPolarHBondContact CB-OD2 3.3Å; S76-D137 PolarHBondContact OG-OD1 3.2Å; S76-D137 PolarHBondContact OG-OD2 2.95Å; S76-Y148 PolarHBondContact OG-OH 3.49Å; S76-Y148 VanDerWaalsContact OG-OH 3.12Å
77Y92.7Very high92.9Very high17 Ų1737.6 Ų37.67%0.06719%0.191CC..Hα-helixtrans-76.9-17.4175.7-69.6-71.6000113L71 K74 P75 I80 G81 C313 E315 L316L71-Y77 HydrophobicContact CB-CD2 4.11Å; L71-Y77 HydrophobicContact CB-CG 4.15Å; L71-Y77 HydrophobicContact CD2-CD1 3.63Å; L71-Y77 HydrophobicContact CD2-CD2 4.27Å; L71-Y77 HydrophobicContact CD2-CE1 3.59Å; L71-Y77 HydrophobicContact CD2-CE2 4.23Å; L71-Y77 HydrophobicContact CD2-CG 4Å; L71-Y77 HydrophobicContact CG-CD1 4.34Å; L71-Y77 HydrophobicContact CG-CD2 4.1Å; L71-Y77 HydrophobicContact CG-CE1 4.32Å; L71-Y77 HydrophobicContact CG-CE2 4.07Å; L71-Y77 HydrophobicContact CG-CG 4.24Å; K74-Y77 HydrophobicContact CB-CD2 3.81Å; K74-Y77 HydrophobicContact CB-CE2 4.4Å; K74-Y77 HydrophobicContact CD-CD2 4.09Å; K74-Y77 HydrophobicContact CD-CE2 3.85Å; K74-Y77 PolarHBondContact O-N 2.95Å; P75-Y77 VanDerWaalsContact C-N 3.26Å; P75-Y77 PolarHBondContact O-N 3.31Å; Y77-I80 HydrophobicContact CD1-CD1 3.84Å; Y77-I80 HydrophobicContact CE1-CD1 4.2Å; Y77-G81 PolarHBondContact O-N 2.96Å; Y77-C313 HydrophobicContact CE1-CB 4.44Å; Y77-E315 WeakPolarHBondContact CE2-OE2 3.46Å; Y77-E315 WeakPolarHBondContact OH-CB 3.28Å; Y77-E315 PolarHBondContact OH-OE2 3.48Å; Y77-L316 HydrophobicContact CE1-CB 4.2Å
78L94.8Very high93.1Very high20 Ų2034.1 Ų34.111%0.10517%0.17CC..Hα-helixtrans-70.3-37.3171-58.6174.3000110.9P75 S76 G81 S82 R154 M158 L161P75-L78 VanDerWaalsContact O-CB 3.28Å; P75-L78 WeakPolarHBondContact O-CB 3.43Å; P75-L78 PolarHBondContact O-N 3.27Å; S76-L78 VanDerWaalsContact C-N 3.31Å; L78-G81 PolarHBondContact O-N 3.36Å; L78-S82 WeakPolarHBondContact O-CB 3.39Å; L78-S82 PolarHBondContact O-N 2.92Å; L78-R154 HydrophobicContact CD1-CG 3.94Å; L78-M158 HydrophobicContact CD1-CG 4.01Å; L78-M158 HydrophobicContact CD1-SD 3.79Å; L78-M158 HydrophobicContact CD2-SD 4.31Å; L78-L161 HydrophobicContact CB-CD1 3.98Å
79F94.8Very high93.4Very high6 Ų636.3 Ų36.33%0.02618%0.176CC..Hα-helixtrans-66.1-41.5173.5-57.6-38.1000111.9P75 S76 G81 S82 L83 L133 D137 L152 A157 L161P75-F79 PolarHBondContact O-N 2.93Å; S76-F79 PolarHBondContact O-N 3.35Å; F79-G81 VanDerWaalsContact C-N 3.34Å; F79-S82 WeakPolarHBondContact O-CB 3.47Å; F79-S82 PolarHBondContact O-N 2.84Å; F79-L83 PolarHBondContact O-N 2.86Å; F79-L133 HydrophobicContact CD1-CB 3.83Å; F79-L133 HydrophobicContact CD1-CD1 3.95Å; F79-L133 HydrophobicContact CD2-CB 4.33Å; F79-L133 HydrophobicContact CE1-CB 3.99Å; F79-L133 HydrophobicContact CE1-CD1 3.88Å; F79-L133 HydrophobicContact CE1-CG 4.38Å; F79-L133 HydrophobicContact CE2-CB 4.46Å; F79-L133 HydrophobicContact CG-CB 4.02Å; F79-L133 HydrophobicContact CZ-CB 4.3Å; F79-D137 HydrophobicContact CD2-CB 4.05Å; F79-D137 HydrophobicContact CE2-CB 4.02Å; F79-L152 HydrophobicContact CE2-CD1 4.03Å; F79-L152 HydrophobicContact CZ-CD1 4.1Å; F79-A157 HydrophobicContact CE1-CB 3.85Å; F79-A157 HydrophobicContact CZ-CB 3.71Å; F79-L161 HydrophobicContact CD1-CD1 4.2Å; F79-L161 HydrophobicContact CD1-CD2 3.86Å; F79-L161 HydrophobicContact CD1-CG 3.98Å; F79-L161 HydrophobicContact CE1-CD2 4.36Å; F79-L161 HydrophobicContact CE1-CG 4.13Å
80I93.3Very high93.6Very high1 Ų134.1 Ų34.11%0.00516%0.158CC..Hα-helixtrans-62.5-42.5173.5-63.3170.7000110.8I61 I65 S76 Y77 L83 A84 Y309I61-I80 HydrophobicContact CG2-CG2 4.23Å; I65-I80 HydrophobicContact CD1-CB 4.45Å; I65-I80 HydrophobicContact CD1-CG2 4.07Å; S76-I80 PolarHBondContact O-N 2.86Å; Y77-I80 HydrophobicContact CD1-CD1 3.84Å; Y77-I80 HydrophobicContact CE1-CD1 4.2Å; I80-L83 PolarHBondContact O-N 2.64Å; I80-A84 PolarHBondContact O-N 3.12Å; I80-Y309 HydrophobicContact CD1-CD1 3.98Å; I80-Y309 HydrophobicContact CD1-CE1 4.11Å; I80-Y309 HydrophobicContact CG1-CD1 4.19Å; I80-Y309 HydrophobicContact CG1-CE1 3.88Å; I80-Y309 HydrophobicContact CG2-CD1 4.37Å; I80-Y309 HydrophobicContact CG2-CD2 3.79Å; I80-Y309 HydrophobicContact CG2-CE1 4.44Å; I80-Y309 HydrophobicContact CG2-CE2 3.86Å; I80-Y309 HydrophobicContact CG2-CG 4.07Å
81G95.5Very high93.8Very high10 Ų1029.5 Ų29.510%0.10314%0.136CC..Hα-helixtrans-62.6-4117500000112.7L62 Y77 L78 F79 L83 A84 L85L62-G81 VanDerWaalsContact CD2-O 3.25Å; L62-G81 WeakPolarHBondContact CD2-O 2.97Å; Y77-G81 PolarHBondContact O-N 2.96Å; L78-G81 PolarHBondContact O-N 3.36Å; F79-G81 VanDerWaalsContact C-N 3.34Å; G81-L83 VanDerWaalsContact C-N 3.35Å; G81-L83 PolarHBondContact O-N 3.33Å; G81-A84 PolarHBondContact O-N 3.43Å; G81-L85 WeakPolarHBondContact O-CB 3.29Å; G81-L85 PolarHBondContact O-N 2.87Å
82S97.1Very high94Very high7 Ų731.9 Ų31.95%0.04915%0.152CC..Hα-helixtrans-61.1-43174.1-178.80000112.1L78 F79 L85 A86 S130 L161 W165L78-S82 WeakPolarHBondContact O-CB 3.39Å; L78-S82 PolarHBondContact O-N 2.92Å; F79-S82 WeakPolarHBondContact O-CB 3.47Å; F79-S82 PolarHBondContact O-N 2.84Å; S82-L85 PolarHBondContact O-N 3.22Å; S82-A86 PolarHBondContact O-N 2.93Å; S82-S130 PolarHBondContact OG-OG 3.16Å; S82-L161 VanDerWaalsContact OG-CD2 3.31Å; S82-L161 WeakPolarHBondContact OG-CD2 3.11Å; S82-W165 PolarHBondContact OG-NE1 3.49Å
83L94.9Very high94.1Very high0 Ų029.4 Ų29.40%014%0.144CC..Hα-helixtrans-62.3-47.7175.6-178.363.2000111.6F79 I80 G81 L85 A86 D87 S127 L131 N305 Y309F79-L83 PolarHBondContact O-N 2.86Å; I80-L83 PolarHBondContact O-N 2.64Å; G81-L83 VanDerWaalsContact C-N 3.35Å; G81-L83 PolarHBondContact O-N 3.33Å; L83-L85 VanDerWaalsContact C-N 3.27Å; L83-L85 PolarHBondContact O-N 3.41Å; L83-A86 WeakPolarHBondContact O-CB 3.43Å; L83-A86 PolarHBondContact O-N 2.85Å; L83-A86 VanDerWaalsContact O-N 3.11Å; L83-D87 PolarHBondContact O-N 3.09Å; L83-S127 WeakPolarHBondContact CD1-O 3.32Å; L83-S127 WeakPolarHBondContact CD1-OG 3.31Å; L83-L131 HydrophobicContact CD1-CG 4.1Å; L83-L131 HydrophobicContact CD2-CD2 3.69Å; L83-L131 HydrophobicContact CD2-CG 4.18Å; L83-N305 HydrophobicContact CD2-CB 4.2Å; L83-Y309 HydrophobicContact CD2-CE2 3.88Å; L83-Y309 WeakPolarHBondContact CD2-OH 3.32Å
84A95.9Very high94.2Very high3 Ų321.6 Ų21.63%0.02512%0.115CC..Hα-helixtrans-60.3-38177.700000111.8N58 I61 L62 I80 G81 D87 V88N58-A84 HydrophobicContact CB-CB 4.39Å; I61-A84 HydrophobicContact CB-CB 4.27Å; I61-A84 HydrophobicContact CG2-CB 4.01Å; L62-A84 HydrophobicContact CD2-CB 4.02Å; L62-A84 HydrophobicContact CG-CB 3.9Å; I80-A84 PolarHBondContact O-N 3.12Å; G81-A84 PolarHBondContact O-N 3.43Å; A84-D87 PolarHBondContact O-N 2.12Å; A84-V88 WeakPolarHBondContact O-CG2 3.4Å; A84-V88 PolarHBondContact O-N 3Å
85L97.4Very high94Very high64 Ų6418.7 Ų18.734%0.33510%0.103SC..Hα-helixtrans-64.6-42.6174.1-178.161.8000112.2L62 G81 S82 L83 D87 V88 F89 W165L62-L85 HydrophobicContact CD1-CB 4.36Å; L62-L85 HydrophobicContact CD1-CD1 4.29Å; L62-L85 HydrophobicContact CD2-CB 4.3Å; G81-L85 WeakPolarHBondContact O-CB 3.29Å; G81-L85 PolarHBondContact O-N 2.87Å; S82-L85 PolarHBondContact O-N 3.22Å; L83-L85 VanDerWaalsContact C-N 3.27Å; L83-L85 PolarHBondContact O-N 3.41Å; L85-D87 VanDerWaalsContact C-N 3.34Å; L85-V88 PolarHBondContact O-N 3.21Å; L85-F89 HydrophobicContact CD1-CD2 4.18Å; L85-F89 HydrophobicContact CD1-CE2 3.72Å; L85-F89 HydrophobicContact CD1-CZ 4.47Å; L85-F89 HydrophobicContact CD2-CE2 4.37Å; L85-F89 HydrophobicContact CG-CD2 4.1Å; L85-F89 HydrophobicContact CG-CE2 3.82Å; L85-F89 VanDerWaalsContact O-CD2 3.24Å; L85-F89 WeakPolarHBondContact O-CD2 3.24Å; L85-F89 PolarHBondContact O-N 3.4Å; L85-F89 VanDerWaalsContact O-N 3.07Å; L85-W165 HydrophobicContact CB-CZ2 4.23Å; L85-W165 HydrophobicContact CD2-CH2 4.21Å; L85-W165 HydrophobicContact CD2-CZ2 3.91Å; L85-W165 HydrophobicContact CG-CH2 4.06Å; L85-W165 HydrophobicContact CG-CZ2 4.02Å
86A97.1Very high93.8Very high0 Ų021.3 Ų21.30%012%0.119CC..Hα-helixtrans-61.5-42.5174.800000111.6S82 L83 V88 F89 A90 W165S82-A86 PolarHBondContact O-N 2.93Å; L83-A86 WeakPolarHBondContact O-CB 3.43Å; L83-A86 PolarHBondContact O-N 2.85Å; L83-A86 VanDerWaalsContact O-N 3.11Å; A86-V88 PolarHBondContact O-N 2.98Å; A86-F89 PolarHBondContact O-N 2.93Å; A86-A90 PolarHBondContact O-N 2.95Å; A86-W165 HydrophobicContact CB-CH2 4.13Å; A86-W165 HydrophobicContact CB-CZ2 4.22Å
87D95.6Very high93.6Very high0 Ų021.5 Ų21.50%012%0.12CC..Hα-helixtrans-69.6-30.5178.2-71.7-22.7000112.8N58 L83 A84 L85 A90 S91 S127 S302 N305N58-D87 HydrophobicContact CB-CB 4.33Å; L83-D87 PolarHBondContact O-N 3.09Å; A84-D87 PolarHBondContact O-N 2.12Å; L85-D87 VanDerWaalsContact C-N 3.34Å; D87-A90 PolarHBondContact O-N 3.17Å; D87-S91 WeakPolarHBondContact O-CB 3.44Å; D87-S91 PolarHBondContact O-N 3.39Å; D87-S91 PolarHBondContact O-OG 3.39Å; D87-S127 PolarHBondContact OD1-OG 2.96Å; D87-S302 VanDerWaalsContact CG-OG 3.32Å; D87-S302 WeakPolarHBondContact OD1-CB 3.34Å; D87-S302 PolarHBondContact OD1-OG 3.28Å; D87-N305 PolarHBondContact OD2-ND2 2.69Å
88V96.1Very high93.1Very high21 Ų2121.4 Ų21.413%0.12712%0.12CC..Hα-helixtrans-62-49.9168163.80000110.6L55 N58 V59 L62 A84 L85 A86 A90 S91 C92L55-V88 HydrophobicContact CD1-CB 4.24Å; L55-V88 HydrophobicContact CD1-CG1 3.73Å; L55-V88 HydrophobicContact CD1-CG2 4.16Å; N58-V88 HydrophobicContact CB-CG2 3.8Å; V59-V88 HydrophobicContact CG2-CG2 3.75Å; L62-V88 HydrophobicContact CD1-CG2 4.02Å; A84-V88 WeakPolarHBondContact O-CG2 3.4Å; A84-V88 PolarHBondContact O-N 3Å; L85-V88 PolarHBondContact O-N 3.21Å; A86-V88 PolarHBondContact O-N 2.98Å; V88-A90 VanDerWaalsContact C-N 3.31Å; V88-A90 PolarHBondContact O-N 3.35Å; V88-S91 PolarHBondContact O-N 3.31Å; V88-C92 PolarHBondContact O-N 2.91Å; V88-C92 PolarHBondContact O-SG 3.32Å; V88-C92 VanDerWaalsContact O-SG 3.36Å
89F96.2Very high92.6Very high72 Ų7221.3 Ų21.332%0.31612%0.12SC..Hα-helixtrans-62.5-39.4176.7-77.5-62.1000112L85 A86 C92 F93 M122 A123 W165L85-F89 HydrophobicContact CD1-CD2 4.18Å; L85-F89 HydrophobicContact CD1-CE2 3.72Å; L85-F89 HydrophobicContact CD1-CZ 4.47Å; L85-F89 HydrophobicContact CD2-CE2 4.37Å; L85-F89 HydrophobicContact CG-CD2 4.1Å; L85-F89 HydrophobicContact CG-CE2 3.82Å; L85-F89 VanDerWaalsContact O-CD2 3.24Å; L85-F89 WeakPolarHBondContact O-CD2 3.24Å; L85-F89 PolarHBondContact O-N 3.4Å; L85-F89 VanDerWaalsContact O-N 3.07Å; A86-F89 PolarHBondContact O-N 2.93Å; F89-C92 PolarHBondContact O-N 3.43Å; F89-F93 HydrophobicContact CB-CD2 4.37Å; F89-F93 HydrophobicContact CD1-CD2 4.23Å; F89-F93 AromaticContact CD1-CE2 3.87Å; F89-F93 HydrophobicContact CD1-CE2 3.87Å; F89-F93 WeakPolarHBondContact O-CB 3.29Å; F89-F93 WeakPolarHBondContact O-CD2 3.22Å; F89-F93 PolarHBondContact O-N 3.41Å; F89-M122 HydrophobicContact CB-CE 4.29Å; F89-M122 HydrophobicContact CD1-CE 4.28Å; F89-M122 HydrophobicContact CD2-CE 4.35Å; F89-M122 HydrophobicContact CG-CE 4.08Å; F89-A123 HydrophobicContact CB-CB 3.78Å; F89-W165 AromaticContact CD2-CH2 3.89Å; F89-W165 HydrophobicContact CD2-CH2 3.89Å; F89-W165 HydrophobicContact CD2-CZ3 4.14Å; F89-W165 HydrophobicContact CE2-CH2 4.15Å; F89-W165 HydrophobicContact CE2-CZ3 4.23Å
90A93.7Very high92Very high3 Ų321.8 Ų21.83%0.02512%0.123CC..Hα-helixtrans-60.5-48.6175.700000110.1A86 D87 V88 C92 F93 F94 A123 F124A86-A90 PolarHBondContact O-N 2.95Å; D87-A90 PolarHBondContact O-N 3.17Å; V88-A90 VanDerWaalsContact C-N 3.31Å; V88-A90 PolarHBondContact O-N 3.35Å; A90-C92 VanDerWaalsContact C-N 3.3Å; A90-C92 PolarHBondContact O-N 3.26Å; A90-F93 PolarHBondContact O-N 3.42Å; A90-F94 WeakPolarHBondContact O-CA 3.46Å; A90-F94 WeakPolarHBondContact O-CB 3.32Å; A90-F94 PolarHBondContact O-N 2.99Å; A90-A123 HydrophobicContact CB-CB 3.84Å; A90-A123 VanDerWaalsContact N-CB 3.33Å; A90-F124 HydrophobicContact CB-CE1 4.3Å; A90-F124 HydrophobicContact CB-CZ 4.41Å
91S93.1Very high91.2Very high5 Ų523 Ų234%0.03513%0.128CC..Hα-helixtrans-61.1-38.6178.9-55.80000112.3T54 D87 V88 T95T54-S91 VanDerWaalsContact CG2-OG 3.29Å; T54-S91 WeakPolarHBondContact CG2-OG 3.35Å; D87-S91 WeakPolarHBondContact O-CB 3.44Å; D87-S91 PolarHBondContact O-N 3.39Å; D87-S91 PolarHBondContact O-OG 3.39Å; V88-S91 PolarHBondContact O-N 3.31Å; S91-T95 WeakPolarHBondContact O-CB 3.45Å; S91-T95 PolarHBondContact O-N 3.47Å; S91-T95 PolarHBondContact O-OG1 2.92Å; S91-T95 VanDerWaalsContact O-OG1 3.13Å
92C92.9Very high90.1Very high51 Ų5123.9 Ų23.935%0.34513%0.129SC..Hα-helixtrans-69.3-59.3175.9-69.70000111.7V88 F89 A90 T96V88-C92 PolarHBondContact O-N 2.91Å; V88-C92 PolarHBondContact O-SG 3.32Å; V88-C92 VanDerWaalsContact O-SG 3.36Å; F89-C92 PolarHBondContact O-N 3.43Å; A90-C92 VanDerWaalsContact C-N 3.3Å; A90-C92 PolarHBondContact O-N 3.26Å; C92-T96 VanDerWaalsContact O-CB 3.27Å; C92-T96 WeakPolarHBondContact O-CB 3.15Å; C92-T96 WeakPolarHBondContact O-CG2 3.29Å; C92-T96 PolarHBondContact O-N 2.88Å; C92-T96 VanDerWaalsContact O-N 3.15Å; C92-T96 PolarHBondContact O-OG1 3.23Å
93F93.6Very high89.1Confident40 Ų4027.4 Ų27.418%0.17515%0.147CC..Hα-helixtrans-71.7-43.7-173.1-79.4-75.3000112.5F89 A90 T96 S97 F115 V120 M122F89-F93 HydrophobicContact CB-CD2 4.37Å; F89-F93 HydrophobicContact CD1-CD2 4.23Å; F89-F93 AromaticContact CD1-CE2 3.87Å; F89-F93 HydrophobicContact CD1-CE2 3.87Å; F89-F93 WeakPolarHBondContact O-CB 3.29Å; F89-F93 WeakPolarHBondContact O-CD2 3.22Å; F89-F93 PolarHBondContact O-N 3.41Å; A90-F93 PolarHBondContact O-N 3.42Å; F93-T96 PolarHBondContact O-OG1 3.13Å; F93-S97 WeakPolarHBondContact O-CB 3.39Å; F93-S97 PolarHBondContact O-N 3.06Å; F93-S97 PolarHBondContact O-OG 2.96Å; F93-F115 HydrophobicContact CE1-CD1 4.33Å; F93-F115 AromaticContact CE1-CE1 3.78Å; F93-F115 HydrophobicContact CE1-CE1 3.78Å; F93-F115 HydrophobicContact CE1-CZ 4.24Å; F93-F115 HydrophobicContact CZ-CE1 4.23Å; F93-F115 HydrophobicContact CZ-CZ 4.25Å; F93-V120 HydrophobicContact CB-CG2 3.86Å; F93-M122 HydrophobicContact CE2-CE 4.42Å
94F89.8Confident88.3Confident20 Ų2033.6 Ų33.69%0.08818%0.175CC..Hα-helixtrans-66.2-52-178.1-177.4-102.4000111.2A90 T96 S97 F98 V120 F124 S295 L299A90-F94 WeakPolarHBondContact O-CA 3.46Å; A90-F94 WeakPolarHBondContact O-CB 3.32Å; A90-F94 PolarHBondContact O-N 2.99Å; F94-T96 PolarHBondContact O-N 3.44Å; F94-S97 PolarHBondContact O-N 3.43Å; F94-F98 WeakPolarHBondContact O-CB 3.41Å; F94-F98 PolarHBondContact O-N 3.26Å; F94-V120 HydrophobicContact CB-CG2 4.31Å; F94-V120 HydrophobicContact CD2-CG1 4.27Å; F94-F124 HydrophobicContact CD2-CE2 4.12Å; F94-F124 HydrophobicContact CD2-CZ 4.46Å; F94-S295 WeakPolarHBondContact CZ-O 3.13Å; F94-L299 HydrophobicContact CE1-CB 4.39Å
95T87.8Confident87Confident13 Ų1340.1 Ų40.18%0.0820%0.198CC..Hα-helixtrans-65.3-43.4-177.9-59.30000111.6C47 G51 S91 L99C47-T95 HydrophobicContact CB-CG2 4.39Å; C47-T95 VanDerWaalsContact O-CG2 3.31Å; C47-T95 WeakPolarHBondContact O-CG2 3.27Å; G51-T95 WeakPolarHBondContact CA-OG1 3.24Å; S91-T95 WeakPolarHBondContact O-CB 3.45Å; S91-T95 PolarHBondContact O-N 3.47Å; S91-T95 PolarHBondContact O-OG1 2.92Å; S91-T95 VanDerWaalsContact O-OG1 3.13Å; T95-L99 HydrophobicContact CG2-CD1 3.76Å; T95-L99 HydrophobicContact CG2-CG 4.34Å; T95-L99 WeakPolarHBondContact O-CB 3.41Å; T95-L99 VanDerWaalsContact O-CG 3.22Å; T95-L99 WeakPolarHBondContact O-CG 3.45Å; T95-L99 PolarHBondContact O-N 3.47Å
96T86.9Confident85.9Confident78 Ų7844.6 Ų44.648%0.47921%0.211SC..Hα-helixtrans-65.4-46.1177.757.30000111.6C92 F93 F94 F98 L99 D100C92-T96 VanDerWaalsContact O-CB 3.27Å; C92-T96 WeakPolarHBondContact O-CB 3.15Å; C92-T96 WeakPolarHBondContact O-CG2 3.29Å; C92-T96 PolarHBondContact O-N 2.88Å; C92-T96 VanDerWaalsContact O-N 3.15Å; C92-T96 PolarHBondContact O-OG1 3.23Å; F93-T96 PolarHBondContact O-OG1 3.13Å; F94-T96 PolarHBondContact O-N 3.44Å; T96-F98 PolarHBondContact O-N 3.14Å; T96-L99 PolarHBondContact O-N 3.02Å; T96-D100 WeakPolarHBondContact O-CB 3.29Å; T96-D100 PolarHBondContact O-N 3.25Å
97S86.3Confident84.6Confident21 Ų2146.6 Ų46.615%0.14723%0.225CC..Hα-helixtrans-63.6-42.4179.7-550000111.8F93 F94 F101 K116F93-S97 WeakPolarHBondContact O-CB 3.39Å; F93-S97 PolarHBondContact O-N 3.06Å; F93-S97 PolarHBondContact O-OG 2.96Å; F94-S97 PolarHBondContact O-N 3.43Å; S97-F101 WeakPolarHBondContact O-CB 3.34Å; S97-F101 PolarHBondContact O-N 3.28Å; S97-K116 VanDerWaalsContact OG-CB 3.31Å; S97-K116 WeakPolarHBondContact OG-CB 3.45Å
98F82.9Confident83.7Confident14 Ų1448.5 Ų48.56%0.06124%0.235CC..Hα-helixtrans-64.1-48.5179.7-170.2-81.1000111.5I43 C47 F94 T96 H102I43-F98 HydrophobicContact CB-CE1 4.02Å; I43-F98 HydrophobicContact CB-CZ 3.76Å; I43-F98 HydrophobicContact CD1-CZ 4.38Å; I43-F98 HydrophobicContact CG2-CD1 4.3Å; I43-F98 HydrophobicContact CG2-CE1 3.42Å; I43-F98 VanDerWaalsContact CG2-CE1 3.42Å; I43-F98 HydrophobicContact CG2-CE2 3.74Å; I43-F98 HydrophobicContact CG2-CZ 3.09Å; C47-F98 HydrophobicContact CB-CD1 4.29Å; F94-F98 WeakPolarHBondContact O-CB 3.41Å; F94-F98 PolarHBondContact O-N 3.26Å; T96-F98 PolarHBondContact O-N 3.14Å; F98-H102 HydrophobicContact CD1-CB 4.44Å; F98-H102 AromaticContact CD2-CD2 3.52Å; F98-H102 HydrophobicContact CE1-CB 3.99Å; F98-H102 AromaticContact CE1-CD2 3.87Å; F98-H102 AromaticContact CE2-CD2 3.26Å; F98-H102 WeakPolarHBondContact CE2-CD2 3.37Å; F98-H102 AromaticContact CE2-NE2 3.7Å; F98-H102 AromaticContact CG-CD2 3.92Å; F98-H102 HydrophobicContact CZ-CB 4.18Å; F98-H102 AromaticContact CZ-CD2 3.41Å; F98-H102 VanDerWaalsContact CZ-CD2 3.41Å; F98-H102 WeakPolarHBondContact CZ-CD2 2.92Å; F98-H102 AromaticContact CZ-CG 3.94Å; F98-H102 WeakPolarHBondContact O-CB 2.96Å; F98-H102 PolarHBondContact O-N 3.15Å
99L83.5Confident83Confident19 Ų1949.3 Ų49.310%0.09925%0.247CC..Iπ-helixtrans-66.6-43-179.9-67.5175.2000111.5F48 T95 T96 F101 L103 F104F48-L99 HydrophobicContact CB-CD2 4.48Å; F48-L99 HydrophobicContact CD2-CD1 4.12Å; T95-L99 HydrophobicContact CG2-CD1 3.76Å; T95-L99 HydrophobicContact CG2-CG 4.34Å; T95-L99 WeakPolarHBondContact O-CB 3.41Å; T95-L99 VanDerWaalsContact O-CG 3.22Å; T95-L99 WeakPolarHBondContact O-CG 3.45Å; T95-L99 PolarHBondContact O-N 3.47Å; T96-L99 PolarHBondContact O-N 3.02Å; L99-F101 PolarHBondContact O-N 2.6Å; L99-L103 HydrophobicContact CD2-CB 4.44Å; L99-L103 WeakPolarHBondContact O-CA 3.1Å; L99-L103 WeakPolarHBondContact O-CB 3.37Å; L99-L103 PolarHBondContact O-N 3.33Å; L99-F104 HydrophobicContact CB-CD2 4.37Å; L99-F104 HydrophobicContact CB-CE2 4.18Å; L99-F104 WeakPolarHBondContact O-CD2 3.27Å; L99-F104 PolarHBondContact O-N 3.35Å
100D82.6Confident82.4Confident16 Ų1648 Ų489%0.08625%0.246CC..Iπ-helixtrans-64.5-42-179.3-149.537.7000111.4T96 F104 R105 R106 K116T96-D100 WeakPolarHBondContact O-CB 3.29Å; T96-D100 PolarHBondContact O-N 3.25Å; D100-F104 CarbonylContact O-C 3.58Å; D100-R105 PolarHBondContact O-N 2.96Å; D100-R105 VanDerWaalsContact O-N 3.15Å; D100-R106 PolarHBondContact O-N 3.48Å; D100-R106 WeakPolarHBondContact OD1-CB 3.45Å; D100-R106 WeakPolarHBondContact OD1-CD 3.45Å; D100-R106 WeakPolarHBondContact OD1-CG 3.18Å; D100-R106 IonicContact OD1-CZ 2.81Å; D100-R106 IonicContact OD1-NE 3.82Å; D100-R106 IonicContact OD1-NH1 3.53Å; D100-R106 PolarHBondContact OD1-NH1 3.27Å; D100-R106 IonicContact OD2-NH1 2.64Å; D100-K116 IonicContact OD2-NZ 3.42Å; D100-K116 PolarHBondContact OD2-NZ 2.87Å
101F76.3Confident82.1Confident25 Ų2552.9 Ų52.911%0.1128%0.276CS..Iπ-helixtrans-76.7-49.8-178.8-171.6-108.5000113.3L29 M33 S97 L99L29-F101 HydrophobicContact CB-CE2 4.38Å; L29-F101 HydrophobicContact CD2-CE2 3.63Å; L29-F101 HydrophobicContact CD2-CZ 4.23Å; M33-F101 VanDerWaalsContact CE-O 3.25Å; M33-F101 WeakPolarHBondContact CE-O 3.41Å; M33-F101 HydrophobicContact CG-CE1 4.27Å; M33-F101 HydrophobicContact CG-CZ 4.13Å; S97-F101 WeakPolarHBondContact O-CB 3.34Å; S97-F101 PolarHBondContact O-N 3.28Å; L99-F101 PolarHBondContact O-N 2.6Å
102H72.9Confident81.9Confident29 Ų2954.1 Ų54.113%0.13429%0.289CS..Iπ-helixtrans-91.3-31.6-172.5-69.3-64.8000114.5L35 F98L35-H102 WeakPolarHBondContact CD1-ND1 3.42Å; F98-H102 HydrophobicContact CD1-CB 4.44Å; F98-H102 AromaticContact CD2-CD2 3.52Å; F98-H102 HydrophobicContact CE1-CB 3.99Å; F98-H102 AromaticContact CE1-CD2 3.87Å; F98-H102 AromaticContact CE2-CD2 3.26Å; F98-H102 WeakPolarHBondContact CE2-CD2 3.37Å; F98-H102 AromaticContact CE2-NE2 3.7Å; F98-H102 AromaticContact CG-CD2 3.92Å; F98-H102 HydrophobicContact CZ-CB 4.18Å; F98-H102 AromaticContact CZ-CD2 3.41Å; F98-H102 VanDerWaalsContact CZ-CD2 3.41Å; F98-H102 WeakPolarHBondContact CZ-CD2 2.92Å; F98-H102 AromaticContact CZ-CG 3.94Å; F98-H102 WeakPolarHBondContact O-CB 2.96Å; F98-H102 PolarHBondContact O-N 3.15Å
103L76Confident81.6Confident81 Ų8153 Ų5342%0.42428%0.277SS..Iπ-helixtrans-97.9-52-174.9-157102.1000111.6L99L99-L103 HydrophobicContact CD2-CB 4.44Å; L99-L103 WeakPolarHBondContact O-CA 3.1Å; L99-L103 WeakPolarHBondContact O-CB 3.37Å; L99-L103 PolarHBondContact O-N 3.33Å
104F76.8Confident81.6Confident131 Ų13151.4 Ų51.458%0.57527%0.271SS*.SBendtrans-87.8-6.5-177-60.8-63.6000113.7L99 D100 R106L99-F104 HydrophobicContact CB-CD2 4.37Å; L99-F104 HydrophobicContact CB-CE2 4.18Å; L99-F104 WeakPolarHBondContact O-CD2 3.27Å; L99-F104 PolarHBondContact O-N 3.35Å; D100-F104 CarbonylContact O-C 3.58Å; F104-R106 HydrophobicContact CB-CG 4.25Å; F104-R106 PolarHBondContact O-N 2.76Å; F104-R106 VanDerWaalsContact O-N 3.12Å
