A0A096MXQ8_PAPAN Loading...

Trace amine-associated receptor 1

AlphaFold DB , UniProt , Accession A0A096MXQ8, Species PAPAN (Papio anubis, Olive baboon), Gene TAAR1, Length 339 aa.

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

 

Download Structure   PDB   PAE   Table  
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
1I54Low69.5Low218 Ų218103.5 Ų103.5100%1.11854%0.535SS*.  0122.10-62.4169.8000106.5P3I1-P3 WeakPolarHBondContact O-CD 3.41Å
2M62Low70.4Confident119 Ų11995.7 Ų95.759%0.58650%0.496SS*.  trans-74.3121-179.2-153.5150.380.900108.4F4 V14M2-F4 VanDerWaalsContact O-CD2 3.28Å; M2-F4 WeakPolarHBondContact O-CD2 3.22Å; M2-F4 VanDerWaalsContact O-CE2 3.31Å; M2-F4 WeakPolarHBondContact O-CE2 3.41Å; M2-V14 HydrophobicContact CE-CB 4.4Å; M2-V14 HydrophobicContact CE-CG1 3.84Å; M2-V14 HydrophobicContact CE-CG2 3.63Å; M2-V14 HydrophobicContact CG-CG1 3.72Å; M2-V14 HydrophobicContact SD-CG1 4.05Å
3P75.5Confident71.3Confident43 Ų4389.1 Ų89.128%0.27946%0.463SS..  trans-72.3142.5-178.728.2-31.6000110.2I1 K15I1-P3 WeakPolarHBondContact O-CD 3.41Å; P3-K15 HydrophobicContact CB-CB 3.98Å; P3-K15 HydrophobicContact CB-CD 4.22Å; P3-K15 HydrophobicContact CB-CG 4.43Å; P3-K15 HydrophobicContact CG-CB 4.04Å; P3-K15 HydrophobicContact CG-CG 4.43Å; P3-K15 VanDerWaalsContact O-CB 3.29Å; P3-K15 WeakPolarHBondContact O-CB 3.49Å; P3-K15 PolarHBondContact O-N 3.13Å
4F80Confident72Confident63 Ų6387.2 Ų87.228%0.27646%0.457SS..BIsolated β-bridgetrans-113.8154177.7-67.6-85.2000110.3M2 H6 I9 V14M2-F4 VanDerWaalsContact O-CD2 3.28Å; M2-F4 WeakPolarHBondContact O-CD2 3.22Å; M2-F4 VanDerWaalsContact O-CE2 3.31Å; M2-F4 WeakPolarHBondContact O-CE2 3.41Å; F4-H6 VanDerWaalsContact C-N 3.29Å; F4-H6 WeakPolarHBondContact CB-O 3.37Å; F4-H6 PolarHBondContact O-N 3.46Å; F4-I9 HydrophobicContact CE2-CG1 4.47Å; F4-I9 HydrophobicContact CE2-CG2 3.87Å; F4-I9 HydrophobicContact CZ-CG2 3.88Å; F4-V14 HydrophobicContact CE1-CG2 4.22Å
5C80.1Confident72.7Confident13 Ų1384.7 Ų84.79%0.08844%0.441CS..SBendtrans-63.9-34.1176.6-55.80000112.9S12 C13 C88 Y90C5-S12 PolarHBondContact N-OG 3.22Å; C5-C13 PolarHBondContact N-O 3.43Å; C5-C13 PolarHBondContact SG-O 3.26Å; C5-C13 VanDerWaalsContact SG-O 3.34Å; C5-C88 WeakPolarHBondContact CA-SG 3.44Å; C5-C88 HydrophobicContact CB-CB 3.7Å; C5-C88 WeakPolarHBondContact CB-SG 3.34Å; C5-C88 WeakPolarHBondContact SG-CA 3.29Å; C5-C88 WeakPolarHBondContact SG-CB 3.47Å; C5-C88 CovalentContact SG-SG 2.02Å; C5-C88 PolarHBondContact SG-SG 2.78Å; C5-Y90 HydrophobicContact CB-CE1 4.21Å
6H77Confident72.9Confident62 Ų6281.6 Ų81.629%0.28743%0.425SS..SBendtrans-132.2156.8174.1-65.1-70.3000110.4F4 I8 S12F4-H6 VanDerWaalsContact C-N 3.29Å; F4-H6 WeakPolarHBondContact CB-O 3.37Å; F4-H6 PolarHBondContact O-N 3.46Å; H6-I8 PolarHBondContact O-N 2.97Å; H6-S12 PolarHBondContact N-OG 3.2Å; H6-S12 WeakPolarHBondContact O-CB 3.48Å; H6-S12 PolarHBondContact O-OG 3.11Å
7N68.6Low73.4Confident168 Ų16884.9 Ų84.990%0.89844%0.444SS*.SBendtrans-65.84.6-178.9-69.4-14.4000115.1I9N7-I9 PolarHBondContact O-N 3.35Å
8I66.3Low74Confident81 Ų8184.2 Ų84.242%0.41543%0.434SS..  trans-96.494.2178.9-52.5-173.7000109.1H6 N10 I11 S12H6-I8 PolarHBondContact O-N 2.97Å; I8-N10 VanDerWaalsContact C-N 3.34Å; I8-N10 PolarHBondContact O-N 3.2Å; I8-I11 PolarHBondContact O-N 3.16Å; I8-S12 WeakPolarHBondContact O-CB 3.36Å; I8-S12 PolarHBondContact O-N 3.06Å
9I63.5Low74.8Confident112 Ų11282.9 Ų82.957%0.57443%0.434SS*.THydrogen-bonded Turntrans-59.5-36.3-166.6-61.5169.8000113.5F4 N7F4-I9 HydrophobicContact CE2-CG1 4.47Å; F4-I9 HydrophobicContact CE2-CG2 3.87Å; F4-I9 HydrophobicContact CZ-CG2 3.88Å; N7-I9 PolarHBondContact O-N 3.35Å
10N65.1Low75.5Confident157 Ų15784.4 Ų84.484%0.8444%0.442SS*.THydrogen-bonded Turntrans-86.4-9.9-171.1-73.3-5.6000115.3I8I8-N10 VanDerWaalsContact C-N 3.34Å; I8-N10 PolarHBondContact O-N 3.2Å
11I72Confident76.2Confident103 Ų10386.2 Ų86.253%0.52845%0.452SS..THydrogen-bonded Turntrans-131.2-17.9-173-47.4174.6000111.3I8 R179I8-I11 PolarHBondContact O-N 3.16Å; I11-R179 HydrophobicContact CG2-CB 4.16Å; I11-R179 PolarHBondContact O-N 3.02Å
12S81.3Confident78Confident9 Ų978.9 Ų78.96%0.06342%0.417CS..BIsolated β-bridgetrans-74.1143.6-179.5-1780000112.2C5 H6 I8 R179C5-S12 PolarHBondContact N-OG 3.22Å; H6-S12 PolarHBondContact N-OG 3.2Å; H6-S12 WeakPolarHBondContact O-CB 3.48Å; H6-S12 PolarHBondContact O-OG 3.11Å; I8-S12 WeakPolarHBondContact O-CB 3.36Å; I8-S12 PolarHBondContact O-N 3.06Å; S12-R179 WeakPolarHBondContact CA-O 3.44Å
13C81.4Confident79.3Confident10 Ų1076.5 Ų76.57%0.06840%0.402CS..PPolyproline II helixtrans-62.9152.3167.8-53.40000111.4C5 C178 R179 G181C5-C13 PolarHBondContact N-O 3.43Å; C5-C13 PolarHBondContact SG-O 3.26Å; C5-C13 VanDerWaalsContact SG-O 3.34Å; C13-C178 VanDerWaalsContact CA-SG 3.55Å; C13-C178 HydrophobicContact CB-CB 4.08Å; C13-C178 WeakPolarHBondContact CB-SG 3.18Å; C13-C178 WeakPolarHBondContact SG-CB 3.41Å; C13-C178 PolarHBondContact SG-O 2.9Å; C13-C178 VanDerWaalsContact SG-O 3.33Å; C13-C178 CovalentContact SG-SG 2.02Å; C13-C178 PolarHBondContact SG-SG 3.47Å; C13-R179 PolarHBondContact N-O 3.02Å; C13-G181 WeakPolarHBondContact SG-CA 3.33Å; C13-G181 PolarHBondContact SG-N 3.37Å
14V81.7Confident80.2Confident63 Ų6376.9 Ų76.938%0.38241%0.408SS..BIsolated β-bridgetrans-79.4124.4177.7178.40000109M2 F4M2-V14 HydrophobicContact CE-CB 4.4Å; M2-V14 HydrophobicContact CE-CG1 3.84Å; M2-V14 HydrophobicContact CE-CG2 3.63Å; M2-V14 HydrophobicContact CG-CG1 3.72Å; M2-V14 HydrophobicContact SD-CG1 4.05Å; F4-V14 HydrophobicContact CE1-CG2 4.22Å
15K81.5Confident80.8Confident50 Ų5077.4 Ų77.422%0.21742%0.42CS..PPolyproline II helixtrans-74146.8175.7-177173.9179151.70109.9P3 E86P3-K15 HydrophobicContact CB-CB 3.98Å; P3-K15 HydrophobicContact CB-CD 4.22Å; P3-K15 HydrophobicContact CB-CG 4.43Å; P3-K15 HydrophobicContact CG-CB 4.04Å; P3-K15 HydrophobicContact CG-CG 4.43Å; P3-K15 VanDerWaalsContact O-CB 3.29Å; P3-K15 WeakPolarHBondContact O-CB 3.49Å; P3-K15 PolarHBondContact O-N 3.13Å; K15-E86 WeakPolarHBondContact CE-OE2 3.5Å; K15-E86 IonicContact NZ-OE2 2.68Å; K15-E86 PolarHBondContact NZ-OE2 2.86Å
16N76.7Confident81.4Confident34 Ų3478.8 Ų78.818%0.18243%0.426CS..PPolyproline II helixtrans-64.7140.1177.2-134.2-8.9000111.6W18 E86 R87N16-W18 HydrophobicContact CB-CD2 4.48Å; N16-W18 HydrophobicContact CB-CG 4.41Å; N16-W18 VanDerWaalsContact ND2-CD2 3.3Å; N16-W18 WeakPolarHBondContact ND2-CZ2 3.15Å; N16-W18 PolarHBondContact ND2-NE1 2.84Å; N16-W18 VanDerWaalsContact ND2-NE1 3.11Å; N16-W18 PolarHBondContact OD1-NE1 3.24Å; N16-E86 PolarHBondContact N-O 2.65Å; N16-E86 VanDerWaalsContact N-O 3.11Å; N16-R87 HydrophobicContact CB-CB 4.13Å; N16-R87 HydrophobicContact CB-CG 4.23Å
17N81.2Confident82.2Confident138 Ų13878.7 Ų78.774%0.73842%0.424SS*.  trans-101.638.2178.8-161.142.9000112
18W84.1Confident83.5Confident72 Ų7274.5 Ų74.527%0.27341%0.408SS..  trans-67.9146.1177.4-69-5.9000110.9N16 V22 L26 S84 A85N16-W18 HydrophobicContact CB-CD2 4.48Å; N16-W18 HydrophobicContact CB-CG 4.41Å; N16-W18 VanDerWaalsContact ND2-CD2 3.3Å; N16-W18 WeakPolarHBondContact ND2-CZ2 3.15Å; N16-W18 PolarHBondContact ND2-NE1 2.84Å; N16-W18 VanDerWaalsContact ND2-NE1 3.11Å; N16-W18 PolarHBondContact OD1-NE1 3.24Å; W18-V22 HydrophobicContact CB-CB 4.35Å; W18-V22 HydrophobicContact CB-CG1 4.14Å; W18-V22 HydrophobicContact CD2-CG1 4.02Å; W18-V22 HydrophobicContact CE3-CG1 4.21Å; W18-V22 HydrophobicContact CG-CG1 4.04Å; W18-L26 HydrophobicContact CD2-CD1 4.08Å; W18-L26 HydrophobicContact CE3-CD1 3.38Å; W18-L26 HydrophobicContact CH2-CD1 3.33Å; W18-L26 HydrophobicContact CZ2-CD1 3.99Å; W18-L26 HydrophobicContact CZ3-CB 4.14Å; W18-L26 HydrophobicContact CZ3-CD1 2.96Å; W18-L26 HydrophobicContact CZ3-CG 4.09Å; W18-S84 VanDerWaalsContact CH2-O 3.24Å; W18-S84 WeakPolarHBondContact CH2-O 3.32Å; W18-A85 HydrophobicContact CZ3-CB 4.48Å; W18-A85 WeakPolarHBondContact CZ3-O 3.33Å
19S89.4Confident84.9Confident61 Ų6175.2 Ų75.243%0.42741%0.412SS..  trans-62155168.9690000109.8D21 V22 R23S19-D21 PolarHBondContact O-N 3.19Å; S19-V22 PolarHBondContact O-N 2.66Å; S19-V22 VanDerWaalsContact OG-CG2 3.3Å; S19-V22 WeakPolarHBondContact OG-CG2 3.06Å; S19-V22 PolarHBondContact OG-N 3.35Å; S19-R23 PolarHBondContact O-N 3.01Å
20N88.9Confident86.4Confident111 Ų11170.6 Ų70.659%0.59439%0.388SS*.Hα-helixtrans-56.4-36.5177.8-72.9-28.7000111.8R23 A24N20-R23 PolarHBondContact O-N 3.34Å; N20-R23 PolarHBondContact OD1-NH2 3.45Å; N20-A24 VanDerWaalsContact O-CB 3.28Å; N20-A24 WeakPolarHBondContact O-CB 3.37Å; N20-A24 PolarHBondContact O-N 3.46Å
21D91Very high87.9Confident123 Ų12366 Ų6666%0.65837%0.366SS*.Hα-helixtrans-66.9-43.5179.4-51-47000112.4S19 A24 S25S19-D21 PolarHBondContact O-N 3.19Å; D21-A24 PolarHBondContact O-N 3.23Å; D21-S25 WeakPolarHBondContact O-CB 3.46Å; D21-S25 PolarHBondContact O-N 3.4Å; D21-S25 PolarHBondContact O-OG 2.79Å
22V90.5Very high89.1Confident64 Ų6466.1 Ų66.139%0.38837%0.367SS..Hα-helixtrans-64.7-44.8177.4169.60000110.1W18 S19 S25 L26W18-V22 HydrophobicContact CB-CB 4.35Å; W18-V22 HydrophobicContact CB-CG1 4.14Å; W18-V22 HydrophobicContact CD2-CG1 4.02Å; W18-V22 HydrophobicContact CE3-CG1 4.21Å; W18-V22 HydrophobicContact CG-CG1 4.04Å; S19-V22 PolarHBondContact O-N 2.66Å; S19-V22 VanDerWaalsContact OG-CG2 3.3Å; S19-V22 WeakPolarHBondContact OG-CG2 3.06Å; S19-V22 PolarHBondContact OG-N 3.35Å; V22-S25 PolarHBondContact O-N 2.88Å; V22-L26 HydrophobicContact CG1-CD1 3.65Å; V22-L26 WeakPolarHBondContact O-CB 3.29Å; V22-L26 WeakPolarHBondContact O-CD1 3.42Å; V22-L26 WeakPolarHBondContact O-CG 3.09Å; V22-L26 PolarHBondContact O-N 3.27Å
23R90.5Very high89.8Confident69 Ų6966.8 Ų66.826%0.2637%0.369SS..Hα-helixtrans-62.9-45.9177.7178170.453.2174.5-1.7112.1S19 N20 S25 L26 Y27 E86S19-R23 PolarHBondContact O-N 3.01Å; N20-R23 PolarHBondContact O-N 3.34Å; N20-R23 PolarHBondContact OD1-NH2 3.45Å; R23-S25 VanDerWaalsContact C-N 3.31Å; R23-S25 PolarHBondContact O-N 2.97Å; R23-L26 PolarHBondContact O-N 3.49Å; R23-Y27 HydrophobicContact CG-CD2 3.72Å; R23-Y27 HydrophobicContact CG-CE2 3.6Å; R23-Y27 VanDerWaalsContact O-CD2 3.28Å; R23-Y27 WeakPolarHBondContact O-CD2 3.45Å; R23-Y27 PolarHBondContact O-N 2.88Å; R23-E86 WeakPolarHBondContact CD-OE1 3.39Å; R23-E86 IonicContact CZ-OE1 2.69Å; R23-E86 IonicContact NE-OE1 3.93Å; R23-E86 IonicContact NH1-OE1 3.11Å; R23-E86 PolarHBondContact NH1-OE1 2.89Å; R23-E86 VanDerWaalsContact NH1-OE1 3.11Å; R23-E86 IonicContact NH1-OE2 3.45Å; R23-E86 PolarHBondContact NH1-OE2 3.01Å