105R69.6Low81.7Confident140 Ų14056.3 Ų56.353%0.52829%0.292SS..  trans50.334.6180-44-175.279.9166.20.7112.2M33 D100 C107M33-R105 HydrophobicContact CE-CB 4.02Å; M33-R105 HydrophobicContact CE-CG 3.64Å; D100-R105 PolarHBondContact O-N 2.96Å; D100-R105 VanDerWaalsContact O-N 3.15Å; R105-C107 PolarHBondContact O-N 3.13Å
106R74.3Confident82Confident157 Ų15757.5 Ų57.559%0.59230%0.296SS*.  trans-71.7130.5175.6-73.1-148.3-174.1128-12.1109.4D100 F104D100-R106 PolarHBondContact O-N 3.48Å; D100-R106 WeakPolarHBondContact OD1-CB 3.45Å; D100-R106 WeakPolarHBondContact OD1-CD 3.45Å; D100-R106 WeakPolarHBondContact OD1-CG 3.18Å; D100-R106 IonicContact OD1-CZ 2.81Å; D100-R106 IonicContact OD1-NE 3.82Å; D100-R106 IonicContact OD1-NH1 3.53Å; D100-R106 PolarHBondContact OD1-NH1 3.27Å; D100-R106 IonicContact OD2-NH1 2.64Å; F104-R106 HydrophobicContact CB-CG 4.25Å; F104-R106 PolarHBondContact O-N 2.76Å; F104-R106 VanDerWaalsContact O-N 3.12Å
107C70.7Confident82.2Confident43 Ų4354.8 Ų54.829%0.29128%0.279SS..  trans-100.785179.5-71.20000108.9F25 C26 R105F25-C107 HydrophobicContact CD1-CB 4.36Å; C26-C107 WeakPolarHBondContact CA-SG 3.26Å; C26-C107 HydrophobicContact CB-CB 3.52Å; C26-C107 WeakPolarHBondContact CB-SG 3.47Å; C26-C107 WeakPolarHBondContact SG-CB 3.38Å; C26-C107 CovalentContact SG-SG 2.04Å; C26-C107 PolarHBondContact SG-SG 3.36Å; R105-C107 PolarHBondContact O-N 3.13Å
108D75.6Confident82.7Confident39 Ų3954.4 Ų54.421%0.20928%0.278CS..  trans-69.1129.6175-60.6-63.5000110.6F25 K116F25-D108 WeakPolarHBondContact CE1-O 3.5Å; F25-D108 WeakPolarHBondContact CZ-O 3.41Å; D108-K116 IonicContact OD1-NZ 3.54Å; D108-K116 PolarHBondContact OD1-NZ 2.89Å; D108-K116 WeakPolarHBondContact OD2-CD 3.39Å; D108-K116 IonicContact OD2-NZ 2.87Å; D108-K116 PolarHBondContact OD2-NZ 3.32Å
109G81.3Confident83.3Confident38 Ų3854 Ų5439%0.39228%0.278SS..  trans-50.7162.8169.600000112.8T111 G112 Y113G109-T111 PolarHBondContact O-N 2.89Å; G109-G112 PolarHBondContact O-N 3.46Å; G109-Y113 PolarHBondContact O-N 2.84Å; G109-Y113 VanDerWaalsContact O-N 3.09Å
110P83.1Confident83.9Confident44 Ų4454 Ų5429%0.28628%0.278SS..Hα-helixtrans-50.4-42.2-170.6-24.429.6000114F25 L114 F195F25-P110 VanDerWaalsContact CE2-CD 3.44Å; F25-P110 HydrophobicContact CE2-CG 3.72Å; F25-P110 HydrophobicContact CZ-CG 4.33Å; P110-L114 VanDerWaalsContact O-CB 3.29Å; P110-L114 WeakPolarHBondContact O-CB 3.5Å; P110-L114 WeakPolarHBondContact O-CG 3.35Å; P110-L114 PolarHBondContact O-N 2.84Å; P110-F195 HydrophobicContact CB-CD1 4.43Å; P110-F195 HydrophobicContact CB-CE1 4.37Å; P110-F195 HydrophobicContact CB-CZ 4.46Å; P110-F195 HydrophobicContact CG-CE1 4.24Å; P110-F195 HydrophobicContact CG-CZ 4.29Å
111T88.1Confident84.5Confident107 Ų10753.9 Ų53.966%0.65628%0.279SS*.Hα-helixtrans-65.4-41.6179.3-48.20000112.5G109 F115 L176G109-T111 PolarHBondContact O-N 2.89Å; T111-F115 VanDerWaalsContact O-CB 3.27Å; T111-F115 WeakPolarHBondContact O-CB 3.37Å; T111-F115 PolarHBondContact O-N 3.43Å; T111-L176 HydrophobicContact CG2-CD2 4.25Å
112G88.7Confident85.5Confident30 Ų3054 Ų5431%0.30928%0.28SS..Hα-helixtrans-67.1-44.9179.300000111.7G109 F115 K116G109-G112 PolarHBondContact O-N 3.46Å; G112-F115 PolarHBondContact O-N 3.25Å; G112-K116 WeakPolarHBondContact O-CB 3.38Å; G112-K116 PolarHBondContact O-N 2.81Å
113Y88Confident86.6Confident27 Ų2752.6 Ų52.611%0.10627%0.273CS..Hα-helixtrans-61.2-49.3175178.9-90.4000111.8G109 F115 K116 L117 P194 F195G109-Y113 PolarHBondContact O-N 2.84Å; G109-Y113 VanDerWaalsContact O-N 3.09Å; Y113-F115 VanDerWaalsContact C-N 3.3Å; Y113-F115 PolarHBondContact O-N 3.49Å; Y113-K116 WeakPolarHBondContact O-CB 3.18Å; Y113-K116 PolarHBondContact O-N 3.23Å; Y113-L117 HydrophobicContact CE1-CB 4.31Å; Y113-L117 HydrophobicContact CE1-CD2 3.81Å; Y113-L117 WeakPolarHBondContact O-CB 3.37Å; Y113-L117 PolarHBondContact O-N 3.37Å; Y113-P194 HydrophobicContact CD1-CB 4.21Å; Y113-P194 HydrophobicContact CE1-CB 3.85Å; Y113-P194 HydrophobicContact CE1-CG 4.19Å; Y113-P194 WeakPolarHBondContact CE1-O 3.31Å; Y113-P194 HydrophobicContact CE2-CB 4.49Å; Y113-P194 HydrophobicContact CE2-CG 4.1Å; Y113-P194 VanDerWaalsContact OH-CD 3.31Å; Y113-P194 WeakPolarHBondContact OH-CD 3.48Å; Y113-F195 AromaticContact CD1-CD2 3.9Å; Y113-F195 HydrophobicContact CD1-CD2 3.9Å; Y113-F195 HydrophobicContact CG-CD2 4.45Å
114L91.8Very high87.5Confident7 Ų749.4 Ų49.44%0.03726%0.256CS..Hα-helixtrans-65.9-31-179.9-72.3176.3000112.7P110 G118 P175 L176 R180 F195 I196P110-L114 VanDerWaalsContact O-CB 3.29Å; P110-L114 WeakPolarHBondContact O-CB 3.5Å; P110-L114 WeakPolarHBondContact O-CG 3.35Å; P110-L114 PolarHBondContact O-N 2.84Å; L114-G118 WeakPolarHBondContact O-CA 3.22Å; L114-G118 PolarHBondContact O-N 3.38Å; L114-P175 HydrophobicContact CD2-CB 3.91Å; L114-L176 HydrophobicContact CB-CD2 3.49Å; L114-L176 VanDerWaalsContact CB-CD2 3.49Å; L114-L176 HydrophobicContact CB-CG 4.03Å; L114-R180 HydrophobicContact CD1-CB 4.21Å; L114-F195 HydrophobicContact CD1-CB 4.34Å; L114-F195 HydrophobicContact CD2-CB 4.01Å; L114-F195 HydrophobicContact CG-CB 4.28Å; L114-I196 HydrophobicContact CD2-CD1 3.81Å
115F93.4Very high88.4Confident123 Ų12343.2 Ų43.254%0.53923%0.229SC..Hα-helixtrans-67.4-47.1173.5176.4-99.6000111.9F93 T111 G112 Y113 G118 G119F93-F115 HydrophobicContact CE1-CD1 4.33Å; F93-F115 AromaticContact CE1-CE1 3.78Å; F93-F115 HydrophobicContact CE1-CE1 3.78Å; F93-F115 HydrophobicContact CE1-CZ 4.24Å; F93-F115 HydrophobicContact CZ-CE1 4.23Å; F93-F115 HydrophobicContact CZ-CZ 4.25Å; T111-F115 VanDerWaalsContact O-CB 3.27Å; T111-F115 WeakPolarHBondContact O-CB 3.37Å; T111-F115 PolarHBondContact O-N 3.43Å; G112-F115 PolarHBondContact O-N 3.25Å; Y113-F115 VanDerWaalsContact C-N 3.3Å; Y113-F115 PolarHBondContact O-N 3.49Å; F115-G118 PolarHBondContact O-N 3.23Å; F115-G119 PolarHBondContact O-N 3.5Å
116K92.7Very high89.7Confident38 Ų3836.5 Ų36.517%0.16520%0.204CC..Hα-helixtrans-57.2-50.8174.4-83.9174.2177.6171.80111.5S97 D100 D108 G112 Y113 G118 G119 V120S97-K116 VanDerWaalsContact OG-CB 3.31Å; S97-K116 WeakPolarHBondContact OG-CB 3.45Å; D100-K116 IonicContact OD2-NZ 3.42Å; D100-K116 PolarHBondContact OD2-NZ 2.87Å; D108-K116 IonicContact OD1-NZ 3.54Å; D108-K116 PolarHBondContact OD1-NZ 2.89Å; D108-K116 WeakPolarHBondContact OD2-CD 3.39Å; D108-K116 IonicContact OD2-NZ 2.87Å; D108-K116 PolarHBondContact OD2-NZ 3.32Å; G112-K116 WeakPolarHBondContact O-CB 3.38Å; G112-K116 PolarHBondContact O-N 2.81Å; Y113-K116 WeakPolarHBondContact O-CB 3.18Å; Y113-K116 PolarHBondContact O-N 3.23Å; K116-G118 PolarHBondContact O-N 3.38Å; K116-G119 PolarHBondContact O-N 2.85Å; K116-V120 WeakPolarHBondContact O-CG2 3.26Å; K116-V120 PolarHBondContact O-N 3.33Å; K116-V120 VanDerWaalsContact O-N 3.13Å
117L92.7Very high90.7Very high22 Ų2229 Ų2912%0.11518%0.175CC..Hα-helixtrans-64.7-39.2177.5-175.261.8000112.2Y113 G119 V120 T121 F193 I196Y113-L117 HydrophobicContact CE1-CB 4.31Å; Y113-L117 HydrophobicContact CE1-CD2 3.81Å; Y113-L117 WeakPolarHBondContact O-CB 3.37Å; Y113-L117 PolarHBondContact O-N 3.37Å; L117-G119 VanDerWaalsContact C-N 3.31Å; L117-G119 PolarHBondContact O-N 2.94Å; L117-V120 WeakPolarHBondContact O-CB 3.36Å; L117-V120 PolarHBondContact O-N 2.81Å; L117-V120 VanDerWaalsContact O-N 3.14Å; L117-T121 PolarHBondContact O-N 2.72Å; L117-T121 PolarHBondContact O-OG1 2.99Å; L117-F193 HydrophobicContact CD1-CD1 3.93Å; L117-F193 HydrophobicContact CD1-CE1 4.01Å; L117-F193 HydrophobicContact CD2-CB 4.11Å; L117-F193 HydrophobicContact CD2-CD1 4.19Å; L117-F193 HydrophobicContact CD2-CG 4.31Å; L117-I196 HydrophobicContact CD2-CD1 3.79Å; L117-I196 HydrophobicContact CD2-CG1 3.56Å
118G95.4Very high91.8Very high12 Ų1227 Ų2712%0.12416%0.161CC..Hα-helixtrans-61-37.4174.100000112.8L114 F115 K116 T121 M122 S172L114-G118 WeakPolarHBondContact O-CA 3.22Å; L114-G118 PolarHBondContact O-N 3.38Å; F115-G118 PolarHBondContact O-N 3.23Å; K116-G118 PolarHBondContact O-N 3.38Å; G118-T121 WeakPolarHBondContact CA-OG1 3.31Å; G118-T121 PolarHBondContact O-OG1 3.21Å; G118-T121 VanDerWaalsContact O-OG1 3.07Å; G118-M122 WeakPolarHBondContact O-CB 3.43Å; G118-M122 PolarHBondContact O-N 2.93Å; G118-S172 WeakPolarHBondContact O-CB 3.28Å
119G96.4Very high92.8Very high5 Ų525.3 Ų25.35%0.05215%0.153CC..Hα-helixtrans-64.7-40.6172.100000112.6F115 K116 L117 A123F115-G119 PolarHBondContact O-N 3.5Å; K116-G119 PolarHBondContact O-N 2.85Å; L117-G119 VanDerWaalsContact C-N 3.31Å; L117-G119 PolarHBondContact O-N 2.94Å; G119-A123 VanDerWaalsContact O-CB 3.29Å; G119-A123 WeakPolarHBondContact O-CB 3.05Å; G119-A123 PolarHBondContact O-N 3.46Å
120V94.6Very high93.5Very high19 Ų1923.5 Ų23.512%0.11513%0.134CC..Hα-helixtrans-64.1-50.3174.8175.20000111.3F93 F94 K116 L117 M122 A123 F124F93-V120 HydrophobicContact CB-CG2 3.86Å; F94-V120 HydrophobicContact CB-CG2 4.31Å; F94-V120 HydrophobicContact CD2-CG1 4.27Å; K116-V120 WeakPolarHBondContact O-CG2 3.26Å; K116-V120 PolarHBondContact O-N 3.33Å; K116-V120 VanDerWaalsContact O-N 3.13Å; L117-V120 WeakPolarHBondContact O-CB 3.36Å; L117-V120 PolarHBondContact O-N 2.81Å; L117-V120 VanDerWaalsContact O-N 3.14Å; V120-M122 VanDerWaalsContact C-N 3.34Å; V120-M122 PolarHBondContact O-N 2.94Å; V120-A123 PolarHBondContact O-N 3.35Å; V120-F124 HydrophobicContact CG1-CD2 3.55Å; V120-F124 HydrophobicContact CG1-CE2 3.56Å; V120-F124 VanDerWaalsContact O-CD2 3.26Å; V120-F124 WeakPolarHBondContact O-CD2 3.47Å; V120-F124 PolarHBondContact O-N 2.94Å
121T95.7Very high93.9Very high15 Ų1521.8 Ų21.89%0.09212%0.123CC..Hα-helixtrans-63.7-39.5179.552.90000111.6L117 G118 S125 S172 W204L117-T121 PolarHBondContact O-N 2.72Å; L117-T121 PolarHBondContact O-OG1 2.99Å; G118-T121 WeakPolarHBondContact CA-OG1 3.31Å; G118-T121 PolarHBondContact O-OG1 3.21Å; G118-T121 VanDerWaalsContact O-OG1 3.07Å; T121-S125 VanDerWaalsContact O-CB 3.22Å; T121-S125 WeakPolarHBondContact O-CB 3.34Å; T121-S125 PolarHBondContact O-N 2.88Å; T121-S125 PolarHBondContact O-OG 3.42Å; T121-S172 VanDerWaalsContact C-OG 3.32Å; T121-S172 VanDerWaalsContact OG1-CB 3.26Å; T121-S172 WeakPolarHBondContact OG1-CB 3.47Å; T121-S172 PolarHBondContact OG1-OG 3.22Å; T121-W204 HydrophobicContact CG2-CZ2 4.48Å
122M97.4Very high94.3Very high27 Ų2717.7 Ų17.713%0.13310%0.097CC..Hα-helixtrans-59.7-55.8174.5175.4-164.467.200110.3F89 F93 G118 V120 F124 S125 S126 W165 I169 S172F89-M122 HydrophobicContact CB-CE 4.29Å; F89-M122 HydrophobicContact CD1-CE 4.28Å; F89-M122 HydrophobicContact CD2-CE 4.35Å; F89-M122 HydrophobicContact CG-CE 4.08Å; F93-M122 HydrophobicContact CE2-CE 4.42Å; G118-M122 WeakPolarHBondContact O-CB 3.43Å; G118-M122 PolarHBondContact O-N 2.93Å; V120-M122 VanDerWaalsContact C-N 3.34Å; V120-M122 PolarHBondContact O-N 2.94Å; M122-F124 PolarHBondContact O-N 3.16Å; M122-S125 PolarHBondContact O-N 3.26Å; M122-S126 WeakPolarHBondContact O-CB 3.46Å; M122-S126 PolarHBondContact O-N 2.99Å; M122-S126 PolarHBondContact O-OG 2.78Å; M122-W165 HydrophobicContact SD-CZ3 4.45Å; M122-I169 HydrophobicContact CG-CG1 3.96Å; M122-I169 HydrophobicContact SD-CD1 4.48Å; M122-I169 HydrophobicContact SD-CG1 3.65Å; M122-S172 WeakPolarHBondContact CA-OG 3.13Å; M122-S172 PolarHBondContact N-OG 3.42Å
123A96.5Very high94.6Very high0 Ų017.6 Ų17.60%09%0.089CC..Hα-helixtrans-57.3-48.6-175.900000112.1F89 A90 G119 V120 S126 S127F89-A123 HydrophobicContact CB-CB 3.78Å; A90-A123 HydrophobicContact CB-CB 3.84Å; A90-A123 VanDerWaalsContact N-CB 3.33Å; G119-A123 VanDerWaalsContact O-CB 3.29Å; G119-A123 WeakPolarHBondContact O-CB 3.05Å; G119-A123 PolarHBondContact O-N 3.46Å; V120-A123 PolarHBondContact O-N 3.35Å; A123-S126 PolarHBondContact O-N 2.86Å; A123-S127 VanDerWaalsContact O-CB 3.31Å; A123-S127 WeakPolarHBondContact O-CB 3.38Å; A123-S127 PolarHBondContact O-N 3.41Å
124F93.9Very high94.7Very high14 Ų1416.8 Ų16.86%0.0619%0.087CC..Hα-helixtrans-67-39.6178.5-78.3-54.8000112.8A90 F94 V120 M122 S127 V128 W268 C298A90-F124 HydrophobicContact CB-CE1 4.3Å; A90-F124 HydrophobicContact CB-CZ 4.41Å; F94-F124 HydrophobicContact CD2-CE2 4.12Å; F94-F124 HydrophobicContact CD2-CZ 4.46Å; V120-F124 HydrophobicContact CG1-CD2 3.55Å; V120-F124 HydrophobicContact CG1-CE2 3.56Å; V120-F124 VanDerWaalsContact O-CD2 3.26Å; V120-F124 WeakPolarHBondContact O-CD2 3.47Å; V120-F124 PolarHBondContact O-N 2.94Å; M122-F124 PolarHBondContact O-N 3.16Å; F124-S127 PolarHBondContact O-N 3.38Å; F124-V128 WeakPolarHBondContact O-CG2 3.25Å; F124-V128 PolarHBondContact O-N 3.3Å; F124-W268 HydrophobicContact CB-CH2 3.71Å; F124-W268 HydrophobicContact CB-CZ2 4.06Å; F124-W268 HydrophobicContact CD1-CH2 4.42Å; F124-W268 HydrophobicContact CD1-CZ2 4.03Å; F124-W268 HydrophobicContact CG-CH2 4.32Å; F124-W268 HydrophobicContact CG-CZ2 4.38Å; F124-C298 HydrophobicContact CD1-CB 4.45Å; F124-C298 HydrophobicContact CE1-CB 3.53Å; F124-C298 HydrophobicContact CE2-CB 4.36Å; F124-C298 HydrophobicContact CZ-CB 3.47Å; F124-C298 VanDerWaalsContact CZ-CB 3.47Å
125S96.3Very high94.7Very high0 Ų016.4 Ų16.40%09%0.085CC..Hα-helixtrans-63.3-44.3175.5-54.10000111.7T121 M122 S127 V128 G129 W204T121-S125 VanDerWaalsContact O-CB 3.22Å; T121-S125 WeakPolarHBondContact O-CB 3.34Å; T121-S125 PolarHBondContact O-N 2.88Å; T121-S125 PolarHBondContact O-OG 3.42Å; M122-S125 PolarHBondContact O-N 3.26Å; S125-S127 VanDerWaalsContact C-N 3.31Å; S125-S127 PolarHBondContact O-N 2.85Å; S125-V128 PolarHBondContact O-N 2.89Å; S125-G129 PolarHBondContact O-N 3.44Å; S125-W204 PolarHBondContact OG-NE1 3.47Å
126S97.1Very high94.6Very high0 Ų014.1 Ų14.10%08%0.078CC..Hα-helixtrans-67-33.2178.4-52.40000111.7M122 A123 S130 T168M122-S126 WeakPolarHBondContact O-CB 3.46Å; M122-S126 PolarHBondContact O-N 2.99Å; M122-S126 PolarHBondContact O-OG 2.78Å; A123-S126 PolarHBondContact O-N 2.86Å; S126-S130 VanDerWaalsContact O-CB 3.26Å; S126-S130 WeakPolarHBondContact O-CB 3.17Å; S126-S130 PolarHBondContact O-N 3.12Å; S126-S130 PolarHBondContact O-OG 3.32Å; S126-T168 WeakPolarHBondContact OG-CB 3.44Å; S126-T168 PolarHBondContact OG-OG1 3.07Å
127S95Very high94.5Very high0 Ų012.4 Ų12.40%07%0.07CC..Hα-helixtrans-64.4-52.2175-179.40000111.1L83 D87 A123 F124 S125 G129 S130 L131L83-S127 WeakPolarHBondContact CD1-O 3.32Å; L83-S127 WeakPolarHBondContact CD1-OG 3.31Å; D87-S127 PolarHBondContact OD1-OG 2.96Å; A123-S127 VanDerWaalsContact O-CB 3.31Å; A123-S127 WeakPolarHBondContact O-CB 3.38Å; A123-S127 PolarHBondContact O-N 3.41Å; F124-S127 PolarHBondContact O-N 3.38Å; S125-S127 VanDerWaalsContact C-N 3.31Å; S125-S127 PolarHBondContact O-N 2.85Å; S127-G129 PolarHBondContact O-N 2.85Å; S127-S130 PolarHBondContact O-N 3.43Å; S127-S130 VanDerWaalsContact O-N 3.16Å; S127-L131 WeakPolarHBondContact O-CG 3.41Å; S127-L131 PolarHBondContact O-N 3.35Å
128V94.6Very high94.3Very high0 Ų014.5 Ų14.50%08%0.077CC..Hα-helixtrans-60.9-43.7175.8178.70000111.6F124 S125 S130 L131 L132 L211 L212 I215 W268F124-V128 WeakPolarHBondContact O-CG2 3.25Å; F124-V128 PolarHBondContact O-N 3.3Å; S125-V128 PolarHBondContact O-N 2.89Å; V128-S130 VanDerWaalsContact C-N 3.33Å; V128-S130 PolarHBondContact O-N 3.15Å; V128-L131 WeakPolarHBondContact O-CB 3.38Å; V128-L131 PolarHBondContact O-N 3.31Å; V128-L132 PolarHBondContact O-N 2.81Å; V128-L211 HydrophobicContact CG1-CB 3.63Å; V128-L211 HydrophobicContact CG1-CD1 4.06Å; V128-L212 HydrophobicContact CG1-CD2 4.06Å; V128-L212 HydrophobicContact CG1-CG 4.28Å; V128-I215 HydrophobicContact CG1-CD1 3.9Å; V128-W268 HydrophobicContact CG2-CD2 4.32Å; V128-W268 HydrophobicContact CG2-CH2 3.47Å; V128-W268 VanDerWaalsContact CG2-CH2 3.47Å; V128-W268 HydrophobicContact CG2-CZ2 3.11Å; V128-W268 HydrophobicContact CG2-CZ3 4.3Å
129G96.1Very high94Very high3 Ų316.9 Ų16.93%0.0318%0.083CC..Hα-helixtrans-63.6-36.8176.500000113.5S125 S127 L131 L132 L133S125-G129 PolarHBondContact O-N 3.44Å; S127-G129 PolarHBondContact O-N 2.85Å; G129-L131 VanDerWaalsContact C-N 3.34Å; G129-L132 WeakPolarHBondContact O-CB 3.37Å; G129-L132 PolarHBondContact O-N 3.4Å; G129-L133 WeakPolarHBondContact O-CG 3.22Å; G129-L133 PolarHBondContact O-N 3.25Å
130S95.8Very high93.6Very high0 Ų018.2 Ų18.20%09%0.088CC..Hα-helixtrans-68.6-34.4175.3-60.70000111.7S82 S126 S127 V128 L133 T134S82-S130 PolarHBondContact OG-OG 3.16Å; S126-S130 VanDerWaalsContact O-CB 3.26Å; S126-S130 WeakPolarHBondContact O-CB 3.17Å; S126-S130 PolarHBondContact O-N 3.12Å; S126-S130 PolarHBondContact O-OG 3.32Å; S127-S130 PolarHBondContact O-N 3.43Å; S127-S130 VanDerWaalsContact O-N 3.16Å; V128-S130 VanDerWaalsContact C-N 3.33Å; V128-S130 PolarHBondContact O-N 3.15Å; S130-L133 PolarHBondContact O-N 2.62Å; S130-T134 WeakPolarHBondContact O-CB 3.5Å; S130-T134 PolarHBondContact O-N 3.46Å; S130-T134 PolarHBondContact O-OG1 2.96Å
131L92.3Very high93.2Very high8 Ų818.6 Ų18.64%0.0429%0.092CC..Hα-helixtrans-65-40170.7-72.8171.6000112L83 S127 V128 G129 T134 A135 I215 L264L83-L131 HydrophobicContact CD1-CG 4.1Å; L83-L131 HydrophobicContact CD2-CD2 3.69Å; L83-L131 HydrophobicContact CD2-CG 4.18Å; S127-L131 WeakPolarHBondContact O-CG 3.41Å; S127-L131 PolarHBondContact O-N 3.35Å; V128-L131 WeakPolarHBondContact O-CB 3.38Å; V128-L131 PolarHBondContact O-N 3.31Å; G129-L131 VanDerWaalsContact C-N 3.34Å; L131-T134 PolarHBondContact O-N 2.91Å; L131-A135 WeakPolarHBondContact O-CB 3.31Å; L131-A135 PolarHBondContact O-N 3.26Å; L131-I215 HydrophobicContact CB-CD1 3.99Å; L131-L264 HydrophobicContact CD1-CD1 3.54Å; L131-L264 HydrophobicContact CD1-CD2 4.49Å
132L95.1Very high92.6Very high21 Ų2121.3 Ų21.311%0.1111%0.105CC..Hα-helixtrans-61.8-47.9173.317761.6000111.7V128 G129 T134 A135 L136 L211 L214 I215V128-L132 PolarHBondContact O-N 2.81Å; G129-L132 WeakPolarHBondContact O-CB 3.37Å; G129-L132 PolarHBondContact O-N 3.4Å; L132-T134 VanDerWaalsContact C-N 3.25Å; L132-T134 PolarHBondContact O-N 3.09Å; L132-A135 WeakPolarHBondContact O-CB 3.34Å; L132-A135 PolarHBondContact O-N 3.29Å; L132-A135 VanDerWaalsContact O-N 3.12Å; L132-L136 HydrophobicContact CD1-CD1 4.27Å; L132-L136 HydrophobicContact CD1-CG 4.19Å; L132-L136 HydrophobicContact CG-CD1 4.16Å; L132-L136 HydrophobicContact CG-CG 4.5Å; L132-L136 WeakPolarHBondContact O-CG 3.49Å; L132-L136 PolarHBondContact O-N 2.85Å; L132-L211 HydrophobicContact CD2-CD2 3.77Å; L132-L214 HydrophobicContact CD1-CB 3.73Å; L132-L214 HydrophobicContact CD2-CB 4.4Å; L132-L214 HydrophobicContact CD2-CD1 4.15Å; L132-I215 HydrophobicContact CB-CD1 4.12Å; L132-I215 HydrophobicContact CB-CG1 3.78Å; L132-I215 HydrophobicContact CD1-CG1 3.93Å; L132-I215 HydrophobicContact CG-CG1 4.46Å
133L95.2Very high91.9Very high29 Ų2922.4 Ų22.415%0.15211%0.11CC..Hα-helixtrans-60.8-37.8176.1-69.1177000111.9F79 G129 S130 L136 D137 L161 L164F79-L133 HydrophobicContact CD1-CB 3.83Å; F79-L133 HydrophobicContact CD1-CD1 3.95Å; F79-L133 HydrophobicContact CD2-CB 4.33Å; F79-L133 HydrophobicContact CE1-CB 3.99Å; F79-L133 HydrophobicContact CE1-CD1 3.88Å; F79-L133 HydrophobicContact CE1-CG 4.38Å; F79-L133 HydrophobicContact CE2-CB 4.46Å; F79-L133 HydrophobicContact CG-CB 4.02Å; F79-L133 HydrophobicContact CZ-CB 4.3Å; G129-L133 WeakPolarHBondContact O-CG 3.22Å; G129-L133 PolarHBondContact O-N 3.25Å; S130-L133 PolarHBondContact O-N 2.62Å; L133-L136 PolarHBondContact O-N 3.06Å; L133-D137 WeakPolarHBondContact O-CB 3.44Å; L133-D137 PolarHBondContact O-N 3.27Å; L133-L161 HydrophobicContact CD1-CD2 3.74Å; L133-L161 HydrophobicContact CD1-CG 4.46Å; L133-L164 HydrophobicContact CD1-CD2 3.83Å
134T91.8Very high91.2Very high9 Ų926.3 Ų26.36%0.05513%0.128CC..Hα-helixtrans-65.5-42.2174-56.60000111.5S130 L131 L132 D137 R138S130-T134 WeakPolarHBondContact O-CB 3.5Å; S130-T134 PolarHBondContact O-N 3.46Å; S130-T134 PolarHBondContact O-OG1 2.96Å; L131-T134 PolarHBondContact O-N 2.91Å; L132-T134 VanDerWaalsContact C-N 3.25Å; L132-T134 PolarHBondContact O-N 3.09Å; T134-D137 WeakPolarHBondContact O-CB 3.34Å; T134-D137 PolarHBondContact O-N 2.99Å; T134-R138 WeakPolarHBondContact O-CG 3.18Å; T134-R138 PolarHBondContact O-N 3.35Å; T134-R138 VanDerWaalsContact O-N 3.07Å
135A90.1Very high90.6Very high0 Ų027 Ų270%014%0.136CC..Hα-helixtrans-63.7-41.4176.400000111.5L131 L132 R138 Y139 A218 Y219L131-A135 WeakPolarHBondContact O-CB 3.31Å; L131-A135 PolarHBondContact O-N 3.26Å; L132-A135 WeakPolarHBondContact O-CB 3.34Å; L132-A135 PolarHBondContact O-N 3.29Å; L132-A135 VanDerWaalsContact O-N 3.12Å; A135-R138 PolarHBondContact O-N 2.95Å; A135-Y139 WeakPolarHBondContact O-CB 3.3Å; A135-Y139 PolarHBondContact O-N 3.39Å; A135-A218 HydrophobicContact CB-CB 4.13Å; A135-Y219 HydrophobicContact CB-CD2 4.22Å; A135-Y219 HydrophobicContact CB-CE2 3.74Å
136L92.1Very high89.9Confident74 Ų7432 Ų3239%0.38717%0.171SC..Hα-helixtrans-66-41.4175.2-68.9174.3000112.2L132 L133 R138 Y139 L140L132-L136 HydrophobicContact CD1-CD1 4.27Å; L132-L136 HydrophobicContact CD1-CG 4.19Å; L132-L136 HydrophobicContact CG-CD1 4.16Å; L132-L136 HydrophobicContact CG-CG 4.5Å; L132-L136 WeakPolarHBondContact O-CG 3.49Å; L132-L136 PolarHBondContact O-N 2.85Å; L133-L136 PolarHBondContact O-N 3.06Å; L136-R138 VanDerWaalsContact C-N 3.31Å; L136-R138 PolarHBondContact O-N 2.95Å; L136-Y139 PolarHBondContact O-N 3.21Å; L136-L140 WeakPolarHBondContact O-CB 3.38Å; L136-L140 VanDerWaalsContact O-CG 3.28Å; L136-L140 WeakPolarHBondContact O-CG 3.42Å; L136-L140 PolarHBondContact O-N 2.87Å
137D91.3Very high89.4Confident2 Ų234.8 Ų34.81%0.01119%0.191CC..Hα-helixtrans-54.6-47.6171.5167.270.7000111.5S76 F79 L133 T134 L140 C141 Y148 L152S76-D137 WeakPolarHBondContact CB-OD2 3.3Å; S76-D137 PolarHBondContact OG-OD1 3.2Å; S76-D137 PolarHBondContact OG-OD2 2.95Å; F79-D137 HydrophobicContact CD2-CB 4.05Å; F79-D137 HydrophobicContact CE2-CB 4.02Å; L133-D137 WeakPolarHBondContact O-CB 3.44Å; L133-D137 PolarHBondContact O-N 3.27Å; T134-D137 WeakPolarHBondContact O-CB 3.34Å; T134-D137 PolarHBondContact O-N 2.99Å; D137-L140 PolarHBondContact O-N 3.28Å; D137-C141 PolarHBondContact O-N 3.34Å; D137-Y148 WeakPolarHBondContact OD1-CE2 3.35Å; D137-Y148 PolarHBondContact OD1-OH 2.77Å; D137-L152 HydrophobicContact CB-CD2 4.49Å; D137-L152 WeakPolarHBondContact OD1-CD2 2.99Å
138R88.3Confident89Confident67 Ų6736.4 Ų36.425%0.25320%0.197SC..Hα-helixtrans-65.3-42.8177.5-64.2-52.3-179.2-149.20.6112.2T134 A135 L136 L140 I142 I222T134-R138 WeakPolarHBondContact O-CG 3.18Å; T134-R138 PolarHBondContact O-N 3.35Å; T134-R138 VanDerWaalsContact O-N 3.07Å; A135-R138 PolarHBondContact O-N 2.95Å; L136-R138 VanDerWaalsContact C-N 3.31Å; L136-R138 PolarHBondContact O-N 2.95Å; R138-L140 VanDerWaalsContact C-N 3.3Å; R138-L140 PolarHBondContact O-N 2.97Å; R138-I142 WeakPolarHBondContact O-CB 3.36Å; R138-I142 VanDerWaalsContact O-CG1 3.31Å; R138-I142 WeakPolarHBondContact O-CG1 3.42Å; R138-I142 PolarHBondContact O-N 3.22Å; R138-I142 VanDerWaalsContact O-N 3.15Å; R138-I222 HydrophobicContact CB-CD1 3.86Å
139Y88Confident88.4Confident61 Ų6144.9 Ų44.924%0.23923%0.229CC..Hα-helixtrans-57.6-45.4175.7175.9-96.6000110.8A135 L136 I142 H143 L221 I222A135-Y139 WeakPolarHBondContact O-CB 3.3Å; A135-Y139 PolarHBondContact O-N 3.39Å; L136-Y139 PolarHBondContact O-N 3.21Å; Y139-I142 PolarHBondContact O-N 3.31Å; Y139-H143 AromaticContact CD2-CD2 3.5Å; Y139-H143 VanDerWaalsContact CD2-CD2 3.5Å; Y139-H143 WeakPolarHBondContact CD2-CD2 3.17Å; Y139-H143 AromaticContact CD2-NE2 3.86Å; Y139-H143 HydrophobicContact CE1-CB 4.49Å; Y139-H143 HydrophobicContact CE2-CB 4.32Å; Y139-H143 AromaticContact CE2-CD2 3.37Å; Y139-H143 WeakPolarHBondContact CE2-CD2 3.49Å; Y139-H143 AromaticContact CE2-CE1 3.88Å; Y139-H143 AromaticContact CE2-CG 3.72Å; Y139-H143 AromaticContact CE2-NE2 3.5Å; Y139-H143 WeakPolarHBondContact O-CB 3.38Å; Y139-H143 PolarHBondContact O-N 2.97Å; Y139-L221 HydrophobicContact CD2-CB 4.21Å; Y139-L221 HydrophobicContact CE2-CB 3.87Å; Y139-L221 HydrophobicContact CE2-CD1 3.99Å; Y139-I222 HydrophobicContact CD2-CG1 4.29Å
140L88.9Confident88Confident33 Ų3350 Ų5017%0.17326%0.259CS..Hα-helixtrans-68.7-44.6179.9-67.1174.3000113.6L136 D137 R138 I142 Q144 Y148 L151L136-L140 WeakPolarHBondContact O-CB 3.38Å; L136-L140 VanDerWaalsContact O-CG 3.28Å; L136-L140 WeakPolarHBondContact O-CG 3.42Å; L136-L140 PolarHBondContact O-N 2.87Å; D137-L140 PolarHBondContact O-N 3.28Å; R138-L140 VanDerWaalsContact C-N 3.3Å; R138-L140 PolarHBondContact O-N 2.97Å; L140-I142 PolarHBondContact O-N 3.47Å; L140-Q144 CarbonylContact O-C 3.59Å; L140-Q144 VanDerWaalsContact O-C 3.28Å; L140-Q144 WeakPolarHBondContact O-CA 3.45Å; L140-Q144 PolarHBondContact O-N 2.79Å; L140-Y148 HydrophobicContact CB-CD2 3.9Å; L140-Y148 HydrophobicContact CB-CE2 4.37Å; L140-L151 HydrophobicContact CD1-CD2 3.84Å; L140-L151 HydrophobicContact CD2-CD2 3.65Å; L140-L151 HydrophobicContact CG-CD2 4.32Å
141C85.7Confident87.6Confident27 Ų2753.3 Ų53.318%0.18228%0.276CS..Hα-helixtrans-63.4-29.6176.5161.60000111.4D137 Y148 C370D137-C141 PolarHBondContact O-N 3.34Å; C141-Y148 HydrophobicContact CB-CD1 4.35Å; C141-Y148 HydrophobicContact CB-CD2 3.82Å; C141-Y148 HydrophobicContact CB-CE1 4.29Å; C141-Y148 HydrophobicContact CB-CE2 3.74Å; C141-Y148 HydrophobicContact CB-CG 4.12Å; C141-C370 WeakPolarHBondContact CB-SG 3.08Å; C141-C370 WeakPolarHBondContact SG-CB 3.24Å; C141-C370 CovalentContact SG-SG 2.12Å; C141-C370 PolarHBondContact SG-SG 2.97Å
142I83.1Confident87.5Confident72 Ų7254.1 Ų54.137%0.36928%0.281SS..Hα-helixtrans-86.4-48.1-178.6-64.3171.1000112.4R138 Y139 L140 I222R138-I142 WeakPolarHBondContact O-CB 3.36Å; R138-I142 VanDerWaalsContact O-CG1 3.31Å; R138-I142 WeakPolarHBondContact O-CG1 3.42Å; R138-I142 PolarHBondContact O-N 3.22Å; R138-I142 VanDerWaalsContact O-N 3.15Å; Y139-I142 PolarHBondContact O-N 3.31Å; L140-I142 PolarHBondContact O-N 3.47Å; I142-I222 HydrophobicContact CD1-CG1 4.46Å; I142-I222 HydrophobicContact CD1-CG2 3.61Å
143H81.9Confident87.4Confident51 Ų5155.6 Ų55.624%0.23629%0.291CS..Hα-helixtrans-85.6-30.3-175-82.5-102.1000113.7Y139 L221 K225Y139-H143 AromaticContact CD2-CD2 3.5Å; Y139-H143 VanDerWaalsContact CD2-CD2 3.5Å; Y139-H143 WeakPolarHBondContact CD2-CD2 3.17Å; Y139-H143 AromaticContact CD2-NE2 3.86Å; Y139-H143 HydrophobicContact CE1-CB 4.49Å; Y139-H143 HydrophobicContact CE2-CB 4.32Å; Y139-H143 AromaticContact CE2-CD2 3.37Å; Y139-H143 WeakPolarHBondContact CE2-CD2 3.49Å; Y139-H143 AromaticContact CE2-CE1 3.88Å; Y139-H143 AromaticContact CE2-CG 3.72Å; Y139-H143 AromaticContact CE2-NE2 3.5Å; Y139-H143 WeakPolarHBondContact O-CB 3.38Å; Y139-H143 PolarHBondContact O-N 2.97Å; H143-L221 PolarHBondContact NE2-O 2.91Å; H143-K225 WeakPolarHBondContact CE1-CB 3.32Å; H143-K225 VanDerWaalsContact CE1-CG 3.46Å; H143-K225 WeakPolarHBondContact CE1-CG 3.29Å; H143-K225 WeakPolarHBondContact NE2-CB 3.46Å
144Q83Confident87.2Confident82 Ų8259.2 Ų59.238%0.38330%0.302SS..  trans-125.947.2-175.3-61.7-175.217.800111.4L140 S146 S147 Y148L140-Q144 CarbonylContact O-C 3.59Å; L140-Q144 VanDerWaalsContact O-C 3.28Å; L140-Q144 WeakPolarHBondContact O-CA 3.45Å; L140-Q144 PolarHBondContact O-N 2.79Å; Q144-S146 VanDerWaalsContact C-N 3.26Å; Q144-S146 PolarHBondContact O-N 2.98Å; Q144-S146 VanDerWaalsContact O-N 3.17Å; Q144-S147 PolarHBondContact O-N 3.16Å; Q144-S147 VanDerWaalsContact O-N 3.09Å; Q144-Y148 WeakPolarHBondContact O-CB 3.2Å; Q144-Y148 PolarHBondContact O-N 2.98Å
145A81.7Confident87.3Confident28 Ų2869.4 Ų69.423%0.23134%0.34CS..Hα-helixtrans-52.7-40.2-175.100000113.6V373A145-V373 HydrophobicContact CB-CG1 4.24Å
146S81.4Confident87.6Confident105 Ų10575.7 Ų75.773%0.73436%0.363SS*.Hα-helixtrans-65.3-38.6179.553.80000113.3Q144Q144-S146 VanDerWaalsContact C-N 3.26Å; Q144-S146 PolarHBondContact O-N 2.98Å; Q144-S146 VanDerWaalsContact O-N 3.17Å
147S85.6Confident87.7Confident59 Ų5972.1 Ų72.141%0.41335%0.345SS..Hα-helixtrans-94.5-11.7-178.1-590000113.4Q144 R149 V150 L151Q144-S147 PolarHBondContact O-N 3.16Å; Q144-S147 VanDerWaalsContact O-N 3.09Å; S147-R149 VanDerWaalsContact C-N 3.33Å; S147-R149 PolarHBondContact O-N 3.47Å; S147-V150 PolarHBondContact O-N 3.07Å; S147-L151 WeakPolarHBondContact O-CB 3.21Å; S147-L151 PolarHBondContact O-N 3.38Å
148Y87.5Confident87.9Confident34 Ų3476.4 Ų76.413%0.13337%0.366CS..Hα-helixtrans-52.6-46.2-173.1173.4-103.1000113S76 D137 L140 C141 Q144 V150 L151 L152S76-Y148 PolarHBondContact OG-OH 3.49Å; S76-Y148 VanDerWaalsContact OG-OH 3.12Å; D137-Y148 WeakPolarHBondContact OD1-CE2 3.35Å; D137-Y148 PolarHBondContact OD1-OH 2.77Å; L140-Y148 HydrophobicContact CB-CD2 3.9Å; L140-Y148 HydrophobicContact CB-CE2 4.37Å; C141-Y148 HydrophobicContact CB-CD1 4.35Å; C141-Y148 HydrophobicContact CB-CD2 3.82Å; C141-Y148 HydrophobicContact CB-CE1 4.29Å; C141-Y148 HydrophobicContact CB-CE2 3.74Å; C141-Y148 HydrophobicContact CB-CG 4.12Å; Q144-Y148 WeakPolarHBondContact O-CB 3.2Å; Q144-Y148 PolarHBondContact O-N 2.98Å; Y148-V150 VanDerWaalsContact C-N 3.29Å; Y148-V150 PolarHBondContact O-N 3.38Å; Y148-L151 PolarHBondContact O-N 2.76Å; Y148-L152 HydrophobicContact CD2-CB 4.36Å; Y148-L152 HydrophobicContact CE2-CB 4.08Å; Y148-L152 HydrophobicContact CE2-CD2 3.59Å; Y148-L152 HydrophobicContact CE2-CG 4.48Å; Y148-L152 PolarHBondContact O-N 3.27Å; Y148-L152 VanDerWaalsContact OH-CD2 3.28Å; Y148-L152 WeakPolarHBondContact OH-CD2 3.29Å
149R82.7Confident88.4Confident177 Ų17777.9 Ų77.967%0.66838%0.378SS*.Hα-helixtrans-65.5-30.4-178.9-67.9-169.5-179.8-139.82.8113.3S147S147-R149 VanDerWaalsContact C-N 3.33Å; S147-R149 PolarHBondContact O-N 3.47Å
150V86.6Confident88.8Confident110 Ų11077.4 Ų77.467%0.66738%0.384SS*.Hα-helixtrans-82.6-36.5177.9-178.80000110.5S147 Y148 R156S147-V150 PolarHBondContact O-N 3.07Å; Y148-V150 VanDerWaalsContact C-N 3.29Å; Y148-V150 PolarHBondContact O-N 3.38Å; V150-R156 PolarHBondContact O-NH1 3.13Å
151L87Confident89.2Confident70 Ų7076.5 Ų76.537%0.36638%0.379SS..Hα-helixtrans-75.6-49.4-176.2-165.263.8000111.7L140 S147 Y148 T153 R156L140-L151 HydrophobicContact CD1-CD2 3.84Å; L140-L151 HydrophobicContact CD2-CD2 3.65Å; L140-L151 HydrophobicContact CG-CD2 4.32Å; S147-L151 WeakPolarHBondContact O-CB 3.21Å; S147-L151 PolarHBondContact O-N 3.38Å; Y148-L151 PolarHBondContact O-N 2.76Å; L151-T153 PolarHBondContact O-N 3.16Å; L151-R156 VanDerWaalsContact O-CD 3.28Å; L151-R156 WeakPolarHBondContact O-CD 3.41Å; L151-R156 PolarHBondContact O-NH1 3.48Å; L151-R156 VanDerWaalsContact O-NH1 3.08Å
152L90.1Very high89.8Confident25 Ų2580.5 Ų80.513%0.13140%0.398CS..SBendtrans-95.583.3-176.8-166.574.2000111.5P75 F79 D137 Y148P75-L152 HydrophobicContact CB-CD1 4.44Å; P75-L152 HydrophobicContact CB-CD2 3.78Å; P75-L152 HydrophobicContact CB-CG 3.76Å; P75-L152 HydrophobicContact CG-CD2 4.43Å; P75-L152 HydrophobicContact CG-CG 4.23Å; F79-L152 HydrophobicContact CE2-CD1 4.03Å; F79-L152 HydrophobicContact CZ-CD1 4.1Å; D137-L152 HydrophobicContact CB-CD2 4.49Å; D137-L152 WeakPolarHBondContact OD1-CD2 2.99Å; Y148-L152 HydrophobicContact CD2-CB 4.36Å; Y148-L152 HydrophobicContact CE2-CB 4.08Å; Y148-L152 HydrophobicContact CE2-CD2 3.59Å; Y148-L152 HydrophobicContact CE2-CG 4.48Å; Y148-L152 PolarHBondContact O-N 3.27Å; Y148-L152 VanDerWaalsContact OH-CD2 3.28Å; Y148-L152 WeakPolarHBondContact OH-CD2 3.29Å
153T93.3Very high90.5Very high52 Ų5281.3 Ų81.332%0.31940%0.402SS..  trans-93.6156.4172.170.30000111.1L151 R155 R156 A157L151-T153 PolarHBondContact O-N 3.16Å; T153-R155 VanDerWaalsContact C-N 3.29Å; T153-R155 PolarHBondContact O-N 2.95Å; T153-R156 PolarHBondContact O-N 3.13Å; T153-R156 WeakPolarHBondContact OG1-CG 3.37Å; T153-R156 PolarHBondContact OG1-N 2.88Å; T153-A157 PolarHBondContact O-N 2.93Å
154R91.9Very high91.3Very high106 Ų10680 Ų8040%0.440%0.397SS..Hα-helixtrans-56.9-41.9177.4179173176166.20112.8R72 L78 A157 M158R72-R154 PolarHBondContact O-NH1 3.37Å; L78-R154 HydrophobicContact CD1-CG 3.94Å; R154-A157 PolarHBondContact O-N 2.91Å; R154-M158 HydrophobicContact CG-CG 4.48Å; R154-M158 WeakPolarHBondContact O-CG 3.31Å; R154-M158 PolarHBondContact O-N 2.91Å
155R93.9Very high92Very high222 Ų22277.9 Ų77.984%0.83839%0.385SS*.Hα-helixtrans-62.3-45.3179.5-69.5-176.2-178.5177.70.4111.2T153 M158 L159T153-R155 VanDerWaalsContact C-N 3.29Å; T153-R155 PolarHBondContact O-N 2.95Å; R155-M158 PolarHBondContact O-N 3.46Å; R155-L159 WeakPolarHBondContact O-CB 3.29Å; R155-L159 PolarHBondContact O-N 2.94Å
156R94.9Very high92.8Very high132 Ų13279.5 Ų79.550%0.49840%0.395SS..Hα-helixtrans-63.5-44177-71.4177.4178.7177.6-2.1111.7V150 L151 T153 M158 L159 S160V150-R156 PolarHBondContact O-NH1 3.13Å; L151-R156 VanDerWaalsContact O-CD 3.28Å; L151-R156 WeakPolarHBondContact O-CD 3.41Å; L151-R156 PolarHBondContact O-NH1 3.48Å; L151-R156 VanDerWaalsContact O-NH1 3.08Å; T153-R156 PolarHBondContact O-N 3.13Å; T153-R156 WeakPolarHBondContact OG1-CG 3.37Å; T153-R156 PolarHBondContact OG1-N 2.88Å; R156-M158 PolarHBondContact O-N 3.03Å; R156-L159 PolarHBondContact O-N 3.43Å; R156-S160 PolarHBondContact O-N 2.81Å; R156-S160 PolarHBondContact O-OG 3.09Å; R156-S160 VanDerWaalsContact O-OG 3.05Å
157A95.4Very high93.6Very high0 Ų078.2 Ų78.20%038%0.379CS..Hα-helixtrans-61.3-44.6176.700000112.8P75 F79 T153 R154 L159 S160 L161P75-A157 HydrophobicContact CB-CB 3.85Å; F79-A157 HydrophobicContact CE1-CB 3.85Å; F79-A157 HydrophobicContact CZ-CB 3.71Å; T153-A157 PolarHBondContact O-N 2.93Å; R154-A157 PolarHBondContact O-N 2.91Å; A157-L159 VanDerWaalsContact C-N 3.35Å; A157-L159 PolarHBondContact O-N 3.42Å; A157-S160 PolarHBondContact O-N 2.98Å; A157-L161 WeakPolarHBondContact O-CG 3.19Å; A157-L161 PolarHBondContact O-N 2.61Å
158M95.6Very high94.2Very high92 Ų9275.4 Ų75.445%0.45336%0.36SS..Hα-helixtrans-62-41.3174.8-72.2-63.8-5900112.1L78 R154 R155 R156 L161 L162L78-M158 HydrophobicContact CD1-CG 4.01Å; L78-M158 HydrophobicContact CD1-SD 3.79Å; L78-M158 HydrophobicContact CD2-SD 4.31Å; R154-M158 HydrophobicContact CG-CG 4.48Å; R154-M158 WeakPolarHBondContact O-CG 3.31Å; R154-M158 PolarHBondContact O-N 2.91Å; R155-M158 PolarHBondContact O-N 3.46Å; R156-M158 PolarHBondContact O-N 3.03Å; M158-L161 PolarHBondContact O-N 3.46Å; M158-L162 WeakPolarHBondContact O-CB 3.48Å; M158-L162 PolarHBondContact O-N 2.86Å
159L97.2Very high94.7Very high98 Ų9877.8 Ų77.851%0.51337%0.374SS..Hα-helixtrans-64.3-44.3176.3-17863.1000111.6R155 R156 A157 L161 L162 I163R155-L159 WeakPolarHBondContact O-CB 3.29Å; R155-L159 PolarHBondContact O-N 2.94Å; R156-L159 PolarHBondContact O-N 3.43Å; A157-L159 VanDerWaalsContact C-N 3.35Å; A157-L159 PolarHBondContact O-N 3.42Å; L159-L161 VanDerWaalsContact C-N 3.29Å; L159-L161 PolarHBondContact O-N 3.06Å; L159-L162 PolarHBondContact O-N 3.35Å; L159-I163 HydrophobicContact CD1-CD1 4.27Å; L159-I163 HydrophobicContact CD1-CG1 4.47Å; L159-I163 HydrophobicContact CG-CD1 3.99Å; L159-I163 VanDerWaalsContact O-CG1 3.31Å; L159-I163 WeakPolarHBondContact O-CG1 3.48Å; L159-I163 PolarHBondContact O-N 3.49Å
160S97.1Very high95.4Very high50 Ų5074.9 Ų74.935%0.3537%0.366SS..Hα-helixtrans-59.7-40.2174.8-60.80000112R156 A157 L164R156-S160 PolarHBondContact O-N 2.81Å; R156-S160 PolarHBondContact O-OG 3.09Å; R156-S160 VanDerWaalsContact O-OG 3.05Å; A157-S160 PolarHBondContact O-N 2.98Å; S160-L164 VanDerWaalsContact O-CB 3.3Å; S160-L164 WeakPolarHBondContact O-CB 3.44Å; S160-L164 PolarHBondContact O-N 3.49Å
161L97.9Very high95.9Very high15 Ų1571 Ų718%0.07934%0.341CS..Hα-helixtrans-65.3-45.3173.9-73.5177.2000111.9L78 F79 S82 L133 A157 M158 L159 I163 L164 W165L78-L161 HydrophobicContact CB-CD1 3.98Å; F79-L161 HydrophobicContact CD1-CD1 4.2Å; F79-L161 HydrophobicContact CD1-CD2 3.86Å; F79-L161 HydrophobicContact CD1-CG 3.98Å; F79-L161 HydrophobicContact CE1-CD2 4.36Å; F79-L161 HydrophobicContact CE1-CG 4.13Å; S82-L161 VanDerWaalsContact OG-CD2 3.31Å; S82-L161 WeakPolarHBondContact OG-CD2 3.11Å; L133-L161 HydrophobicContact CD1-CD2 3.74Å; L133-L161 HydrophobicContact CD1-CG 4.46Å; A157-L161 WeakPolarHBondContact O-CG 3.19Å; A157-L161 PolarHBondContact O-N 2.61Å; M158-L161 PolarHBondContact O-N 3.46Å; L159-L161 VanDerWaalsContact C-N 3.29Å; L159-L161 PolarHBondContact O-N 3.06Å; L161-I163 VanDerWaalsContact C-N 3.32Å; L161-I163 PolarHBondContact O-N 2.68Å; L161-L164 HydrophobicContact CD2-CD2 4.41Å; L161-L164 WeakPolarHBondContact O-CB 3.31Å; L161-L164 PolarHBondContact O-N 3.32Å; L161-W165 PolarHBondContact O-N 3.45Å
162L97.9Very high96.3Very high110 Ų11067.9 Ų67.958%0.57633%0.325SS*.Hα-helixtrans-58.3-45.7177.4179.964.9000111.4M158 L159 S166M158-L162 WeakPolarHBondContact O-CB 3.48Å; M158-L162 PolarHBondContact O-N 2.86Å; L159-L162 PolarHBondContact O-N 3.35Å; L162-S166 VanDerWaalsContact O-CB 3.32Å; L162-S166 WeakPolarHBondContact O-CB 3.26Å; L162-S166 PolarHBondContact O-N 2.85Å; L162-S166 PolarHBondContact O-OG 2.6Å
163I98.3Very high96.6Very high89 Ų8968.1 Ų68.146%0.45633%0.329SS..Hα-helixtrans-61.8-48176.5-67.7165.6000110.2L159 L161 S166 I167L159-I163 HydrophobicContact CD1-CD1 4.27Å; L159-I163 HydrophobicContact CD1-CG1 4.47Å; L159-I163 HydrophobicContact CG-CD1 3.99Å; L159-I163 VanDerWaalsContact O-CG1 3.31Å; L159-I163 WeakPolarHBondContact O-CG1 3.48Å; L159-I163 PolarHBondContact O-N 3.49Å; L161-I163 VanDerWaalsContact C-N 3.32Å; L161-I163 PolarHBondContact O-N 2.68Å; I163-S166 PolarHBondContact O-N 3.28Å; I163-I167 HydrophobicContact CG2-CD1 3.69Å; I163-I167 HydrophobicContact CG2-CG1 4.43Å; I163-I167 VanDerWaalsContact O-CG1 3.31Å; I163-I167 WeakPolarHBondContact O-CG1 3.46Å; I163-I167 PolarHBondContact O-N 2.9Å
164L98.2Very high96.7Very high23 Ų2367 Ų6712%0.1232%0.321CS..Hα-helixtrans-55.5-55.5178.117165.4000111.4L133 S160 L161 S166 I167 T168L133-L164 HydrophobicContact CD1-CD2 3.83Å; S160-L164 VanDerWaalsContact O-CB 3.3Å; S160-L164 WeakPolarHBondContact O-CB 3.44Å; S160-L164 PolarHBondContact O-N 3.49Å; L161-L164 HydrophobicContact CD2-CD2 4.41Å; L161-L164 WeakPolarHBondContact O-CB 3.31Å; L161-L164 PolarHBondContact O-N 3.32Å; L164-S166 VanDerWaalsContact C-N 3.31Å; L164-S166 PolarHBondContact O-N 3.35Å; L164-I167 PolarHBondContact O-N 3.33Å; L164-T168 HydrophobicContact CD1-CG2 3.98Å; L164-T168 WeakPolarHBondContact O-CG2 3.45Å; L164-T168 PolarHBondContact O-N 3.22Å; L164-T168 PolarHBondContact O-OG1 3.02Å; L164-T168 VanDerWaalsContact O-OG1 3.09Å
165W98.4Very high96.9Very high38 Ų3862.2 Ų62.214%0.14430%0.304CS..Hα-helixtrans-59.9-43.4-178.4-82.593.7000111.3S82 L85 A86 F89 M122 L161 I167 T168 I169S82-W165 PolarHBondContact OG-NE1 3.49Å; L85-W165 HydrophobicContact CB-CZ2 4.23Å; L85-W165 HydrophobicContact CD2-CH2 4.21Å; L85-W165 HydrophobicContact CD2-CZ2 3.91Å; L85-W165 HydrophobicContact CG-CH2 4.06Å; L85-W165 HydrophobicContact CG-CZ2 4.02Å; A86-W165 HydrophobicContact CB-CH2 4.13Å; A86-W165 HydrophobicContact CB-CZ2 4.22Å; F89-W165 AromaticContact CD2-CH2 3.89Å; F89-W165 HydrophobicContact CD2-CH2 3.89Å; F89-W165 HydrophobicContact CD2-CZ3 4.14Å; F89-W165 HydrophobicContact CE2-CH2 4.15Å; F89-W165 HydrophobicContact CE2-CZ3 4.23Å; M122-W165 HydrophobicContact SD-CZ3 4.45Å; L161-W165 PolarHBondContact O-N 3.45Å; W165-I167 PolarHBondContact O-N 2.94Å; W165-T168 WeakPolarHBondContact CA-OG1 3.42Å; W165-T168 PolarHBondContact O-N 2.99Å; W165-T168 PolarHBondContact O-OG1 3.29Å; W165-I169 HydrophobicContact CE3-CD1 4.47Å; W165-I169 WeakPolarHBondContact O-CB 3.43Å; W165-I169 WeakPolarHBondContact O-CD1 3.46Å; W165-I169 WeakPolarHBondContact O-CG1 3.32Å; W165-I169 PolarHBondContact O-N 3.46Å
166S98.4Very high96.8Very high63 Ų6355 Ų5544%0.44128%0.281SS..Hα-helixtrans-59.1-47.2177.6-57.10000112.1L162 I163 L164 F170L162-S166 VanDerWaalsContact O-CB 3.32Å; L162-S166 WeakPolarHBondContact O-CB 3.26Å; L162-S166 PolarHBondContact O-N 2.85Å; L162-S166 PolarHBondContact O-OG 2.6Å; I163-S166 PolarHBondContact O-N 3.28Å; L164-S166 VanDerWaalsContact C-N 3.31Å; L164-S166 PolarHBondContact O-N 3.35Å; S166-F170 VanDerWaalsContact O-CB 3.26Å; S166-F170 WeakPolarHBondContact O-CB 3.18Å; S166-F170 PolarHBondContact O-N 3.4Å
167I97.8Very high96.8Very high78 Ų7855 Ų5540%0.429%0.288SS..Hα-helixtrans-61.8-47177.3-69.1168.6000110.5I163 L164 W165 F170 I171 F207I163-I167 HydrophobicContact CG2-CD1 3.69Å; I163-I167 HydrophobicContact CG2-CG1 4.43Å; I163-I167 VanDerWaalsContact O-CG1 3.31Å; I163-I167 WeakPolarHBondContact O-CG1 3.46Å; I163-I167 PolarHBondContact O-N 2.9Å; L164-I167 PolarHBondContact O-N 3.33Å; W165-I167 PolarHBondContact O-N 2.94Å; I167-F170 PolarHBondContact O-N 3.34Å; I167-I171 HydrophobicContact CG2-CD1 3.64Å; I167-I171 HydrophobicContact CG2-CG1 4.36Å; I167-I171 WeakPolarHBondContact O-CG1 3.31Å; I167-I171 PolarHBondContact O-N 2.6Å; I167-F207 HydrophobicContact CG2-CZ 4.35Å
168T98Very high96.5Very high0 Ų057.2 Ų57.20%031%0.312CS..Hα-helixtrans-67.4-38.6-177.3540000112.7S126 L164 W165 S172S126-T168 WeakPolarHBondContact OG-CB 3.44Å; S126-T168 PolarHBondContact OG-OG1 3.07Å; L164-T168 HydrophobicContact CD1-CG2 3.98Å; L164-T168 WeakPolarHBondContact O-CG2 3.45Å; L164-T168 PolarHBondContact O-N 3.22Å; L164-T168 PolarHBondContact O-OG1 3.02Å; L164-T168 VanDerWaalsContact O-OG1 3.09Å; W165-T168 WeakPolarHBondContact CA-OG1 3.42Å; W165-T168 PolarHBondContact O-N 2.99Å; W165-T168 PolarHBondContact O-OG1 3.29Å; T168-S172 WeakPolarHBondContact O-CB 3.3Å; T168-S172 PolarHBondContact O-N 2.79Å; T168-S172 PolarHBondContact O-OG 3.35Å
169I97.9Very high96.3Very high84 Ų8458.1 Ų58.143%0.43131%0.31SS..Hα-helixtrans-63.9-48.4174.2-71.1164.4000109.7M122 W165 S172 S173M122-I169 HydrophobicContact CG-CG1 3.96Å; M122-I169 HydrophobicContact SD-CD1 4.48Å; M122-I169 HydrophobicContact SD-CG1 3.65Å; W165-I169 HydrophobicContact CE3-CD1 4.47Å; W165-I169 WeakPolarHBondContact O-CB 3.43Å; W165-I169 WeakPolarHBondContact O-CD1 3.46Å; W165-I169 WeakPolarHBondContact O-CG1 3.32Å; W165-I169 PolarHBondContact O-N 3.46Å; I169-S172 PolarHBondContact O-N 3.32Å; I169-S173 WeakPolarHBondContact O-CB 3.44Å; I169-S173 PolarHBondContact O-N 3.41Å; I169-S173 PolarHBondContact O-OG 3.15Å