24A92.8Very high90.6Very high51 Ų5167 Ų6742%0.42137%0.369SS..Hα-helixtrans-61.3-40.9176.500000111.7N20 D21 S28N20-A24 VanDerWaalsContact O-CB 3.28Å; N20-A24 WeakPolarHBondContact O-CB 3.37Å; N20-A24 PolarHBondContact O-N 3.46Å; D21-A24 PolarHBondContact O-N 3.23Å; A24-S28 WeakPolarHBondContact O-CB 3.41Å; A24-S28 PolarHBondContact O-N 3.04Å; A24-S28 PolarHBondContact O-OG 3.34Å
25S93.3Very high91.3Very high74 Ų7468.5 Ų68.552%0.51738%0.375SS..Hα-helixtrans-62.5-42.4176-59.70000111.9D21 V22 R23 S28 L29D21-S25 WeakPolarHBondContact O-CB 3.46Å; D21-S25 PolarHBondContact O-N 3.4Å; D21-S25 PolarHBondContact O-OG 2.79Å; V22-S25 PolarHBondContact O-N 2.88Å; R23-S25 VanDerWaalsContact C-N 3.31Å; R23-S25 PolarHBondContact O-N 2.97Å; S25-S28 PolarHBondContact O-N 3.41Å; S25-L29 WeakPolarHBondContact O-CB 3.41Å; S25-L29 PolarHBondContact O-N 2.69Å
26L92.3Very high91.9Very high42 Ų4268.6 Ų68.622%0.2238%0.38CS..Hα-helixtrans-70.4-42.4-179.2-73.6162.9000112.3W18 V22 R23 S28 L29 M30W18-L26 HydrophobicContact CD2-CD1 4.08Å; W18-L26 HydrophobicContact CE3-CD1 3.38Å; W18-L26 HydrophobicContact CH2-CD1 3.33Å; W18-L26 HydrophobicContact CZ2-CD1 3.99Å; W18-L26 HydrophobicContact CZ3-CB 4.14Å; W18-L26 HydrophobicContact CZ3-CD1 2.96Å; W18-L26 HydrophobicContact CZ3-CG 4.09Å; V22-L26 HydrophobicContact CG1-CD1 3.65Å; V22-L26 WeakPolarHBondContact O-CB 3.29Å; V22-L26 WeakPolarHBondContact O-CD1 3.42Å; V22-L26 WeakPolarHBondContact O-CG 3.09Å; V22-L26 PolarHBondContact O-N 3.27Å; R23-L26 PolarHBondContact O-N 3.49Å; L26-S28 VanDerWaalsContact C-N 3.33Å; L26-S28 PolarHBondContact O-N 3Å; L26-L29 PolarHBondContact O-N 3.22Å; L26-M30 WeakPolarHBondContact O-CB 3.44Å; L26-M30 VanDerWaalsContact O-CG 3.26Å; L26-M30 WeakPolarHBondContact O-CG 3.22Å; L26-M30 PolarHBondContact O-N 3.06Å
27Y94.9Very high92.9Very high60 Ų6067 Ų6724%0.23537%0.371CS..Hα-helixtrans-58.1-46.5170.1-84.1-61.7000111.7R23 L29 M30 V31 M81 A85 E86R23-Y27 HydrophobicContact CG-CD2 3.72Å; R23-Y27 HydrophobicContact CG-CE2 3.6Å; R23-Y27 VanDerWaalsContact O-CD2 3.28Å; R23-Y27 WeakPolarHBondContact O-CD2 3.45Å; R23-Y27 PolarHBondContact O-N 2.88Å; Y27-L29 PolarHBondContact O-N 3.21Å; Y27-M30 PolarHBondContact O-N 3.37Å; Y27-V31 WeakPolarHBondContact O-CB 3.24Å; Y27-V31 WeakPolarHBondContact O-CG2 3.36Å; Y27-V31 PolarHBondContact O-N 3.18Å; Y27-M81 HydrophobicContact CD1-CE 4.05Å; Y27-M81 HydrophobicContact CD1-CG 3.76Å; Y27-M81 HydrophobicContact CD1-SD 3.78Å; Y27-M81 HydrophobicContact CE1-CE 4.15Å; Y27-M81 HydrophobicContact CE1-CG 3.92Å; Y27-M81 HydrophobicContact CE1-SD 4.31Å; Y27-A85 HydrophobicContact CD1-CB 4.33Å; Y27-A85 HydrophobicContact CD2-CB 4.29Å; Y27-A85 HydrophobicContact CE1-CB 3.8Å; Y27-A85 HydrophobicContact CE2-CB 3.76Å; Y27-A85 VanDerWaalsContact CZ-CB 3.49Å; Y27-E86 VanDerWaalsContact OH-CG 3.32Å; Y27-E86 WeakPolarHBondContact OH-CG 3.36Å; Y27-E86 PolarHBondContact OH-OE1 3.16Å
28S95.1Very high93.6Very high81 Ų8162.2 Ų62.257%0.56635%0.346SS*.Hα-helixtrans-60.7-45.2-179.5-580000111.8A24 S25 L26 L32A24-S28 WeakPolarHBondContact O-CB 3.41Å; A24-S28 PolarHBondContact O-N 3.04Å; A24-S28 PolarHBondContact O-OG 3.34Å; S25-S28 PolarHBondContact O-N 3.41Å; L26-S28 VanDerWaalsContact C-N 3.33Å; L26-S28 PolarHBondContact O-N 3Å; S28-L32 WeakPolarHBondContact O-CB 3.21Å; S28-L32 PolarHBondContact O-N 3.39Å
29L95.4Very high94.2Very high96 Ų9662.8 Ų62.850%0.50336%0.357SS..Hα-helixtrans-64.1-47.8177.4179.263.4000112S25 L26 Y27 L32 I33S25-L29 WeakPolarHBondContact O-CB 3.41Å; S25-L29 PolarHBondContact O-N 2.69Å; L26-L29 PolarHBondContact O-N 3.22Å; Y27-L29 PolarHBondContact O-N 3.21Å; L29-L32 WeakPolarHBondContact O-CB 3.42Å; L29-L32 PolarHBondContact O-N 3.38Å; L29-I33 HydrophobicContact CD1-CD1 4.37Å; L29-I33 HydrophobicContact CG-CD1 4.16Å; L29-I33 WeakPolarHBondContact O-CG1 3.28Å; L29-I33 PolarHBondContact O-N 2.85Å
30M95.7Very high94.4Very high15 Ų1560.5 Ų60.57%0.07434%0.343CS..Hα-helixtrans-65.5-41-179.4-71.2176-176.500111.7L26 Y27 L32 I33 I34 M81 W291L26-M30 WeakPolarHBondContact O-CB 3.44Å; L26-M30 VanDerWaalsContact O-CG 3.26Å; L26-M30 WeakPolarHBondContact O-CG 3.22Å; L26-M30 PolarHBondContact O-N 3.06Å; Y27-M30 PolarHBondContact O-N 3.37Å; M30-L32 VanDerWaalsContact C-N 3.33Å; M30-L32 PolarHBondContact O-N 2.97Å; M30-I33 PolarHBondContact O-N 3.05Å; M30-I34 VanDerWaalsContact O-CG1 3.22Å; M30-I34 WeakPolarHBondContact O-CG1 3.29Å; M30-I34 PolarHBondContact O-N 3.19Å; M30-M81 HydrophobicContact CB-CB 4.28Å; M30-M81 HydrophobicContact CB-CG 3.71Å; M30-M81 HydrophobicContact CB-SD 3.83Å; M30-M81 HydrophobicContact CG-CG 4.32Å; M30-M81 HydrophobicContact SD-CB 4.03Å; M30-M81 HydrophobicContact SD-CG 3.69Å; M30-W291 HydrophobicContact CB-CH2 3.62Å; M30-W291 HydrophobicContact CB-CZ2 4.02Å; M30-W291 HydrophobicContact CB-CZ3 4.02Å; M30-W291 HydrophobicContact CE-CD2 4.24Å; M30-W291 HydrophobicContact CE-CG 4.38Å; M30-W291 HydrophobicContact CE-CZ2 4.23Å; M30-W291 HydrophobicContact CG-CD2 4.18Å; M30-W291 HydrophobicContact CG-CE3 4.19Å; M30-W291 HydrophobicContact CG-CH2 3.65Å; M30-W291 HydrophobicContact CG-CZ2 3.64Å; M30-W291 HydrophobicContact CG-CZ3 3.93Å; M30-W291 HydrophobicContact SD-CD2 4.47Å; M30-W291 HydrophobicContact SD-CH2 4.13Å; M30-W291 HydrophobicContact SD-CZ2 3.51Å; M30-W291 VanDerWaalsContact SD-CZ2 3.51Å
31V97Very high94.8Very high60 Ų6055.2 Ų55.236%0.36432%0.315SS..Hα-helixtrans-60.9-42.9174168.70000110.9Y27 I33 I34 L35 M81Y27-V31 WeakPolarHBondContact O-CB 3.24Å; Y27-V31 WeakPolarHBondContact O-CG2 3.36Å; Y27-V31 PolarHBondContact O-N 3.18Å; V31-I33 VanDerWaalsContact C-N 3.34Å; V31-I33 PolarHBondContact O-N 3.16Å; V31-I34 PolarHBondContact O-N 3.14Å; V31-L35 HydrophobicContact CG1-CD1 3.79Å; V31-L35 HydrophobicContact CG1-CG 4.16Å; V31-L35 WeakPolarHBondContact O-CB 3.45Å; V31-L35 VanDerWaalsContact O-CG 3.31Å; V31-L35 WeakPolarHBondContact O-CG 3Å; V31-L35 PolarHBondContact O-N 3.26Å; V31-M81 HydrophobicContact CG2-CE 4.28Å; V31-M81 HydrophobicContact CG2-SD 3.67Å
32L96.4Very high95Very high106 Ų10653.4 Ų53.456%0.55530%0.304SS*.Hα-helixtrans-60.3-43.6176.3179.665000111.8S28 L29 M30 T36S28-L32 WeakPolarHBondContact O-CB 3.21Å; S28-L32 PolarHBondContact O-N 3.39Å; L29-L32 WeakPolarHBondContact O-CB 3.42Å; L29-L32 PolarHBondContact O-N 3.38Å; M30-L32 VanDerWaalsContact C-N 3.33Å; M30-L32 PolarHBondContact O-N 2.97Å; L32-T36 WeakPolarHBondContact O-CB 3.11Å; L32-T36 PolarHBondContact O-N 3.21Å; L32-T36 PolarHBondContact O-OG1 3.38Å
33I96Very high95.2Very high23 Ų2351.7 Ų51.712%0.11829%0.293CS..Hα-helixtrans-61.3-47.3175.8-67.8165.7000110.6L29 M30 V31 T36 T37 W291 L295L29-I33 HydrophobicContact CD1-CD1 4.37Å; L29-I33 HydrophobicContact CG-CD1 4.16Å; L29-I33 WeakPolarHBondContact O-CG1 3.28Å; L29-I33 PolarHBondContact O-N 2.85Å; M30-I33 PolarHBondContact O-N 3.05Å; V31-I33 VanDerWaalsContact C-N 3.34Å; V31-I33 PolarHBondContact O-N 3.16Å; I33-T36 PolarHBondContact O-N 3.35Å; I33-T37 WeakPolarHBondContact O-CB 3.3Å; I33-T37 PolarHBondContact O-N 3.11Å; I33-T37 PolarHBondContact O-OG1 3.18Å; I33-W291 HydrophobicContact CB-CZ3 4.31Å; I33-W291 HydrophobicContact CD1-CE3 4.25Å; I33-W291 HydrophobicContact CD1-CZ3 4.46Å; I33-W291 HydrophobicContact CG2-CE3 4.39Å; I33-W291 HydrophobicContact CG2-CZ3 4.04Å; I33-L295 HydrophobicContact CD1-CD2 3.94Å; I33-L295 HydrophobicContact CG1-CD2 3.98Å; I33-L295 HydrophobicContact CG2-CD2 4.01Å
34I97.6Very high95.4Very high13 Ų1348.4 Ų48.47%0.06728%0.281CS..Hα-helixtrans-59.5-52.3178.9-69.5164.7000110.6M30 V31 T36 T37 L38 M77 P78 M81 W291M30-I34 VanDerWaalsContact O-CG1 3.22Å; M30-I34 WeakPolarHBondContact O-CG1 3.29Å; M30-I34 PolarHBondContact O-N 3.19Å; V31-I34 PolarHBondContact O-N 3.14Å; I34-T36 VanDerWaalsContact C-N 3.33Å; I34-T36 PolarHBondContact O-N 3.4Å; I34-T37 WeakPolarHBondContact O-CB 3.43Å; I34-T37 PolarHBondContact O-N 3.12Å; I34-T37 VanDerWaalsContact O-N 3.16Å; I34-L38 HydrophobicContact CG2-CD1 3.81Å; I34-L38 HydrophobicContact CG2-CG 4.3Å; I34-L38 WeakPolarHBondContact O-CG 3.45Å; I34-L38 PolarHBondContact O-N 2.8Å; I34-M77 HydrophobicContact CD1-CB 4.01Å; I34-M77 HydrophobicContact CG1-CB 3.59Å; I34-M77 HydrophobicContact CG1-SD 4.18Å; I34-P78 HydrophobicContact CD1-CG 4.36Å; I34-P78 HydrophobicContact CG2-CG 4.49Å; I34-M81 HydrophobicContact CD1-CB 4.38Å; I34-M81 HydrophobicContact CD1-SD 4Å; I34-W291 HydrophobicContact CD1-CH2 4.21Å; I34-W291 HydrophobicContact CG1-CH2 4.31Å
35L96.9Very high95.6Very high96 Ų9647.4 Ų47.450%0.50327%0.268SS..Hα-helixtrans-60.8-43-178.9-71175.7000111.6V31 T37 L38 V39V31-L35 HydrophobicContact CG1-CD1 3.79Å; V31-L35 HydrophobicContact CG1-CG 4.16Å; V31-L35 WeakPolarHBondContact O-CB 3.45Å; V31-L35 VanDerWaalsContact O-CG 3.31Å; V31-L35 WeakPolarHBondContact O-CG 3Å; V31-L35 PolarHBondContact O-N 3.26Å; L35-T37 VanDerWaalsContact C-N 3.32Å; L35-T37 PolarHBondContact O-N 2.9Å; L35-L38 PolarHBondContact O-N 3.32Å; L35-V39 WeakPolarHBondContact O-CB 3.07Å; L35-V39 VanDerWaalsContact O-CG2 3.3Å; L35-V39 WeakPolarHBondContact O-CG2 3.49Å; L35-V39 PolarHBondContact O-N 3.29Å
36T94.9Very high95.6Very high52 Ų5246.4 Ų46.432%0.31926%0.258SS..Hα-helixtrans-62.4-42177.1-55.90000111.1L32 I33 I34 G40 T298 M302L32-T36 WeakPolarHBondContact O-CB 3.11Å; L32-T36 PolarHBondContact O-N 3.21Å; L32-T36 PolarHBondContact O-OG1 3.38Å; I33-T36 PolarHBondContact O-N 3.35Å; I34-T36 VanDerWaalsContact C-N 3.33Å; I34-T36 PolarHBondContact O-N 3.4Å; T36-G40 WeakPolarHBondContact O-CA 3.3Å; T36-G40 PolarHBondContact O-N 3.42Å; T36-T298 HydrophobicContact CG2-CG2 3.65Å; T36-M302 HydrophobicContact CG2-CE 3.82Å
37T96Very high95.6Very high0 Ų044.4 Ų44.40%025%0.248CC..Hα-helixtrans-64.2-46.8178-55.40000111.5I33 I34 L35 N41 M77 T298I33-T37 WeakPolarHBondContact O-CB 3.3Å; I33-T37 PolarHBondContact O-N 3.11Å; I33-T37 PolarHBondContact O-OG1 3.18Å; I34-T37 WeakPolarHBondContact O-CB 3.43Å; I34-T37 PolarHBondContact O-N 3.12Å; I34-T37 VanDerWaalsContact O-N 3.16Å; L35-T37 VanDerWaalsContact C-N 3.32Å; L35-T37 PolarHBondContact O-N 2.9Å; T37-N41 WeakPolarHBondContact O-CB 3.36Å; T37-N41 PolarHBondContact O-N 2.68Å; T37-N41 VanDerWaalsContact O-N 3.12Å; T37-N41 PolarHBondContact O-ND2 3.01Å; T37-M77 HydrophobicContact CG2-CE 3.92Å; T37-M77 HydrophobicContact CG2-SD 4.49Å; T37-T298 PolarHBondContact OG1-OG1 3.08Å
38L97.6Very high95.5Very high38 Ų3841.5 Ų41.520%0.19924%0.237CC..Hα-helixtrans-64.1-53179.9-70.4175.2000111.6I34 L35 L42 F70 C74I34-L38 HydrophobicContact CG2-CD1 3.81Å; I34-L38 HydrophobicContact CG2-CG 4.3Å; I34-L38 WeakPolarHBondContact O-CG 3.45Å; I34-L38 PolarHBondContact O-N 2.8Å; L35-L38 PolarHBondContact O-N 3.32Å; L38-L42 WeakPolarHBondContact O-CB 3.31Å; L38-L42 PolarHBondContact O-N 3.42Å; L38-F70 HydrophobicContact CB-CE2 4.36Å; L38-F70 HydrophobicContact CD2-CD2 3.86Å; L38-F70 HydrophobicContact CD2-CE2 3.77Å; L38-F70 HydrophobicContact CD2-CG 4.46Å; L38-F70 HydrophobicContact CD2-CZ 4.3Å; L38-C74 HydrophobicContact CD2-CB 3.87Å
39V95.8Very high95.5Very high84 Ų8440.6 Ų40.651%0.50923%0.23SC..Hα-helixtrans-65.1-46.1-177.6173.30000110.7L35 N41 L42 I43L35-V39 WeakPolarHBondContact O-CB 3.07Å; L35-V39 VanDerWaalsContact O-CG2 3.3Å; L35-V39 WeakPolarHBondContact O-CG2 3.49Å; L35-V39 PolarHBondContact O-N 3.29Å; V39-N41 PolarHBondContact O-N 2.89Å; V39-L42 PolarHBondContact O-N 2.9Å; V39-I43 HydrophobicContact CG1-CD1 3.78Å; V39-I43 WeakPolarHBondContact O-CD1 3.43Å; V39-I43 VanDerWaalsContact O-CG1 3.24Å; V39-I43 WeakPolarHBondContact O-CG1 3.17Å; V39-I43 PolarHBondContact O-N 2.9Å
40G94.4Very high95.3Very high13 Ų1338.5 Ų38.513%0.13422%0.217CC..Hα-helixtrans-59.4-49.7-17900000112.3T36 I43 V44T36-G40 WeakPolarHBondContact O-CA 3.3Å; T36-G40 PolarHBondContact O-N 3.42Å; G40-I43 PolarHBondContact O-N 3.16Å; G40-V44 WeakPolarHBondContact O-CG2 3.31Å; G40-V44 PolarHBondContact O-N 3.33Å
41N96.4Very high95.1Very high0 Ų037.8 Ų37.80%021%0.214CC..Hα-helixtrans-72.8-33.4-179.2-72.2-65.7000112.6T37 V39 I43 V44 I45 A66 F70 S297 P301T37-N41 WeakPolarHBondContact O-CB 3.36Å; T37-N41 PolarHBondContact O-N 2.68Å; T37-N41 VanDerWaalsContact O-N 3.12Å; T37-N41 PolarHBondContact O-ND2 3.01Å; V39-N41 PolarHBondContact O-N 2.89Å; N41-I43 VanDerWaalsContact C-N 3.31Å; N41-I43 PolarHBondContact O-N 3.01Å; N41-V44 WeakPolarHBondContact O-CB 3.47Å; N41-V44 PolarHBondContact O-N 2.88Å; N41-V44 VanDerWaalsContact O-N 3.13Å; N41-I45 WeakPolarHBondContact O-CG1 3.42Å; N41-I45 PolarHBondContact O-N 3.2Å; N41-A66 HydrophobicContact CB-CB 4.42Å; N41-F70 HydrophobicContact CB-CB 4.08Å; N41-S297 PolarHBondContact ND2-O 3.44Å; N41-P301 WeakPolarHBondContact OD1-CG 3.47Å
42L96.1Very high94.6Very high84 Ų8440.6 Ų40.644%0.4422%0.221SC..Hα-helixtrans-60.4-41.5172.2-178.262.1000111.6L38 V39 V44 I45 V46 F70L38-L42 WeakPolarHBondContact O-CB 3.31Å; L38-L42 PolarHBondContact O-N 3.42Å; V39-L42 PolarHBondContact O-N 2.9Å; L42-V44 VanDerWaalsContact C-N 3.3Å; L42-V44 PolarHBondContact O-N 2.77Å; L42-I45 PolarHBondContact O-N 3.34Å; L42-V46 HydrophobicContact CD1-CG2 4.19Å; L42-V46 HydrophobicContact CG-CG2 4.39Å; L42-V46 WeakPolarHBondContact O-CB 3.47Å; L42-V46 VanDerWaalsContact O-CG2 3.3Å; L42-V46 WeakPolarHBondContact O-CG2 3.23Å; L42-V46 PolarHBondContact O-N 2.92Å; L42-F70 HydrophobicContact CB-CD2 4.28Å; L42-F70 HydrophobicContact CB-CE2 4.21Å
43I93.9Very high94.2Very high29 Ų2939.2 Ų39.215%0.14921%0.212CC..Hα-helixtrans-61.8-39.2175.4-69.5163.7000111.1V39 G40 N41 S47 F311 L315 I318V39-I43 HydrophobicContact CG1-CD1 3.78Å; V39-I43 WeakPolarHBondContact O-CD1 3.43Å; V39-I43 VanDerWaalsContact O-CG1 3.24Å; V39-I43 WeakPolarHBondContact O-CG1 3.17Å; V39-I43 PolarHBondContact O-N 2.9Å; G40-I43 PolarHBondContact O-N 3.16Å; N41-I43 VanDerWaalsContact C-N 3.31Å; N41-I43 PolarHBondContact O-N 3.01Å; I43-S47 WeakPolarHBondContact O-CB 3.41Å; I43-S47 PolarHBondContact O-N 3.27Å; I43-S47 PolarHBondContact O-OG 3.4Å; I43-F311 HydrophobicContact CG2-CE2 4.04Å; I43-F311 HydrophobicContact CG2-CZ 3.83Å; I43-L315 HydrophobicContact CD1-CD1 3.85Å; I43-L315 HydrophobicContact CG2-CD1 3.91Å; I43-I318 HydrophobicContact CG2-CD1 4.07Å
44V94.6Very high93.9Very high0 Ų038.1 Ų38.10%021%0.207CC..Hα-helixtrans-63-49.8176.1177.40000110.9G40 N41 L42 S47 I48 I62 A66 P301 Y304 F311G40-V44 WeakPolarHBondContact O-CG2 3.31Å; G40-V44 PolarHBondContact O-N 3.33Å; N41-V44 WeakPolarHBondContact O-CB 3.47Å; N41-V44 PolarHBondContact O-N 2.88Å; N41-V44 VanDerWaalsContact O-N 3.13Å; L42-V44 VanDerWaalsContact C-N 3.3Å; L42-V44 PolarHBondContact O-N 2.77Å; V44-S47 PolarHBondContact O-N 3.49Å; V44-I48 HydrophobicContact CG1-CD1 3.83Å; V44-I48 WeakPolarHBondContact O-CG1 3.33Å; V44-I48 PolarHBondContact O-N 3.46Å; V44-I62 HydrophobicContact CG1-CG2 3.99Å; V44-A66 HydrophobicContact CB-CB 3.91Å; V44-A66 HydrophobicContact CG1-CB 3.65Å; V44-P301 HydrophobicContact CG2-CB 4.19Å; V44-P301 HydrophobicContact CG2-CG 4.26Å; V44-Y304 HydrophobicContact CG1-CD2 4.26Å; V44-Y304 HydrophobicContact CG1-CE2 4.2Å; V44-Y304 HydrophobicContact CG2-CD2 3.74Å; V44-Y304 HydrophobicContact CG2-CE2 4.19Å; V44-F311 HydrophobicContact CB-CE2 4.23Å; V44-F311 HydrophobicContact CG2-CD2 4.43Å; V44-F311 HydrophobicContact CG2-CE2 3.46Å; V44-F311 VanDerWaalsContact CG2-CE2 3.46Å; V44-F311 HydrophobicContact CG2-CZ 3.82Å
45I96.4Very high93.5Very high29 Ų2941.2 Ų41.215%0.14922%0.22CC..Hα-helixtrans-55.4-58.2177.5-67.1165.3000109.3N41 L42 S47 I48 S49 A66 F70N41-I45 WeakPolarHBondContact O-CG1 3.42Å; N41-I45 PolarHBondContact O-N 3.2Å; L42-I45 PolarHBondContact O-N 3.34Å; I45-S47 VanDerWaalsContact C-N 3.3Å; I45-S47 PolarHBondContact O-N 2.75Å; I45-I48 PolarHBondContact O-N 2.92Å; I45-I48 VanDerWaalsContact O-N 3.16Å; I45-S49 PolarHBondContact O-N 3.44Å; I45-S49 PolarHBondContact O-OG 3.24Å; I45-A66 HydrophobicContact CG1-CB 3.89Å; I45-F70 HydrophobicContact CD1-CB 4.09Å; I45-F70 HydrophobicContact CD1-CG 4.4Å
46V94.1Very high93.1Very high53 Ų5339.1 Ų39.132%0.32121%0.212SC..Hα-helixtrans-56.6-43.3-179.31710000111.7L42 H50 I318 I323L42-V46 HydrophobicContact CD1-CG2 4.19Å; L42-V46 HydrophobicContact CG-CG2 4.39Å; L42-V46 WeakPolarHBondContact O-CB 3.47Å; L42-V46 VanDerWaalsContact O-CG2 3.3Å; L42-V46 WeakPolarHBondContact O-CG2 3.23Å; L42-V46 PolarHBondContact O-N 2.92Å; V46-H50 WeakPolarHBondContact O-CB 3.44Å; V46-H50 PolarHBondContact O-N 3.29Å; V46-I318 HydrophobicContact CG1-CD1 4.05Å; V46-I318 HydrophobicContact CG1-CG1 4.48Å; V46-I323 HydrophobicContact CG1-CD1 3.73Å
47S92.4Very high92.9Very high0 Ų038.3 Ų38.30%021%0.207CC..Hα-helixtrans-59.6-50.8179-63.70000111.1I43 V44 I45 F51 I318I43-S47 WeakPolarHBondContact O-CB 3.41Å; I43-S47 PolarHBondContact O-N 3.27Å; I43-S47 PolarHBondContact O-OG 3.4Å; V44-S47 PolarHBondContact O-N 3.49Å; I45-S47 VanDerWaalsContact C-N 3.3Å; I45-S47 PolarHBondContact O-N 2.75Å; S47-F51 VanDerWaalsContact O-CD2 3.22Å; S47-F51 WeakPolarHBondContact O-CD2 3.27Å; S47-F51 PolarHBondContact O-N 2.82Å; S47-F51 VanDerWaalsContact O-N 3.14Å; S47-I318 WeakPolarHBondContact OG-CD1 3.3Å
48I93.3Very high92.6Very high0 Ų038.6 Ų38.60%021%0.209CC..Hα-helixtrans-71.4-38.8-175.6-62.6170000111.1V44 I45 L54 H55 N59 I62 H63 W310V44-I48 HydrophobicContact CG1-CD1 3.83Å; V44-I48 WeakPolarHBondContact O-CG1 3.33Å; V44-I48 PolarHBondContact O-N 3.46Å; I45-I48 PolarHBondContact O-N 2.92Å; I45-I48 VanDerWaalsContact O-N 3.16Å; I48-L54 HydrophobicContact CG1-CD1 4.4Å; I48-H55 PolarHBondContact O-CD2 3.5Å; I48-H55 PolarHBondContact O-NE2 3.12Å; I48-H55 VanDerWaalsContact O-NE2 3.11Å; I48-N59 HydrophobicContact CD1-CB 4.38Å; I48-N59 HydrophobicContact CG2-CB 4.13Å; I48-I62 HydrophobicContact CD1-CB 4.18Å; I48-I62 HydrophobicContact CD1-CG2 3.8Å; I48-H63 HydrophobicContact CB-CB 4.26Å; I48-H63 HydrophobicContact CD1-CB 4.05Å; I48-H63 HydrophobicContact CG2-CB 3.94Å; I48-W310 HydrophobicContact CD1-CH2 4.26Å; I48-W310 HydrophobicContact CG1-CH2 4.04Å; I48-W310 HydrophobicContact CG1-CZ3 4.34Å
49S93.7Very high92.3Very high61 Ų6137.3 Ų37.343%0.42720%0.202SC..Hα-helixtrans-68.2-33.5178-42.70000113I45 H63I45-S49 PolarHBondContact O-N 3.44Å; I45-S49 PolarHBondContact O-OG 3.24Å; S49-H63 PolarHBondContact OG-CD2 3.1Å; S49-H63 PolarHBondContact OG-NE2 3.45Å
50H91.6Very high92.2Very high52 Ų5238.2 Ų38.224%0.24120%0.197CC..Hα-helixtrans-84-46.6-173.8-176.278000113.2V46 K52 I323 S328 S329V46-H50 WeakPolarHBondContact O-CB 3.44Å; V46-H50 PolarHBondContact O-N 3.29Å; H50-K52 PolarHBondContact O-N 3.4Å; H50-I323 HydrophobicContact CB-CD1 4.05Å; H50-I323 WeakPolarHBondContact NE2-CG1 3.37Å; H50-S328 PolarHBondContact CE1-OG 2.88Å; H50-S328 VanDerWaalsContact CE1-OG 3.24Å; H50-S328 PolarHBondContact NE2-OG 3.49Å; H50-S329 PolarHBondContact NE2-N 3.49Å; H50-S329 WeakPolarHBondContact O-CA 3.25Å; H50-S329 WeakPolarHBondContact O-CB 3.24Å
51F91.4Very high92.2Very high0 Ų037.6 Ų37.60%019%0.19CC..  trans-88.2106.9-172.5-65.2-73.6000111.2S47 Q53 L54 A314 M317 S328 C331 L333S47-F51 VanDerWaalsContact O-CD2 3.22Å; S47-F51 WeakPolarHBondContact O-CD2 3.27Å; S47-F51 PolarHBondContact O-N 2.82Å; S47-F51 VanDerWaalsContact O-N 3.14Å; F51-Q53 PolarHBondContact O-N 2.95Å; F51-L54 HydrophobicContact CB-CD1 3.93Å; F51-L54 HydrophobicContact CB-CG 4Å; F51-L54 HydrophobicContact CD2-CD1 4.36Å; F51-L54 WeakPolarHBondContact O-CB 3.38Å; F51-L54 PolarHBondContact O-N 3.24Å; F51-A314 HydrophobicContact CD2-CB 3.98Å; F51-A314 HydrophobicContact CE2-CB 3.58Å; F51-A314 HydrophobicContact CZ-CB 4.41Å; F51-M317 HydrophobicContact CE1-CE 3.68Å; F51-M317 HydrophobicContact CE1-SD 3.7Å; F51-M317 HydrophobicContact CZ-CB 4.06Å; F51-M317 HydrophobicContact CZ-CE 3.93Å; F51-M317 HydrophobicContact CZ-SD 3.74Å; F51-S328 WeakPolarHBondContact CD1-O 3.36Å; F51-S328 WeakPolarHBondContact CE1-O 3.37Å; F51-C331 HydrophobicContact CE1-CB 4.4Å; F51-L333 HydrophobicContact CB-CD1 3.6Å; F51-L333 HydrophobicContact CB-CG 4.46Å; F51-L333 HydrophobicContact CD1-CD1 3.96Å; F51-L333 HydrophobicContact CD1-CD2 4.2Å; F51-L333 HydrophobicContact CD1-CG 4.1Å; F51-L333 HydrophobicContact CD2-CD1 3.67Å; F51-L333 HydrophobicContact CE1-CD2 4.08Å; F51-L333 HydrophobicContact CE1-CG 4.48Å; F51-L333 HydrophobicContact CE2-CD1 4.32Å; F51-L333 HydrophobicContact CE2-CD2 4.42Å; F51-L333 HydrophobicContact CG-CD1 3.48Å; F51-L333 VanDerWaalsContact CG-CD1 3.48Å; F51-L333 HydrophobicContact CG-CD2 4.43Å; F51-L333 HydrophobicContact CG-CG 4.13Å; F51-L333 HydrophobicContact CZ-CD2 4.2Å