170F97.4Very high95.9Very high116 Ų11658.7 Ų58.751%0.50931%0.306SS..Hα-helixtrans-57.4-56.6-179.6178-107.2000111.4S166 I167 S172 S173 L174 M177S166-F170 VanDerWaalsContact O-CB 3.26Å; S166-F170 WeakPolarHBondContact O-CB 3.18Å; S166-F170 PolarHBondContact O-N 3.4Å; I167-F170 PolarHBondContact O-N 3.34Å; F170-S172 VanDerWaalsContact C-N 3.25Å; F170-S172 PolarHBondContact O-N 3.39Å; F170-S173 PolarHBondContact O-N 3.12Å; F170-S173 VanDerWaalsContact O-N 3.08Å; F170-S173 PolarHBondContact O-OG 3.23Å; F170-L174 HydrophobicContact CE1-CD2 4.07Å; F170-L174 HydrophobicContact CE2-CD2 4.25Å; F170-L174 HydrophobicContact CZ-CD2 3.85Å; F170-L174 PolarHBondContact O-N 3.03Å; F170-M177 HydrophobicContact CE2-SD 4.42Å
171I96.3Very high95.4Very high28 Ų2856.5 Ų56.514%0.14429%0.29CS..Hα-helixtrans-57.1-40.2179.3-66.3172.6000111.3I167 S173 L174 Y200 F207I167-I171 HydrophobicContact CG2-CD1 3.64Å; I167-I171 HydrophobicContact CG2-CG1 4.36Å; I167-I171 WeakPolarHBondContact O-CG1 3.31Å; I167-I171 PolarHBondContact O-N 2.6Å; I171-S173 VanDerWaalsContact C-N 3.31Å; I171-S173 PolarHBondContact O-N 3.07Å; I171-L174 PolarHBondContact O-N 3.29Å; I171-Y200 VanDerWaalsContact O-CE2 3.29Å; I171-Y200 WeakPolarHBondContact O-CE2 3.49Å; I171-Y200 PolarHBondContact O-OH 3.06Å; I171-Y200 VanDerWaalsContact O-OH 3.04Å; I171-F207 HydrophobicContact CD1-CD1 4.21Å; I171-F207 HydrophobicContact CD1-CD2 4.39Å; I171-F207 HydrophobicContact CD1-CE1 4.06Å; I171-F207 HydrophobicContact CD1-CE2 4.25Å; I171-F207 HydrophobicContact CD1-CG 4.37Å; I171-F207 HydrophobicContact CD1-CZ 4.07Å
172S96.9Very high94.3Very high4 Ų461.2 Ų61.23%0.02832%0.322CS..Hα-helixtrans-72.2-26-178.1-56.80000113.1G118 T121 M122 T168 I169 F170G118-S172 WeakPolarHBondContact O-CB 3.28Å; T121-S172 VanDerWaalsContact C-OG 3.32Å; T121-S172 VanDerWaalsContact OG1-CB 3.26Å; T121-S172 WeakPolarHBondContact OG1-CB 3.47Å; T121-S172 PolarHBondContact OG1-OG 3.22Å; M122-S172 WeakPolarHBondContact CA-OG 3.13Å; M122-S172 PolarHBondContact N-OG 3.42Å; T168-S172 WeakPolarHBondContact O-CB 3.3Å; T168-S172 PolarHBondContact O-N 2.79Å; T168-S172 PolarHBondContact O-OG 3.35Å; I169-S172 PolarHBondContact O-N 3.32Å; F170-S172 VanDerWaalsContact C-N 3.25Å; F170-S172 PolarHBondContact O-N 3.39Å
173S95.9Very high92.8Very high31 Ų3159.5 Ų59.522%0.21732%0.316CS..Hα-helixtrans-85.3-11.7178.269.80000114.5I169 F170 I171 P175 L176 M177I169-S173 WeakPolarHBondContact O-CB 3.44Å; I169-S173 PolarHBondContact O-N 3.41Å; I169-S173 PolarHBondContact O-OG 3.15Å; F170-S173 PolarHBondContact O-N 3.12Å; F170-S173 VanDerWaalsContact O-N 3.08Å; F170-S173 PolarHBondContact O-OG 3.23Å; I171-S173 VanDerWaalsContact C-N 3.31Å; I171-S173 PolarHBondContact O-N 3.07Å; S173-P175 VanDerWaalsContact C-CD 3.48Å; S173-L176 WeakPolarHBondContact O-CA 3.41Å; S173-L176 WeakPolarHBondContact O-CB 3.11Å; S173-L176 PolarHBondContact O-N 3.25Å; S173-M177 PolarHBondContact O-N 3.09Å
174L96Very high91.3Very high28 Ų2856 Ų5615%0.14730%0.298CS..THydrogen-bonded Turntrans-53.8-39.8-177.1-68.4171.1000114.5F170 I171 L176 M177 G178 W179 Y200F170-L174 HydrophobicContact CE1-CD2 4.07Å; F170-L174 HydrophobicContact CE2-CD2 4.25Å; F170-L174 HydrophobicContact CZ-CD2 3.85Å; F170-L174 PolarHBondContact O-N 3.03Å; I171-L174 PolarHBondContact O-N 3.29Å; L174-L176 VanDerWaalsContact C-N 3.33Å; L174-L176 PolarHBondContact O-N 2.74Å; L174-M177 PolarHBondContact O-N 3.4Å; L174-G178 PolarHBondContact O-N 3.15Å; L174-W179 HydrophobicContact CB-CB 4.3Å; L174-W179 HydrophobicContact CB-CE3 4.23Å; L174-W179 HydrophobicContact CD1-CE3 3.84Å; L174-W179 HydrophobicContact CD1-CZ3 3.97Å; L174-W179 HydrophobicContact CG-CE3 4.45Å; L174-W179 PolarHBondContact O-N 3.43Å; L174-Y200 HydrophobicContact CB-CD2 4.26Å; L174-Y200 HydrophobicContact CB-CE2 3.97Å; L174-Y200 HydrophobicContact CD1-CE2 4.38Å
175P94.4Very high89.5Confident5 Ų560.1 Ų60.13%0.03232%0.32CS..THydrogen-bonded Turntrans-63.3-36.9175.3-25.137.2000113.1L114 S173 M177 G178 R180 I196 Y200L114-P175 HydrophobicContact CD2-CB 3.91Å; S173-P175 VanDerWaalsContact C-CD 3.48Å; P175-M177 VanDerWaalsContact C-N 3.31Å; P175-G178 PolarHBondContact O-N 3.35Å; P175-R180 WeakPolarHBondContact O-CB 3.41Å; P175-I196 HydrophobicContact CB-CD1 3.94Å; P175-I196 HydrophobicContact CG-CD1 3.86Å; P175-Y200 HydrophobicContact CG-CD1 3.84Å; P175-Y200 HydrophobicContact CG-CD2 4.03Å; P175-Y200 HydrophobicContact CG-CE1 3.5Å; P175-Y200 HydrophobicContact CG-CE2 3.73Å; P175-Y200 HydrophobicContact CG-CG 4.07Å; P175-Y200 VanDerWaalsContact CG-CZ 3.43Å
176L93.1Very high87.7Confident70 Ų7063.2 Ų63.237%0.36634%0.339SS..THydrogen-bonded Turntrans-67.2-33.9174.5-70.6167.2000111.8T111 L114 S173 L174 G178T111-L176 HydrophobicContact CG2-CD2 4.25Å; L114-L176 HydrophobicContact CB-CD2 3.49Å; L114-L176 VanDerWaalsContact CB-CD2 3.49Å; L114-L176 HydrophobicContact CB-CG 4.03Å; S173-L176 WeakPolarHBondContact O-CA 3.41Å; S173-L176 WeakPolarHBondContact O-CB 3.11Å; S173-L176 PolarHBondContact O-N 3.25Å; L174-L176 VanDerWaalsContact C-N 3.33Å; L174-L176 PolarHBondContact O-N 2.74Å; L176-G178 PolarHBondContact O-N 2.94Å
177M93.7Very high86.1Confident132 Ų13263.9 Ų63.965%0.6534%0.342SS*.THydrogen-bonded Turntrans-76.9-4.3176.8-63.117969.700113.7F170 S173 L174 P175F170-M177 HydrophobicContact CE2-SD 4.42Å; S173-M177 PolarHBondContact O-N 3.09Å; L174-M177 PolarHBondContact O-N 3.4Å; P175-M177 VanDerWaalsContact C-N 3.31Å
178G89.9Confident84.8Confident48 Ų4864 Ų6450%0.49535%0.349SS..THydrogen-bonded Turntrans121.4-5.8173.200000115.5L174 P175 L176 R180L174-G178 PolarHBondContact O-N 3.15Å; P175-G178 PolarHBondContact O-N 3.35Å; L176-G178 PolarHBondContact O-N 2.94Å; G178-R180 PolarHBondContact O-N 3.07Å
179W92.3Very high84.3Confident110 Ų11064.5 Ų64.542%0.41735%0.351SS..  trans-78.353.1172.5-161.2-7.8000111.6L174 S197 A199 Y200 C203L174-W179 HydrophobicContact CB-CB 4.3Å; L174-W179 HydrophobicContact CB-CE3 4.23Å; L174-W179 HydrophobicContact CD1-CE3 3.84Å; L174-W179 HydrophobicContact CD1-CZ3 3.97Å; L174-W179 HydrophobicContact CG-CE3 4.45Å; L174-W179 PolarHBondContact O-N 3.43Å; W179-S197 PolarHBondContact NE1-OG 3.49Å; W179-A199 HydrophobicContact CZ2-CB 4.36Å; W179-Y200 HydrophobicContact CD2-CD2 4.39Å; W179-Y200 HydrophobicContact CE3-CD2 4.41Å; W179-C203 HydrophobicContact CH2-CB 4.3Å
180R88.9Confident83.8Confident111 Ų11160.5 Ų60.542%0.41933%0.331SS..BIsolated β-bridgetrans-119.3161.4-176.364.6-178.3-176.9104.1-2110.9L114 P175 G178 F195L114-R180 HydrophobicContact CD1-CB 4.21Å; P175-R180 WeakPolarHBondContact O-CB 3.41Å; G178-R180 PolarHBondContact O-N 3.07Å; R180-F195 CarbonylContact C-O 3.28Å; R180-F195 WeakPolarHBondContact CA-O 3.46Å; R180-F195 WeakPolarHBondContact CB-O 3.21Å
181C86Confident83.2Confident4 Ų456.1 Ų56.13%0.02731%0.314CS..  trans-76.8127.7170.3-124.30000110.6C189 F195C181-C189 HydrophobicContact CB-CB 3.85Å; C181-C189 WeakPolarHBondContact CB-SG 3.22Å; C181-C189 WeakPolarHBondContact SG-CA 3.41Å; C181-C189 WeakPolarHBondContact SG-CB 3.31Å; C181-C189 CovalentContact SG-SG 2.02Å; C181-C189 PolarHBondContact SG-SG 2.9Å; C181-F195 PolarHBondContact N-O 3.13Å
182P73.9Confident82.8Confident114 Ų11455.7 Ų55.774%0.7431%0.312SS*.SBendtrans-73.3-36179.6-313.6000112.8
183T67.6Low82.4Confident73 Ų7356.9 Ų56.945%0.44832%0.317SS..SBendtrans-113.5144.8177.153.80000108.8C189T183-C189 PolarHBondContact O-SG 3.29Å
184V65.1Low81.9Confident15 Ų1555.5 Ų55.59%0.09131%0.307CS..SBendtrans-82.1-21.2-176-178.30000111.8Y32 F195Y32-V184 HydrophobicContact CE2-CG1 3.46Å; Y32-V184 VanDerWaalsContact CE2-CG1 3.46Å; Y32-V184 PolarHBondContact OH-O 3.32Å; V184-F195 HydrophobicContact CG2-CD1 3.82Å; V184-F195 HydrophobicContact CG2-CE1 3.25Å; V184-F195 HydrophobicContact CG2-CZ 3.76Å
185L60.9Low81.5Confident111 Ų11154.7 Ų54.758%0.58130%0.303SS*.SBendtrans-110.4-9.9-162.7-100.372.5000116.2I31I31-L185 HydrophobicContact CD1-CD1 4.02Å; I31-L185 HydrophobicContact CD1-CD2 4.49Å
186N61.9Low81.4Confident102 Ų10254.6 Ų54.655%0.54530%0.302SS..SBendtrans-113.4138.2-176.2-70.9-26.6000111.2C189N186-C189 PolarHBondContact O-N 2.9Å; N186-C189 PolarHBondContact O-SG 2.9Å
187P63.5Low81.4Confident77 Ų7751.9 Ų51.950%0.529%0.289SS..SBendtrans-51.9140.1169.824.3-35.5000110.2Y282P187-Y282 VanDerWaalsContact CB-OH 3.24Å; P187-Y282 WeakPolarHBondContact CB-OH 3.39Å; P187-Y282 WeakPolarHBondContact CD-OH 3.48Å; P187-Y282 WeakPolarHBondContact CG-OH 3.43Å
188P71.8Confident81.3Confident82 Ų8247 Ų4753%0.53226%0.264SS..SBendcis-103.658.818.439.2-35.6000115.1Q198P188-Q198 PolarHBondContact O-N 3.03Å
189C86.3Confident81.4Confident9 Ų947.5 Ų47.56%0.06126%0.264CS..BIsolated β-bridgetrans-97.4153.8178.1-49.40000113.8C181 T183 N186C181-C189 HydrophobicContact CB-CB 3.85Å; C181-C189 WeakPolarHBondContact CB-SG 3.22Å; C181-C189 WeakPolarHBondContact SG-CA 3.41Å; C181-C189 WeakPolarHBondContact SG-CB 3.31Å; C181-C189 CovalentContact SG-SG 2.02Å; C181-C189 PolarHBondContact SG-SG 2.9Å; T183-C189 PolarHBondContact O-SG 3.29Å; N186-C189 PolarHBondContact O-N 2.9Å; N186-C189 PolarHBondContact O-SG 2.9Å
190S87.5Confident81.6Confident1 Ų142.7 Ų42.71%0.00725%0.246CC..  trans-70.5137.1177.3174.80000112.4Y32 L192 F193 I196 D278Y32-S190 PolarHBondContact OH-O 2.92Å; S190-L192 VanDerWaalsContact C-N 3.33Å; S190-L192 PolarHBondContact OG-N 2.85Å; S190-L192 VanDerWaalsContact OG-N 3.1Å; S190-F193 PolarHBondContact OG-N 3.14Å; S190-I196 WeakPolarHBondContact CB-O 3.34Å; S190-I196 PolarHBondContact N-O 3.07Å; S190-D278 WeakPolarHBondContact CA-OD2 3.43Å; S190-D278 VanDerWaalsContact CB-OD2 3.24Å; S190-D278 WeakPolarHBondContact CB-OD2 3.33Å; S190-D278 PolarHBondContact OG-OD2 3.35Å
191C85.1Confident81.9Confident23 Ų2337.7 Ų37.716%0.15523%0.227CC..SBendtrans-84.7-11.1171.4-55.20000112Y32 D278 L283 Q288Y32-C191 WeakPolarHBondContact CE1-O 3.46Å; C191-D278 WeakPolarHBondContact CA-OD1 3.26Å; C191-D278 WeakPolarHBondContact CB-OD1 3.39Å; C191-D278 PolarHBondContact N-OD1 3.3Å; C191-D278 PolarHBondContact N-OD2 3.38Å; C191-L283 HydrophobicContact CB-CB 4.47Å; C191-Q288 PolarHBondContact O-NE2 3.35Å
192L87.1Confident82.3Confident19 Ų1938.8 Ų38.810%0.09924%0.236CC..SBendtrans-93.8-38.7178-67.7177.2000112.4S190 F274 M275 D278 L283 Q288 F291S190-L192 VanDerWaalsContact C-N 3.33Å; S190-L192 PolarHBondContact OG-N 2.85Å; S190-L192 VanDerWaalsContact OG-N 3.1Å; L192-F274 HydrophobicContact CD1-CB 4.44Å; L192-M275 HydrophobicContact CD1-CG 4.35Å; L192-D278 HydrophobicContact CD1-CB 3.81Å; L192-D278 HydrophobicContact CG-CB 4.08Å; L192-L283 HydrophobicContact CD1-CD2 4.3Å; L192-L283 HydrophobicContact CD2-CD2 3.64Å; L192-L283 HydrophobicContact CG-CD2 4.03Å; L192-Q288 HydrophobicContact CD2-CG 4.22Å; L192-F291 HydrophobicContact CB-CE1 4.46Å; L192-F291 HydrophobicContact CD1-CD1 4.39Å; L192-F291 HydrophobicContact CD1-CD2 3.92Å; L192-F291 HydrophobicContact CD1-CE1 4.48Å; L192-F291 HydrophobicContact CD1-CE2 4Å; L192-F291 HydrophobicContact CD1-CG 4.11Å; L192-F291 HydrophobicContact CD1-CZ 4.3Å; L192-F291 HydrophobicContact CD2-CB 3.85Å; L192-F291 HydrophobicContact CD2-CD1 3.62Å; L192-F291 HydrophobicContact CD2-CD2 4.31Å; L192-F291 HydrophobicContact CD2-CE1 4.27Å; L192-F291 HydrophobicContact CD2-CG 3.64Å; L192-F291 HydrophobicContact CG-CD1 4.43Å; L192-F291 HydrophobicContact CG-CG 4.47Å
193F88.9Confident83.3Confident30 Ų3036.4 Ų36.413%0.13222%0.222CC..SBendtrans-126.5115.7-172.4-58.4-70.4000112L117 S190 I196 L201 M275 F291L117-F193 HydrophobicContact CD1-CD1 3.93Å; L117-F193 HydrophobicContact CD1-CE1 4.01Å; L117-F193 HydrophobicContact CD2-CB 4.11Å; L117-F193 HydrophobicContact CD2-CD1 4.19Å; L117-F193 HydrophobicContact CD2-CG 4.31Å; S190-F193 PolarHBondContact OG-N 3.14Å; F193-I196 HydrophobicContact CB-CB 3.88Å; F193-I196 HydrophobicContact CB-CG1 3.64Å; F193-I196 PolarHBondContact O-N 3.44Å; F193-L201 HydrophobicContact CD2-CD1 4.06Å; F193-L201 HydrophobicContact CE2-CD1 4Å; F193-M275 HydrophobicContact CE2-CE 3.62Å; F193-M275 HydrophobicContact CE2-CG 4.32Å; F193-M275 HydrophobicContact CE2-SD 4.32Å; F193-M275 HydrophobicContact CZ-CE 3.54Å; F193-F291 HydrophobicContact CE1-CE1 4.23Å; F193-F291 HydrophobicContact CE1-CZ 4.17Å; F193-F291 HydrophobicContact CE2-CZ 4.13Å; F193-F291 HydrophobicContact CZ-CE1 4Å; F193-F291 AromaticContact CZ-CZ 3.52Å; F193-F291 HydrophobicContact CZ-CZ 3.52Å
194P86.8Confident84.7Confident1 Ų133.5 Ų33.51%0.00620%0.203CC..THydrogen-bonded Turntrans-48.6140.2171-26.726.3000113.2L29 Y32 Y113 I196L29-P194 HydrophobicContact CD2-CB 3.86Å; L29-P194 HydrophobicContact CD2-CG 3.61Å; Y32-P194 HydrophobicContact CD1-CG 3.95Å; Y32-P194 HydrophobicContact CD2-CB 4.45Å; Y32-P194 HydrophobicContact CD2-CG 3.68Å; Y32-P194 HydrophobicContact CE1-CG 4.13Å; Y32-P194 HydrophobicContact CE2-CB 4.22Å; Y32-P194 HydrophobicContact CE2-CG 3.89Å; Y32-P194 HydrophobicContact CG-CG 3.7Å; Y113-P194 HydrophobicContact CD1-CB 4.21Å; Y113-P194 HydrophobicContact CE1-CB 3.85Å; Y113-P194 HydrophobicContact CE1-CG 4.19Å; Y113-P194 WeakPolarHBondContact CE1-O 3.31Å; Y113-P194 HydrophobicContact CE2-CB 4.49Å; Y113-P194 HydrophobicContact CE2-CG 4.1Å; Y113-P194 VanDerWaalsContact OH-CD 3.31Å; Y113-P194 WeakPolarHBondContact OH-CD 3.48Å; P194-I196 PolarHBondContact O-N 3.24Å
195F87.4Confident86.2Confident11 Ų1132.8 Ų32.85%0.04820%0.198CC..THydrogen-bonded Turntrans62.64.2176.6-46.8-72.5000116.1F25 L29 P110 Y113 L114 R180 C181 V184F25-F195 HydrophobicContact CD2-CZ 4.36Å; F25-F195 HydrophobicContact CE2-CE1 4.17Å; F25-F195 AromaticContact CE2-CE2 3.98Å; F25-F195 HydrophobicContact CE2-CE2 3.98Å; F25-F195 AromaticContact CE2-CZ 3.32Å; F25-F195 HydrophobicContact CE2-CZ 3.32Å; F25-F195 AromaticContact CZ-CE2 3.91Å; F25-F195 HydrophobicContact CZ-CE2 3.91Å; F25-F195 AromaticContact CZ-CZ 3.74Å; F25-F195 HydrophobicContact CZ-CZ 3.74Å; L29-F195 HydrophobicContact CD2-CE2 4.49Å; P110-F195 HydrophobicContact CB-CD1 4.43Å; P110-F195 HydrophobicContact CB-CE1 4.37Å; P110-F195 HydrophobicContact CB-CZ 4.46Å; P110-F195 HydrophobicContact CG-CE1 4.24Å; P110-F195 HydrophobicContact CG-CZ 4.29Å; Y113-F195 AromaticContact CD1-CD2 3.9Å; Y113-F195 HydrophobicContact CD1-CD2 3.9Å; Y113-F195 HydrophobicContact CG-CD2 4.45Å; L114-F195 HydrophobicContact CD1-CB 4.34Å; L114-F195 HydrophobicContact CD2-CB 4.01Å; L114-F195 HydrophobicContact CG-CB 4.28Å; R180-F195 CarbonylContact C-O 3.28Å; R180-F195 WeakPolarHBondContact CA-O 3.46Å; R180-F195 WeakPolarHBondContact CB-O 3.21Å; C181-F195 PolarHBondContact N-O 3.13Å; V184-F195 HydrophobicContact CG2-CD1 3.82Å; V184-F195 HydrophobicContact CG2-CE1 3.25Å; V184-F195 HydrophobicContact CG2-CZ 3.76Å
196I91.7Very high87.8Confident4 Ų431 Ų312%0.02119%0.192CC..BIsolated β-bridgetrans-91129.7176.9-66-56.7000110.3L114 L117 P175 S190 F193 P194 Y200 L201L114-I196 HydrophobicContact CD2-CD1 3.81Å; L117-I196 HydrophobicContact CD2-CD1 3.79Å; L117-I196 HydrophobicContact CD2-CG1 3.56Å; P175-I196 HydrophobicContact CB-CD1 3.94Å; P175-I196 HydrophobicContact CG-CD1 3.86Å; S190-I196 WeakPolarHBondContact CB-O 3.34Å; S190-I196 PolarHBondContact N-O 3.07Å; F193-I196 HydrophobicContact CB-CB 3.88Å; F193-I196 HydrophobicContact CB-CG1 3.64Å; F193-I196 PolarHBondContact O-N 3.44Å; P194-I196 PolarHBondContact O-N 3.24Å; I196-Y200 HydrophobicContact CD1-CD1 4.13Å; I196-Y200 HydrophobicContact CD1-CE1 4.19Å; I196-Y200 HydrophobicContact CG2-CD1 3.87Å; I196-L201 HydrophobicContact CG2-CB 4Å
197S92.3Very high89.5Confident12 Ų1228.4 Ų28.48%0.08418%0.176CC..BIsolated β-bridgetrans-76.6143.8171.1700000110.5W179 A199 Y200 L201W179-S197 PolarHBondContact NE1-OG 3.49Å; S197-A199 PolarHBondContact O-N 2.9Å; S197-Y200 PolarHBondContact O-N 2.79Å; S197-Y200 VanDerWaalsContact OG-CB 3.32Å; S197-Y200 WeakPolarHBondContact OG-CB 3.37Å; S197-Y200 PolarHBondContact OG-N 3.2Å; S197-L201 PolarHBondContact O-N 3.46Å
198Q91.6Very high91Very high30 Ų3024.7 Ų24.714%0.1415%0.152CC..Hα-helixtrans-60.4-32.6175.8-73.1174.3-39.900111.9P188 L201 A202 D278P188-Q198 PolarHBondContact O-N 3.03Å; Q198-L201 PolarHBondContact O-N 2.99Å; Q198-A202 VanDerWaalsContact O-CB 3.27Å; Q198-A202 WeakPolarHBondContact O-CB 3.23Å; Q198-A202 PolarHBondContact O-N 2.61Å; Q198-D278 PolarHBondContact NE2-O 3.19Å
199A93.3Very high92.1Very high59 Ų5923.1 Ų23.149%0.48814%0.138SC..Hα-helixtrans-64.1-44.7176.400000112.6W179 S197 C203W179-A199 HydrophobicContact CZ2-CB 4.36Å; S197-A199 PolarHBondContact O-N 2.9Å; A199-C203 WeakPolarHBondContact O-CB 3.22Å; A199-C203 PolarHBondContact O-N 3.48Å
200Y95.1Very high92.6Very high9 Ų927.1 Ų27.14%0.03516%0.158CC..Hα-helixtrans-63.1-46.4173.8171.8-98.4000111.1I171 L174 P175 W179 I196 S197 A202 C203 W204I171-Y200 VanDerWaalsContact O-CE2 3.29Å; I171-Y200 WeakPolarHBondContact O-CE2 3.49Å; I171-Y200 PolarHBondContact O-OH 3.06Å; I171-Y200 VanDerWaalsContact O-OH 3.04Å; L174-Y200 HydrophobicContact CB-CD2 4.26Å; L174-Y200 HydrophobicContact CB-CE2 3.97Å; L174-Y200 HydrophobicContact CD1-CE2 4.38Å; P175-Y200 HydrophobicContact CG-CD1 3.84Å; P175-Y200 HydrophobicContact CG-CD2 4.03Å; P175-Y200 HydrophobicContact CG-CE1 3.5Å; P175-Y200 HydrophobicContact CG-CE2 3.73Å; P175-Y200 HydrophobicContact CG-CG 4.07Å; P175-Y200 VanDerWaalsContact CG-CZ 3.43Å; W179-Y200 HydrophobicContact CD2-CD2 4.39Å; W179-Y200 HydrophobicContact CE3-CD2 4.41Å; I196-Y200 HydrophobicContact CD1-CD1 4.13Å; I196-Y200 HydrophobicContact CD1-CE1 4.19Å; I196-Y200 HydrophobicContact CG2-CD1 3.87Å; S197-Y200 PolarHBondContact O-N 2.79Å; S197-Y200 VanDerWaalsContact OG-CB 3.32Å; S197-Y200 WeakPolarHBondContact OG-CB 3.37Å; S197-Y200 PolarHBondContact OG-N 3.2Å; Y200-A202 VanDerWaalsContact C-N 3.32Å; Y200-A202 PolarHBondContact O-N 2.94Å; Y200-C203 PolarHBondContact O-N 3.06Å; Y200-W204 WeakPolarHBondContact O-CB 3.29Å; Y200-W204 PolarHBondContact O-N 3.4Å
201L95.1Very high92.9Very high6 Ų628 Ų283%0.03116%0.163CC..Hα-helixtrans-59-44.5179.4-175.562.9000111.4F193 I196 S197 Q198 T205 M275 D278 V279F193-L201 HydrophobicContact CD2-CD1 4.06Å; F193-L201 HydrophobicContact CE2-CD1 4Å; I196-L201 HydrophobicContact CG2-CB 4Å; S197-L201 PolarHBondContact O-N 3.46Å; Q198-L201 PolarHBondContact O-N 2.99Å; L201-T205 VanDerWaalsContact O-CB 3.23Å; L201-T205 WeakPolarHBondContact O-CB 3.5Å; L201-T205 PolarHBondContact O-N 3.4Å; L201-T205 PolarHBondContact O-OG1 2.92Å; L201-M275 HydrophobicContact CD1-CB 4.22Å; L201-M275 HydrophobicContact CD1-CG 4.12Å; L201-M275 HydrophobicContact CD1-SD 3.94Å; L201-M275 HydrophobicContact CD2-CB 4.5Å; L201-M275 HydrophobicContact CG-CB 4.4Å; L201-D278 HydrophobicContact CD2-CB 4.24Å; L201-D278 WeakPolarHBondContact CD2-OD2 3.36Å; L201-V279 HydrophobicContact CB-CG2 4.21Å; L201-V279 HydrophobicContact CD2-CG2 4.06Å; L201-V279 HydrophobicContact CG-CG2 4.11Å
202A95.1Very high93.4Very high26 Ų2627.5 Ų27.522%0.21516%0.159CC..Hα-helixtrans-60.9-50.1175.400000111.3Q198 Y200 W204 T205 T206 V279Q198-A202 VanDerWaalsContact O-CB 3.27Å; Q198-A202 WeakPolarHBondContact O-CB 3.23Å; Q198-A202 PolarHBondContact O-N 2.61Å; Y200-A202 VanDerWaalsContact C-N 3.32Å; Y200-A202 PolarHBondContact O-N 2.94Å; A202-W204 PolarHBondContact O-N 2.94Å; A202-T205 PolarHBondContact O-N 3.47Å; A202-T206 WeakPolarHBondContact O-CB 3.49Å; A202-T206 PolarHBondContact O-N 3.35Å; A202-T206 PolarHBondContact O-OG1 2.96Å; A202-V279 HydrophobicContact CB-CG1 3.86Å; A202-V279 HydrophobicContact CB-CG2 3.92Å
203C96Very high93.7Very high64 Ų6430.3 Ų30.343%0.43218%0.177SC..Hα-helixtrans-56.8-48.8179-177.70000111.8W179 A199 Y200 F207W179-C203 HydrophobicContact CH2-CB 4.3Å; A199-C203 WeakPolarHBondContact O-CB 3.22Å; A199-C203 PolarHBondContact O-N 3.48Å; Y200-C203 PolarHBondContact O-N 3.06Å; C203-F207 WeakPolarHBondContact O-CB 3.49Å; C203-F207 PolarHBondContact O-N 3.04Å
204W96.7Very high94Very high13 Ų1333 Ų335%0.04919%0.192CC..Hα-helixtrans-64.1-45178.2-177.583.8000112T121 S125 Y200 A202 T206 F207 I208 W268 L272 M275T121-W204 HydrophobicContact CG2-CZ2 4.48Å; S125-W204 PolarHBondContact OG-NE1 3.47Å; Y200-W204 WeakPolarHBondContact O-CB 3.29Å; Y200-W204 PolarHBondContact O-N 3.4Å; A202-W204 PolarHBondContact O-N 2.94Å; W204-T206 PolarHBondContact O-N 2.99Å; W204-F207 WeakPolarHBondContact O-CB 3.45Å; W204-F207 PolarHBondContact O-N 3.22Å; W204-I208 HydrophobicContact CD2-CG1 4.11Å; W204-I208 HydrophobicContact CE3-CG1 4.31Å; W204-I208 HydrophobicContact CH2-CG1 3.99Å; W204-I208 HydrophobicContact CZ2-CD1 4.14Å; W204-I208 HydrophobicContact CZ2-CG1 3.76Å; W204-I208 HydrophobicContact CZ3-CG1 4.23Å; W204-I208 WeakPolarHBondContact O-CG1 3.34Å; W204-I208 PolarHBondContact O-N 3.25Å; W204-W268 HydrophobicContact CH2-CZ3 4.07Å; W204-L272 HydrophobicContact CZ3-CD2 4.22Å; W204-M275 HydrophobicContact CE3-SD 4Å; W204-M275 HydrophobicContact CH2-CE 4.45Å; W204-M275 HydrophobicContact CH2-SD 4.49Å; W204-M275 HydrophobicContact CZ3-CE 3.91Å; W204-M275 HydrophobicContact CZ3-SD 3.46Å; W204-M275 WeakPolarHBondContact CZ3-SD 3.26Å