52K87.9Confident92.1Very high119 Ų11937.6 Ų37.652%0.51719%0.19SC..G310 helixtrans-56.8-29.7-178-66.1-175.2178.4-174.20113.6H50 L54 H55 S329H50-K52 PolarHBondContact O-N 3.4Å; K52-L54 PolarHBondContact O-N 3.42Å; K52-H55 PolarHBondContact O-N 3.13Å; K52-S329 PolarHBondContact N-O 2.99Å
53Q88Confident92Very high78 Ų7835 Ų3536%0.36418%0.176SC..G310 helixtrans-63.6-21.9176.8-163.3178.526.100112.9F51 F334F51-Q53 PolarHBondContact O-N 2.95Å; Q53-F334 VanDerWaalsContact CD-CD2 3.48Å; Q53-F334 HydrophobicContact CG-CD2 4.06Å; Q53-F334 HydrophobicContact CG-CE2 4.03Å
54L87.8Confident92.2Very high0 Ų034 Ų340%017%0.172CC..G310 helixtrans-88.6-3.1178.8-59.7-179.8000113.3I48 F51 K52 T56 N59 W310 L333 F334I48-L54 HydrophobicContact CG1-CD1 4.4Å; F51-L54 HydrophobicContact CB-CD1 3.93Å; F51-L54 HydrophobicContact CB-CG 4Å; F51-L54 HydrophobicContact CD2-CD1 4.36Å; F51-L54 WeakPolarHBondContact O-CB 3.38Å; F51-L54 PolarHBondContact O-N 3.24Å; K52-L54 PolarHBondContact O-N 3.42Å; L54-T56 PolarHBondContact O-N 3.41Å; L54-N59 WeakPolarHBondContact O-CB 3.43Å; L54-N59 PolarHBondContact O-ND2 2.98Å; L54-W310 HydrophobicContact CD1-CD2 4.2Å; L54-W310 HydrophobicContact CD1-CE3 3.33Å; L54-W310 HydrophobicContact CD1-CH2 4.3Å; L54-W310 HydrophobicContact CD1-CZ3 3.4Å; L54-W310 VanDerWaalsContact CD1-CZ3 3.4Å; L54-W310 HydrophobicContact CD2-CB 4.02Å; L54-W310 HydrophobicContact CD2-CD2 3.44Å; L54-W310 VanDerWaalsContact CD2-CD2 3.44Å; L54-W310 HydrophobicContact CD2-CE3 3.48Å; L54-W310 VanDerWaalsContact CD2-CE3 3.48Å; L54-W310 HydrophobicContact CD2-CG 3.71Å; L54-W310 HydrophobicContact CD2-CZ3 4.15Å; L54-W310 HydrophobicContact CG-CD2 4.48Å; L54-W310 HydrophobicContact CG-CE3 4.06Å; L54-W310 HydrophobicContact CG-CZ3 4.4Å; L54-L333 HydrophobicContact CD1-CD1 3.63Å; L54-L333 HydrophobicContact CD2-CD1 3.96Å; L54-L333 HydrophobicContact CG-CD1 3.74Å; L54-F334 HydrophobicContact CD2-CE2 4.3Å; L54-F334 HydrophobicContact CD2-CZ 4.34Å
55H90.9Very high92.3Very high77 Ų7734 Ų3436%0.35617%0.172SC..  trans-74.967.4-179.7-63.5174.9000112I48 K52 W60I48-H55 PolarHBondContact O-CD2 3.5Å; I48-H55 PolarHBondContact O-NE2 3.12Å; I48-H55 VanDerWaalsContact O-NE2 3.11Å; K52-H55 PolarHBondContact O-N 3.13Å; H55-W60 HydrophobicContact CB-CZ2 4.39Å
56T88.9Confident92.3Very high53 Ų5332.7 Ų32.733%0.32517%0.165SC..SBendtrans-108.2156.2176.268.40000110.1L54 T58 N59 W60L54-T56 PolarHBondContact O-N 3.41Å; T56-T58 VanDerWaalsContact C-N 3.29Å; T56-T58 PolarHBondContact O-N 3.34Å; T56-N59 PolarHBondContact O-N 2.95Å; T56-N59 VanDerWaalsContact O-N 3.07Å; T56-N59 WeakPolarHBondContact OG1-CB 3.35Å; T56-N59 VanDerWaalsContact OG1-CG 3.23Å; T56-N59 PolarHBondContact OG1-N 3.07Å; T56-N59 PolarHBondContact OG1-ND2 3.31Å; T56-W60 PolarHBondContact O-N 3.23Å
57P89.4Confident92.4Very high34 Ų3432 Ų3222%0.22116%0.161CC..Hα-helixtrans-47.5-47.9178.6-32.438.3000113.9W60 L61 I135 I140P57-W60 PolarHBondContact O-N 3.24Å; P57-L61 PolarHBondContact O-N 2.99Å; P57-I135 HydrophobicContact CB-CG2 3.99Å; P57-I135 HydrophobicContact CG-CG2 4.48Å; P57-I140 HydrophobicContact CB-CD1 3.81Å; P57-I140 HydrophobicContact CB-CG1 3.74Å
58T89.4Confident92.7Very high7 Ų732 Ų324%0.04316%0.161CC..Hα-helixtrans-65.3-41.2179.5-39.40000112.7T56 W60 L61 I62 I117 D120 R121T56-T58 VanDerWaalsContact C-N 3.29Å; T56-T58 PolarHBondContact O-N 3.34Å; T58-W60 VanDerWaalsContact C-N 3.28Å; T58-W60 PolarHBondContact O-N 3.47Å; T58-L61 WeakPolarHBondContact O-CB 3.45Å; T58-L61 PolarHBondContact O-N 3.32Å; T58-L61 VanDerWaalsContact O-N 3.15Å; T58-I62 HydrophobicContact CG2-CD1 4.16Å; T58-I62 WeakPolarHBondContact O-CG1 3.34Å; T58-I62 PolarHBondContact O-N 3.28Å; T58-I117 HydrophobicContact CG2-CG2 4.42Å; T58-D120 WeakPolarHBondContact CB-OD2 3.44Å; T58-D120 WeakPolarHBondContact CG2-OD2 3.25Å; T58-D120 PolarHBondContact OG1-OD2 3.45Å; T58-R121 VanDerWaalsContact OG1-CZ 3.27Å; T58-R121 PolarHBondContact OG1-NH2 3.43Å
59N91.6Very high92.9Very high10 Ų1032 Ų325%0.05316%0.161CC..Hα-helixtrans-70.2-29-178.5-72.7-11.9000111.4I48 L54 T56 I62 H63I48-N59 HydrophobicContact CD1-CB 4.38Å; I48-N59 HydrophobicContact CG2-CB 4.13Å; L54-N59 WeakPolarHBondContact O-CB 3.43Å; L54-N59 PolarHBondContact O-ND2 2.98Å; T56-N59 PolarHBondContact O-N 2.95Å; T56-N59 VanDerWaalsContact O-N 3.07Å; T56-N59 WeakPolarHBondContact OG1-CB 3.35Å; T56-N59 VanDerWaalsContact OG1-CG 3.23Å; T56-N59 PolarHBondContact OG1-N 3.07Å; T56-N59 PolarHBondContact OG1-ND2 3.31Å; N59-I62 PolarHBondContact O-N 3.16Å; N59-H63 VanDerWaalsContact O-CB 3.27Å; N59-H63 WeakPolarHBondContact O-CB 3.5Å; N59-H63 PolarHBondContact O-N 3.45Å
60W94.3Very high93.1Very high103 Ų10331.9 Ų31.939%0.3915%0.153SC..Hα-helixtrans-64.3-39169.4-75.3114000112.4H55 T56 P57 T58 H63 S64 I140H55-W60 HydrophobicContact CB-CZ2 4.39Å; T56-W60 PolarHBondContact O-N 3.23Å; P57-W60 PolarHBondContact O-N 3.24Å; T58-W60 VanDerWaalsContact C-N 3.28Å; T58-W60 PolarHBondContact O-N 3.47Å; W60-H63 PolarHBondContact O-N 3.5Å; W60-S64 PolarHBondContact O-N 3.06Å; W60-I140 HydrophobicContact CB-CG2 4.03Å
61L94.6Very high93.4Very high0 Ų031.8 Ų31.80%015%0.154CC..Hα-helixtrans-65.9-42.9172.5-66.5172.4000112P57 T58 H63 S64 M65 F116 I117 D120 I140 M143 I144P57-L61 PolarHBondContact O-N 2.99Å; T58-L61 WeakPolarHBondContact O-CB 3.45Å; T58-L61 PolarHBondContact O-N 3.32Å; T58-L61 VanDerWaalsContact O-N 3.15Å; L61-H63 VanDerWaalsContact C-N 3.33Å; L61-H63 PolarHBondContact O-N 2.79Å; L61-S64 PolarHBondContact O-N 3.37Å; L61-M65 WeakPolarHBondContact O-CB 3.21Å; L61-M65 PolarHBondContact O-N 3.38Å; L61-F116 HydrophobicContact CD1-CB 4.36Å; L61-F116 HydrophobicContact CD2-CB 4.43Å; L61-I117 HydrophobicContact CB-CD1 4.27Å; L61-I117 HydrophobicContact CB-CG1 3.65Å; L61-I117 HydrophobicContact CD1-CG1 4.11Å; L61-D120 HydrophobicContact CD1-CB 4.21Å; L61-I140 HydrophobicContact CD1-CD1 3.9Å; L61-I140 HydrophobicContact CD2-CG2 4.18Å; L61-I140 HydrophobicContact CG-CD1 4.15Å; L61-I140 HydrophobicContact CG-CG2 4.2Å; L61-M143 HydrophobicContact CD1-SD 4.49Å; L61-M143 HydrophobicContact CD2-CB 4.14Å; L61-I144 HydrophobicContact CD2-CD1 4.47Å; L61-I144 HydrophobicContact CD2-CG1 3.79Å
62I93.5Very high93.7Very high0 Ų031.9 Ų31.90%015%0.154CC..Hα-helixtrans-62.7-41175.5-68.2168.3000110.9V44 I48 T58 N59 M65 A66 I117 Y304V44-I62 HydrophobicContact CG1-CG2 3.99Å; I48-I62 HydrophobicContact CD1-CB 4.18Å; I48-I62 HydrophobicContact CD1-CG2 3.8Å; T58-I62 HydrophobicContact CG2-CD1 4.16Å; T58-I62 WeakPolarHBondContact O-CG1 3.34Å; T58-I62 PolarHBondContact O-N 3.28Å; N59-I62 PolarHBondContact O-N 3.16Å; I62-M65 PolarHBondContact O-N 3.07Å; I62-A66 WeakPolarHBondContact O-CB 3.32Å; I62-A66 PolarHBondContact O-N 3.43Å; I62-I117 HydrophobicContact CG1-CD1 3.98Å; I62-Y304 HydrophobicContact CG2-CD2 4.37Å; I62-Y304 HydrophobicContact CG2-CE1 4.46Å; I62-Y304 HydrophobicContact CG2-CE2 3.65Å
63H95.4Very high94.1Very high30 Ų3026.2 Ų26.214%0.13913%0.13CC..Hα-helixtrans-61.9-47.2175.7178.5-60.9000110.9I48 S49 N59 W60 L61 M65 A66 T67I48-H63 HydrophobicContact CB-CB 4.26Å; I48-H63 HydrophobicContact CD1-CB 4.05Å; I48-H63 HydrophobicContact CG2-CB 3.94Å; S49-H63 PolarHBondContact OG-CD2 3.1Å; S49-H63 PolarHBondContact OG-NE2 3.45Å; N59-H63 VanDerWaalsContact O-CB 3.27Å; N59-H63 WeakPolarHBondContact O-CB 3.5Å; N59-H63 PolarHBondContact O-N 3.45Å; W60-H63 PolarHBondContact O-N 3.5Å; L61-H63 VanDerWaalsContact C-N 3.33Å; L61-H63 PolarHBondContact O-N 2.79Å; H63-M65 VanDerWaalsContact C-N 3.34Å; H63-M65 PolarHBondContact O-N 3.15Å; H63-A66 PolarHBondContact O-N 3.35Å; H63-T67 PolarHBondContact O-N 2.91Å; H63-T67 PolarHBondContact O-OG1 2.61Å
64S97.4Very high94.6Very high9 Ų925.1 Ų25.16%0.06313%0.13CC..Hα-helixtrans-61.6-42177.8-173.20000111.8W60 L61 T67 V68 H113 W148W60-S64 PolarHBondContact O-N 3.06Å; L61-S64 PolarHBondContact O-N 3.37Å; S64-T67 WeakPolarHBondContact O-CB 3.31Å; S64-T67 PolarHBondContact O-N 3.23Å; S64-V68 PolarHBondContact O-N 2.67Å; S64-H113 WeakPolarHBondContact CB-NE2 3.42Å; S64-H113 PolarHBondContact OG-NE2 2.92Å; S64-W148 PolarHBondContact OG-NE1 3.33Å
65M95.3Very high95Very high0 Ų029 Ų290%015%0.151CC..Hα-helixtrans-59.6-46.4172.1176.6-179.1-74.300112.4L61 I62 H63 T67 V68 D69 S110 H113 L114 I117L61-M65 WeakPolarHBondContact O-CB 3.21Å; L61-M65 PolarHBondContact O-N 3.38Å; I62-M65 PolarHBondContact O-N 3.07Å; H63-M65 VanDerWaalsContact C-N 3.34Å; H63-M65 PolarHBondContact O-N 3.15Å; M65-T67 PolarHBondContact O-N 2.66Å; M65-V68 WeakPolarHBondContact O-CA 3.44Å; M65-V68 WeakPolarHBondContact O-CB 3.49Å; M65-V68 PolarHBondContact O-N 3.31Å; M65-D69 PolarHBondContact O-N 3.32Å; M65-S110 WeakPolarHBondContact CE-O 3.33Å; M65-H113 HydrophobicContact CB-CB 3.95Å; M65-H113 HydrophobicContact CE-CB 3.46Å; M65-H113 VanDerWaalsContact CE-CB 3.46Å; M65-H113 HydrophobicContact CG-CB 4.43Å; M65-L114 HydrophobicContact CE-CB 3.99Å; M65-L114 HydrophobicContact CE-CD2 3.52Å; M65-L114 HydrophobicContact CE-CG 3.36Å; M65-L114 HydrophobicContact SD-CD2 4.11Å; M65-L114 HydrophobicContact SD-CG 4.36Å; M65-I117 HydrophobicContact CE-CD1 3.64Å; M65-I117 HydrophobicContact SD-CD1 4.23Å
66A96.6Very high95.3Very high0 Ų025.3 Ų25.30%013%0.134CC..Hα-helixtrans-61.8-33.4177.600000111.9N41 V44 I45 I62 H63 F70N41-A66 HydrophobicContact CB-CB 4.42Å; V44-A66 HydrophobicContact CB-CB 3.91Å; V44-A66 HydrophobicContact CG1-CB 3.65Å; I45-A66 HydrophobicContact CG1-CB 3.89Å; I62-A66 WeakPolarHBondContact O-CB 3.32Å; I62-A66 PolarHBondContact O-N 3.43Å; H63-A66 PolarHBondContact O-N 3.35Å; A66-F70 VanDerWaalsContact O-CB 3.23Å; A66-F70 WeakPolarHBondContact O-CB 3.33Å; A66-F70 PolarHBondContact O-N 2.93Å
67T97.9Very high95.6Very high39 Ų3922.8 Ų22.824%0.23912%0.118CC..Hα-helixtrans-63.6-44.8170.6-57.10000111.6H63 S64 M65 D69 F70 L71 W148H63-T67 PolarHBondContact O-N 2.91Å; H63-T67 PolarHBondContact O-OG1 2.61Å; S64-T67 WeakPolarHBondContact O-CB 3.31Å; S64-T67 PolarHBondContact O-N 3.23Å; M65-T67 PolarHBondContact O-N 2.66Å; T67-D69 PolarHBondContact O-N 3.25Å; T67-F70 PolarHBondContact O-N 3.43Å; T67-L71 HydrophobicContact CG2-CD1 4.31Å; T67-L71 HydrophobicContact CG2-CG 4.48Å; T67-L71 WeakPolarHBondContact O-CB 3.39Å; T67-L71 VanDerWaalsContact O-CG 3.29Å; T67-L71 WeakPolarHBondContact O-CG 3.09Å; T67-L71 PolarHBondContact O-N 3.33Å; T67-W148 HydrophobicContact CG2-CH2 4.25Å; T67-W148 HydrophobicContact CG2-CZ2 4.25Å
68V97.9Very high95.9Very high1 Ų123 Ų231%0.00612%0.119CC..Hα-helixtrans-57.8-49.3175.2172.40000110.8S64 M65 F70 L71 L72 L106 A109 W148S64-V68 PolarHBondContact O-N 2.67Å; M65-V68 WeakPolarHBondContact O-CA 3.44Å; M65-V68 WeakPolarHBondContact O-CB 3.49Å; M65-V68 PolarHBondContact O-N 3.31Å; V68-F70 PolarHBondContact O-N 3.06Å; V68-L71 PolarHBondContact O-N 3.23Å; V68-L72 PolarHBondContact O-N 3.45Å; V68-L106 HydrophobicContact CG1-CB 4.05Å; V68-L106 HydrophobicContact CG1-CD2 3.97Å; V68-L106 WeakPolarHBondContact CG1-O 3.22Å; V68-A109 HydrophobicContact CG1-CB 4.04Å; V68-A109 HydrophobicContact CG2-CB 4.05Å; V68-W148 HydrophobicContact CB-CH2 4.45Å; V68-W148 HydrophobicContact CG2-CD2 4.49Å; V68-W148 HydrophobicContact CG2-CH2 3.52Å; V68-W148 HydrophobicContact CG2-CZ2 3.35Å; V68-W148 HydrophobicContact CG2-CZ3 4.17Å
69D97.1Very high96.2Very high0 Ų026.5 Ų26.50%013%0.132CC..Hα-helixtrans-66.8-37.3-178.5-70.7-27.7000112.5M65 T67 L72 G73 S110 S297 N300M65-D69 PolarHBondContact O-N 3.32Å; T67-D69 PolarHBondContact O-N 3.25Å; D69-L72 PolarHBondContact O-N 2.97Å; D69-G73 PolarHBondContact O-N 3.18Å; D69-S110 PolarHBondContact OD1-OG 3.25Å; D69-S297 WeakPolarHBondContact OD1-CB 2.87Å; D69-S297 PolarHBondContact OD1-OG 3.06Å; D69-N300 PolarHBondContact OD2-ND2 2.91Å
70F97.9Very high96.3Very high57 Ų5726 Ų2625%0.2513%0.13CC..Hα-helixtrans-63.3-45.3172.7177.2-93.5000111.5L38 N41 L42 I45 A66 T67 V68 L72 G73 C74L38-F70 HydrophobicContact CB-CE2 4.36Å; L38-F70 HydrophobicContact CD2-CD2 3.86Å; L38-F70 HydrophobicContact CD2-CE2 3.77Å; L38-F70 HydrophobicContact CD2-CG 4.46Å; L38-F70 HydrophobicContact CD2-CZ 4.3Å; N41-F70 HydrophobicContact CB-CB 4.08Å; L42-F70 HydrophobicContact CB-CD2 4.28Å; L42-F70 HydrophobicContact CB-CE2 4.21Å; I45-F70 HydrophobicContact CD1-CB 4.09Å; I45-F70 HydrophobicContact CD1-CG 4.4Å; A66-F70 VanDerWaalsContact O-CB 3.23Å; A66-F70 WeakPolarHBondContact O-CB 3.33Å; A66-F70 PolarHBondContact O-N 2.93Å; T67-F70 PolarHBondContact O-N 3.43Å; V68-F70 PolarHBondContact O-N 3.06Å; F70-L72 VanDerWaalsContact C-N 3.31Å; F70-L72 PolarHBondContact O-N 3.2Å; F70-G73 PolarHBondContact O-N 2.77Å; F70-C74 WeakPolarHBondContact O-CB 3.16Å; F70-C74 PolarHBondContact O-N 3.14Å
71L98.1Very high96.3Very high51 Ų5122.3 Ų22.327%0.26712%0.117SC..Hα-helixtrans-64.6-35.9176-70.1179.7000111.7T67 V68 C74 L75 L106 W148T67-L71 HydrophobicContact CG2-CD1 4.31Å; T67-L71 HydrophobicContact CG2-CG 4.48Å; T67-L71 WeakPolarHBondContact O-CB 3.39Å; T67-L71 VanDerWaalsContact O-CG 3.29Å; T67-L71 WeakPolarHBondContact O-CG 3.09Å; T67-L71 PolarHBondContact O-N 3.33Å; V68-L71 PolarHBondContact O-N 3.23Å; L71-C74 PolarHBondContact O-N 3.25Å; L71-L75 HydrophobicContact CB-CD1 4.41Å; L71-L75 HydrophobicContact CD2-CD1 4.15Å; L71-L75 VanDerWaalsContact O-CB 3.3Å; L71-L75 WeakPolarHBondContact O-CB 3.46Å; L71-L75 WeakPolarHBondContact O-CG 3.45Å; L71-L75 PolarHBondContact O-N 2.87Å; L71-L106 HydrophobicContact CB-CD1 3.96Å; L71-L106 HydrophobicContact CB-CD2 4.11Å; L71-L106 HydrophobicContact CD1-CD2 4.41Å; L71-W148 HydrophobicContact CD1-CH2 3.83Å; L71-W148 HydrophobicContact CD1-CZ3 4.15Å
72L97.5Very high96.2Very high1 Ų123.7 Ų23.71%0.00513%0.125CC..Hα-helixtrans-62.3-48.1174.7-174.574.4000110.5V68 D69 F70 C74 V76 M77 L106 Y294 S297V68-L72 PolarHBondContact O-N 3.45Å; D69-L72 PolarHBondContact O-N 2.97Å; F70-L72 VanDerWaalsContact C-N 3.31Å; F70-L72 PolarHBondContact O-N 3.2Å; L72-C74 PolarHBondContact O-N 3.02Å; L72-V76 HydrophobicContact CD1-CB 3.82Å; L72-V76 HydrophobicContact CD1-CG1 3.98Å; L72-V76 HydrophobicContact CD1-CG2 3.93Å; L72-V76 HydrophobicContact CG-CB 4.48Å; L72-V76 WeakPolarHBondContact O-CB 3.43Å; L72-V76 PolarHBondContact O-N 3.46Å; L72-V76 VanDerWaalsContact O-N 3.07Å; L72-M77 HydrophobicContact CD2-CE 3.87Å; L72-M77 HydrophobicContact CG-CE 4.06Å; L72-M77 PolarHBondContact O-N 2.74Å; L72-L106 HydrophobicContact CB-CB 4.39Å; L72-L106 HydrophobicContact CB-CD1 4.27Å; L72-L106 HydrophobicContact CD1-CB 3.98Å; L72-L106 HydrophobicContact CD1-CD1 4.42Å; L72-Y294 HydrophobicContact CD1-CE1 4.26Å; L72-Y294 HydrophobicContact CD2-CD1 4.04Å; L72-S297 WeakPolarHBondContact CD2-OG 3.34Å
73G97.2Very high96.1Very high0 Ų024.9 Ų24.90%013%0.13CC..Hα-helixtrans-61.4-30175.600000113.9D69 F70 P78D69-G73 PolarHBondContact O-N 3.18Å; F70-G73 PolarHBondContact O-N 2.77Å; G73-P78 WeakPolarHBondContact O-CD 3.43Å
74C97Very high95.8Very high56 Ų5623.7 Ų23.738%0.37813%0.125SC..Hα-helixtrans-89.1-47.6-176.7-172.80000112.9L38 F70 L71 L72 P78L38-C74 HydrophobicContact CD2-CB 3.87Å; F70-C74 WeakPolarHBondContact O-CB 3.16Å; F70-C74 PolarHBondContact O-N 3.14Å; L71-C74 PolarHBondContact O-N 3.25Å; L72-C74 PolarHBondContact O-N 3.02Å; C74-P78 WeakPolarHBondContact O-CG 3.48Å
75L96.6Very high95.4Very high81 Ų8123.3 Ų23.342%0.42412%0.122SC..Hα-helixtrans-97.6-23.2-168.4-58.1-179.5000113.5L71 Y79L71-L75 HydrophobicContact CB-CD1 4.41Å; L71-L75 HydrophobicContact CD2-CD1 4.15Å; L71-L75 VanDerWaalsContact O-CB 3.3Å; L71-L75 WeakPolarHBondContact O-CB 3.46Å; L71-L75 WeakPolarHBondContact O-CG 3.45Å; L71-L75 PolarHBondContact O-N 2.87Å; L75-Y79 WeakPolarHBondContact O-CD2 3.37Å
76V96.9Very high95Very high0 Ų024.1 Ų24.10%013%0.126CC..THydrogen-bonded Turntrans-111.2-55.9-172.3176.80000111L72 Y79 S80 H99 T102 D103 L106 Y294L72-V76 HydrophobicContact CD1-CB 3.82Å; L72-V76 HydrophobicContact CD1-CG1 3.98Å; L72-V76 HydrophobicContact CD1-CG2 3.93Å; L72-V76 HydrophobicContact CG-CB 4.48Å; L72-V76 WeakPolarHBondContact O-CB 3.43Å; L72-V76 PolarHBondContact O-N 3.46Å; L72-V76 VanDerWaalsContact O-N 3.07Å; V76-Y79 PolarHBondContact O-N 2.93Å; V76-S80 WeakPolarHBondContact O-CB 3.21Å; V76-S80 PolarHBondContact O-N 3.28Å; V76-S80 PolarHBondContact O-OG 3.27Å; V76-H99 PolarHBondContact O-NE2 3.45Å; V76-H99 VanDerWaalsContact O-NE2 3.07Å; V76-T102 HydrophobicContact CG2-CG2 3.96Å; V76-D103 HydrophobicContact CG1-CB 3.68Å; V76-D103 HydrophobicContact CG2-CB 4.22Å; V76-L106 HydrophobicContact CG2-CD1 4.16Å; V76-Y294 HydrophobicContact CG1-CE1 4.38Å; V76-Y294 VanDerWaalsContact CG1-OH 3.29Å; V76-Y294 WeakPolarHBondContact CG1-OH 3.35Å
77M96.8Very high94.4Very high0 Ų028.1 Ų28.10%014%0.141CC..Hα-helixtrans-58.4-40.3-172.1-62.8-172.4-168.800114.8I34 T37 L72 Y79 S80 M81 W291 Y294I34-M77 HydrophobicContact CD1-CB 4.01Å; I34-M77 HydrophobicContact CG1-CB 3.59Å; I34-M77 HydrophobicContact CG1-SD 4.18Å; T37-M77 HydrophobicContact CG2-CE 3.92Å; T37-M77 HydrophobicContact CG2-SD 4.49Å; L72-M77 HydrophobicContact CD2-CE 3.87Å; L72-M77 HydrophobicContact CG-CE 4.06Å; L72-M77 PolarHBondContact O-N 2.74Å; M77-Y79 PolarHBondContact O-N 2.91Å; M77-S80 PolarHBondContact O-N 3.41Å; M77-M81 WeakPolarHBondContact O-CB 3.49Å; M77-M81 PolarHBondContact O-N 2.98Å; M77-W291 HydrophobicContact CB-CH2 4.27Å; M77-Y294 HydrophobicContact CE-CG 4.08Å; M77-Y294 HydrophobicContact CG-CD2 3.97Å; M77-Y294 HydrophobicContact CG-CE2 4.28Å; M77-Y294 HydrophobicContact CG-CG 4.34Å
78P95.9Very high93.9Very high38 Ų3826.3 Ų26.325%0.24713%0.13CC..Hα-helixtrans-65.6-37.2-178.7-24.136.4000113.3I34 G73 C74 M81 V82I34-P78 HydrophobicContact CD1-CG 4.36Å; I34-P78 HydrophobicContact CG2-CG 4.49Å; G73-P78 WeakPolarHBondContact O-CD 3.43Å; C74-P78 WeakPolarHBondContact O-CG 3.48Å; P78-M81 WeakPolarHBondContact O-CB 3.34Å; P78-M81 PolarHBondContact O-N 3.39Å; P78-V82 PolarHBondContact O-N 2.73Å
79Y94.6Very high93.6Very high80 Ų8026.5 Ų26.531%0.31413%0.131SC..Hα-helixtrans-77.9-37.5177.7-57.5-82.8000111.1L75 V76 M77 M81 V82 R83 F91 F95L75-Y79 WeakPolarHBondContact O-CD2 3.37Å; V76-Y79 PolarHBondContact O-N 2.93Å; M77-Y79 PolarHBondContact O-N 2.91Å; Y79-M81 VanDerWaalsContact C-N 3.25Å; Y79-M81 PolarHBondContact O-N 2.97Å; Y79-V82 PolarHBondContact O-N 3.06Å; Y79-R83 PolarHBondContact O-N 3.32Å; Y79-R83 VanDerWaalsContact O-N 3.1Å; Y79-F91 HydrophobicContact CD1-CD1 4.13Å; Y79-F91 HydrophobicContact CD1-CD2 4.05Å; Y79-F91 AromaticContact CD1-CE1 3.84Å; Y79-F91 HydrophobicContact CD1-CE1 3.84Å; Y79-F91 AromaticContact CD1-CE2 3.76Å; Y79-F91 HydrophobicContact CD1-CE2 3.76Å; Y79-F91 HydrophobicContact CD1-CG 4.23Å; Y79-F91 AromaticContact CD1-CZ 3.65Å; Y79-F91 HydrophobicContact CD1-CZ 3.65Å; Y79-F91 HydrophobicContact CE1-CD1 4.21Å; Y79-F91 AromaticContact CE1-CE1 3.97Å; Y79-F91 HydrophobicContact CE1-CE1 3.97Å; Y79-F91 HydrophobicContact CE1-CZ 4.23Å; Y79-F95 AromaticContact CD1-CE1 3.5Å; Y79-F95 HydrophobicContact CD1-CE1 3.5Å; Y79-F95 AromaticContact CD1-CZ 3.99Å; Y79-F95 HydrophobicContact CD1-CZ 3.99Å; Y79-F95 HydrophobicContact CD2-CE1 4.2Å; Y79-F95 HydrophobicContact CD2-CZ 4.12Å; Y79-F95 AromaticContact CE1-CE1 3.66Å; Y79-F95 HydrophobicContact CE1-CE1 3.66Å; Y79-F95 AromaticContact CE1-CZ 3.75Å; Y79-F95 HydrophobicContact CE1-CZ 3.75Å; Y79-F95 HydrophobicContact CE2-CE1 4.34Å; Y79-F95 AromaticContact CE2-CZ 3.9Å; Y79-F95 HydrophobicContact CE2-CZ 3.9Å; Y79-F95 AromaticContact CG-CE1 3.78Å; Y79-F95 HydrophobicContact CG-CE1 3.78Å; Y79-F95 HydrophobicContact CG-CZ 4.16Å; Y79-F95 AromaticContact CZ-CZ 3.7Å
80S94.3Very high93.2Very high0 Ų031.1 Ų31.10%015%0.149CC..Hα-helixtrans-60.9-34.4170.3-67.80000111.9V76 M77 R83 S84 H99 Y294V76-S80 WeakPolarHBondContact O-CB 3.21Å; V76-S80 PolarHBondContact O-N 3.28Å; V76-S80 PolarHBondContact O-OG 3.27Å; M77-S80 PolarHBondContact O-N 3.41Å; S80-R83 WeakPolarHBondContact O-CB 3.47Å; S80-R83 PolarHBondContact O-N 3.3Å; S80-S84 WeakPolarHBondContact O-CB 3.37Å; S80-S84 PolarHBondContact O-N 3.11Å; S80-S84 PolarHBondContact O-OG 2.87Å; S80-S84 VanDerWaalsContact O-OG 3.08Å; S80-H99 PolarHBondContact OG-CE1 3.27Å; S80-H99 PolarHBondContact OG-NE2 2.89Å; S80-Y294 PolarHBondContact OG-OH 3.33Å