205T95.7Very high94.3Very high0 Ų033 Ų330%019%0.192CC..Hα-helixtrans-62.4-44.6179.8-57.60000111.2L201 A202 I208 L209 L272 M275 L276L201-T205 VanDerWaalsContact O-CB 3.23Å; L201-T205 WeakPolarHBondContact O-CB 3.5Å; L201-T205 PolarHBondContact O-N 3.4Å; L201-T205 PolarHBondContact O-OG1 2.92Å; A202-T205 PolarHBondContact O-N 3.47Å; T205-I208 PolarHBondContact O-N 3.27Å; T205-L209 HydrophobicContact CG2-CD1 4.19Å; T205-L209 WeakPolarHBondContact O-CG 3.34Å; T205-L209 PolarHBondContact O-N 3Å; T205-L272 HydrophobicContact CG2-CB 4.39Å; T205-L272 HydrophobicContact CG2-CD2 4.01Å; T205-M275 HydrophobicContact CG2-CB 4.27Å; T205-L276 HydrophobicContact CG2-CD2 3.76Å; T205-L276 HydrophobicContact CG2-CG 3.79Å
206T95.7Very high94.5Very high72 Ų7235.7 Ų35.744%0.44221%0.207SC..Hα-helixtrans-62.2-43.1175-60.80000111.6A202 W204 I208 L209 I210A202-T206 WeakPolarHBondContact O-CB 3.49Å; A202-T206 PolarHBondContact O-N 3.35Å; A202-T206 PolarHBondContact O-OG1 2.96Å; W204-T206 PolarHBondContact O-N 2.99Å; T206-I208 PolarHBondContact O-N 3.03Å; T206-L209 PolarHBondContact O-N 3.06Å; T206-I210 HydrophobicContact CG2-CD1 4.05Å; T206-I210 WeakPolarHBondContact O-CG1 3.49Å; T206-I210 PolarHBondContact O-N 3.44Å
207F95.8Very high94.6Very high48 Ų4839.1 Ų39.121%0.21123%0.228CC..Hα-helixtrans-57.1-48176167.9-110000111.8I167 I171 C203 W204 L209 I210 L211I167-F207 HydrophobicContact CG2-CZ 4.35Å; I171-F207 HydrophobicContact CD1-CD1 4.21Å; I171-F207 HydrophobicContact CD1-CD2 4.39Å; I171-F207 HydrophobicContact CD1-CE1 4.06Å; I171-F207 HydrophobicContact CD1-CE2 4.25Å; I171-F207 HydrophobicContact CD1-CG 4.37Å; I171-F207 HydrophobicContact CD1-CZ 4.07Å; C203-F207 WeakPolarHBondContact O-CB 3.49Å; C203-F207 PolarHBondContact O-N 3.04Å; W204-F207 WeakPolarHBondContact O-CB 3.45Å; W204-F207 PolarHBondContact O-N 3.22Å; F207-L209 PolarHBondContact O-N 2.93Å; F207-I210 PolarHBondContact O-N 3.38Å; F207-L211 HydrophobicContact CD1-CD1 4.46Å; F207-L211 HydrophobicContact CE1-CD1 3.83Å; F207-L211 HydrophobicContact CE2-CD1 4.1Å; F207-L211 HydrophobicContact CE2-CD2 4.34Å; F207-L211 HydrophobicContact CE2-CG 4.25Å; F207-L211 HydrophobicContact CZ-CD1 3.63Å; F207-L211 HydrophobicContact CZ-CG 4.28Å; F207-L211 WeakPolarHBondContact O-CG 3.29Å; F207-L211 PolarHBondContact O-N 2.97Å; F207-L211 VanDerWaalsContact O-N 3.16Å
208I95.4Very high94.5Very high0 Ų038.9 Ų38.90%023%0.226CC..Hα-helixtrans-63.7-42.3177-64.8-57.7000111.9W204 T205 T206 I210 L211 L212 W268 L272W204-I208 HydrophobicContact CD2-CG1 4.11Å; W204-I208 HydrophobicContact CE3-CG1 4.31Å; W204-I208 HydrophobicContact CH2-CG1 3.99Å; W204-I208 HydrophobicContact CZ2-CD1 4.14Å; W204-I208 HydrophobicContact CZ2-CG1 3.76Å; W204-I208 HydrophobicContact CZ3-CG1 4.23Å; W204-I208 WeakPolarHBondContact O-CG1 3.34Å; W204-I208 PolarHBondContact O-N 3.25Å; T205-I208 PolarHBondContact O-N 3.27Å; T206-I208 PolarHBondContact O-N 3.03Å; I208-I210 VanDerWaalsContact C-N 3.29Å; I208-I210 PolarHBondContact O-N 3.17Å; I208-L211 HydrophobicContact CD1-CD1 4.46Å; I208-L211 PolarHBondContact O-N 3.26Å; I208-L211 VanDerWaalsContact O-N 3.14Å; I208-L212 HydrophobicContact CG2-CD1 3.97Å; I208-L212 HydrophobicContact CG2-CG 4.23Å; I208-L212 WeakPolarHBondContact O-CG 3.39Å; I208-L212 PolarHBondContact O-N 2.98Å; I208-W268 HydrophobicContact CG1-CZ3 4.4Å; I208-W268 HydrophobicContact CG2-CE3 3.78Å; I208-W268 HydrophobicContact CG2-CH2 4.19Å; I208-W268 HydrophobicContact CG2-CZ3 3.51Å; I208-L272 HydrophobicContact CB-CD2 4.25Å; I208-L272 HydrophobicContact CG2-CD1 3.92Å; I208-L272 HydrophobicContact CG2-CD2 3.93Å
209L95.4Very high94.3Very high48 Ų4838 Ų3825%0.25122%0.222SC..Hα-helixtrans-60.2-39.2177.8-76.8168.5000112.3T205 T206 F207 L212 T213 L272 L276T205-L209 HydrophobicContact CG2-CD1 4.19Å; T205-L209 WeakPolarHBondContact O-CG 3.34Å; T205-L209 PolarHBondContact O-N 3Å; T206-L209 PolarHBondContact O-N 3.06Å; F207-L209 PolarHBondContact O-N 2.93Å; L209-L212 PolarHBondContact O-N 3.21Å; L209-T213 WeakPolarHBondContact O-CB 3.48Å; L209-T213 PolarHBondContact O-N 2.69Å; L209-T213 PolarHBondContact O-OG1 3.38Å; L209-L272 HydrophobicContact CD2-CB 4.47Å; L209-L272 HydrophobicContact CD2-CD1 3.78Å; L209-L272 HydrophobicContact CG-CD1 4.21Å; L209-L276 HydrophobicContact CD1-CD1 3.96Å
210I96.3Very high94.1Very high93 Ų9337.8 Ų37.848%0.47722%0.22SC..Hα-helixtrans-61.1-48.3174.1-68.8165.4000110T206 F207 I208 L212 T213 L214T206-I210 HydrophobicContact CG2-CD1 4.05Å; T206-I210 WeakPolarHBondContact O-CG1 3.49Å; T206-I210 PolarHBondContact O-N 3.44Å; F207-I210 PolarHBondContact O-N 3.38Å; I208-I210 VanDerWaalsContact C-N 3.29Å; I208-I210 PolarHBondContact O-N 3.17Å; I210-L212 PolarHBondContact O-N 3.44Å; I210-T213 PolarHBondContact O-N 3.07Å; I210-L214 HydrophobicContact CG2-CD1 4.16Å; I210-L214 WeakPolarHBondContact O-CG 3.37Å; I210-L214 PolarHBondContact O-N 3.5Å
211L95.3Very high93.8Very high19 Ų1940.2 Ų40.210%0.09923%0.233CC..Hα-helixtrans-61.1-45.1178.9-63.3-178.7000112.3V128 L132 F207 I208 T213 L214 I215V128-L211 HydrophobicContact CG1-CB 3.63Å; V128-L211 HydrophobicContact CG1-CD1 4.06Å; L132-L211 HydrophobicContact CD2-CD2 3.77Å; F207-L211 HydrophobicContact CD1-CD1 4.46Å; F207-L211 HydrophobicContact CE1-CD1 3.83Å; F207-L211 HydrophobicContact CE2-CD1 4.1Å; F207-L211 HydrophobicContact CE2-CD2 4.34Å; F207-L211 HydrophobicContact CE2-CG 4.25Å; F207-L211 HydrophobicContact CZ-CD1 3.63Å; F207-L211 HydrophobicContact CZ-CG 4.28Å; F207-L211 WeakPolarHBondContact O-CG 3.29Å; F207-L211 PolarHBondContact O-N 2.97Å; F207-L211 VanDerWaalsContact O-N 3.16Å; I208-L211 HydrophobicContact CD1-CD1 4.46Å; I208-L211 PolarHBondContact O-N 3.26Å; I208-L211 VanDerWaalsContact O-N 3.14Å; L211-T213 VanDerWaalsContact C-N 3.33Å; L211-T213 PolarHBondContact O-N 3.13Å; L211-L214 PolarHBondContact O-N 3.37Å; L211-I215 VanDerWaalsContact O-CG1 3.31Å; L211-I215 WeakPolarHBondContact O-CG1 3.42Å; L211-I215 PolarHBondContact O-N 3.28Å
212L93.8Very high93.3Very high14 Ų1440.1 Ų40.17%0.07323%0.233CC..Hα-helixtrans-61.8-41.6176.4-72.2175.7000111.5V128 I208 L209 I210 L214 I215 L216 L264 W268 L272V128-L212 HydrophobicContact CG1-CD2 4.06Å; V128-L212 HydrophobicContact CG1-CG 4.28Å; I208-L212 HydrophobicContact CG2-CD1 3.97Å; I208-L212 HydrophobicContact CG2-CG 4.23Å; I208-L212 WeakPolarHBondContact O-CG 3.39Å; I208-L212 PolarHBondContact O-N 2.98Å; L209-L212 PolarHBondContact O-N 3.21Å; I210-L212 PolarHBondContact O-N 3.44Å; L212-L214 PolarHBondContact O-N 3.29Å; L212-I215 HydrophobicContact CD2-CD1 4.4Å; L212-I215 WeakPolarHBondContact O-CB 3.37Å; L212-I215 PolarHBondContact O-N 3.45Å; L212-L216 WeakPolarHBondContact O-CG 3.33Å; L212-L216 PolarHBondContact O-N 3.08Å; L212-L264 HydrophobicContact CD2-CD1 4.08Å; L212-L264 HydrophobicContact CD2-CD2 4Å; L212-L264 HydrophobicContact CD2-CG 3.94Å; L212-W268 HydrophobicContact CD1-CB 3.87Å; L212-W268 HydrophobicContact CD1-CD2 4.46Å; L212-W268 HydrophobicContact CD1-CG 4.22Å; L212-L272 HydrophobicContact CD1-CD1 3.44Å; L212-L272 VanDerWaalsContact CD1-CD1 3.44Å
213T94.6Very high92.8Very high78 Ų7841.7 Ų41.748%0.47924%0.237SC..Hα-helixtrans-61.7-44.1176.3-57.30000111.2L209 I210 L211 I215 L216 V217L209-T213 WeakPolarHBondContact O-CB 3.48Å; L209-T213 PolarHBondContact O-N 2.69Å; L209-T213 PolarHBondContact O-OG1 3.38Å; I210-T213 PolarHBondContact O-N 3.07Å; L211-T213 VanDerWaalsContact C-N 3.33Å; L211-T213 PolarHBondContact O-N 3.13Å; T213-I215 VanDerWaalsContact C-N 3.32Å; T213-I215 PolarHBondContact O-N 3.33Å; T213-L216 PolarHBondContact O-N 3.46Å; T213-V217 HydrophobicContact CG2-CG2 4.44Å; T213-V217 WeakPolarHBondContact O-CG2 3.15Å; T213-V217 PolarHBondContact O-N 2.95Å
214L95.4Very high92.2Very high86 Ų8645.4 Ų45.445%0.4524%0.242SC..Hα-helixtrans-61.5-39.7175.5-68.9172.8000112.1L132 I210 L211 L212 A218L132-L214 HydrophobicContact CD1-CB 3.73Å; L132-L214 HydrophobicContact CD2-CB 4.4Å; L132-L214 HydrophobicContact CD2-CD1 4.15Å; I210-L214 HydrophobicContact CG2-CD1 4.16Å; I210-L214 WeakPolarHBondContact O-CG 3.37Å; I210-L214 PolarHBondContact O-N 3.5Å; L211-L214 PolarHBondContact O-N 3.37Å; L212-L214 PolarHBondContact O-N 3.29Å; L214-A218 WeakPolarHBondContact O-CB 3.23Å; L214-A218 PolarHBondContact O-N 2.82Å
215I92.9Very high91.5Very high0 Ų048.4 Ų48.40%026%0.256CS..Hα-helixtrans-61.2-49174.1-68.7163.9000110.5V128 L131 L132 L211 L212 T213 V217 A218 Y219 L261 L264V128-I215 HydrophobicContact CG1-CD1 3.9Å; L131-I215 HydrophobicContact CB-CD1 3.99Å; L132-I215 HydrophobicContact CB-CD1 4.12Å; L132-I215 HydrophobicContact CB-CG1 3.78Å; L132-I215 HydrophobicContact CD1-CG1 3.93Å; L132-I215 HydrophobicContact CG-CG1 4.46Å; L211-I215 VanDerWaalsContact O-CG1 3.31Å; L211-I215 WeakPolarHBondContact O-CG1 3.42Å; L211-I215 PolarHBondContact O-N 3.28Å; L212-I215 HydrophobicContact CD2-CD1 4.4Å; L212-I215 WeakPolarHBondContact O-CB 3.37Å; L212-I215 PolarHBondContact O-N 3.45Å; T213-I215 VanDerWaalsContact C-N 3.32Å; T213-I215 PolarHBondContact O-N 3.33Å; I215-V217 PolarHBondContact O-N 2.96Å; I215-A218 PolarHBondContact O-N 2.92Å; I215-Y219 HydrophobicContact CG2-CD2 3.63Å; I215-Y219 HydrophobicContact CG2-CE2 3.65Å; I215-Y219 VanDerWaalsContact O-CD2 3.3Å; I215-Y219 WeakPolarHBondContact O-CD2 3.05Å; I215-Y219 PolarHBondContact O-N 2.88Å; I215-L261 HydrophobicContact CG2-CD2 4.48Å; I215-L264 HydrophobicContact CD1-CD2 4.36Å; I215-L264 HydrophobicContact CG2-CD2 3.81Å
216L91.8Very high90.4Very high69 Ų6950.4 Ų50.436%0.36127%0.272SS..Hα-helixtrans-60.1-46179.6-69.8177.4000111.6L212 T213 Y219 A220 L261 V265L212-L216 WeakPolarHBondContact O-CG 3.33Å; L212-L216 PolarHBondContact O-N 3.08Å; T213-L216 PolarHBondContact O-N 3.46Å; L216-Y219 PolarHBondContact O-N 2.98Å; L216-A220 VanDerWaalsContact O-CB 3.29Å; L216-A220 WeakPolarHBondContact O-CB 3.42Å; L216-A220 PolarHBondContact O-N 2.85Å; L216-L261 HydrophobicContact CD2-CD2 3.7Å; L216-V265 HydrophobicContact CD1-CG2 4.47Å; L216-V265 HydrophobicContact CD2-CG2 3.79Å
217V92.5Very high89.5Confident76 Ų7653.3 Ų53.346%0.46128%0.28SS..Hα-helixtrans-61.7-46176.5171.60000110.8T213 I215 Y219 A220 L221T213-V217 HydrophobicContact CG2-CG2 4.44Å; T213-V217 WeakPolarHBondContact O-CG2 3.15Å; T213-V217 PolarHBondContact O-N 2.95Å; I215-V217 PolarHBondContact O-N 2.96Å; V217-Y219 PolarHBondContact O-N 2.82Å; V217-A220 PolarHBondContact O-N 3.12Å; V217-L221 HydrophobicContact CG1-CD1 4Å; V217-L221 HydrophobicContact CG1-CG 4.34Å; V217-L221 WeakPolarHBondContact O-CB 3.43Å; V217-L221 VanDerWaalsContact O-CG 3.28Å; V217-L221 WeakPolarHBondContact O-CG 3.46Å; V217-L221 PolarHBondContact O-N 3.47Å
218A91.2Very high88.4Confident7 Ų757.5 Ų57.56%0.05830%0.295CS..Hα-helixtrans-58.7-46.4178.400000111.8A135 L214 I215 L221 I222A135-A218 HydrophobicContact CB-CB 4.13Å; L214-A218 WeakPolarHBondContact O-CB 3.23Å; L214-A218 PolarHBondContact O-N 2.82Å; I215-A218 PolarHBondContact O-N 2.92Å; A218-L221 PolarHBondContact O-N 3.49Å; A218-I222 VanDerWaalsContact O-CG1 3.26Å; A218-I222 WeakPolarHBondContact O-CG1 3.16Å; A218-I222 PolarHBondContact O-N 2.89Å
219Y87.9Confident87Confident11 Ų1162.3 Ų62.34%0.04332%0.317CS..Hα-helixtrans-69.1-36.6176.9-78.6-68.1000113.4A135 I215 L216 V217 L221 I222 L223 F257 L261A135-Y219 HydrophobicContact CB-CD2 4.22Å; A135-Y219 HydrophobicContact CB-CE2 3.74Å; I215-Y219 HydrophobicContact CG2-CD2 3.63Å; I215-Y219 HydrophobicContact CG2-CE2 3.65Å; I215-Y219 VanDerWaalsContact O-CD2 3.3Å; I215-Y219 WeakPolarHBondContact O-CD2 3.05Å; I215-Y219 PolarHBondContact O-N 2.88Å; L216-Y219 PolarHBondContact O-N 2.98Å; V217-Y219 PolarHBondContact O-N 2.82Å; Y219-L221 VanDerWaalsContact C-N 3.32Å; Y219-L221 PolarHBondContact O-N 3.15Å; Y219-I222 HydrophobicContact CD1-CD1 4.01Å; Y219-I222 HydrophobicContact CE1-CD1 4.4Å; Y219-I222 WeakPolarHBondContact O-CB 3.37Å; Y219-I222 PolarHBondContact O-N 3.48Å; Y219-L223 WeakPolarHBondContact O-CG 3.46Å; Y219-L223 PolarHBondContact O-N 3.03Å; Y219-F257 HydrophobicContact CD1-CB 4.22Å; Y219-F257 HydrophobicContact CD1-CD1 4.13Å; Y219-F257 HydrophobicContact CD1-CG 4.16Å; Y219-F257 HydrophobicContact CE1-CB 4.44Å; Y219-F257 AromaticContact CE1-CD1 3.58Å; Y219-F257 HydrophobicContact CE1-CD1 3.58Å; Y219-F257 AromaticContact CE1-CE1 3.99Å; Y219-F257 HydrophobicContact CE1-CE1 3.99Å; Y219-F257 HydrophobicContact CE1-CG 4.09Å; Y219-L261 HydrophobicContact CD2-CD2 3.46Å; Y219-L261 VanDerWaalsContact CD2-CD2 3.46Å; Y219-L261 HydrophobicContact CD2-CG 4.25Å; Y219-L261 HydrophobicContact CE2-CD2 4.17Å; Y219-L261 HydrophobicContact CG-CD1 4.34Å; Y219-L261 HydrophobicContact CG-CD2 3.93Å; Y219-L261 HydrophobicContact CG-CG 4.31Å
220A88.3Confident85.3Confident55 Ų5563.7 Ų63.746%0.45532%0.322SS..Hα-helixtrans-60.7-42.9173.600000111.2L216 V217 L223 W224L216-A220 VanDerWaalsContact O-CB 3.29Å; L216-A220 WeakPolarHBondContact O-CB 3.42Å; L216-A220 PolarHBondContact O-N 2.85Å; V217-A220 PolarHBondContact O-N 3.12Å; A220-L223 PolarHBondContact O-N 3.42Å; A220-W224 VanDerWaalsContact O-CB 3.3Å; A220-W224 WeakPolarHBondContact O-CB 3.25Å; A220-W224 PolarHBondContact O-N 2.92Å
221L89Confident83.6Confident59 Ų5962.7 Ų62.731%0.30932%0.323SS..Hα-helixtrans-66.5-35.1175.3-67.9174.4000112.7Y139 H143 V217 A218 Y219 W224 K225Y139-L221 HydrophobicContact CD2-CB 4.21Å; Y139-L221 HydrophobicContact CE2-CB 3.87Å; Y139-L221 HydrophobicContact CE2-CD1 3.99Å; H143-L221 PolarHBondContact NE2-O 2.91Å; V217-L221 HydrophobicContact CG1-CD1 4Å; V217-L221 HydrophobicContact CG1-CG 4.34Å; V217-L221 WeakPolarHBondContact O-CB 3.43Å; V217-L221 VanDerWaalsContact O-CG 3.28Å; V217-L221 WeakPolarHBondContact O-CG 3.46Å; V217-L221 PolarHBondContact O-N 3.47Å; A218-L221 PolarHBondContact O-N 3.49Å; Y219-L221 VanDerWaalsContact C-N 3.32Å; Y219-L221 PolarHBondContact O-N 3.15Å; L221-W224 HydrophobicContact CD2-CE3 4.07Å; L221-W224 HydrophobicContact CD2-CZ3 4.47Å; L221-K225 WeakPolarHBondContact O-CB 3.28Å; L221-K225 PolarHBondContact O-N 3.46Å
222I85.2Confident81.9Confident4 Ų465.7 Ų65.72%0.02135%0.346CS..Hα-helixtrans-61.7-50.3172.9-72164.4000110R138 Y139 I142 A218 Y219 K225 A226 F257R138-I222 HydrophobicContact CB-CD1 3.86Å; Y139-I222 HydrophobicContact CD2-CG1 4.29Å; I142-I222 HydrophobicContact CD1-CG1 4.46Å; I142-I222 HydrophobicContact CD1-CG2 3.61Å; A218-I222 VanDerWaalsContact O-CG1 3.26Å; A218-I222 WeakPolarHBondContact O-CG1 3.16Å; A218-I222 PolarHBondContact O-N 2.89Å; Y219-I222 HydrophobicContact CD1-CD1 4.01Å; Y219-I222 HydrophobicContact CE1-CD1 4.4Å; Y219-I222 WeakPolarHBondContact O-CB 3.37Å; Y219-I222 PolarHBondContact O-N 3.48Å; I222-K225 PolarHBondContact O-N 3Å; I222-A226 WeakPolarHBondContact O-CB 3.34Å; I222-A226 PolarHBondContact O-N 3.24Å; I222-F257 HydrophobicContact CG2-CD2 4.41Å; I222-F257 HydrophobicContact CG2-CE2 4.19Å
223L83.4Confident80.1Confident59 Ų5970.4 Ų70.431%0.30937%0.369SS..Hα-helixtrans-65.2-42.3179.9-67.9173.8000111.9Y219 A220 K225 A226 H227 A254Y219-L223 WeakPolarHBondContact O-CG 3.46Å; Y219-L223 PolarHBondContact O-N 3.03Å; A220-L223 PolarHBondContact O-N 3.42Å; L223-K225 PolarHBondContact O-N 3.39Å; L223-A226 PolarHBondContact O-N 3.05Å; L223-H227 WeakPolarHBondContact O-CB 3.26Å; L223-H227 PolarHBondContact O-N 2.99Å; L223-A254 HydrophobicContact CD2-CB 3.94Å
224W84.5Confident78.3Confident142 Ų14271.3 Ų71.354%0.53837%0.374SS..Hα-helixtrans-61.8-44.9178177.253.7000112A220 L221 H227 R228A220-W224 VanDerWaalsContact O-CB 3.3Å; A220-W224 WeakPolarHBondContact O-CB 3.25Å; A220-W224 PolarHBondContact O-N 2.92Å; L221-W224 HydrophobicContact CD2-CE3 4.07Å; L221-W224 HydrophobicContact CD2-CZ3 4.47Å; W224-H227 PolarHBondContact O-N 3.07Å; W224-R228 WeakPolarHBondContact O-CB 3.28Å; W224-R228 PolarHBondContact O-N 2.96Å
225K81.7Confident76.4Confident77 Ų7771.8 Ų71.834%0.33539%0.385SS..Hα-helixtrans-66.8-40.4177.8-17764.6173.6179.90112.2H143 L221 I222 L223 H227 R228 H229H143-K225 WeakPolarHBondContact CE1-CB 3.32Å; H143-K225 VanDerWaalsContact CE1-CG 3.46Å; H143-K225 WeakPolarHBondContact CE1-CG 3.29Å; H143-K225 WeakPolarHBondContact NE2-CB 3.46Å; L221-K225 WeakPolarHBondContact O-CB 3.28Å; L221-K225 PolarHBondContact O-N 3.46Å; I222-K225 PolarHBondContact O-N 3Å; L223-K225 PolarHBondContact O-N 3.39Å; K225-H227 VanDerWaalsContact C-N 3.32Å; K225-H227 PolarHBondContact O-N 3.38Å; K225-R228 PolarHBondContact O-N 3.29Å; K225-H229 WeakPolarHBondContact O-CB 3.1Å; K225-H229 PolarHBondContact O-N 3.37Å
226A73.5Confident74.8Confident41 Ų4178.2 Ų78.234%0.33942%0.419SS..Hα-helixtrans-55.9-50.4173.600000110.1I222 L223 R228 H229 E230I222-A226 WeakPolarHBondContact O-CB 3.34Å; I222-A226 PolarHBondContact O-N 3.24Å; L223-A226 PolarHBondContact O-N 3.05Å; A226-R228 PolarHBondContact O-N 3.19Å; A226-H229 PolarHBondContact O-N 3.45Å; A226-E230 WeakPolarHBondContact O-CG 3.06Å; A226-E230 PolarHBondContact O-N 2.69Å
227H75.1Confident73.1Confident133 Ų13384 Ų8462%0.61644%0.444SS*.Hα-helixtrans-64.5-39.6178.9-168.2-78000113.6L223 W224 K225 E230 S231L223-H227 WeakPolarHBondContact O-CB 3.26Å; L223-H227 PolarHBondContact O-N 2.99Å; W224-H227 PolarHBondContact O-N 3.07Å; K225-H227 VanDerWaalsContact C-N 3.32Å; K225-H227 PolarHBondContact O-N 3.38Å; H227-E230 WeakPolarHBondContact O-CB 3.5Å; H227-E230 PolarHBondContact O-N 3.46Å; H227-S231 PolarHBondContact O-N 2.92Å
228R73.8Confident71.4Confident136 Ų13684.5 Ų84.551%0.51346%0.464SS..Hα-helixtrans-71.1-34.9179.5-173.7173.1179.9178.21.1112.8W224 K225 A226 E230 S231 S232W224-R228 WeakPolarHBondContact O-CB 3.28Å; W224-R228 PolarHBondContact O-N 2.96Å; K225-R228 PolarHBondContact O-N 3.29Å; A226-R228 PolarHBondContact O-N 3.19Å; R228-E230 PolarHBondContact O-N 3.3Å; R228-S231 PolarHBondContact O-N 2.94Å; R228-S231 PolarHBondContact O-OG 3.31Å; R228-S232 PolarHBondContact O-N 3.48Å
229H66Low70Confident101 Ų10186.9 Ų86.947%0.46848%0.484SS..Hα-helixtrans-64-28.1175.5-156-64.8000111.3K225 A226 M233K225-H229 WeakPolarHBondContact O-CB 3.1Å; K225-H229 PolarHBondContact O-N 3.37Å; A226-H229 PolarHBondContact O-N 3.45Å; H229-M233 PolarHBondContact CE1-SD 3.14Å; H229-M233 PolarHBondContact ND1-SD 2.04Å; H229-M233 WeakPolarHBondContact O-CB 3.37Å; H229-M233 VanDerWaalsContact O-CG 3.32Å; H229-M233 WeakPolarHBondContact O-CG 3.18Å; H229-M233 PolarHBondContact O-N 3.02Å
230E59.2Low68.7Low78 Ų7891.2 Ų91.236%0.36452%0.516SS..Hα-helixtrans-71.7-47.6172.9-59.4-148.3118.200112.5A226 H227 R228 S232 M233 T234A226-E230 WeakPolarHBondContact O-CG 3.06Å; A226-E230 PolarHBondContact O-N 2.69Å; H227-E230 WeakPolarHBondContact O-CB 3.5Å; H227-E230 PolarHBondContact O-N 3.46Å; R228-E230 PolarHBondContact O-N 3.3Å; E230-S232 PolarHBondContact O-N 2.89Å; E230-M233 PolarHBondContact O-N 2.79Å; E230-T234 PolarHBondContact O-N 2.84Å; E230-T234 VanDerWaalsContact O-N 3.07Å; E230-T234 PolarHBondContact O-OG1 3.41Å; E230-T234 VanDerWaalsContact O-OG1 3.11Å
231S59.8Low67.6Low72 Ų7290.9 Ų90.950%0.50352%0.518SS..Hα-helixtrans-62.4-29.6-177.961.60000113.6H227 R228 T234H227-S231 PolarHBondContact O-N 2.92Å; R228-S231 PolarHBondContact O-N 2.94Å; R228-S231 PolarHBondContact O-OG 3.31Å; S231-T234 WeakPolarHBondContact CA-OG1 3.33Å; S231-T234 PolarHBondContact O-OG1 3.34Å
232S61.4Low66.4Low82 Ų8289.9 Ų89.957%0.57352%0.518SS*.Hα-helixtrans-82.8-20.7174.8-82.60000114.1R228 E230 S235R228-S232 PolarHBondContact O-N 3.48Å; E230-S232 PolarHBondContact O-N 2.89Å; S232-S235 PolarHBondContact O-OG 2.94Å; S232-S235 VanDerWaalsContact O-OG 3.12Å
233M55.6Low65.3Low112 Ų11297.9 Ų97.955%0.55255%0.548SS*.Hα-helixtrans-94.3-12.6179-74.8-169.4134.200113.5H229 E230 S235 L236H229-M233 PolarHBondContact CE1-SD 3.14Å; H229-M233 PolarHBondContact ND1-SD 2.04Å; H229-M233 WeakPolarHBondContact O-CB 3.37Å; H229-M233 VanDerWaalsContact O-CG 3.32Å; H229-M233 WeakPolarHBondContact O-CG 3.18Å; H229-M233 PolarHBondContact O-N 3.02Å; E230-M233 PolarHBondContact O-N 2.79Å; M233-S235 PolarHBondContact O-N 3.5Å; M233-S235 VanDerWaalsContact O-N 3.15Å; M233-L236 PolarHBondContact O-N 3.31Å
234T56.3Low64.3Low97 Ų97100.3 Ų100.360%0.59556%0.558SS**THydrogen-bonded Turntrans-62.7-11.717220.80000114.5E230 S231E230-T234 PolarHBondContact O-N 2.84Å; E230-T234 VanDerWaalsContact O-N 3.07Å; E230-T234 PolarHBondContact O-OG1 3.41Å; E230-T234 VanDerWaalsContact O-OG1 3.11Å; S231-T234 WeakPolarHBondContact CA-OG1 3.33Å; S231-T234 PolarHBondContact O-OG1 3.34Å
235S55.8Low63.3Low96 Ų9696.6 Ų96.667%0.67156%0.557SS**THydrogen-bonded Turntrans-86.5-10.4175.756.30000114.6S232 M233S232-S235 PolarHBondContact O-OG 2.94Å; S232-S235 VanDerWaalsContact O-OG 3.12Å; M233-S235 PolarHBondContact O-N 3.5Å; M233-S235 VanDerWaalsContact O-N 3.15Å
236L59.4Low62.4Low136 Ų13699 Ų9971%0.71256%0.564SS**SBendtrans-115.187.6179.3-85.4131.3000111.8M233M233-L236 PolarHBondContact O-N 3.31Å
237Q55Low61.7Low189 Ų189102.2 Ų102.288%0.88357%0.574SS**  trans40.9125.5149.3-72.7165.3-12.700121.3
238G58.3Low61.2Low87 Ų87104 Ų10490%0.89758%0.575SS**  114.7-9.210800000122.6
239A60.4Low60.8Low57 Ų57101.7 Ų101.747%0.47157%0.571SS.*  trans-139.3102.2-178.600000113.9G241 A242 R243A239-G241 VanDerWaalsContact C-N 3.32Å; A239-G241 PolarHBondContact O-N 3.3Å; A239-A242 HydrophobicContact CB-CB 3.92Å; A239-A242 PolarHBondContact O-N 3.32Å; A239-R243 WeakPolarHBondContact O-CB 3.47Å; A239-R243 PolarHBondContact O-N 2.87Å