81M94.4Very high92.8Very high26 Ų2632.2 Ų32.213%0.12815%0.154CC..Hα-helixtrans-62.5-47.8175.7173.4-175.573.700111.8Y27 M30 V31 I34 M77 P78 Y79 R83 S84 A85 W291Y27-M81 HydrophobicContact CD1-CE 4.05Å; Y27-M81 HydrophobicContact CD1-CG 3.76Å; Y27-M81 HydrophobicContact CD1-SD 3.78Å; Y27-M81 HydrophobicContact CE1-CE 4.15Å; Y27-M81 HydrophobicContact CE1-CG 3.92Å; Y27-M81 HydrophobicContact CE1-SD 4.31Å; M30-M81 HydrophobicContact CB-CB 4.28Å; M30-M81 HydrophobicContact CB-CG 3.71Å; M30-M81 HydrophobicContact CB-SD 3.83Å; M30-M81 HydrophobicContact CG-CG 4.32Å; M30-M81 HydrophobicContact SD-CB 4.03Å; M30-M81 HydrophobicContact SD-CG 3.69Å; V31-M81 HydrophobicContact CG2-CE 4.28Å; V31-M81 HydrophobicContact CG2-SD 3.67Å; I34-M81 HydrophobicContact CD1-CB 4.38Å; I34-M81 HydrophobicContact CD1-SD 4Å; M77-M81 WeakPolarHBondContact O-CB 3.49Å; M77-M81 PolarHBondContact O-N 2.98Å; P78-M81 WeakPolarHBondContact O-CB 3.34Å; P78-M81 PolarHBondContact O-N 3.39Å; Y79-M81 VanDerWaalsContact C-N 3.25Å; Y79-M81 PolarHBondContact O-N 2.97Å; M81-R83 VanDerWaalsContact C-N 3.29Å; M81-R83 PolarHBondContact O-N 2.89Å; M81-S84 PolarHBondContact O-N 3.34Å; M81-A85 VanDerWaalsContact O-CB 3.22Å; M81-A85 WeakPolarHBondContact O-CB 3.45Å; M81-A85 PolarHBondContact O-N 3.39Å; M81-W291 HydrophobicContact CB-CH2 4.17Å; M81-W291 HydrophobicContact CB-CZ2 3.84Å
82V91.6Very high92.4Very high28 Ų2831.7 Ų31.717%0.1716%0.16CC..Hα-helixtrans-59.7-44.9175.7177.30000110.3P78 Y79 A85 E86 Y90 F91P78-V82 PolarHBondContact O-N 2.73Å; Y79-V82 PolarHBondContact O-N 3.06Å; V82-A85 PolarHBondContact O-N 3.41Å; V82-E86 WeakPolarHBondContact O-CB 3.33Å; V82-E86 PolarHBondContact O-N 2.95Å; V82-Y90 HydrophobicContact CG1-CD2 4.05Å; V82-Y90 HydrophobicContact CG1-CE2 4.28Å; V82-F91 HydrophobicContact CB-CE2 4.24Å; V82-F91 HydrophobicContact CB-CZ 4.39Å; V82-F91 HydrophobicContact CG1-CE2 4.22Å; V82-F91 HydrophobicContact CG1-CZ 4.35Å; V82-F91 HydrophobicContact CG2-CZ 4.29Å
83R90.8Very high91.9Very high25 Ų2537.9 Ų37.99%0.09419%0.189CC..Hα-helixtrans-59.6-48.6177.9-173.7-177.662.377.47.2112.3Y79 S80 M81 R87 W89 C182 D287Y79-R83 PolarHBondContact O-N 3.32Å; Y79-R83 VanDerWaalsContact O-N 3.1Å; S80-R83 WeakPolarHBondContact O-CB 3.47Å; S80-R83 PolarHBondContact O-N 3.3Å; M81-R83 VanDerWaalsContact C-N 3.29Å; M81-R83 PolarHBondContact O-N 2.89Å; R83-R87 WeakPolarHBondContact O-CA 3.3Å; R83-R87 PolarHBondContact O-N 3.03Å; R83-W89 HydrophobicContact CB-CE3 4.13Å; R83-W89 HydrophobicContact CB-CZ3 4.43Å; R83-W89 HydrophobicContact CG-CE3 4.4Å; R83-C182 WeakPolarHBondContact CD-O 3.48Å; R83-D287 IonicContact CZ-OD1 3.22Å; R83-D287 VanDerWaalsContact CZ-OD1 3.22Å; R83-D287 IonicContact NH1-OD1 2.66Å; R83-D287 PolarHBondContact NH1-OD1 2.94Å; R83-D287 IonicContact NH1-OD2 3.74Å; R83-D287 IonicContact NH2-OD1 2.95Å; R83-D287 PolarHBondContact NH2-OD1 2.93Å
84S90.3Very high91.7Very high5 Ų542.7 Ų42.74%0.03522%0.219CC..Hα-helixtrans-71.4-34.9-178.7-61.50000112.6W18 S80 M81 W291W18-S84 VanDerWaalsContact CH2-O 3.24Å; W18-S84 WeakPolarHBondContact CH2-O 3.32Å; S80-S84 WeakPolarHBondContact O-CB 3.37Å; S80-S84 PolarHBondContact O-N 3.11Å; S80-S84 PolarHBondContact O-OG 2.87Å; S80-S84 VanDerWaalsContact O-OG 3.08Å; M81-S84 PolarHBondContact O-N 3.34Å; S84-W291 PolarHBondContact OG-NE1 2.77Å; S84-W291 VanDerWaalsContact OG-NE1 3.11Å
85A89Confident91.6Very high1 Ų143 Ų431%0.00821%0.213CC..Hα-helixtrans-76.3-41.1-178.500000113.2W18 Y27 M81 V82W18-A85 HydrophobicContact CZ3-CB 4.48Å; W18-A85 WeakPolarHBondContact CZ3-O 3.33Å; Y27-A85 HydrophobicContact CD1-CB 4.33Å; Y27-A85 HydrophobicContact CD2-CB 4.29Å; Y27-A85 HydrophobicContact CE1-CB 3.8Å; Y27-A85 HydrophobicContact CE2-CB 3.76Å; Y27-A85 VanDerWaalsContact CZ-CB 3.49Å; M81-A85 VanDerWaalsContact O-CB 3.22Å; M81-A85 WeakPolarHBondContact O-CB 3.45Å; M81-A85 PolarHBondContact O-N 3.39Å; V82-A85 PolarHBondContact O-N 3.41Å
86E86.1Confident91.4Very high18 Ų1840 Ų408%0.08420%0.199CC..Hα-helixtrans-101-14.4-174.3-60.8-72.5150.800112.7K15 N16 R23 Y27 V82 C88 Y90K15-E86 WeakPolarHBondContact CE-OE2 3.5Å; K15-E86 IonicContact NZ-OE2 2.68Å; K15-E86 PolarHBondContact NZ-OE2 2.86Å; N16-E86 PolarHBondContact N-O 2.65Å; N16-E86 VanDerWaalsContact N-O 3.11Å; R23-E86 WeakPolarHBondContact CD-OE1 3.39Å; R23-E86 IonicContact CZ-OE1 2.69Å; R23-E86 IonicContact NE-OE1 3.93Å; R23-E86 IonicContact NH1-OE1 3.11Å; R23-E86 PolarHBondContact NH1-OE1 2.89Å; R23-E86 VanDerWaalsContact NH1-OE1 3.11Å; R23-E86 IonicContact NH1-OE2 3.45Å; R23-E86 PolarHBondContact NH1-OE2 3.01Å; Y27-E86 VanDerWaalsContact OH-CG 3.32Å; Y27-E86 WeakPolarHBondContact OH-CG 3.36Å; Y27-E86 PolarHBondContact OH-OE1 3.16Å; V82-E86 WeakPolarHBondContact O-CB 3.33Å; V82-E86 PolarHBondContact O-N 2.95Å; E86-C88 HydrophobicContact CB-CB 4.19Å; E86-C88 PolarHBondContact O-N 3.15Å; E86-C88 PolarHBondContact O-SG 3.18Å; E86-Y90 HydrophobicContact CB-CE2 4.39Å
87R84.3Confident91.3Very high83 Ų8343.2 Ų43.231%0.31321%0.213SC..SBendtrans5720.4-165-84.3-152.9175.8-163.47.3114.5N16 R83 T284N16-R87 HydrophobicContact CB-CB 4.13Å; N16-R87 HydrophobicContact CB-CG 4.23Å; R83-R87 WeakPolarHBondContact O-CA 3.3Å; R83-R87 PolarHBondContact O-N 3.03Å; R87-T284 VanDerWaalsContact NH2-N 3.16Å; R87-T284 PolarHBondContact NH2-OG1 3.27Å
88C88Confident91.3Very high1 Ų146.3 Ų46.31%0.00723%0.229CC..  trans-127.1145.3-175.9-660000111.4C5 E86 Y90 G180C5-C88 WeakPolarHBondContact CA-SG 3.44Å; C5-C88 HydrophobicContact CB-CB 3.7Å; C5-C88 WeakPolarHBondContact CB-SG 3.34Å; C5-C88 WeakPolarHBondContact SG-CA 3.29Å; C5-C88 WeakPolarHBondContact SG-CB 3.47Å; C5-C88 CovalentContact SG-SG 2.02Å; C5-C88 PolarHBondContact SG-SG 2.78Å; E86-C88 HydrophobicContact CB-CB 4.19Å; E86-C88 PolarHBondContact O-N 3.15Å; E86-C88 PolarHBondContact O-SG 3.18Å; C88-Y90 HydrophobicContact CB-CD1 4.38Å; C88-Y90 HydrophobicContact CB-CD2 4.44Å; C88-Y90 HydrophobicContact CB-CE1 3.63Å; C88-Y90 HydrophobicContact CB-CE2 3.71Å; C88-Y90 VanDerWaalsContact CB-OH 3.25Å; C88-Y90 WeakPolarHBondContact CB-OH 3.48Å; C88-Y90 PolarHBondContact SG-OH 3.36Å; C88-G180 CarbonylContact C-O 3.21Å
89W90.8Very high91.3Very high6 Ų644.9 Ų44.92%0.02322%0.219CC..  trans-116106.8174.7-173.7-99.2000110.2R83 F91 G92 F95 C96 H99 G180 C182R83-W89 HydrophobicContact CB-CE3 4.13Å; R83-W89 HydrophobicContact CB-CZ3 4.43Å; R83-W89 HydrophobicContact CG-CE3 4.4Å; W89-F91 AromaticContact CD2-CD2 3.86Å; W89-F91 HydrophobicContact CD2-CD2 3.86Å; W89-F91 AromaticContact CE2-CD2 3.85Å; W89-F91 AromaticContact CE3-CD2 3.92Å; W89-F91 HydrophobicContact CE3-CD2 3.92Å; W89-F91 HydrophobicContact CE3-CE2 4.42Å; W89-F91 HydrophobicContact CH2-CD2 4.04Å; W89-F91 HydrophobicContact CZ2-CB 4.09Å; W89-F91 AromaticContact CZ2-CD2 3.99Å; W89-F91 HydrophobicContact CZ2-CD2 3.99Å; W89-F91 HydrophobicContact CZ2-CG 4.47Å; W89-F91 HydrophobicContact CZ3-CD2 4Å; W89-F91 HydrophobicContact CZ3-CE2 4.41Å; W89-G92 PolarHBondContact NE1-O 3.04Å; W89-F95 HydrophobicContact CH2-CD1 4.01Å; W89-F95 HydrophobicContact CH2-CE1 4.09Å; W89-F95 AromaticContact CZ2-CD1 3.41Å; W89-F95 HydrophobicContact CZ2-CD1 3.41Å; W89-F95 VanDerWaalsContact CZ2-CD1 3.41Å; W89-F95 AromaticContact CZ2-CE1 3.97Å; W89-F95 HydrophobicContact CZ2-CE1 3.97Å; W89-F95 HydrophobicContact CZ2-CG 4.38Å; W89-C96 HydrophobicContact CZ2-CB 4.17Å; W89-H99 HydrophobicContact CH2-CB 3.74Å; W89-H99 AromaticContact CH2-CD2 3.91Å; W89-H99 AromaticContact CH2-CG 3.51Å; W89-H99 AromaticContact CH2-ND1 3.76Å; W89-H99 HydrophobicContact CZ2-CB 4.02Å; W89-G180 PolarHBondContact N-O 3.32Å; W89-G180 VanDerWaalsContact O-CA 3.3Å; W89-G180 WeakPolarHBondContact O-CA 3.48Å; W89-C182 HydrophobicContact CB-CB 3.7Å; W89-C182 HydrophobicContact CD2-CB 3.42Å; W89-C182 VanDerWaalsContact CD2-CB 3.42Å; W89-C182 HydrophobicContact CE3-CB 3.74Å; W89-C182 HydrophobicContact CG-CB 3.42Å; W89-C182 VanDerWaalsContact CG-CB 3.42Å; W89-C182 HydrophobicContact CZ3-CB 4.48Å
90Y88.3Confident91.2Very high96 Ų9641.5 Ų41.538%0.37621%0.207SC..  trans-95.6-4.3-174.6-56.4-62.8000113.9C5 V82 E86 C88C5-Y90 HydrophobicContact CB-CE1 4.21Å; V82-Y90 HydrophobicContact CG1-CD2 4.05Å; V82-Y90 HydrophobicContact CG1-CE2 4.28Å; E86-Y90 HydrophobicContact CB-CE2 4.39Å; C88-Y90 HydrophobicContact CB-CD1 4.38Å; C88-Y90 HydrophobicContact CB-CD2 4.44Å; C88-Y90 HydrophobicContact CB-CE1 3.63Å; C88-Y90 HydrophobicContact CB-CE2 3.71Å; C88-Y90 VanDerWaalsContact CB-OH 3.25Å; C88-Y90 WeakPolarHBondContact CB-OH 3.48Å; C88-Y90 PolarHBondContact SG-OH 3.36Å
91F90.1Very high91.3Very high81 Ų8141.5 Ų41.536%0.35521%0.207SC..SBendtrans-93.22.1-167.6-51.1-75.2000114.2Y79 V82 W89 F95Y79-F91 HydrophobicContact CD1-CD1 4.13Å; Y79-F91 HydrophobicContact CD1-CD2 4.05Å; Y79-F91 AromaticContact CD1-CE1 3.84Å; Y79-F91 HydrophobicContact CD1-CE1 3.84Å; Y79-F91 AromaticContact CD1-CE2 3.76Å; Y79-F91 HydrophobicContact CD1-CE2 3.76Å; Y79-F91 HydrophobicContact CD1-CG 4.23Å; Y79-F91 AromaticContact CD1-CZ 3.65Å; Y79-F91 HydrophobicContact CD1-CZ 3.65Å; Y79-F91 HydrophobicContact CE1-CD1 4.21Å; Y79-F91 AromaticContact CE1-CE1 3.97Å; Y79-F91 HydrophobicContact CE1-CE1 3.97Å; Y79-F91 HydrophobicContact CE1-CZ 4.23Å; V82-F91 HydrophobicContact CB-CE2 4.24Å; V82-F91 HydrophobicContact CB-CZ 4.39Å; V82-F91 HydrophobicContact CG1-CE2 4.22Å; V82-F91 HydrophobicContact CG1-CZ 4.35Å; V82-F91 HydrophobicContact CG2-CZ 4.29Å; W89-F91 AromaticContact CD2-CD2 3.86Å; W89-F91 HydrophobicContact CD2-CD2 3.86Å; W89-F91 AromaticContact CE2-CD2 3.85Å; W89-F91 AromaticContact CE3-CD2 3.92Å; W89-F91 HydrophobicContact CE3-CD2 3.92Å; W89-F91 HydrophobicContact CE3-CE2 4.42Å; W89-F91 HydrophobicContact CH2-CD2 4.04Å; W89-F91 HydrophobicContact CZ2-CB 4.09Å; W89-F91 AromaticContact CZ2-CD2 3.99Å; W89-F91 HydrophobicContact CZ2-CD2 3.99Å; W89-F91 HydrophobicContact CZ2-CG 4.47Å; W89-F91 HydrophobicContact CZ3-CD2 4Å; W89-F91 HydrophobicContact CZ3-CE2 4.41Å; F91-F95 HydrophobicContact CB-CB 4.19Å; F91-F95 HydrophobicContact CB-CD1 3.38Å; F91-F95 HydrophobicContact CB-CE1 4.14Å; F91-F95 HydrophobicContact CB-CG 4.1Å; F91-F95 HydrophobicContact CD2-CD1 4.49Å; F91-F95 AromaticContact CG-CD1 3.99Å; F91-F95 HydrophobicContact CG-CD1 3.99Å; F91-F95 HydrophobicContact CG-CE1 4.27Å; F91-F95 WeakPolarHBondContact O-CB 3.22Å
92G89.5Confident91.4Very high39 Ų3941.1 Ų41.140%0.40221%0.206SC..  trans84.3165.7179.700000114.7W89 C96W89-G92 PolarHBondContact NE1-O 3.04Å; G92-C96 PolarHBondContact O-N 3.2Å
93E88.6Confident91.6Very high131 Ų13140.6 Ų40.661%0.61220%0.202SC*.Hα-helixtrans-71.6-40-170.6-68.4173.4-166.400113.4F95 C96 K97E93-F95 VanDerWaalsContact C-N 3.32Å; E93-F95 PolarHBondContact O-N 3.14Å; E93-C96 VanDerWaalsContact O-CB 3.31Å; E93-C96 WeakPolarHBondContact O-CB 3.28Å; E93-C96 PolarHBondContact O-N 3.22Å; E93-C96 VanDerWaalsContact O-N 3.13Å; E93-K97 PolarHBondContact O-N 3.42Å
94V91.8Very high91.7Very high102 Ų10240.6 Ų40.662%0.61820%0.204SC*.Hα-helixtrans-61.5-44.4177.41780000110.3C96 K97 I98V94-C96 VanDerWaalsContact C-N 3.31Å; V94-C96 PolarHBondContact O-N 2.96Å; V94-K97 PolarHBondContact O-N 3.48Å; V94-I98 HydrophobicContact CG1-CD1 4.01Å; V94-I98 WeakPolarHBondContact O-CG1 3.46Å; V94-I98 PolarHBondContact O-N 3.47Å
95F94.3Very high91.9Very high61 Ų6141.7 Ų41.727%0.26821%0.209SC..Hα-helixtrans-67.4-33.1176.6-166.4-107.2000111.8Y79 W89 F91 E93 I98 H99Y79-F95 AromaticContact CD1-CE1 3.5Å; Y79-F95 HydrophobicContact CD1-CE1 3.5Å; Y79-F95 AromaticContact CD1-CZ 3.99Å; Y79-F95 HydrophobicContact CD1-CZ 3.99Å; Y79-F95 HydrophobicContact CD2-CE1 4.2Å; Y79-F95 HydrophobicContact CD2-CZ 4.12Å; Y79-F95 AromaticContact CE1-CE1 3.66Å; Y79-F95 HydrophobicContact CE1-CE1 3.66Å; Y79-F95 AromaticContact CE1-CZ 3.75Å; Y79-F95 HydrophobicContact CE1-CZ 3.75Å; Y79-F95 HydrophobicContact CE2-CE1 4.34Å; Y79-F95 AromaticContact CE2-CZ 3.9Å; Y79-F95 HydrophobicContact CE2-CZ 3.9Å; Y79-F95 AromaticContact CG-CE1 3.78Å; Y79-F95 HydrophobicContact CG-CE1 3.78Å; Y79-F95 HydrophobicContact CG-CZ 4.16Å; Y79-F95 AromaticContact CZ-CZ 3.7Å; W89-F95 HydrophobicContact CH2-CD1 4.01Å; W89-F95 HydrophobicContact CH2-CE1 4.09Å; W89-F95 AromaticContact CZ2-CD1 3.41Å; W89-F95 HydrophobicContact CZ2-CD1 3.41Å; W89-F95 VanDerWaalsContact CZ2-CD1 3.41Å; W89-F95 AromaticContact CZ2-CE1 3.97Å; W89-F95 HydrophobicContact CZ2-CE1 3.97Å; W89-F95 HydrophobicContact CZ2-CG 4.38Å; F91-F95 HydrophobicContact CB-CB 4.19Å; F91-F95 HydrophobicContact CB-CD1 3.38Å; F91-F95 HydrophobicContact CB-CE1 4.14Å; F91-F95 HydrophobicContact CB-CG 4.1Å; F91-F95 HydrophobicContact CD2-CD1 4.49Å; F91-F95 AromaticContact CG-CD1 3.99Å; F91-F95 HydrophobicContact CG-CD1 3.99Å; F91-F95 HydrophobicContact CG-CE1 4.27Å; F91-F95 WeakPolarHBondContact O-CB 3.22Å; E93-F95 VanDerWaalsContact C-N 3.32Å; E93-F95 PolarHBondContact O-N 3.14Å; F95-I98 PolarHBondContact O-N 3.36Å; F95-H99 WeakPolarHBondContact O-CB 3.48Å; F95-H99 PolarHBondContact O-N 3.47Å
96C93.7Very high92.3Very high19 Ų1941.7 Ų41.713%0.12821%0.208CC..Hα-helixtrans-59.7-45.9171.3176.50000112.1W89 G92 E93 V94 H99 T100 C182W89-C96 HydrophobicContact CZ2-CB 4.17Å; G92-C96 PolarHBondContact O-N 3.2Å; E93-C96 VanDerWaalsContact O-CB 3.31Å; E93-C96 WeakPolarHBondContact O-CB 3.28Å; E93-C96 PolarHBondContact O-N 3.22Å; E93-C96 VanDerWaalsContact O-N 3.13Å; V94-C96 VanDerWaalsContact C-N 3.31Å; V94-C96 PolarHBondContact O-N 2.96Å; C96-H99 PolarHBondContact O-N 2.99Å; C96-T100 VanDerWaalsContact O-CB 3.27Å; C96-T100 WeakPolarHBondContact O-CB 3.36Å; C96-T100 PolarHBondContact O-N 3.5Å; C96-T100 PolarHBondContact O-OG1 2.88Å; C96-C182 WeakPolarHBondContact CA-SG 3.48Å; C96-C182 HydrophobicContact CB-CB 3.8Å; C96-C182 WeakPolarHBondContact CB-SG 3.35Å; C96-C182 WeakPolarHBondContact SG-CA 3.38Å; C96-C182 WeakPolarHBondContact SG-CB 3.46Å; C96-C182 CovalentContact SG-SG 2.03Å; C96-C182 PolarHBondContact SG-SG 2.68Å
97K93.9Very high92.6Very high67 Ų6741.2 Ų41.229%0.29121%0.207SC..Hα-helixtrans-61.2-47.8176.4-71.2-174.3174.4-173.10111.1E93 V94 T100 S101 I159 F160 E162E93-K97 PolarHBondContact O-N 3.42Å; V94-K97 PolarHBondContact O-N 3.48Å; K97-T100 PolarHBondContact O-N 3.42Å; K97-S101 WeakPolarHBondContact O-CB 3.38Å; K97-S101 PolarHBondContact O-N 2.78Å; K97-S101 PolarHBondContact O-OG 3.31Å; K97-I159 HydrophobicContact CB-CG2 3.98Å; K97-I159 HydrophobicContact CG-CG2 4.06Å; K97-F160 HydrophobicContact CB-CE2 4.32Å; K97-F160 HydrophobicContact CB-CZ 4.25Å; K97-E162 IonicContact NZ-OE1 2.67Å; K97-E162 PolarHBondContact NZ-OE1 2.69Å
98I96.2Very high92.9Very high66 Ų6637.5 Ų37.534%0.33819%0.194SC..Hα-helixtrans-60.4-48.1177.3-66.3168000111.1V94 F95 S101 T102 F160V94-I98 HydrophobicContact CG1-CD1 4.01Å; V94-I98 WeakPolarHBondContact O-CG1 3.46Å; V94-I98 PolarHBondContact O-N 3.47Å; F95-I98 PolarHBondContact O-N 3.36Å; I98-S101 PolarHBondContact O-N 3.26Å; I98-T102 VanDerWaalsContact O-CB 3.27Å; I98-T102 WeakPolarHBondContact O-CB 3.33Å; I98-T102 PolarHBondContact O-N 2.97Å; I98-T102 PolarHBondContact O-OG1 3.32Å; I98-F160 HydrophobicContact CG1-CZ 3.91Å
99H96.1Very high93.3Very high7 Ų737.5 Ų37.53%0.03219%0.194CC..Hα-helixtrans-61.6-49.1-179.5171.7-88.4000111.3V76 S80 W89 F95 C96 S101 T102 D103V76-H99 PolarHBondContact O-NE2 3.45Å; V76-H99 VanDerWaalsContact O-NE2 3.07Å; S80-H99 PolarHBondContact OG-CE1 3.27Å; S80-H99 PolarHBondContact OG-NE2 2.89Å; W89-H99 HydrophobicContact CH2-CB 3.74Å; W89-H99 AromaticContact CH2-CD2 3.91Å; W89-H99 AromaticContact CH2-CG 3.51Å; W89-H99 AromaticContact CH2-ND1 3.76Å; W89-H99 HydrophobicContact CZ2-CB 4.02Å; F95-H99 WeakPolarHBondContact O-CB 3.48Å; F95-H99 PolarHBondContact O-N 3.47Å; C96-H99 PolarHBondContact O-N 2.99Å; H99-S101 PolarHBondContact O-N 3.47Å; H99-T102 PolarHBondContact O-N 3.37Å; H99-D103 WeakPolarHBondContact O-CB 3.36Å; H99-D103 PolarHBondContact O-N 2.94Å
100T93.8Very high93.4Very high10 Ų1037.3 Ų37.36%0.06119%0.193CC..Hα-helixtrans-61.2-46.3178.4-61.30000111.6C96 K97 T102 D103 I104 I159 V184C96-T100 VanDerWaalsContact O-CB 3.27Å; C96-T100 WeakPolarHBondContact O-CB 3.36Å; C96-T100 PolarHBondContact O-N 3.5Å; C96-T100 PolarHBondContact O-OG1 2.88Å; K97-T100 PolarHBondContact O-N 3.42Å; T100-T102 VanDerWaalsContact C-N 3.32Å; T100-T102 PolarHBondContact O-N 3.5Å; T100-D103 PolarHBondContact O-N 3.03Å; T100-I104 HydrophobicContact CG2-CD1 3.91Å; T100-I104 WeakPolarHBondContact O-CG1 3.3Å; T100-I104 PolarHBondContact O-N 3.4Å; T100-I159 HydrophobicContact CG2-CD1 3.82Å; T100-I159 HydrophobicContact CG2-CG1 4.2Å; T100-V184 HydrophobicContact CG2-CB 4.38Å; T100-V184 HydrophobicContact CG2-CG1 4.23Å; T100-V184 HydrophobicContact CG2-CG2 3.58Å
101S95.9Very high93.5Very high0 Ų032.7 Ų32.70%018%0.176CC..Hα-helixtrans-61.1-41.1174.8-69.60000112.3K97 I98 H99 M105 A155 I159K97-S101 WeakPolarHBondContact O-CB 3.38Å; K97-S101 PolarHBondContact O-N 2.78Å; K97-S101 PolarHBondContact O-OG 3.31Å; I98-S101 PolarHBondContact O-N 3.26Å; H99-S101 PolarHBondContact O-N 3.47Å; S101-M105 WeakPolarHBondContact O-CB 3.47Å; S101-M105 PolarHBondContact O-N 2.73Å; S101-A155 VanDerWaalsContact O-CB 3.31Å; S101-A155 WeakPolarHBondContact O-CB 3.36Å; S101-A155 PolarHBondContact OG-O 2.92Å; S101-I159 VanDerWaalsContact OG-CB 3.26Å; S101-I159 WeakPolarHBondContact OG-CB 3.32Å; S101-I159 WeakPolarHBondContact OG-CG1 3.3Å
102T96.8Very high93.6Very high18 Ų1830.3 Ų30.311%0.1117%0.165CC..Hα-helixtrans-67.2-40.1179.6-57.80000111.4V76 I98 H99 T100 M105 L106V76-T102 HydrophobicContact CG2-CG2 3.96Å; I98-T102 VanDerWaalsContact O-CB 3.27Å; I98-T102 WeakPolarHBondContact O-CB 3.33Å; I98-T102 PolarHBondContact O-N 2.97Å; I98-T102 PolarHBondContact O-OG1 3.32Å; H99-T102 PolarHBondContact O-N 3.37Å; T100-T102 VanDerWaalsContact C-N 3.32Å; T100-T102 PolarHBondContact O-N 3.5Å; T102-M105 HydrophobicContact CG2-CE 4.41Å; T102-M105 PolarHBondContact O-N 2.85Å; T102-L106 HydrophobicContact CG2-CD1 3.64Å; T102-L106 HydrophobicContact CG2-CG 4.17Å; T102-L106 WeakPolarHBondContact O-CB 3.5Å; T102-L106 VanDerWaalsContact O-CG 3.29Å; T102-L106 WeakPolarHBondContact O-CG 3.28Å; T102-L106 PolarHBondContact O-N 3.27Å
103D95.1Very high93.8Very high17 Ų1728.5 Ų28.59%0.09115%0.146CC..Hα-helixtrans-60.2-54174.7-172.51.9000111.2V76 H99 T100 M105 L106 S107 Y294V76-D103 HydrophobicContact CG1-CB 3.68Å; V76-D103 HydrophobicContact CG2-CB 4.22Å; H99-D103 WeakPolarHBondContact O-CB 3.36Å; H99-D103 PolarHBondContact O-N 2.94Å; T100-D103 PolarHBondContact O-N 3.03Å; D103-M105 VanDerWaalsContact C-N 3.31Å; D103-M105 PolarHBondContact O-N 3.05Å; D103-L106 PolarHBondContact O-N 3.49Å; D103-S107 WeakPolarHBondContact O-CB 3.36Å; D103-S107 PolarHBondContact O-N 3.48Å; D103-S107 PolarHBondContact O-OG 3.41Å; D103-S107 PolarHBondContact OD1-OG 2.86Å; D103-S107 VanDerWaalsContact OD1-OG 3.1Å; D103-Y294 VanDerWaalsContact CG-OH 3.32Å; D103-Y294 WeakPolarHBondContact OD1-CE1 3.31Å; D103-Y294 PolarHBondContact OD2-OH 3.41Å
104I92.8Very high93.8Very high24 Ų2422.5 Ų22.512%0.12312%0.118CC..Hα-helixtrans-58.9-45.1178.4-63163.6000110.1T100 S108 A155 I159 V184 F186T100-I104 HydrophobicContact CG2-CD1 3.91Å; T100-I104 WeakPolarHBondContact O-CG1 3.3Å; T100-I104 PolarHBondContact O-N 3.4Å; I104-S108 WeakPolarHBondContact O-CB 3.44Å; I104-S108 PolarHBondContact O-N 2.96Å; I104-S108 PolarHBondContact O-OG 2.93Å; I104-A155 HydrophobicContact CB-CB 3.86Å; I104-A155 HydrophobicContact CG2-CB 3.71Å; I104-I159 HydrophobicContact CD1-CD1 4.12Å; I104-I159 HydrophobicContact CD1-CG1 4.23Å; I104-V184 HydrophobicContact CD1-CG1 4.39Å; I104-F186 HydrophobicContact CD1-CZ 3.87Å
105M95.6Very high93.7Very high28 Ų2818.1 Ų18.114%0.1389%0.092CC..Hα-helixtrans-59.4-53.4179177.2-172.875.200111.9S101 T102 D103 S108 A109 P151 A152 A155 F156S101-M105 WeakPolarHBondContact O-CB 3.47Å; S101-M105 PolarHBondContact O-N 2.73Å; T102-M105 HydrophobicContact CG2-CE 4.41Å; T102-M105 PolarHBondContact O-N 2.85Å; D103-M105 VanDerWaalsContact C-N 3.31Å; D103-M105 PolarHBondContact O-N 3.05Å; M105-S108 PolarHBondContact O-N 3.01Å; M105-A109 WeakPolarHBondContact O-CB 3.37Å; M105-A109 PolarHBondContact O-N 3Å; M105-P151 HydrophobicContact CG-CB 4.32Å; M105-A152 HydrophobicContact CG-CB 4.03Å; M105-A152 HydrophobicContact SD-CB 3.55Å; M105-A152 VanDerWaalsContact SD-CB 3.55Å; M105-A155 HydrophobicContact CB-CB 3.91Å; M105-F156 HydrophobicContact CB-CE2 4.48Å; M105-F156 HydrophobicContact CE-CE2 4.5Å; M105-F156 HydrophobicContact SD-CD2 4.42Å; M105-F156 HydrophobicContact SD-CE2 3.8Å