240S62.2Low60.6Low102 Ų10298.8 Ų98.871%0.71356%0.559SS**Hα-helixtrans-54.2-42.7178.152.90000112.7R243 Q244S240-R243 PolarHBondContact O-N 3.49Å; S240-Q244 WeakPolarHBondContact O-CB 3.47Å; S240-Q244 PolarHBondContact O-N 2.96Å
241G64.1Low60.8Low48 Ų4899.7 Ų99.750%0.49557%0.565SS.*Hα-helixtrans-67.2-40.3178.200000114.2A239 Q244 A245A239-G241 VanDerWaalsContact C-N 3.32Å; A239-G241 PolarHBondContact O-N 3.3Å; G241-Q244 PolarHBondContact O-N 3.34Å; G241-A245 WeakPolarHBondContact O-CB 3.23Å; G241-A245 PolarHBondContact O-N 3.49Å
242A63.3Low61.4Low38 Ų38105.1 Ų105.131%0.31458%0.575SS.*Hα-helixtrans-73.3-32.2177.800000112.1A239 R246A239-A242 HydrophobicContact CB-CB 3.92Å; A239-A242 PolarHBondContact O-N 3.32Å; A242-R246 WeakPolarHBondContact O-CB 3.37Å; A242-R246 PolarHBondContact O-N 3.22Å; A242-R246 PolarHBondContact O-NE 3.11Å
243R62Low61.6Low173 Ų173103.8 Ų103.865%0.65356%0.561SS**Hα-helixtrans-64.5-43.1170.4-179.9175.4171.7170.2-2.9111.4A239 S240 R246 M247A239-R243 WeakPolarHBondContact O-CB 3.47Å; A239-R243 PolarHBondContact O-N 2.87Å; S240-R243 PolarHBondContact O-N 3.49Å; R243-R246 PolarHBondContact O-N 3.06Å; R243-M247 WeakPolarHBondContact O-CB 3.45Å; R243-M247 PolarHBondContact O-N 2.96Å
244Q63.4Low62.2Low110 Ų110100.5 Ų100.551%0.51455%0.552SS.*Hα-helixtrans-72.2-35-180-155.1162.7800112.4S240 G241 R248S240-Q244 WeakPolarHBondContact O-CB 3.47Å; S240-Q244 PolarHBondContact O-N 2.96Å; G241-Q244 PolarHBondContact O-N 3.34Å; Q244-R248 WeakPolarHBondContact O-CB 3.36Å; Q244-R248 WeakPolarHBondContact O-CD 2.95Å; Q244-R248 WeakPolarHBondContact O-CG 3.23Å; Q244-R248 PolarHBondContact O-N 3.46Å; Q244-R248 VanDerWaalsContact O-N 3.13Å
245A63.9Low63Low63 Ų63105.1 Ų105.152%0.52156%0.558SS.*Hα-helixtrans-66.8-40.3171.500000112.6G241 M249G241-A245 WeakPolarHBondContact O-CB 3.23Å; G241-A245 PolarHBondContact O-N 3.49Å; A245-M249 PolarHBondContact O-N 2.89Å; A245-M249 VanDerWaalsContact O-N 3.14Å
246R61Low63.7Low127 Ų127101.7 Ų101.748%0.47953%0.533SS..Hα-helixtrans-62.3-55.2173.3-94.8-179-80.9-88.53.2112A242 R243 R248 M249 D250A242-R246 WeakPolarHBondContact O-CB 3.37Å; A242-R246 PolarHBondContact O-N 3.22Å; A242-R246 PolarHBondContact O-NE 3.11Å; R243-R246 PolarHBondContact O-N 3.06Å; R246-R248 PolarHBondContact O-N 3.04Å; R246-R248 VanDerWaalsContact O-N 3.09Å; R246-M249 CarbonylContact O-C 3.58Å; R246-M249 WeakPolarHBondContact O-CA 2.85Å; R246-M249 VanDerWaalsContact O-CB 3.32Å; R246-M249 WeakPolarHBondContact O-CB 3.31Å; R246-M249 PolarHBondContact O-N 3.49Å; R246-D250 VanDerWaalsContact C-OD2 3.31Å; R246-D250 PolarHBondContact O-N 3.06Å
247M60.7Low64.4Low110 Ų11096 Ų9654%0.54250%0.503SS..Hα-helixtrans-53.2-38.5177.6-174-178.417600112.5R243 D250 I251R243-M247 WeakPolarHBondContact O-CB 3.45Å; R243-M247 PolarHBondContact O-N 2.96Å; M247-D250 PolarHBondContact O-N 3.36Å; M247-I251 HydrophobicContact CE-CD1 4.16Å; M247-I251 HydrophobicContact CG-CD1 3.97Å; M247-I251 WeakPolarHBondContact O-CB 3.42Å; M247-I251 WeakPolarHBondContact O-CD1 3.34Å; M247-I251 WeakPolarHBondContact O-CG1 3.33Å; M247-I251 PolarHBondContact O-N 3.4Å
248R64.3Low65.4Low169 Ų16988.5 Ų88.564%0.63848%0.477SS*.Hα-helixtrans-66.7-37174.4-74.4172.9-174.6-147.84113.2Q244 R246 R252Q244-R248 WeakPolarHBondContact O-CB 3.36Å; Q244-R248 WeakPolarHBondContact O-CD 2.95Å; Q244-R248 WeakPolarHBondContact O-CG 3.23Å; Q244-R248 PolarHBondContact O-N 3.46Å; Q244-R248 VanDerWaalsContact O-N 3.13Å; R246-R248 PolarHBondContact O-N 3.04Å; R246-R248 VanDerWaalsContact O-N 3.09Å; R248-R252 WeakPolarHBondContact O-CB 3.49Å; R248-R252 PolarHBondContact O-N 3.46Å; R248-R252 VanDerWaalsContact O-N 3.13Å
249M65.4Low66.3Low89 Ų8988.6 Ų88.644%0.43846%0.456SS..Hα-helixtrans-68.7-42.6175.1-176.1177.465.100111.1A245 R246 R252 L253A245-M249 PolarHBondContact O-N 2.89Å; A245-M249 VanDerWaalsContact O-N 3.14Å; R246-M249 CarbonylContact O-C 3.58Å; R246-M249 WeakPolarHBondContact O-CA 2.85Å; R246-M249 VanDerWaalsContact O-CB 3.32Å; R246-M249 WeakPolarHBondContact O-CB 3.31Å; R246-M249 PolarHBondContact O-N 3.49Å; M249-R252 WeakPolarHBondContact O-CB 3.44Å; M249-R252 PolarHBondContact O-N 3.04Å; M249-R252 VanDerWaalsContact O-N 3.16Å; M249-L253 HydrophobicContact CG-CD1 4.29Å; M249-L253 WeakPolarHBondContact O-CG 3.15Å; M249-L253 PolarHBondContact O-N 3.01Å
250D61.3Low67.1Low39 Ų3986.8 Ų86.821%0.20944%0.438CS..Hα-helixtrans-68.6-41.8-179.7-63.5-49000112.1R246 M247 R252 L253 A254R246-D250 VanDerWaalsContact C-OD2 3.31Å; R246-D250 PolarHBondContact O-N 3.06Å; M247-D250 PolarHBondContact O-N 3.36Å; D250-R252 VanDerWaalsContact C-N 3.28Å; D250-R252 PolarHBondContact O-N 3.21Å; D250-L253 PolarHBondContact O-N 3.47Å; D250-A254 VanDerWaalsContact O-CB 3.29Å; D250-A254 WeakPolarHBondContact O-CB 3.46Å; D250-A254 PolarHBondContact O-N 2.91Å
251I64.4Low67.9Low97 Ų9783.1 Ų83.150%0.49741%0.411SS..Hα-helixtrans-59.1-41.1169.8-69.9166.6000110.7M247 R255M247-I251 HydrophobicContact CE-CD1 4.16Å; M247-I251 HydrophobicContact CG-CD1 3.97Å; M247-I251 WeakPolarHBondContact O-CB 3.42Å; M247-I251 WeakPolarHBondContact O-CD1 3.34Å; M247-I251 WeakPolarHBondContact O-CG1 3.33Å; M247-I251 PolarHBondContact O-N 3.4Å; I251-R255 WeakPolarHBondContact O-CB 3.29Å; I251-R255 PolarHBondContact O-N 3Å
252R70.3Confident68.8Low186 Ų18687 Ų8770%0.70242%0.419SS*.Hα-helixtrans-67.4-40.5179.3-173.5-178.7-72180-4111.9R248 M249 D250 T256R248-R252 WeakPolarHBondContact O-CB 3.49Å; R248-R252 PolarHBondContact O-N 3.46Å; R248-R252 VanDerWaalsContact O-N 3.13Å; M249-R252 WeakPolarHBondContact O-CB 3.44Å; M249-R252 PolarHBondContact O-N 3.04Å; M249-R252 VanDerWaalsContact O-N 3.16Å; D250-R252 VanDerWaalsContact C-N 3.28Å; D250-R252 PolarHBondContact O-N 3.21Å; R252-T256 PolarHBondContact O-N 2.98Å; R252-T256 VanDerWaalsContact O-N 3.07Å; R252-T256 PolarHBondContact O-OG1 3.28Å
253L66.7Low69.8Low54 Ų5487.2 Ų87.228%0.28342%0.415SS..Hα-helixtrans-66.3-49.7176.6-70.6175000111.1M249 D250 T256 F257M249-L253 HydrophobicContact CG-CD1 4.29Å; M249-L253 WeakPolarHBondContact O-CG 3.15Å; M249-L253 PolarHBondContact O-N 3.01Å; D250-L253 PolarHBondContact O-N 3.47Å; L253-T256 PolarHBondContact O-N 3.42Å; L253-F257 VanDerWaalsContact O-CD2 3.31Å; L253-F257 WeakPolarHBondContact O-CD2 3.33Å; L253-F257 PolarHBondContact O-N 2.9Å
254A67.3Low70.8Confident43 Ų4379.2 Ų79.236%0.35539%0.385SS..Hα-helixtrans-63.1-43.3177.900000112.1L223 D250 T256 F257 G258L223-A254 HydrophobicContact CD2-CB 3.94Å; D250-A254 VanDerWaalsContact O-CB 3.29Å; D250-A254 WeakPolarHBondContact O-CB 3.46Å; D250-A254 PolarHBondContact O-N 2.91Å; A254-T256 VanDerWaalsContact C-N 3.3Å; A254-T256 PolarHBondContact O-N 3.48Å; A254-F257 PolarHBondContact O-N 2.82Å; A254-G258 WeakPolarHBondContact O-CA 3.28Å; A254-G258 PolarHBondContact O-N 3.26Å
255R73.1Confident71.8Confident194 Ų19476 Ų7673%0.73237%0.373SS*.Hα-helixtrans-60.8-40.1175.7-175.9175-178.9166.80.9111.6I251 L259I251-R255 WeakPolarHBondContact O-CB 3.29Å; I251-R255 PolarHBondContact O-N 3Å; R255-L259 VanDerWaalsContact O-CB 3.23Å; R255-L259 WeakPolarHBondContact O-CB 3.36Å; R255-L259 PolarHBondContact O-N 3.4Å
256T71.8Confident72.9Confident25 Ų2575 Ų7515%0.15337%0.368CS..Hα-helixtrans-73.7-45.9180-45.10000111.8R252 L253 A254 G258 L259 I260 L308 R312R252-T256 PolarHBondContact O-N 2.98Å; R252-T256 VanDerWaalsContact O-N 3.07Å; R252-T256 PolarHBondContact O-OG1 3.28Å; L253-T256 PolarHBondContact O-N 3.42Å; A254-T256 VanDerWaalsContact C-N 3.3Å; A254-T256 PolarHBondContact O-N 3.48Å; T256-G258 VanDerWaalsContact C-N 3.34Å; T256-G258 PolarHBondContact O-N 2.9Å; T256-L259 PolarHBondContact O-N 2.85Å; T256-I260 HydrophobicContact CG2-CD1 4.15Å; T256-I260 WeakPolarHBondContact O-CD1 3.47Å; T256-I260 WeakPolarHBondContact O-CG1 3.22Å; T256-I260 PolarHBondContact O-N 3.23Å; T256-L308 HydrophobicContact CG2-CD1 3.84Å; T256-R312 VanDerWaalsContact CB-NE 3.29Å; T256-R312 HydrophobicContact CG2-CG 3.7Å; T256-R312 PolarHBondContact OG1-NE 3.47Å
257F74.4Confident74.2Confident15 Ų1569.2 Ų69.27%0.06635%0.347CS..Hα-helixtrans-64.1-39.8176.8-65.8-42.9000111.9Y219 I222 L253 A254 L259 I260 L261Y219-F257 HydrophobicContact CD1-CB 4.22Å; Y219-F257 HydrophobicContact CD1-CD1 4.13Å; Y219-F257 HydrophobicContact CD1-CG 4.16Å; Y219-F257 HydrophobicContact CE1-CB 4.44Å; Y219-F257 AromaticContact CE1-CD1 3.58Å; Y219-F257 HydrophobicContact CE1-CD1 3.58Å; Y219-F257 AromaticContact CE1-CE1 3.99Å; Y219-F257 HydrophobicContact CE1-CE1 3.99Å; Y219-F257 HydrophobicContact CE1-CG 4.09Å; I222-F257 HydrophobicContact CG2-CD2 4.41Å; I222-F257 HydrophobicContact CG2-CE2 4.19Å; L253-F257 VanDerWaalsContact O-CD2 3.31Å; L253-F257 WeakPolarHBondContact O-CD2 3.33Å; L253-F257 PolarHBondContact O-N 2.9Å; A254-F257 PolarHBondContact O-N 2.82Å; F257-L259 PolarHBondContact O-N 3.03Å; F257-I260 HydrophobicContact CD1-CD1 4Å; F257-I260 PolarHBondContact O-N 2.85Å; F257-L261 VanDerWaalsContact O-CG 3.28Å; F257-L261 WeakPolarHBondContact O-CG 3.3Å; F257-L261 PolarHBondContact O-N 3.28Å
258G75Confident75.6Confident33 Ų3364.1 Ų64.134%0.3432%0.322SS..Hα-helixtrans-61.2-41173.300000113A254 T256 L261 L262A254-G258 WeakPolarHBondContact O-CA 3.28Å; A254-G258 PolarHBondContact O-N 3.26Å; T256-G258 VanDerWaalsContact C-N 3.34Å; T256-G258 PolarHBondContact O-N 2.9Å; G258-L261 PolarHBondContact O-N 2.96Å; G258-L262 WeakPolarHBondContact O-CB 3.5Å; G258-L262 PolarHBondContact O-N 3.01Å
259L77.9Confident76.9Confident88 Ų8859.9 Ų59.946%0.46131%0.312SS..Hα-helixtrans-65.6-41.9175.6-177.8138.1000112R255 T256 F257 L262 I263R255-L259 VanDerWaalsContact O-CB 3.23Å; R255-L259 WeakPolarHBondContact O-CB 3.36Å; R255-L259 PolarHBondContact O-N 3.4Å; T256-L259 PolarHBondContact O-N 2.85Å; F257-L259 PolarHBondContact O-N 3.03Å; L259-L262 PolarHBondContact O-N 3.37Å; L259-I263 HydrophobicContact CD2-CD1 3.5Å; L259-I263 HydrophobicContact CG-CD1 3.96Å; L259-I263 WeakPolarHBondContact O-CD1 3.33Å; L259-I263 WeakPolarHBondContact O-CG1 3.34Å; L259-I263 PolarHBondContact O-N 3.47Å
260I77.6Confident78.2Confident20 Ų2057.5 Ų57.510%0.10330%0.303CS..Hα-helixtrans-59.1-49174.5-64.3163.5000110.5T256 F257 L262 I263 L264 L308T256-I260 HydrophobicContact CG2-CD1 4.15Å; T256-I260 WeakPolarHBondContact O-CD1 3.47Å; T256-I260 WeakPolarHBondContact O-CG1 3.22Å; T256-I260 PolarHBondContact O-N 3.23Å; F257-I260 HydrophobicContact CD1-CD1 4Å; F257-I260 PolarHBondContact O-N 2.85Å; I260-L262 VanDerWaalsContact C-N 3.32Å; I260-L262 PolarHBondContact O-N 3.45Å; I260-I263 PolarHBondContact O-N 3.23Å; I260-L264 VanDerWaalsContact O-CB 3.29Å; I260-L264 WeakPolarHBondContact O-CB 3.41Å; I260-L264 PolarHBondContact O-N 3.46Å; I260-L308 HydrophobicContact CB-CD2 4.47Å; I260-L308 HydrophobicContact CD1-CD1 3.64Å; I260-L308 HydrophobicContact CD1-CD2 3.5Å; I260-L308 HydrophobicContact CD1-CG 3.96Å; I260-L308 HydrophobicContact CG1-CD1 3.3Å; I260-L308 HydrophobicContact CG1-CD2 3.39Å; I260-L308 HydrophobicContact CG1-CG 3.87Å; I260-L308 HydrophobicContact CG2-CD2 4.31Å
261L78.4Confident79.7Confident25 Ų2556 Ų5613%0.13130%0.295CS..Hα-helixtrans-61-42.3178.5-71.3173.9000111.5I215 L216 Y219 F257 G258 L264 V265I215-L261 HydrophobicContact CG2-CD2 4.48Å; L216-L261 HydrophobicContact CD2-CD2 3.7Å; Y219-L261 HydrophobicContact CD2-CD2 3.46Å; Y219-L261 VanDerWaalsContact CD2-CD2 3.46Å; Y219-L261 HydrophobicContact CD2-CG 4.25Å; Y219-L261 HydrophobicContact CE2-CD2 4.17Å; Y219-L261 HydrophobicContact CG-CD1 4.34Å; Y219-L261 HydrophobicContact CG-CD2 3.93Å; Y219-L261 HydrophobicContact CG-CG 4.31Å; F257-L261 VanDerWaalsContact O-CG 3.28Å; F257-L261 WeakPolarHBondContact O-CG 3.3Å; F257-L261 PolarHBondContact O-N 3.28Å; G258-L261 PolarHBondContact O-N 2.96Å; L261-L264 PolarHBondContact O-N 3.47Å; L261-V265 VanDerWaalsContact O-CB 3.23Å; L261-V265 WeakPolarHBondContact O-CB 3.47Å; L261-V265 WeakPolarHBondContact O-CG2 3.43Å; L261-V265 PolarHBondContact O-N 3.04Å
262L82.1Confident81.1Confident128 Ų12851.5 Ų51.567%0.6727%0.272SS*.Hα-helixtrans-63.1-43.5179.5-174.8144.3000111.8G258 L259 I260 G266G258-L262 WeakPolarHBondContact O-CB 3.5Å; G258-L262 PolarHBondContact O-N 3.01Å; L259-L262 PolarHBondContact O-N 3.37Å; I260-L262 VanDerWaalsContact C-N 3.32Å; I260-L262 PolarHBondContact O-N 3.45Å; L262-G266 WeakPolarHBondContact O-CA 3.45Å; L262-G266 PolarHBondContact O-N 3.16Å
263I84.1Confident82.2Confident44 Ų4446.3 Ų46.323%0.22626%0.261CS..Hα-helixtrans-67.5-43.8177.1-70.2155.1000110.9L259 I260 S267 V304L259-I263 HydrophobicContact CD2-CD1 3.5Å; L259-I263 HydrophobicContact CG-CD1 3.96Å; L259-I263 WeakPolarHBondContact O-CD1 3.33Å; L259-I263 WeakPolarHBondContact O-CG1 3.34Å; L259-I263 PolarHBondContact O-N 3.47Å; I260-I263 PolarHBondContact O-N 3.23Å; I263-S267 VanDerWaalsContact O-CB 3.28Å; I263-S267 WeakPolarHBondContact O-CB 3.34Å; I263-S267 PolarHBondContact O-N 2.89Å; I263-S267 PolarHBondContact O-OG 3.33Å; I263-V304 HydrophobicContact CD1-CG1 3.75Å; I263-V304 HydrophobicContact CG2-CB 4.49Å
264L83.8Confident83.6Confident5 Ų545.8 Ų45.83%0.02626%0.257CS..Hα-helixtrans-60.8-51.6178.4-177.365.2000111.1L131 L212 I215 I260 L261 S267 W268L131-L264 HydrophobicContact CD1-CD1 3.54Å; L131-L264 HydrophobicContact CD1-CD2 4.49Å; L212-L264 HydrophobicContact CD2-CD1 4.08Å; L212-L264 HydrophobicContact CD2-CD2 4Å; L212-L264 HydrophobicContact CD2-CG 3.94Å; I215-L264 HydrophobicContact CD1-CD2 4.36Å; I215-L264 HydrophobicContact CG2-CD2 3.81Å; I260-L264 VanDerWaalsContact O-CB 3.29Å; I260-L264 WeakPolarHBondContact O-CB 3.41Å; I260-L264 PolarHBondContact O-N 3.46Å; L261-L264 PolarHBondContact O-N 3.47Å; L264-S267 PolarHBondContact O-OG 3.5Å; L264-S267 VanDerWaalsContact O-OG 3.07Å; L264-W268 WeakPolarHBondContact O-CB 3.4Å; L264-W268 VanDerWaalsContact O-CD1 3.27Å; L264-W268 PolarHBondContact O-N 3.14Å; L264-W268 VanDerWaalsContact O-N 3.14Å
265V84.4Confident84.9Confident43 Ų4344.3 Ų44.326%0.26124%0.242SC..Hα-helixtrans-66.6-44.6-179.6172.40000110.9L216 L261 S267 W268 L269L216-V265 HydrophobicContact CD1-CG2 4.47Å; L216-V265 HydrophobicContact CD2-CG2 3.79Å; L261-V265 VanDerWaalsContact O-CB 3.23Å; L261-V265 WeakPolarHBondContact O-CB 3.47Å; L261-V265 WeakPolarHBondContact O-CG2 3.43Å; L261-V265 PolarHBondContact O-N 3.04Å; V265-S267 VanDerWaalsContact C-N 3.33Å; V265-S267 PolarHBondContact O-N 3.38Å; V265-W268 PolarHBondContact O-N 3.42Å; V265-L269 HydrophobicContact CG1-CD1 3.28Å; V265-L269 HydrophobicContact CG1-CG 3.71Å; V265-L269 VanDerWaalsContact O-CB 3.27Å; V265-L269 WeakPolarHBondContact O-CB 3.27Å; V265-L269 WeakPolarHBondContact O-CG 3.44Å; V265-L269 PolarHBondContact O-N 3.28Å
266G86.5Confident85.9Confident40 Ų4038.2 Ų38.241%0.41222%0.224SC..Hα-helixtrans-66.5-31.4-178.400000113.8L262 P270L262-G266 WeakPolarHBondContact O-CA 3.45Å; L262-G266 PolarHBondContact O-N 3.16Å; G266-P270 VanDerWaalsContact O-CD 3.23Å; G266-P270 WeakPolarHBondContact O-CD 3.01Å; G266-P270 WeakPolarHBondContact O-CG 3.38Å
267S88.4Confident86.9Confident6 Ų639 Ų394%0.04223%0.229CC..Hα-helixtrans-81-35.5176.955.20000113I263 L264 V265 L297 N301I263-S267 VanDerWaalsContact O-CB 3.28Å; I263-S267 WeakPolarHBondContact O-CB 3.34Å; I263-S267 PolarHBondContact O-N 2.89Å; I263-S267 PolarHBondContact O-OG 3.33Å; L264-S267 PolarHBondContact O-OG 3.5Å; L264-S267 VanDerWaalsContact O-OG 3.07Å; V265-S267 VanDerWaalsContact C-N 3.33Å; V265-S267 PolarHBondContact O-N 3.38Å; S267-L297 WeakPolarHBondContact CB-O 3.23Å; S267-N301 PolarHBondContact OG-OD1 3.02Å
268W90.8Very high87.7Confident3 Ų338.3 Ų38.31%0.01123%0.225CC..Hα-helixtrans-91.8-41.9-174.2-81.686.1000114.7F124 V128 W204 I208 L212 L264 V265 V271 L272F124-W268 HydrophobicContact CB-CH2 3.71Å; F124-W268 HydrophobicContact CB-CZ2 4.06Å; F124-W268 HydrophobicContact CD1-CH2 4.42Å; F124-W268 HydrophobicContact CD1-CZ2 4.03Å; F124-W268 HydrophobicContact CG-CH2 4.32Å; F124-W268 HydrophobicContact CG-CZ2 4.38Å; V128-W268 HydrophobicContact CG2-CD2 4.32Å; V128-W268 HydrophobicContact CG2-CH2 3.47Å; V128-W268 VanDerWaalsContact CG2-CH2 3.47Å; V128-W268 HydrophobicContact CG2-CZ2 3.11Å; V128-W268 HydrophobicContact CG2-CZ3 4.3Å; W204-W268 HydrophobicContact CH2-CZ3 4.07Å; I208-W268 HydrophobicContact CG1-CZ3 4.4Å; I208-W268 HydrophobicContact CG2-CE3 3.78Å; I208-W268 HydrophobicContact CG2-CH2 4.19Å; I208-W268 HydrophobicContact CG2-CZ3 3.51Å; L212-W268 HydrophobicContact CD1-CB 3.87Å; L212-W268 HydrophobicContact CD1-CD2 4.46Å; L212-W268 HydrophobicContact CD1-CG 4.22Å; L264-W268 WeakPolarHBondContact O-CB 3.4Å; L264-W268 VanDerWaalsContact O-CD1 3.27Å; L264-W268 PolarHBondContact O-N 3.14Å; L264-W268 VanDerWaalsContact O-N 3.14Å; V265-W268 PolarHBondContact O-N 3.42Å; W268-V271 PolarHBondContact O-N 2.83Å; W268-L272 HydrophobicContact CB-CD1 4.26Å; W268-L272 HydrophobicContact CE3-CD1 4.06Å; W268-L272 HydrophobicContact CE3-CD2 4.14Å; W268-L272 HydrophobicContact CE3-CG 4.1Å; W268-L272 HydrophobicContact CZ3-CD2 4.35Å; W268-L272 WeakPolarHBondContact O-CG 3.38Å; W268-L272 PolarHBondContact O-N 2.98Å
269L90.9Very high88.5Confident81 Ų8138.7 Ų38.742%0.42422%0.221SC..Hα-helixtrans-56.6-48-174.1-77.7-172.7000113.1V265 V271 L272 T273V265-L269 HydrophobicContact CG1-CD1 3.28Å; V265-L269 HydrophobicContact CG1-CG 3.71Å; V265-L269 VanDerWaalsContact O-CB 3.27Å; V265-L269 WeakPolarHBondContact O-CB 3.27Å; V265-L269 WeakPolarHBondContact O-CG 3.44Å; V265-L269 PolarHBondContact O-N 3.28Å; L269-V271 VanDerWaalsContact C-N 3.27Å; L269-V271 PolarHBondContact O-N 3.41Å; L269-L272 PolarHBondContact O-N 2.94Å; L269-T273 WeakPolarHBondContact O-CB 3.41Å; L269-T273 PolarHBondContact O-N 3.47Å; L269-T273 PolarHBondContact O-OG1 3.25Å
270P92.6Very high89Confident39 Ų3939 Ų3925%0.25323%0.231SC..Hα-helixtrans-57.8-42.8-179.1-2434.8000112.1G266 T273 F274 C294G266-P270 VanDerWaalsContact O-CD 3.23Å; G266-P270 WeakPolarHBondContact O-CD 3.01Å; G266-P270 WeakPolarHBondContact O-CG 3.38Å; P270-T273 PolarHBondContact O-N 2.89Å; P270-F274 WeakPolarHBondContact O-CD2 3.43Å; P270-F274 PolarHBondContact O-N 2.92Å; P270-F274 VanDerWaalsContact O-N 3.17Å; P270-C294 HydrophobicContact CB-CB 4.04Å
271V92.6Very high89.5Confident7 Ų742.5 Ų42.54%0.04225%0.249CC..Hα-helixtrans-65.2-48.5-179.7176.30000111.1W268 L269 T273 F274 M275 F291 C294W268-V271 PolarHBondContact O-N 2.83Å; L269-V271 VanDerWaalsContact C-N 3.27Å; L269-V271 PolarHBondContact O-N 3.41Å; V271-T273 VanDerWaalsContact C-N 3.33Å; V271-T273 PolarHBondContact O-N 2.89Å; V271-F274 PolarHBondContact O-N 2.97Å; V271-M275 HydrophobicContact CG1-CE 3.69Å; V271-M275 WeakPolarHBondContact O-CG 3.48Å; V271-M275 PolarHBondContact O-N 2.88Å; V271-M275 VanDerWaalsContact O-N 3.11Å; V271-F291 HydrophobicContact CG1-CE2 3.88Å; V271-C294 HydrophobicContact CG2-CB 3.98Å; V271-C294 WeakPolarHBondContact CG2-O 3.41Å
272L94.4Very high89.9Confident2 Ų248.3 Ų48.31%0.0127%0.27CS..Hα-helixtrans-66-35.9179.8-64172.3000112W204 T205 I208 L209 L212 W268 L269 M275 L276W204-L272 HydrophobicContact CZ3-CD2 4.22Å; T205-L272 HydrophobicContact CG2-CB 4.39Å; T205-L272 HydrophobicContact CG2-CD2 4.01Å; I208-L272 HydrophobicContact CB-CD2 4.25Å; I208-L272 HydrophobicContact CG2-CD1 3.92Å; I208-L272 HydrophobicContact CG2-CD2 3.93Å; L209-L272 HydrophobicContact CD2-CB 4.47Å; L209-L272 HydrophobicContact CD2-CD1 3.78Å; L209-L272 HydrophobicContact CG-CD1 4.21Å; L212-L272 HydrophobicContact CD1-CD1 3.44Å; L212-L272 VanDerWaalsContact CD1-CD1 3.44Å; W268-L272 HydrophobicContact CB-CD1 4.26Å; W268-L272 HydrophobicContact CE3-CD1 4.06Å; W268-L272 HydrophobicContact CE3-CD2 4.14Å; W268-L272 HydrophobicContact CE3-CG 4.1Å; W268-L272 HydrophobicContact CZ3-CD2 4.35Å; W268-L272 WeakPolarHBondContact O-CG 3.38Å; W268-L272 PolarHBondContact O-N 2.98Å; L269-L272 PolarHBondContact O-N 2.94Å; L272-M275 PolarHBondContact O-N 3.47Å; L272-L276 WeakPolarHBondContact O-CG 3.41Å; L272-L276 PolarHBondContact O-N 2.88Å
273T94.3Very high90.2Very high78 Ų7843 Ų4348%0.47924%0.242SC..Hα-helixtrans-60.9-47.6174.9-61.80000111.1L269 P270 V271 M275 L276 V277L269-T273 WeakPolarHBondContact O-CB 3.41Å; L269-T273 PolarHBondContact O-N 3.47Å; L269-T273 PolarHBondContact O-OG1 3.25Å; P270-T273 PolarHBondContact O-N 2.89Å; V271-T273 VanDerWaalsContact C-N 3.33Å; V271-T273 PolarHBondContact O-N 2.89Å; T273-M275 VanDerWaalsContact C-N 3.32Å; T273-M275 PolarHBondContact O-N 2.86Å; T273-L276 PolarHBondContact O-N 2.63Å; T273-V277 HydrophobicContact CG2-CG2 4.49Å; T273-V277 VanDerWaalsContact O-CG2 3.28Å; T273-V277 WeakPolarHBondContact O-CG2 3.44Å; T273-V277 PolarHBondContact O-N 3.31Å
274F94.8Very high90.4Very high43 Ų4344.5 Ų44.519%0.18925%0.253CS..Hα-helixtrans-63-37.3176.9-82-66000112.8L192 P270 V271 V277 D278 L283 Q287 A290 F291L192-F274 HydrophobicContact CD1-CB 4.44Å; P270-F274 WeakPolarHBondContact O-CD2 3.43Å; P270-F274 PolarHBondContact O-N 2.92Å; P270-F274 VanDerWaalsContact O-N 3.17Å; V271-F274 PolarHBondContact O-N 2.97Å; F274-V277 PolarHBondContact O-N 3.33Å; F274-D278 WeakPolarHBondContact O-CB 3.24Å; F274-D278 PolarHBondContact O-N 3.07Å; F274-L283 HydrophobicContact CD1-CD2 4.31Å; F274-Q287 HydrophobicContact CD1-CB 4.44Å; F274-Q287 HydrophobicContact CE1-CB 3.97Å; F274-Q287 HydrophobicContact CE1-CG 4.24Å; F274-A290 HydrophobicContact CE1-CB 4.37Å; F274-A290 HydrophobicContact CE2-CB 4.22Å; F274-A290 HydrophobicContact CZ-CB 3.68Å; F274-F291 HydrophobicContact CB-CB 4.31Å; F274-F291 HydrophobicContact CB-CD2 3.62Å; F274-F291 HydrophobicContact CB-CE2 4.45Å; F274-F291 HydrophobicContact CB-CG 4.39Å; F274-F291 HydrophobicContact CD2-CB 4.3Å; F274-F291 HydrophobicContact CD2-CD2 4.41Å; F274-F291 HydrophobicContact CG-CB 4.15Å; F274-F291 HydrophobicContact CG-CD2 4.24Å
275M94.4Very high90.6Very high11 Ų1152.7 Ų52.75%0.05428%0.284CS..Hα-helixtrans-65.4-39.9175.2-67.5-176.1-176.300112.6L192 F193 L201 W204 T205 V271 L272 T273 D278 V279 F291L192-M275 HydrophobicContact CD1-CG 4.35Å; F193-M275 HydrophobicContact CE2-CE 3.62Å; F193-M275 HydrophobicContact CE2-CG 4.32Å; F193-M275 HydrophobicContact CE2-SD 4.32Å; F193-M275 HydrophobicContact CZ-CE 3.54Å; L201-M275 HydrophobicContact CD1-CB 4.22Å; L201-M275 HydrophobicContact CD1-CG 4.12Å; L201-M275 HydrophobicContact CD1-SD 3.94Å; L201-M275 HydrophobicContact CD2-CB 4.5Å; L201-M275 HydrophobicContact CG-CB 4.4Å; W204-M275 HydrophobicContact CE3-SD 4Å; W204-M275 HydrophobicContact CH2-CE 4.45Å; W204-M275 HydrophobicContact CH2-SD 4.49Å; W204-M275 HydrophobicContact CZ3-CE 3.91Å; W204-M275 HydrophobicContact CZ3-SD 3.46Å; W204-M275 WeakPolarHBondContact CZ3-SD 3.26Å; T205-M275 HydrophobicContact CG2-CB 4.27Å; V271-M275 HydrophobicContact CG1-CE 3.69Å; V271-M275 WeakPolarHBondContact O-CG 3.48Å; V271-M275 PolarHBondContact O-N 2.88Å; V271-M275 VanDerWaalsContact O-N 3.11Å; L272-M275 PolarHBondContact O-N 3.47Å; T273-M275 VanDerWaalsContact C-N 3.32Å; T273-M275 PolarHBondContact O-N 2.86Å; M275-D278 PolarHBondContact O-N 2.68Å; M275-V279 WeakPolarHBondContact O-CG2 3.23Å; M275-V279 PolarHBondContact O-N 3.45Å; M275-F291 HydrophobicContact CE-CE2 4.08Å; M275-F291 HydrophobicContact CE-CZ 4.05Å; M275-F291 HydrophobicContact CG-CE2 4.24Å
276L94.1Very high90.8Very high67 Ų6756 Ų5635%0.35130%0.3SS..Hα-helixtrans-65.1-40.1173.8-74.4177.6000112.3T205 L209 L272 T273 D278 V279 S280T205-L276 HydrophobicContact CG2-CD2 3.76Å; T205-L276 HydrophobicContact CG2-CG 3.79Å; L209-L276 HydrophobicContact CD1-CD1 3.96Å; L272-L276 WeakPolarHBondContact O-CG 3.41Å; L272-L276 PolarHBondContact O-N 2.88Å; T273-L276 PolarHBondContact O-N 2.63Å; L276-D278 VanDerWaalsContact C-N 3.3Å; L276-D278 PolarHBondContact O-N 3.33Å; L276-V279 PolarHBondContact O-N 3.2Å; L276-S280 PolarHBondContact O-N 3.29Å; L276-S280 PolarHBondContact O-OG 3.17Å
277V93.5Very high91Very high41 Ų4157 Ų5725%0.24829%0.294CS..Hα-helixtrans-62.8-40.1175.6173.50000110.3T273 F274 V279 S280 I281 L283T273-V277 HydrophobicContact CG2-CG2 4.49Å; T273-V277 VanDerWaalsContact O-CG2 3.28Å; T273-V277 WeakPolarHBondContact O-CG2 3.44Å; T273-V277 PolarHBondContact O-N 3.31Å; F274-V277 PolarHBondContact O-N 3.33Å; V277-V279 VanDerWaalsContact C-N 3.28Å; V277-V279 PolarHBondContact O-N 3.09Å; V277-S280 PolarHBondContact O-N 2.85Å; V277-I281 HydrophobicContact CG1-CD1 3.76Å; V277-I281 HydrophobicContact CG1-CG1 3.59Å; V277-I281 WeakPolarHBondContact O-CG1 3.44Å; V277-I281 PolarHBondContact O-N 2.95Å; V277-I281 VanDerWaalsContact O-O 3.1Å; V277-L283 HydrophobicContact CG1-CD1 3.97Å; V277-L283 HydrophobicContact CG1-CG 4.46Å
278D91.6Very high91.1Very high0 Ų058.1 Ų58.10%030%0.299CS..Hα-helixtrans-64.9-29177.9-174.656.5000114.1S190 C191 L192 Q198 L201 F274 M275 L276 S280 L283S190-D278 WeakPolarHBondContact CA-OD2 3.43Å; S190-D278 VanDerWaalsContact CB-OD2 3.24Å; S190-D278 WeakPolarHBondContact CB-OD2 3.33Å; S190-D278 PolarHBondContact OG-OD2 3.35Å; C191-D278 WeakPolarHBondContact CA-OD1 3.26Å; C191-D278 WeakPolarHBondContact CB-OD1 3.39Å; C191-D278 PolarHBondContact N-OD1 3.3Å; C191-D278 PolarHBondContact N-OD2 3.38Å; L192-D278 HydrophobicContact CD1-CB 3.81Å; L192-D278 HydrophobicContact CG-CB 4.08Å; Q198-D278 PolarHBondContact NE2-O 3.19Å; L201-D278 HydrophobicContact CD2-CB 4.24Å; L201-D278 WeakPolarHBondContact CD2-OD2 3.36Å; F274-D278 WeakPolarHBondContact O-CB 3.24Å; F274-D278 PolarHBondContact O-N 3.07Å; M275-D278 PolarHBondContact O-N 2.68Å; L276-D278 VanDerWaalsContact C-N 3.3Å; L276-D278 PolarHBondContact O-N 3.33Å; D278-S280 VanDerWaalsContact C-N 3.34Å; D278-L283 HydrophobicContact CB-CD1 3.53Å
279V91Very high91.1Very high42 Ų4261.3 Ų61.326%0.25531%0.311SS..Hα-helixtrans-73.7-30.3171.4172.60000111.5L201 A202 M275 L276 V277L201-V279 HydrophobicContact CB-CG2 4.21Å; L201-V279 HydrophobicContact CD2-CG2 4.06Å; L201-V279 HydrophobicContact CG-CG2 4.11Å; A202-V279 HydrophobicContact CB-CG1 3.86Å; A202-V279 HydrophobicContact CB-CG2 3.92Å; M275-V279 WeakPolarHBondContact O-CG2 3.23Å; M275-V279 PolarHBondContact O-N 3.45Å; L276-V279 PolarHBondContact O-N 3.2Å; V277-V279 VanDerWaalsContact C-N 3.28Å; V277-V279 PolarHBondContact O-N 3.09Å
280S89.1Confident91.1Very high95 Ų9559.2 Ų59.266%0.66431%0.305SS*.Hα-helixtrans-94.2-38.5-169-530000113.2L276 V277 D278L276-S280 PolarHBondContact O-N 3.29Å; L276-S280 PolarHBondContact O-OG 3.17Å; V277-S280 PolarHBondContact O-N 2.85Å; D278-S280 VanDerWaalsContact C-N 3.34Å
281I88.4Confident91.1Very high93 Ų9358.3 Ų58.348%0.47730%0.297SS..SBendtrans-144.8161.8-17562.5169.1000110.9V277 L283V277-I281 HydrophobicContact CG1-CD1 3.76Å; V277-I281 HydrophobicContact CG1-CG1 3.59Å; V277-I281 WeakPolarHBondContact O-CG1 3.44Å; V277-I281 PolarHBondContact O-N 2.95Å; V277-I281 VanDerWaalsContact O-O 3.1Å; I281-L283 PolarHBondContact O-N 3.42Å
282Y85.9Confident90.9Very high147 Ų14758.4 Ų58.458%0.57630%0.299SS*.PPolyproline II helixtrans-70.7126.8170.8-67.8-80.5000111.1P187P187-Y282 VanDerWaalsContact CB-OH 3.24Å; P187-Y282 WeakPolarHBondContact CB-OH 3.39Å; P187-Y282 WeakPolarHBondContact CD-OH 3.48Å; P187-Y282 WeakPolarHBondContact CG-OH 3.43Å
283L88.1Confident90.6Very high16 Ų1662 Ų628%0.08432%0.315CS..PPolyproline II helixtrans-75.7140.2176.3-88.272.5000111.6C191 L192 F274 V277 D278 I281 Q287 Q288C191-L283 HydrophobicContact CB-CB 4.47Å; L192-L283 HydrophobicContact CD1-CD2 4.3Å; L192-L283 HydrophobicContact CD2-CD2 3.64Å; L192-L283 HydrophobicContact CG-CD2 4.03Å; F274-L283 HydrophobicContact CD1-CD2 4.31Å; V277-L283 HydrophobicContact CG1-CD1 3.97Å; V277-L283 HydrophobicContact CG1-CG 4.46Å; D278-L283 HydrophobicContact CB-CD1 3.53Å; I281-L283 PolarHBondContact O-N 3.42Å; L283-Q287 HydrophobicContact CB-CB 4.25Å; L283-Q287 HydrophobicContact CD2-CB 3.96Å; L283-Q287 HydrophobicContact CG-CB 4.01Å; L283-Q288 HydrophobicContact CB-CG 4Å; L283-Q288 HydrophobicContact CD2-CG 4.32Å
284T89.8Confident90.4Very high75 Ų7559.4 Ų59.446%0.4630%0.3SS..PPolyproline II helixtrans-72.1156.8165.264.50000110.9N286 Q287 Q288T284-N286 PolarHBondContact O-N 2.95Å; T284-Q287 WeakPolarHBondContact O-CB 3.49Å; T284-Q287 PolarHBondContact O-N 3.5Å; T284-Q287 VanDerWaalsContact OG1-CD 3.29Å; T284-Q287 VanDerWaalsContact OG1-CG 3.32Å; T284-Q287 WeakPolarHBondContact OG1-CG 3.35Å; T284-Q287 PolarHBondContact OG1-N 3.11Å; T284-Q287 PolarHBondContact OG1-OE1 3.32Å; T284-Q288 PolarHBondContact O-N 3.24Å
285R86.8Confident90.1Very high178 Ų17858 Ų5867%0.67230%0.295SS*.Hα-helixtrans-55.1-35.3174.5-79.1-167.1174.5178.71113.3V34 Q288 R289V34-R285 HydrophobicContact CG1-CB 3.63Å; V34-R285 HydrophobicContact CG1-CG 3.65Å; R285-Q288 PolarHBondContact O-N 2.84Å; R285-R289 VanDerWaalsContact O-CG 3.31Å; R285-R289 WeakPolarHBondContact O-CG 3.4Å; R285-R289 PolarHBondContact O-N 3.12Å
286N89.4Confident89.8Confident113 Ų11358.1 Ų58.160%0.60430%0.296SS*.Hα-helixtrans-67-38178.1-69.4-15.3000111.7T284 R289 A290T284-N286 PolarHBondContact O-N 2.95Å; N286-R289 PolarHBondContact O-N 3.4Å; N286-A290 PolarHBondContact O-N 2.97Å
287Q91.1Very high89.4Confident60 Ų6057.8 Ų57.828%0.2829%0.294SS..Hα-helixtrans-68.8-40.2175.4-70.6162.4-38.400111.8F274 L283 T284 R289 A290 F291F274-Q287 HydrophobicContact CD1-CB 4.44Å; F274-Q287 HydrophobicContact CE1-CB 3.97Å; F274-Q287 HydrophobicContact CE1-CG 4.24Å; L283-Q287 HydrophobicContact CB-CB 4.25Å; L283-Q287 HydrophobicContact CD2-CB 3.96Å; L283-Q287 HydrophobicContact CG-CB 4.01Å; T284-Q287 WeakPolarHBondContact O-CB 3.49Å; T284-Q287 PolarHBondContact O-N 3.5Å; T284-Q287 VanDerWaalsContact OG1-CD 3.29Å; T284-Q287 VanDerWaalsContact OG1-CG 3.32Å; T284-Q287 WeakPolarHBondContact OG1-CG 3.35Å; T284-Q287 PolarHBondContact OG1-N 3.11Å; T284-Q287 PolarHBondContact OG1-OE1 3.32Å; Q287-R289 VanDerWaalsContact C-N 3.32Å; Q287-R289 PolarHBondContact O-N 3.01Å; Q287-A290 PolarHBondContact O-N 2.91Å; Q287-F291 PolarHBondContact O-N 3.43Å
288Q89.9Confident88.9Confident30 Ų3056.1 Ų56.114%0.1429%0.285CS..Hα-helixtrans-61.4-40173.8-68.5170.1-37.300111.9V34 C191 L192 L283 T284 R285 F291 A292V34-Q288 HydrophobicContact CB-CB 4.44Å; V34-Q288 HydrophobicContact CG1-CB 4.45Å; V34-Q288 HydrophobicContact CG2-CB 4.2Å; C191-Q288 PolarHBondContact O-NE2 3.35Å; L192-Q288 HydrophobicContact CD2-CG 4.22Å; L283-Q288 HydrophobicContact CB-CG 4Å; L283-Q288 HydrophobicContact CD2-CG 4.32Å; T284-Q288 PolarHBondContact O-N 3.24Å; R285-Q288 PolarHBondContact O-N 2.84Å; Q288-F291 WeakPolarHBondContact O-CB 3.27Å; Q288-F291 PolarHBondContact O-N 2.97Å; Q288-A292 PolarHBondContact O-N 3.03Å
289R90.3Very high88.4Confident69 Ų6956.5 Ų56.526%0.2629%0.287SS..Hα-helixtrans-63.5-46.9173.7-72.6167.167.1-169.92.4111.7V34 E39 R285 N286 Q287 F291 A292 F293V34-R289 HydrophobicContact CB-CG 4.3Å; V34-R289 HydrophobicContact CG1-CG 3.86Å; E39-R289 IonicContact OE1-CZ 3.03Å; E39-R289 VanDerWaalsContact OE1-CZ 3.25Å; E39-R289 IonicContact OE1-NE 2.82Å; E39-R289 PolarHBondContact OE1-NE 3.21Å; E39-R289 IonicContact OE1-NH2 3.14Å; E39-R289 PolarHBondContact OE1-NH2 3.28Å; E39-R289 IonicContact OE2-CZ 3.25Å; E39-R289 IonicContact OE2-NE 3.05Å; E39-R289 PolarHBondContact OE2-NE 3.46Å; E39-R289 IonicContact OE2-NH2 2.67Å; E39-R289 PolarHBondContact OE2-NH2 2.83Å; R285-R289 VanDerWaalsContact O-CG 3.31Å; R285-R289 WeakPolarHBondContact O-CG 3.4Å; R285-R289 PolarHBondContact O-N 3.12Å; N286-R289 PolarHBondContact O-N 3.4Å; Q287-R289 VanDerWaalsContact C-N 3.32Å; Q287-R289 PolarHBondContact O-N 3.01Å; R289-F291 VanDerWaalsContact C-N 3.3Å; R289-F291 PolarHBondContact O-N 3.12Å; R289-A292 WeakPolarHBondContact O-CB 3.31Å; R289-A292 PolarHBondContact O-N 3.35Å; R289-A292 VanDerWaalsContact O-N 3.16Å; R289-F293 WeakPolarHBondContact O-CD2 3.5Å; R289-F293 PolarHBondContact O-N 3.03Å
290A91.4Very high88Confident37 Ų3759.2 Ų59.231%0.30630%0.299SS..Hα-helixtrans-59.6-40.9177.100000111.9F274 N286 Q287 A292 F293 C294F274-A290 HydrophobicContact CE1-CB 4.37Å; F274-A290 HydrophobicContact CE2-CB 4.22Å; F274-A290 HydrophobicContact CZ-CB 3.68Å; N286-A290 PolarHBondContact O-N 2.97Å; Q287-A290 PolarHBondContact O-N 2.91Å; A290-A292 VanDerWaalsContact C-N 3.33Å; A290-A292 PolarHBondContact O-N 3.33Å; A290-F293 PolarHBondContact O-N 3.11Å; A290-C294 PolarHBondContact O-N 3.45Å; A290-C294 PolarHBondContact O-SG 2.66Å; A290-C294 VanDerWaalsContact O-SG 3.41Å
291F91.6Very high87.7Confident20 Ų2054.9 Ų54.99%0.08827%0.268CS..Hα-helixtrans-57.4-43.9174.5172.6-98.1000112.5L192 F193 V271 F274 M275 Q287 Q288 R289 F293 C294 S295L192-F291 HydrophobicContact CB-CE1 4.46Å; L192-F291 HydrophobicContact CD1-CD1 4.39Å; L192-F291 HydrophobicContact CD1-CD2 3.92Å; L192-F291 HydrophobicContact CD1-CE1 4.48Å; L192-F291 HydrophobicContact CD1-CE2 4Å; L192-F291 HydrophobicContact CD1-CG 4.11Å; L192-F291 HydrophobicContact CD1-CZ 4.3Å; L192-F291 HydrophobicContact CD2-CB 3.85Å; L192-F291 HydrophobicContact CD2-CD1 3.62Å; L192-F291 HydrophobicContact CD2-CD2 4.31Å; L192-F291 HydrophobicContact CD2-CE1 4.27Å; L192-F291 HydrophobicContact CD2-CG 3.64Å; L192-F291 HydrophobicContact CG-CD1 4.43Å; L192-F291 HydrophobicContact CG-CG 4.47Å; F193-F291 HydrophobicContact CE1-CE1 4.23Å; F193-F291 HydrophobicContact CE1-CZ 4.17Å; F193-F291 HydrophobicContact CE2-CZ 4.13Å; F193-F291 HydrophobicContact CZ-CE1 4Å; F193-F291 AromaticContact CZ-CZ 3.52Å; F193-F291 HydrophobicContact CZ-CZ 3.52Å; V271-F291 HydrophobicContact CG1-CE2 3.88Å; F274-F291 HydrophobicContact CB-CB 4.31Å; F274-F291 HydrophobicContact CB-CD2 3.62Å; F274-F291 HydrophobicContact CB-CE2 4.45Å; F274-F291 HydrophobicContact CB-CG 4.39Å; F274-F291 HydrophobicContact CD2-CB 4.3Å; F274-F291 HydrophobicContact CD2-CD2 4.41Å; F274-F291 HydrophobicContact CG-CB 4.15Å; F274-F291 HydrophobicContact CG-CD2 4.24Å; M275-F291 HydrophobicContact CE-CE2 4.08Å; M275-F291 HydrophobicContact CE-CZ 4.05Å; M275-F291 HydrophobicContact CG-CE2 4.24Å; Q287-F291 PolarHBondContact O-N 3.43Å; Q288-F291 WeakPolarHBondContact O-CB 3.27Å; Q288-F291 PolarHBondContact O-N 2.97Å; R289-F291 VanDerWaalsContact C-N 3.3Å; R289-F291 PolarHBondContact O-N 3.12Å; F291-F293 VanDerWaalsContact C-N 3.29Å; F291-F293 PolarHBondContact O-N 3.33Å; F291-C294 PolarHBondContact O-N 2.82Å; F291-S295 PolarHBondContact O-N 2.89Å
292A88.7Confident87.6Confident10 Ų1050.5 Ų50.58%0.08325%0.246CC..Hα-helixtrans-58.5-42177.800000111.7L35 I43 Q288 R289 A290 S295L35-A292 HydrophobicContact CD1-CB 3.97Å; L35-A292 HydrophobicContact CD2-CB 4.01Å; L35-A292 HydrophobicContact CG-CB 4.23Å; I43-A292 HydrophobicContact CD1-CB 4.16Å; Q288-A292 PolarHBondContact O-N 3.03Å; R289-A292 WeakPolarHBondContact O-CB 3.31Å; R289-A292 PolarHBondContact O-N 3.35Å; R289-A292 VanDerWaalsContact O-N 3.16Å; A290-A292 VanDerWaalsContact C-N 3.33Å; A290-A292 PolarHBondContact O-N 3.33Å; A292-S295 PolarHBondContact O-N 3.3Å; A292-S295 PolarHBondContact O-OG 2.81Å
293F88.7Confident87.6Confident77 Ų7744.4 Ų44.434%0.33823%0.227SC..Hα-helixtrans-64.4-47.6173.2-76.7-76.3000112.6L35 E39 I43 R289 A290 F291 S295 T296L35-F293 HydrophobicContact CD2-CE2 4.48Å; E39-F293 HydrophobicContact CB-CE2 4.09Å; E39-F293 HydrophobicContact CB-CZ 3.74Å; E39-F293 HydrophobicContact CG-CE2 3.86Å; E39-F293 HydrophobicContact CG-CZ 3.66Å; I43-F293 HydrophobicContact CD1-CD1 3.8Å; I43-F293 HydrophobicContact CD1-CD2 4.28Å; I43-F293 HydrophobicContact CD1-CE1 3.8Å; I43-F293 HydrophobicContact CD1-CE2 4.27Å; I43-F293 HydrophobicContact CD1-CG 4.04Å; I43-F293 HydrophobicContact CD1-CZ 4.04Å; I43-F293 HydrophobicContact CG1-CD1 3.85Å; I43-F293 HydrophobicContact CG1-CE1 3.64Å; I43-F293 HydrophobicContact CG1-CZ 4.2Å; R289-F293 WeakPolarHBondContact O-CD2 3.5Å; R289-F293 PolarHBondContact O-N 3.03Å; A290-F293 PolarHBondContact O-N 3.11Å; F291-F293 VanDerWaalsContact C-N 3.29Å; F291-F293 PolarHBondContact O-N 3.33Å; F293-S295 PolarHBondContact O-N 3.02Å; F293-T296 WeakPolarHBondContact O-CB 3.19Å; F293-T296 PolarHBondContact O-N 2.67Å; F293-T296 VanDerWaalsContact O-N 3.09Å; F293-T296 PolarHBondContact O-OG1 2.97Å
294C90.9Very high87.5Confident24 Ų2445.8 Ų45.816%0.16224%0.236CC..Hα-helixtrans-59.4-36.1178.1-68.90000112.2P270 V271 A290 F291 T296 L297P270-C294 HydrophobicContact CB-CB 4.04Å; V271-C294 HydrophobicContact CG2-CB 3.98Å; V271-C294 WeakPolarHBondContact CG2-O 3.41Å; A290-C294 PolarHBondContact O-N 3.45Å; A290-C294 PolarHBondContact O-SG 2.66Å; A290-C294 VanDerWaalsContact O-SG 3.41Å; F291-C294 PolarHBondContact O-N 2.82Å; C294-T296 PolarHBondContact O-N 2.9Å; C294-L297 VanDerWaalsContact O-CB 3.24Å; C294-L297 WeakPolarHBondContact O-CB 3.49Å; C294-L297 WeakPolarHBondContact O-CG 3.36Å; C294-L297 PolarHBondContact O-N 2.98Å
295S88.6Confident87.4Confident13 Ų1342.6 Ų42.69%0.09122%0.215CC..Hα-helixtrans-61.3-27178.378.70000113.1F94 F291 A292 F293 L297 C298F94-S295 WeakPolarHBondContact CZ-O 3.13Å; F291-S295 PolarHBondContact O-N 2.89Å; A292-S295 PolarHBondContact O-N 3.3Å; A292-S295 PolarHBondContact O-OG 2.81Å; F293-S295 PolarHBondContact O-N 3.02Å; S295-L297 VanDerWaalsContact C-N 3.26Å; S295-L297 PolarHBondContact O-N 2.74Å; S295-C298 WeakPolarHBondContact O-CB 3.4Å; S295-C298 PolarHBondContact O-N 3.3Å
296T86.8Confident87.2Confident14 Ų1434.5 Ų34.59%0.08619%0.186CC..Hα-helixtrans-68.8-24.417571.50000112.9I43 F293 C294 C298 L299 L300I43-T296 HydrophobicContact CB-CG2 4.42Å; I43-T296 HydrophobicContact CG1-CG2 4.37Å; I43-T296 HydrophobicContact CG2-CG2 3.34Å; F293-T296 WeakPolarHBondContact O-CB 3.19Å; F293-T296 PolarHBondContact O-N 2.67Å; F293-T296 VanDerWaalsContact O-N 3.09Å; F293-T296 PolarHBondContact O-OG1 2.97Å; C294-T296 PolarHBondContact O-N 2.9Å; T296-C298 PolarHBondContact O-N 3.27Å; T296-L299 VanDerWaalsContact O-CB 3.29Å; T296-L299 WeakPolarHBondContact O-CB 3.34Å; T296-L299 PolarHBondContact O-N 3.02Å; T296-L300 PolarHBondContact O-N 2.86Å
297L86.4Confident86.6Confident59 Ų5933.7 Ų33.731%0.30918%0.181SC..Hα-helixtrans-65.5-25.8175.8-58.3176.2000111.5S267 C294 S295 L299 L300 N301S267-L297 WeakPolarHBondContact CB-O 3.23Å; C294-L297 VanDerWaalsContact O-CB 3.24Å; C294-L297 WeakPolarHBondContact O-CB 3.49Å; C294-L297 WeakPolarHBondContact O-CG 3.36Å; C294-L297 PolarHBondContact O-N 2.98Å; S295-L297 VanDerWaalsContact C-N 3.26Å; S295-L297 PolarHBondContact O-N 2.74Å; L297-L299 VanDerWaalsContact C-N 3.26Å; L297-L299 PolarHBondContact O-N 3.37Å; L297-L300 HydrophobicContact CD2-CD1 3.89Å; L297-L300 WeakPolarHBondContact O-CB 3.05Å; L297-L300 PolarHBondContact O-N 3.23Å; L297-N301 PolarHBondContact O-N 2.98Å
298C82.4Confident86Confident6 Ų631.7 Ų31.74%0.04117%0.172CC..Hα-helixtrans-65.4-31173.1-61.40000112.1F124 S295 T296 N301 S302F124-C298 HydrophobicContact CD1-CB 4.45Å; F124-C298 HydrophobicContact CE1-CB 3.53Å; F124-C298 HydrophobicContact CE2-CB 4.36Å; F124-C298 HydrophobicContact CZ-CB 3.47Å; F124-C298 VanDerWaalsContact CZ-CB 3.47Å; S295-C298 WeakPolarHBondContact O-CB 3.4Å; S295-C298 PolarHBondContact O-N 3.3Å; T296-C298 PolarHBondContact O-N 3.27Å; C298-N301 WeakPolarHBondContact O-CB 3.36Å; C298-N301 PolarHBondContact O-N 3.26Å; C298-S302 PolarHBondContact O-N 3.41Å
299L81.8Confident85.3Confident9 Ų931 Ų315%0.04717%0.169CC..Hα-helixtrans-67.9-38.5173.4-176.464000111.2T54 F94 T296 L297 N301 S302 A303T54-L299 HydrophobicContact CG2-CD1 4.47Å; F94-L299 HydrophobicContact CE1-CB 4.39Å; T296-L299 VanDerWaalsContact O-CB 3.29Å; T296-L299 WeakPolarHBondContact O-CB 3.34Å; T296-L299 PolarHBondContact O-N 3.02Å; L297-L299 VanDerWaalsContact C-N 3.26Å; L297-L299 PolarHBondContact O-N 3.37Å; L299-N301 VanDerWaalsContact C-N 3.32Å; L299-N301 PolarHBondContact O-N 3.21Å; L299-S302 PolarHBondContact O-N 2.83Å; L299-A303 PolarHBondContact O-N 2.99Å
300L81.1Confident84.5Confident99 Ų9929.4 Ų29.452%0.51817%0.17SC..Hα-helixtrans-63.5-38.3174.1-66175.7000111.6T296 L297 S302 A303 V304T296-L300 PolarHBondContact O-N 2.86Å; L297-L300 HydrophobicContact CD2-CD1 3.89Å; L297-L300 WeakPolarHBondContact O-CB 3.05Å; L297-L300 PolarHBondContact O-N 3.23Å; L300-S302 VanDerWaalsContact C-N 3.3Å; L300-S302 PolarHBondContact O-N 3.45Å; L300-A303 PolarHBondContact O-N 3.29Å; L300-A303 VanDerWaalsContact O-N 3.16Å; L300-V304 VanDerWaalsContact O-CG2 3.3Å; L300-V304 WeakPolarHBondContact O-CG2 3.32Å; L300-V304 PolarHBondContact O-N 3.23Å
301N83.4Confident83.6Confident3 Ų334.5 Ų34.52%0.01619%0.191CC..Hα-helixtrans-56.6-45.1175.9-176.166.1000111.5S267 L297 C298 L299 N305S267-N301 PolarHBondContact OG-OD1 3.02Å; L297-N301 PolarHBondContact O-N 2.98Å; C298-N301 WeakPolarHBondContact O-CB 3.36Å; C298-N301 PolarHBondContact O-N 3.26Å; L299-N301 VanDerWaalsContact C-N 3.32Å; L299-N301 PolarHBondContact O-N 3.21Å; N301-N305 PolarHBondContact O-ND2 2.8Å; N301-N305 PolarHBondContact O-OD1 2.85Å
302S86.9Confident82.7Confident1 Ų137.4 Ų37.41%0.00720%0.202CC..Hα-helixtrans-70.1-31.6176.5-650000113.7N58 D87 C298 L299 L300 P306N58-S302 PolarHBondContact ND2-O 3.15Å; D87-S302 VanDerWaalsContact CG-OG 3.32Å; D87-S302 WeakPolarHBondContact OD1-CB 3.34Å; D87-S302 PolarHBondContact OD1-OG 3.28Å; C298-S302 PolarHBondContact O-N 3.41Å; L299-S302 PolarHBondContact O-N 2.83Å; L300-S302 VanDerWaalsContact C-N 3.3Å; L300-S302 PolarHBondContact O-N 3.45Å; S302-P306 WeakPolarHBondContact O-CD 3.41Å
303A86.8Confident82.2Confident20 Ų2037.5 Ų37.517%0.16520%0.202CC..Hα-helixtrans-71.3-34.3177.200000112.7T54 L299 L300T54-A303 HydrophobicContact CG2-CB 4.35Å; T54-A303 WeakPolarHBondContact OG1-CB 3.31Å; L299-A303 PolarHBondContact O-N 2.99Å; L300-A303 PolarHBondContact O-N 3.29Å; L300-A303 VanDerWaalsContact O-N 3.16Å
304V85.8Confident81.7Confident45 Ų4541.4 Ų41.427%0.27321%0.214SC..Hα-helixtrans-78.4-22.6-176.9177.90000112.5I263 L300 L307 L308I263-V304 HydrophobicContact CD1-CG1 3.75Å; I263-V304 HydrophobicContact CG2-CB 4.49Å; L300-V304 VanDerWaalsContact O-CG2 3.3Å; L300-V304 WeakPolarHBondContact O-CG2 3.32Å; L300-V304 PolarHBondContact O-N 3.23Å; V304-L307 WeakPolarHBondContact O-CB 3.41Å; V304-L307 PolarHBondContact O-N 3.17Å; V304-L308 WeakPolarHBondContact O-CB 3.34Å; V304-L308 PolarHBondContact O-N 3.06Å
305N85.8Confident81.4Confident7 Ų742.7 Ų42.74%0.03722%0.217CC..Hα-helixtrans-57.9-52.5-177.3-70.9-25.9000113.3L83 D87 N301 L307 L308 Y309L83-N305 HydrophobicContact CD2-CB 4.2Å; D87-N305 PolarHBondContact OD2-ND2 2.69Å; N301-N305 PolarHBondContact O-ND2 2.8Å; N301-N305 PolarHBondContact O-OD1 2.85Å; N305-L307 PolarHBondContact O-N 2.92Å; N305-L308 WeakPolarHBondContact O-CB 3.46Å; N305-L308 PolarHBondContact O-N 3.35Å; N305-Y309 HydrophobicContact CB-CE2 4.2Å; N305-Y309 WeakPolarHBondContact O-CD2 3.47Å; N305-Y309 WeakPolarHBondContact O-CE2 3.11Å; N305-Y309 PolarHBondContact O-N 3.41Å; N305-Y309 VanDerWaalsContact O-N 3.13Å
306P83.8Confident81.1Confident9 Ų942.1 Ų42.16%0.05821%0.213CC..Hα-helixtrans-56.8-44.3174.9-29.336.9000114.5E57 N58 I61 S302 L308 Y309 A310E57-P306 HydrophobicContact CB-CB 4.2Å; E57-P306 HydrophobicContact CB-CG 4.03Å; N58-P306 WeakPolarHBondContact OD1-CG 3.32Å; I61-P306 HydrophobicContact CD1-CB 4.28Å; I61-P306 HydrophobicContact CG1-CB 3.82Å; I61-P306 HydrophobicContact CG1-CG 4.2Å; S302-P306 WeakPolarHBondContact O-CD 3.41Å; P306-L308 VanDerWaalsContact C-N 3.31Å; P306-L308 PolarHBondContact O-N 3.16Å; P306-Y309 PolarHBondContact O-N 2.98Å; P306-A310 WeakPolarHBondContact O-CB 3.39Å; P306-A310 PolarHBondContact O-N 3Å
307L77.6Confident81Confident95 Ų9548.9 Ų48.950%0.49724%0.237SC..Hα-helixtrans-57.5-46.1177.2-92.3152.3000111V304 N305 Y309 A310 L311V304-L307 WeakPolarHBondContact O-CB 3.41Å; V304-L307 PolarHBondContact O-N 3.17Å; N305-L307 PolarHBondContact O-N 2.92Å; L307-Y309 PolarHBondContact O-N 3.28Å; L307-A310 PolarHBondContact O-N 3.41Å; L307-L311 WeakPolarHBondContact O-CB 3.49Å; L307-L311 VanDerWaalsContact O-CG 3.24Å; L307-L311 WeakPolarHBondContact O-CG 3.13Å; L307-L311 PolarHBondContact O-N 2.91Å
308L77.4Confident80.9Confident18 Ų1849.5 Ų49.59%0.09424%0.24CC..Hα-helixtrans-59.2-46177.8-179.176.9000111.9T256 I260 V304 N305 P306 L311 R312T256-L308 HydrophobicContact CG2-CD1 3.84Å; I260-L308 HydrophobicContact CB-CD2 4.47Å; I260-L308 HydrophobicContact CD1-CD1 3.64Å; I260-L308 HydrophobicContact CD1-CD2 3.5Å; I260-L308 HydrophobicContact CD1-CG 3.96Å; I260-L308 HydrophobicContact CG1-CD1 3.3Å; I260-L308 HydrophobicContact CG1-CD2 3.39Å; I260-L308 HydrophobicContact CG1-CG 3.87Å; I260-L308 HydrophobicContact CG2-CD2 4.31Å; V304-L308 WeakPolarHBondContact O-CB 3.34Å; V304-L308 PolarHBondContact O-N 3.06Å; N305-L308 WeakPolarHBondContact O-CB 3.46Å; N305-L308 PolarHBondContact O-N 3.35Å; P306-L308 VanDerWaalsContact C-N 3.31Å; P306-L308 PolarHBondContact O-N 3.16Å; L308-L311 PolarHBondContact O-N 3.44Å; L308-R312 VanDerWaalsContact O-CB 3.29Å; L308-R312 WeakPolarHBondContact O-CB 3.16Å; L308-R312 VanDerWaalsContact O-CG 3.22Å; L308-R312 WeakPolarHBondContact O-CG 3.41Å; L308-R312 PolarHBondContact O-N 3.2Å
309Y75.4Confident80.9Confident17 Ų1749.4 Ų49.47%0.06724%0.24CC..Hα-helixtrans-68.4-40.2178.4-61.2-53.9000112.5I80 L83 N305 P306 L307 L311 R312 C313I80-Y309 HydrophobicContact CD1-CD1 3.98Å; I80-Y309 HydrophobicContact CD1-CE1 4.11Å; I80-Y309 HydrophobicContact CG1-CD1 4.19Å; I80-Y309 HydrophobicContact CG1-CE1 3.88Å; I80-Y309 HydrophobicContact CG2-CD1 4.37Å; I80-Y309 HydrophobicContact CG2-CD2 3.79Å; I80-Y309 HydrophobicContact CG2-CE1 4.44Å; I80-Y309 HydrophobicContact CG2-CE2 3.86Å; I80-Y309 HydrophobicContact CG2-CG 4.07Å; L83-Y309 HydrophobicContact CD2-CE2 3.88Å; L83-Y309 WeakPolarHBondContact CD2-OH 3.32Å; N305-Y309 HydrophobicContact CB-CE2 4.2Å; N305-Y309 WeakPolarHBondContact O-CD2 3.47Å; N305-Y309 WeakPolarHBondContact O-CE2 3.11Å; N305-Y309 PolarHBondContact O-N 3.41Å; N305-Y309 VanDerWaalsContact O-N 3.13Å; P306-Y309 PolarHBondContact O-N 2.98Å; L307-Y309 PolarHBondContact O-N 3.28Å; Y309-L311 VanDerWaalsContact C-N 3.26Å; Y309-L311 PolarHBondContact O-N 3.4Å; Y309-R312 PolarHBondContact O-N 3.42Å; Y309-C313 VanDerWaalsContact O-CB 3.31Å; Y309-C313 WeakPolarHBondContact O-CB 3.45Å; Y309-C313 PolarHBondContact O-N 3.45Å
310A74.2Confident81.1Confident34 Ų3450.7 Ų50.728%0.28125%0.247SC..Hα-helixtrans-61.1-36.8176.600000112.1P306 L307P306-A310 WeakPolarHBondContact O-CB 3.39Å; P306-A310 PolarHBondContact O-N 3Å; L307-A310 PolarHBondContact O-N 3.41Å
311L71.8Confident81.2Confident144 Ų14450.4 Ų50.475%0.75425%0.245SC*.Hα-helixtrans-75.5-29.1176.9-68.3172.5000113.1L307 L308 Y309L307-L311 WeakPolarHBondContact O-CB 3.49Å; L307-L311 VanDerWaalsContact O-CG 3.24Å; L307-L311 WeakPolarHBondContact O-CG 3.13Å; L307-L311 PolarHBondContact O-N 2.91Å; L308-L311 PolarHBondContact O-N 3.44Å; Y309-L311 VanDerWaalsContact C-N 3.26Å; Y309-L311 PolarHBondContact O-N 3.4Å
312R71.8Confident81.1Confident82 Ų8255.5 Ų55.531%0.30927%0.269SS..Hα-helixtrans-102.1-32.9-171-69-72.3-95.2123-6.3114.9T256 L308 Y309T256-R312 VanDerWaalsContact CB-NE 3.29Å; T256-R312 HydrophobicContact CG2-CG 3.7Å; T256-R312 PolarHBondContact OG1-NE 3.47Å; L308-R312 VanDerWaalsContact O-CB 3.29Å; L308-R312 WeakPolarHBondContact O-CB 3.16Å; L308-R312 VanDerWaalsContact O-CG 3.22Å; L308-R312 WeakPolarHBondContact O-CG 3.41Å; L308-R312 PolarHBondContact O-N 3.2Å; Y309-R312 PolarHBondContact O-N 3.42Å
313C77.9Confident80.4Confident12 Ų1257.3 Ų57.38%0.08128%0.281CS..  trans-102.895.9-174.1-66.90000110.1Y77 Y309 E315 L316 R317Y77-C313 HydrophobicContact CE1-CB 4.44Å; Y309-C313 VanDerWaalsContact O-CB 3.31Å; Y309-C313 WeakPolarHBondContact O-CB 3.45Å; Y309-C313 PolarHBondContact O-N 3.45Å; C313-E315 VanDerWaalsContact C-N 3.28Å; C313-E315 PolarHBondContact O-N 3.41Å; C313-L316 HydrophobicContact CB-CB 3.7Å; C313-L316 HydrophobicContact CB-CD2 4.4Å; C313-L316 WeakPolarHBondContact O-CB 3.45Å; C313-L316 PolarHBondContact O-N 3.17Å; C313-L316 VanDerWaalsContact O-N 3.12Å; C313-R317 PolarHBondContact O-N 3.28Å
314R79.9Confident79.7Confident159 Ų15960.8 Ų60.860%0.630%0.296SS*.Hα-helixtrans-55.4-41.5179-174-178.9177.7-173.10.3112.6L316 R317 I318R314-L316 VanDerWaalsContact C-N 3.34Å; R314-L316 PolarHBondContact O-N 2.95Å; R314-R317 PolarHBondContact O-N 3.49Å; R314-I318 HydrophobicContact CG-CD1 3.86Å; R314-I318 HydrophobicContact CG-CG1 4.41Å; R314-I318 VanDerWaalsContact O-CG1 3.26Å; R314-I318 WeakPolarHBondContact O-CG1 3.24Å; R314-I318 PolarHBondContact O-N 3.1Å
315E83.4Confident78.3Confident50 Ų5062.3 Ų62.323%0.23431%0.308CS..Hα-helixtrans-66.7-36.7-179.6-45.8177148.400111.9M70 K74 Y77 C313 I318 A319M70-E315 HydrophobicContact CE-CB 4.17Å; K74-E315 IonicContact NZ-OE1 3.74Å; K74-E315 PolarHBondContact NZ-OE1 2.98Å; K74-E315 IonicContact NZ-OE2 2.66Å; K74-E315 PolarHBondContact NZ-OE2 3.23Å; Y77-E315 WeakPolarHBondContact CE2-OE2 3.46Å; Y77-E315 WeakPolarHBondContact OH-CB 3.28Å; Y77-E315 PolarHBondContact OH-OE2 3.48Å; C313-E315 VanDerWaalsContact C-N 3.28Å; C313-E315 PolarHBondContact O-N 3.41Å; E315-I318 PolarHBondContact O-N 3.37Å; E315-A319 WeakPolarHBondContact O-CB 3.36Å; E315-A319 PolarHBondContact O-N 2.95Å
316L82.5Confident76.7Confident1 Ų171.6 Ų71.61%0.00534%0.342CS..Hα-helixtrans-67-43.9174.3-175.567.5000110.8I61 V64 I65 L71 Y77 C313 R314 I318 A319 L320I61-L316 HydrophobicContact CD1-CD2 4.27Å; V64-L316 HydrophobicContact CG1-CD1 3.88Å; I65-L316 HydrophobicContact CG1-CD1 4.29Å; L71-L316 HydrophobicContact CD2-CB 4.25Å; L71-L316 HydrophobicContact CD2-CD1 3.62Å; Y77-L316 HydrophobicContact CE1-CB 4.2Å; C313-L316 HydrophobicContact CB-CB 3.7Å; C313-L316 HydrophobicContact CB-CD2 4.4Å; C313-L316 WeakPolarHBondContact O-CB 3.45Å; C313-L316 PolarHBondContact O-N 3.17Å; C313-L316 VanDerWaalsContact O-N 3.12Å; R314-L316 VanDerWaalsContact C-N 3.34Å; R314-L316 PolarHBondContact O-N 2.95Å; L316-I318 VanDerWaalsContact C-N 3.35Å; L316-I318 PolarHBondContact O-N 2.87Å; L316-A319 PolarHBondContact O-N 3.41Å; L316-L320 VanDerWaalsContact O-CB 3.29Å; L316-L320 WeakPolarHBondContact O-CB 3.09Å; L316-L320 PolarHBondContact O-N 3.31Å
317R84.9Confident75Confident156 Ų15676.5 Ų76.559%0.58938%0.376SS*.Hα-helixtrans-60.1-44.1175.1-178.2179173.8-173.7-0.8111.9C313 R314 L320 L321C313-R317 PolarHBondContact O-N 3.28Å; R314-R317 PolarHBondContact O-N 3.49Å; R317-L320 PolarHBondContact O-N 2.97Å; R317-L321 HydrophobicContact CG-CD1 4.16Å; R317-L321 WeakPolarHBondContact O-CB 3.41Å; R317-L321 VanDerWaalsContact O-CG 3.3Å; R317-L321 WeakPolarHBondContact O-CG 3.27Å; R317-L321 PolarHBondContact O-N 3.35Å
318I84.5Confident73.4Confident72 Ų7277.6 Ų77.637%0.36939%0.391SS..Hα-helixtrans-62.8-46.5176.7-69.1166.1000110.2R314 E315 L316 L320 L321 Q322R314-I318 HydrophobicContact CG-CD1 3.86Å; R314-I318 HydrophobicContact CG-CG1 4.41Å; R314-I318 VanDerWaalsContact O-CG1 3.26Å; R314-I318 WeakPolarHBondContact O-CG1 3.24Å; R314-I318 PolarHBondContact O-N 3.1Å; E315-I318 PolarHBondContact O-N 3.37Å; L316-I318 VanDerWaalsContact C-N 3.35Å; L316-I318 PolarHBondContact O-N 2.87Å; I318-L320 VanDerWaalsContact C-N 3.33Å; I318-L320 PolarHBondContact O-N 2.84Å; I318-L321 PolarHBondContact O-N 3.26Å; I318-Q322 HydrophobicContact CG2-CG 4.44Å; I318-Q322 VanDerWaalsContact O-CG 3.29Å; I318-Q322 WeakPolarHBondContact O-CG 3.31Å; I318-Q322 PolarHBondContact O-N 2.96Å
319A83Confident71.7Confident5 Ų579.2 Ų79.24%0.04141%0.412CS..Hα-helixtrans-62.2-40.9177.900000112V64 L71 E315 L316 Q322 C323V64-A319 HydrophobicContact CG1-CB 3.59Å; L71-A319 HydrophobicContact CD1-CB 3.75Å; E315-A319 WeakPolarHBondContact O-CB 3.36Å; E315-A319 PolarHBondContact O-N 2.95Å; L316-A319 PolarHBondContact O-N 3.41Å; A319-Q322 PolarHBondContact O-N 2.52Å; A319-Q322 VanDerWaalsContact O-N 3.16Å; A319-C323 PolarHBondContact O-N 3.2Å; A319-C323 PolarHBondContact O-SG 3.32Å
320L84.3Confident69.9Low36 Ų3688.5 Ų88.519%0.18845%0.453CS..Hα-helixtrans-62.2-45.2175.4-172.9132.5000111.6L60 I61 V64 L316 R317 I318 Q322 C323 L324L60-L320 HydrophobicContact CD2-CD1 3.94Å; L60-L320 HydrophobicContact CG-CD1 4.22Å; I61-L320 HydrophobicContact CD1-CD1 4.4Å; V64-L320 HydrophobicContact CG2-CB 4.35Å; V64-L320 HydrophobicContact CG2-CD1 4.42Å; L316-L320 VanDerWaalsContact O-CB 3.29Å; L316-L320 WeakPolarHBondContact O-CB 3.09Å; L316-L320 PolarHBondContact O-N 3.31Å; R317-L320 PolarHBondContact O-N 2.97Å; I318-L320 VanDerWaalsContact C-N 3.33Å; I318-L320 PolarHBondContact O-N 2.84Å; L320-Q322 VanDerWaalsContact C-N 3.26Å; L320-Q322 PolarHBondContact O-N 2.94Å; L320-C323 PolarHBondContact O-N 3.36Å; L320-L324 HydrophobicContact CD2-CD1 3.69Å; L320-L324 HydrophobicContact CG-CD1 4.45Å; L320-L324 WeakPolarHBondContact O-CG 3.43Å; L320-L324 PolarHBondContact O-N 2.99Å
321L83.2Confident68.4Low93 Ų9389.9 Ų89.949%0.48747%0.47SS..Hα-helixtrans-66.1-22.5173.8-72.4172.4000113.9R317 I318 L324 P325R317-L321 HydrophobicContact CG-CD1 4.16Å; R317-L321 WeakPolarHBondContact O-CB 3.41Å; R317-L321 VanDerWaalsContact O-CG 3.3Å; R317-L321 WeakPolarHBondContact O-CG 3.27Å; R317-L321 PolarHBondContact O-N 3.35Å; I318-L321 PolarHBondContact O-N 3.26Å; L321-L324 HydrophobicContact CD2-CD1 4.16Å; L321-P325 WeakPolarHBondContact O-CD 3.48Å; L321-P325 WeakPolarHBondContact O-CG 3.32Å
322Q81.9Confident66.4Low110 Ų11095.2 Ų95.251%0.51448%0.481SS..Hα-helixtrans-84.5-22.2174.2-73.9173.9-8.100112.7I318 A319 L320I318-Q322 HydrophobicContact CG2-CG 4.44Å; I318-Q322 VanDerWaalsContact O-CG 3.29Å; I318-Q322 WeakPolarHBondContact O-CG 3.31Å; I318-Q322 PolarHBondContact O-N 2.96Å; A319-Q322 PolarHBondContact O-N 2.52Å; A319-Q322 VanDerWaalsContact O-N 3.16Å; L320-Q322 VanDerWaalsContact C-N 3.26Å; L320-Q322 PolarHBondContact O-N 2.94Å
323C73.3Confident64.4Low39 Ų3996.9 Ų96.926%0.26450%0.503SS..Hα-helixtrans-83.1-36.1174.4-68.20000112.1V64 A319 L320 R326 S327V64-C323 HydrophobicContact CG2-CB 4.48Å; A319-C323 PolarHBondContact O-N 3.2Å; A319-C323 PolarHBondContact O-SG 3.32Å; L320-C323 PolarHBondContact O-N 3.36Å; C323-R326 PolarHBondContact O-N 3.5Å; C323-R326 VanDerWaalsContact O-N 3.11Å; C323-S327 PolarHBondContact O-N 2.91Å
324L70.5Confident62.3Low92 Ų92106 Ų10648%0.48254%0.542SS..Hα-helixtrans-54.1-45.7176.6-79.6159.4000114.9L320 L321 R326 S327 C328L320-L324 HydrophobicContact CD2-CD1 3.69Å; L320-L324 HydrophobicContact CG-CD1 4.45Å; L320-L324 WeakPolarHBondContact O-CG 3.43Å; L320-L324 PolarHBondContact O-N 2.99Å; L321-L324 HydrophobicContact CD2-CD1 4.16Å; L324-R326 VanDerWaalsContact C-N 3.29Å; L324-R326 PolarHBondContact O-N 2.92Å; L324-S327 PolarHBondContact O-N 2.02Å; L324-C328 PolarHBondContact O-N 2.67Å
325P56.8Low59.8Low78 Ų78105.7 Ų105.751%0.50655%0.552SS.*Hα-helixtrans-75.7-13177.526.5-32.4000113.7L321 G329L321-P325 WeakPolarHBondContact O-CD 3.48Å; L321-P325 WeakPolarHBondContact O-CG 3.32Å; P325-G329 WeakPolarHBondContact O-CA 3.4Å; P325-G329 PolarHBondContact O-N 3.05Å; P325-G329 VanDerWaalsContact O-N 3.16Å
326R52.4Low57.2Low201 Ų201108.3 Ų108.376%0.75858%0.575SS**Hα-helixtrans-80.4-26.4172.1-78.1-171169.699.1-3.3112.8C323 L324C323-R326 PolarHBondContact O-N 3.5Å; C323-R326 VanDerWaalsContact O-N 3.11Å; L324-R326 VanDerWaalsContact C-N 3.29Å; L324-R326 PolarHBondContact O-N 2.92Å
327S49.2Very low54.6Low112 Ų112114.5 Ų114.578%0.78361%0.613SS**Hα-helixtrans-87.3-20.4174.4-640000113.6C323 L324C323-S327 PolarHBondContact O-N 2.91Å; L324-S327 PolarHBondContact O-N 2.02Å
328C44.1Very low52.1Low119 Ų119113.6 Ų113.680%0.80462%0.62SS**SBendtrans-106.710.7174.5-68.60000114.2L324L324-C328 PolarHBondContact O-N 2.67Å
329G39.9Very low49.4Very low51 Ų51117.1 Ų117.153%0.52664%0.64SS.*  trans-106.183.3-175.300000113.2P325 G331P325-G329 WeakPolarHBondContact O-CA 3.4Å; P325-G329 PolarHBondContact O-N 3.05Å; P325-G329 VanDerWaalsContact O-N 3.16Å; G329-G331 PolarHBondContact O-N 3.42Å
330F38.7Very low46.9Very low213 Ų213124.3 Ų124.393%0.93468%0.677SS**  trans-60120.3156.1-176.1-100.4000108.6
331G42.6Very low44.2Very low63 Ų63130.1 Ų130.165%0.64971%0.708SS**  trans61.296156.700000118.1G329G329-G331 PolarHBondContact O-N 3.42Å
332R29.9Very low41.8Very low256 Ų256130.9 Ų130.997%0.96672%0.719SS**  trans-149.3100.7136.1-136.7168.3146.3167.1-7.1111.1
333C30.1Very low39.2Very low116 Ų116132.5 Ų132.578%0.78474%0.736SS**  trans-51.9136.3173.7-73.80000111.3N335C333-N335 PolarHBondContact O-N 2.83Å
334K32.4Very low36.9Very low205 Ų205134 Ų13489%0.89176%0.758SS**  trans-62.9116.9156.1-94.2178.3166.8-177.80107.6S336K334-S336 PolarHBondContact O-N 3.18Å
335N27.2Very low34.7Very low152 Ų152138.9 Ų138.981%0.81378%0.779SS**  trans-74.5104156.6-81.52.4000107.6C333C333-N335 PolarHBondContact O-N 2.83Å
336S29.3Very low33Very low104 Ų104140.9 Ų140.973%0.72780%0.795SS**  trans-84.3115.2157.8-161.40000106.3K334K334-S336 PolarHBondContact O-N 3.18Å
337T29Very low31.8Very low131 Ų131136 Ų13680%0.80480%0.798SS**  trans-131.790.4158.7340000106.5
338N31.1Very low30.6Very low137 Ų137139.3 Ų139.373%0.73380%0.801SS**  trans-66.1132.9138.4-77-14.9000105.7
339D28.8Very low29.7Very low147 Ų147141.7 Ų141.779%0.78681%0.805SS**  -175.8135.9125.8-92.9-21.5000112.4
340L30.8Very low28.9Very low155 Ų155147 Ų14781%0.81282%0.821SS**  trans80.998.6149.1-61.5153000119.5
341N27.2Very low28Very low158 Ų158143 Ų14385%0.84582%0.818SS**  trans-73.1147139-103.3-4.2000109.1
342P32.6Very low27.2Very low110 Ų110143.8 Ų143.871%0.71482%0.819SS**  -136.9147.911431.2-15.6000114.4
343T27.1Very low26.8Very low143 Ų143138.1 Ų138.188%0.87781%0.813SS**  trans-12.9139.715938.90000120.1
344G24.8Very low26.5Very low71 Ų71139 Ų13973%0.73282%0.815SS**  trans134115.7131.800000118.6
345Q23.7Very low26.1Very low194 Ų194134.7 Ų134.791%0.90781%0.81SS**  trans80.5111.1145.2-67.3175.3-14.900121.7
346S22.3Very low26Very low121 Ų121135 Ų13585%0.84681%0.812SS**  42.7113.3122.9-1680000119.5
347A26.8Very low25.8Very low99 Ų99137 Ų13782%0.81881%0.814SS**  -164.3127.1128.400000109.1
348E24.6Very low25.6Very low181 Ų181137.2 Ų137.285%0.84682%0.816SS**  trans-65143.2166.5-65.7167.1125.500109.9
349D24Very low25.4Very low169 Ų169138.2 Ų138.290%0.90482%0.82SS**  trans-163.7127.9132.3-105.3-20.9000111.5
350N23.2Very low25.2Very low161 Ų161135.7 Ų135.786%0.86182%0.82SS**  trans-79.4148.2173.7-74.6-49.7000110.3
351C20.9Very low25Very low129 Ų129132.9 Ų132.987%0.87282%0.819SS**  160.8154.1112.5-156.30000112.7
352A24.4Very low24.9Very low80 Ų80136.7 Ų136.766%0.66182%0.821SS**  trans87.885.5159.700000118.4
353T22Very low24.7Very low138 Ų138137.4 Ų137.485%0.84782%0.824SS**  trans-27.8122.6137.642.90000114.8
354V24.9Very low24.8Very low135 Ų135135.8 Ų135.882%0.81882%0.816SS**  trans-134.6111.5143.6176.60000107
355S23.4Very low25.1Very low113 Ų113140.6 Ų140.679%0.7982%0.819SS**  trans-69.8128.5163.3-53.90000108.1
356D24.9Very low25.5Very low158 Ų158137.5 Ų137.585%0.84581%0.808SS**  trans-150.3119.7143.8-124.1-15.4000110.1
357D24.6Very low25.8Very low147 Ų147135.4 Ų135.479%0.78679%0.788SS**  trans-56.5128168.5-79.8-53.2000109.7
358T25.3Very low26.2Very low135 Ų135133.9 Ų133.983%0.82877%0.771SS**  173.3146.3120.3240000113.3
359L26.1Very low26.9Very low159 Ų159130 Ų13083%0.83276%0.759SS**  trans83.465.9154.7-122.876.3000118.4A361L359-A361 PolarHBondContact O-N 3.02Å
360A25.9Very low27.3Very low94 Ų94123.9 Ų123.978%0.77773%0.73SS**  trans-52.7105.1146.800000110.6R362A360-R362 VanDerWaalsContact C-N 3.33Å; A360-R362 PolarHBondContact O-N 3.05Å
361A26.5Very low27.9Very low96 Ų96120.1 Ų120.179%0.79371%0.707SS**  trans-69.190.7169.400000109.7L359 T363L359-A361 PolarHBondContact O-N 3.02Å; A361-T363 PolarHBondContact O-N 3.36Å; A361-T363 VanDerWaalsContact O-N 3.12Å
362R25.5Very low28.8Very low237 Ų237119 Ų11989%0.89469%0.691SS**  trans-60.1104.3166-80.3177.4174.3170.5-0.9110A360A360-R362 VanDerWaalsContact C-N 3.33Å; A360-R362 PolarHBondContact O-N 3.05Å
363T27Very low29.4Very low126 Ų126119.6 Ų119.677%0.77369%0.686SS**  trans-67.9123.9153.832.50000109.4A361 Q365A361-T363 PolarHBondContact O-N 3.36Å; A361-T363 VanDerWaalsContact O-N 3.12Å; T363-Q365 PolarHBondContact O-N 3.46Å; T363-Q365 VanDerWaalsContact O-N 3.15Å
364P29.1Very low30Very low108 Ų108117.1 Ų117.170%0.70167%0.668SS**  trans-77.5105.417629.4-29000109.3L366P364-L366 PolarHBondContact O-N 3.49Å
365Q31.6Very low30.4Very low172 Ų172115.4 Ų115.480%0.80466%0.662SS**  trans-60.5104.1156.1-81.6-125.5-1.600107.8T363 N367T363-Q365 PolarHBondContact O-N 3.46Å; T363-Q365 VanDerWaalsContact O-N 3.15Å; Q365-N367 PolarHBondContact O-N 3.33Å
366L32Very low31.1Very low129 Ų129118.3 Ų118.368%0.67566%0.66SS**  trans-91.790.9177.5-144.484.6000108.2P364P364-L366 PolarHBondContact O-N 3.49Å
367N29.2Very low31.7Very low78 Ų78115.2 Ų115.242%0.41765%0.651SS.*  trans-55.5142.4179.9-72.1-0.9000112Q365 E371Q365-N367 PolarHBondContact O-N 3.33Å; N367-E371 HydrophobicContact CB-CB 3.88Å; N367-E371 WeakPolarHBondContact CB-OE2 3.44Å; N367-E371 PolarHBondContact OD1-OE2 2.98Å
368S36Very low32.1Very low67 Ų67117 Ų11747%0.46968%0.675SS.*  trans-58.8149.3175.2179.90000110.3C370 E371S368-C370 PolarHBondContact O-N 2.84Å; S368-E371 WeakPolarHBondContact O-CB 3.09Å; S368-E371 PolarHBondContact O-N 2.86Å
369V37.6Very low32.4Very low99 Ų99116.2 Ų116.260%0.667%0.668SS**Hα-helixtrans-53.9-26.9-176.3174.50000113.3E371V369-E371 VanDerWaalsContact C-N 3.35Å
370C33.9Very low32.7Very low41 Ų41113.9 Ų113.928%0.27766%0.659SS.*Hα-helixtrans-79.8-10.8177.6-135.40000112C141 S368C141-C370 WeakPolarHBondContact CB-SG 3.08Å; C141-C370 WeakPolarHBondContact SG-CB 3.24Å; C141-C370 CovalentContact SG-SG 2.12Å; C141-C370 PolarHBondContact SG-SG 2.97Å; S368-C370 PolarHBondContact O-N 2.84Å
371E35.6Very low33.1Very low81 Ų81115 Ų11538%0.37965%0.653SS.*Hα-helixtrans-90.2-29.6173.6-92.7172.5176.500113.8N367 S368 V369 V373 N374N367-E371 HydrophobicContact CB-CB 3.88Å; N367-E371 WeakPolarHBondContact CB-OE2 3.44Å; N367-E371 PolarHBondContact OD1-OE2 2.98Å; S368-E371 WeakPolarHBondContact O-CB 3.09Å; S368-E371 PolarHBondContact O-N 2.86Å; V369-E371 VanDerWaalsContact C-N 3.35Å; E371-V373 PolarHBondContact O-N 2.81Å; E371-N374 PolarHBondContact O-N 3.21Å; E371-N374 VanDerWaalsContact O-N 3.11Å
372I38.4Very low33.5Very low106 Ų106116.1 Ų116.154%0.54464%0.644SS.*Hα-helixtrans-64.5-24.1177.9-62.2171.5000111.4
373V37.8Very low34Very low92 Ų92108.6 Ų108.656%0.55863%0.629SS**THydrogen-bonded Turntrans-79.6-27.9177.3-178.70000111.9A145 E371A145-V373 HydrophobicContact CB-CG1 4.24Å; E371-V373 PolarHBondContact O-N 2.81Å
374N33.8Very low34.5Very low86 Ų86107.4 Ų107.446%0.4662%0.619SS.*G310 helixtrans-83.9-18-176.9-111.221000114E371 K376E371-N374 PolarHBondContact O-N 3.21Å; E371-N374 VanDerWaalsContact O-N 3.11Å; N374-K376 VanDerWaalsContact C-N 3.26Å; N374-K376 PolarHBondContact O-N 2.9Å
375S34.5Very low34.8Very low100 Ų100107.4 Ų107.470%0.69961%0.613SS**G310 helixtrans-858.7-177.979.30000114.2
376K36.9Very low35.1Very low173 Ų173102.4 Ų102.475%0.75260%0.598SS**G310 helixtrans-118.99.8-178.6-79.1-167.1173.5-166.50114.2N374N374-K376 VanDerWaalsContact C-N 3.26Å; N374-K376 PolarHBondContact O-N 2.9Å
377S37.6Very low35.3Very low93 Ų93100.2 Ų100.265%0.6559%0.592SS**  trans-119.636.2178.970.90000113.3
378S32.9Very low35.9Very low186 Ų186102.2 Ų102.2100%1.30161%0.608SS**  trans-132.90168.2-65.40000110

Retrieved 378 of 378 residues in 468.8 ms (Link to these results)

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