106L96.3Very high93.7Very high1 Ų116.7 Ų16.71%0.0059%0.086CC..Hα-helixtrans-69.9-41.1-174.6-68.6173.6000111.2V68 L71 L72 V76 T102 D103 A109 S110 W148V68-L106 HydrophobicContact CG1-CB 4.05Å; V68-L106 HydrophobicContact CG1-CD2 3.97Å; V68-L106 WeakPolarHBondContact CG1-O 3.22Å; L71-L106 HydrophobicContact CB-CD1 3.96Å; L71-L106 HydrophobicContact CB-CD2 4.11Å; L71-L106 HydrophobicContact CD1-CD2 4.41Å; L72-L106 HydrophobicContact CB-CB 4.39Å; L72-L106 HydrophobicContact CB-CD1 4.27Å; L72-L106 HydrophobicContact CD1-CB 3.98Å; L72-L106 HydrophobicContact CD1-CD1 4.42Å; V76-L106 HydrophobicContact CG2-CD1 4.16Å; T102-L106 HydrophobicContact CG2-CD1 3.64Å; T102-L106 HydrophobicContact CG2-CG 4.17Å; T102-L106 WeakPolarHBondContact O-CB 3.5Å; T102-L106 VanDerWaalsContact O-CG 3.29Å; T102-L106 WeakPolarHBondContact O-CG 3.28Å; T102-L106 PolarHBondContact O-N 3.27Å; D103-L106 PolarHBondContact O-N 3.49Å; L106-A109 PolarHBondContact O-N 3.28Å; L106-S110 PolarHBondContact O-N 2.9Å; L106-W148 HydrophobicContact CD2-CZ3 4.09Å
107S92.3Very high93.5Very high8 Ų816 Ų166%0.0568%0.081CC..Hα-helixtrans-58.8-51.2174.5-66.40000110.5D103 A109 S110 I111 W264D103-S107 WeakPolarHBondContact O-CB 3.36Å; D103-S107 PolarHBondContact O-N 3.48Å; D103-S107 PolarHBondContact O-OG 3.41Å; D103-S107 PolarHBondContact OD1-OG 2.86Å; D103-S107 VanDerWaalsContact OD1-OG 3.1Å; S107-A109 PolarHBondContact O-N 3.34Å; S107-S110 WeakPolarHBondContact O-CB 3.44Å; S107-S110 PolarHBondContact O-N 3.35Å; S107-I111 WeakPolarHBondContact O-CG1 3.48Å; S107-I111 PolarHBondContact O-N 3.48Å; S107-W264 WeakPolarHBondContact OG-CH2 3.45Å
108S92.1Very high93.2Very high6 Ų612.9 Ų12.94%0.0427%0.067CC..Hα-helixtrans-64.8-38.9176.9-64.40000113I104 M105 S110 I111 F112 S198I104-S108 WeakPolarHBondContact O-CB 3.44Å; I104-S108 PolarHBondContact O-N 2.96Å; I104-S108 PolarHBondContact O-OG 2.93Å; M105-S108 PolarHBondContact O-N 3.01Å; S108-S110 VanDerWaalsContact C-N 3.29Å; S108-S110 PolarHBondContact O-N 2.69Å; S108-I111 WeakPolarHBondContact O-CB 3.34Å; S108-I111 PolarHBondContact O-N 2.88Å; S108-I111 VanDerWaalsContact O-N 3.12Å; S108-F112 WeakPolarHBondContact O-CD2 3.26Å; S108-F112 PolarHBondContact O-N 2.71Å; S108-S198 WeakPolarHBondContact OG-CB 3.3Å; S108-S198 PolarHBondContact OG-OG 2.91Å
109A95.4Very high92.9Very high0 Ų011.6 Ų11.60%06%0.061CC..Hα-helixtrans-60-40176.300000111.6V68 M105 L106 S107 I111 F112 H113 S147 P151V68-A109 HydrophobicContact CG1-CB 4.04Å; V68-A109 HydrophobicContact CG2-CB 4.05Å; M105-A109 WeakPolarHBondContact O-CB 3.37Å; M105-A109 PolarHBondContact O-N 3Å; L106-A109 PolarHBondContact O-N 3.28Å; S107-A109 PolarHBondContact O-N 3.34Å; A109-I111 VanDerWaalsContact C-N 3.29Å; A109-I111 PolarHBondContact O-N 3.41Å; A109-F112 PolarHBondContact O-N 3.25Å; A109-H113 PolarHBondContact O-N 3.25Å; A109-H113 PolarHBondContact O-ND1 3.06Å; A109-S147 WeakPolarHBondContact CA-O 3.44Å; A109-S147 VanDerWaalsContact CB-O 3.24Å; A109-S147 WeakPolarHBondContact CB-O 3.32Å; A109-P151 HydrophobicContact CB-CB 4.37Å; A109-P151 HydrophobicContact CB-CG 4.31Å
110S93.1Very high92.6Very high2 Ų211.3 Ų11.31%0.0146%0.059CC..Hα-helixtrans-59.5-40.5175.5-164.30000111.4M65 D69 L106 S107 S108 H113 L114M65-S110 WeakPolarHBondContact CE-O 3.33Å; D69-S110 PolarHBondContact OD1-OG 3.25Å; L106-S110 PolarHBondContact O-N 2.9Å; S107-S110 WeakPolarHBondContact O-CB 3.44Å; S107-S110 PolarHBondContact O-N 3.35Å; S108-S110 VanDerWaalsContact C-N 3.29Å; S108-S110 PolarHBondContact O-N 2.69Å; S110-H113 PolarHBondContact O-N 3.48Å; S110-L114 PolarHBondContact O-N 3.22Å
111I89.6Confident92.2Very high0 Ų012.4 Ų12.40%06%0.063CC..Hα-helixtrans-65.3-44.3176.8-52.1178.7000111.9S107 S108 A109 H113 L114 S115 S198 F199 P202 F260 F268S107-I111 WeakPolarHBondContact O-CG1 3.48Å; S107-I111 PolarHBondContact O-N 3.48Å; S108-I111 WeakPolarHBondContact O-CB 3.34Å; S108-I111 PolarHBondContact O-N 2.88Å; S108-I111 VanDerWaalsContact O-N 3.12Å; A109-I111 VanDerWaalsContact C-N 3.29Å; A109-I111 PolarHBondContact O-N 3.41Å; I111-H113 VanDerWaalsContact C-N 3.34Å; I111-H113 PolarHBondContact O-N 3Å; I111-L114 PolarHBondContact O-N 2.88Å; I111-S115 PolarHBondContact O-N 3.28Å; I111-S115 PolarHBondContact O-OG 3.13Å; I111-S198 WeakPolarHBondContact CD1-O 3.38Å; I111-F199 HydrophobicContact CD1-CD2 4.2Å; I111-P202 HydrophobicContact CG2-CB 3.64Å; I111-P202 HydrophobicContact CG2-CG 4.34Å; I111-F260 HydrophobicContact CB-CZ 4.21Å; I111-F260 HydrophobicContact CD1-CE2 4.03Å; I111-F260 HydrophobicContact CD1-CZ 3.6Å; I111-F260 HydrophobicContact CG1-CE2 3.55Å; I111-F260 HydrophobicContact CG1-CZ 3.4Å; I111-F260 VanDerWaalsContact CG1-CZ 3.4Å; I111-F260 HydrophobicContact CG2-CE1 4.35Å; I111-F260 HydrophobicContact CG2-CZ 3.94Å; I111-F268 HydrophobicContact CD1-CE2 4.21Å; I111-F268 HydrophobicContact CD1-CZ 4.04Å
112F92.6Very high91.7Very high31 Ų3116.5 Ų16.514%0.1368%0.079CC..Hα-helixtrans-61.8-43.3176.8-88.9-110.8000111.1S108 A109 L114 S115 F116 I146 V150 P151 P202S108-F112 WeakPolarHBondContact O-CD2 3.26Å; S108-F112 PolarHBondContact O-N 2.71Å; A109-F112 PolarHBondContact O-N 3.25Å; F112-L114 PolarHBondContact O-N 3.39Å; F112-S115 WeakPolarHBondContact O-CB 3.48Å; F112-S115 PolarHBondContact O-N 2.73Å; F112-S115 VanDerWaalsContact O-N 3.16Å; F112-F116 HydrophobicContact CD1-CE2 4.25Å; F112-F116 WeakPolarHBondContact O-CD2 3.44Å; F112-F116 PolarHBondContact O-N 3.43Å; F112-I146 HydrophobicContact CD1-CG2 4.4Å; F112-I146 HydrophobicContact CE1-CG2 4.49Å; F112-V150 HydrophobicContact CE1-CB 4.4Å; F112-V150 HydrophobicContact CE1-CG1 4.14Å; F112-V150 HydrophobicContact CZ-CG1 4.03Å; F112-P151 HydrophobicContact CD2-CG 4.03Å; F112-P151 HydrophobicContact CE2-CG 4.28Å; F112-P151 HydrophobicContact CG-CG 4.26Å; F112-P202 HydrophobicContact CD2-CG 4.44Å; F112-P202 HydrophobicContact CE2-CG 4.04Å
113H93.4Very high91.2Very high0 Ų019.2 Ų19.20%09%0.087CC..Hα-helixtrans-62.6-41.9174.8-7292.7000111.9S64 M65 A109 S110 I111 S115 F116 I117 S147 W148S64-H113 WeakPolarHBondContact CB-NE2 3.42Å; S64-H113 PolarHBondContact OG-NE2 2.92Å; M65-H113 HydrophobicContact CB-CB 3.95Å; M65-H113 HydrophobicContact CE-CB 3.46Å; M65-H113 VanDerWaalsContact CE-CB 3.46Å; M65-H113 HydrophobicContact CG-CB 4.43Å; A109-H113 PolarHBondContact O-N 3.25Å; A109-H113 PolarHBondContact O-ND1 3.06Å; S110-H113 PolarHBondContact O-N 3.48Å; I111-H113 VanDerWaalsContact C-N 3.34Å; I111-H113 PolarHBondContact O-N 3Å; H113-S115 VanDerWaalsContact C-N 3.25Å; H113-S115 PolarHBondContact O-N 3.46Å; H113-F116 PolarHBondContact O-N 2.9Å; H113-I117 WeakPolarHBondContact O-CB 3.29Å; H113-I117 WeakPolarHBondContact O-CG1 3.37Å; H113-I117 PolarHBondContact O-N 3.47Å; H113-S147 WeakPolarHBondContact CE1-CB 3.47Å; H113-W148 AromaticContact CE1-CD1 3.99Å; H113-W148 AromaticContact CE1-NE1 3.66Å; H113-W148 AromaticContact NE2-NE1 3.71Å
114L88.8Confident90.7Very high5 Ų518.5 Ų18.53%0.0268%0.084CC..Hα-helixtrans-59.6-39.1174.4-77.7173.1000111.5M65 S110 I111 F112 S118 M206 V256 F260M65-L114 HydrophobicContact CE-CB 3.99Å; M65-L114 HydrophobicContact CE-CD2 3.52Å; M65-L114 HydrophobicContact CE-CG 3.36Å; M65-L114 HydrophobicContact SD-CD2 4.11Å; M65-L114 HydrophobicContact SD-CG 4.36Å; S110-L114 PolarHBondContact O-N 3.22Å; I111-L114 PolarHBondContact O-N 2.88Å; F112-L114 PolarHBondContact O-N 3.39Å; L114-S118 WeakPolarHBondContact O-CB 3.22Å; L114-S118 PolarHBondContact O-N 3.3Å; L114-S118 PolarHBondContact O-OG 2.94Å; L114-M206 HydrophobicContact CB-CE 3.57Å; L114-M206 HydrophobicContact CB-SD 3.72Å; L114-M206 HydrophobicContact CD1-CE 4.24Å; L114-M206 HydrophobicContact CG-CE 4.38Å; L114-V256 HydrophobicContact CD2-CG1 3.58Å; L114-F260 HydrophobicContact CD1-CB 3.85Å; L114-F260 HydrophobicContact CD1-CD1 4.19Å; L114-F260 HydrophobicContact CD1-CD2 3.52Å; L114-F260 HydrophobicContact CD1-CE2 4.19Å; L114-F260 HydrophobicContact CD1-CG 3.54Å
115S90.5Very high90Very high10 Ų1018.3 Ų18.37%0.078%0.084CC..Hα-helixtrans-66.4-43.9177.6-63.30000112.1I111 F112 H113 S118 I119 P202 M206I111-S115 PolarHBondContact O-N 3.28Å; I111-S115 PolarHBondContact O-OG 3.13Å; F112-S115 WeakPolarHBondContact O-CB 3.48Å; F112-S115 PolarHBondContact O-N 2.73Å; F112-S115 VanDerWaalsContact O-N 3.16Å; H113-S115 VanDerWaalsContact C-N 3.25Å; H113-S115 PolarHBondContact O-N 3.46Å; S115-S118 WeakPolarHBondContact O-CA 3.41Å; S115-S118 WeakPolarHBondContact O-CB 3.35Å; S115-S118 PolarHBondContact O-N 3.44Å; S115-I119 WeakPolarHBondContact O-CG1 3.18Å; S115-I119 PolarHBondContact O-N 2.95Å; S115-P202 WeakPolarHBondContact OG-CB 3.21Å; S115-P202 PolarHBondContact OG-O 3.35Å; S115-M206 WeakPolarHBondContact OG-CG 3.44Å; S115-M206 PolarHBondContact OG-SD 2.95Å
116F92.9Very high89.1Confident32 Ų3218.8 Ų18.814%0.149%0.09CC..Hα-helixtrans-71.2-34.8176.3-71.5-57.1000113.3L61 F112 H113 S118 I119 D120 M143 I146 S147L61-F116 HydrophobicContact CD1-CB 4.36Å; L61-F116 HydrophobicContact CD2-CB 4.43Å; F112-F116 HydrophobicContact CD1-CE2 4.25Å; F112-F116 WeakPolarHBondContact O-CD2 3.44Å; F112-F116 PolarHBondContact O-N 3.43Å; H113-F116 PolarHBondContact O-N 2.9Å; F116-S118 PolarHBondContact O-N 3.05Å; F116-I119 HydrophobicContact CD1-CD1 3.88Å; F116-I119 HydrophobicContact CE1-CD1 4.28Å; F116-I119 PolarHBondContact O-N 3.37Å; F116-D120 PolarHBondContact O-N 3.25Å; F116-M143 HydrophobicContact CB-CB 4.12Å; F116-M143 HydrophobicContact CB-CG 4.25Å; F116-M143 HydrophobicContact CB-SD 3.97Å; F116-M143 HydrophobicContact CD1-CB 3.97Å; F116-M143 HydrophobicContact CD1-CE 4.04Å; F116-M143 HydrophobicContact CD1-CG 3.51Å; F116-M143 HydrophobicContact CD1-SD 3.86Å; F116-M143 HydrophobicContact CD2-CB 4.02Å; F116-M143 HydrophobicContact CD2-CG 4.46Å; F116-M143 HydrophobicContact CE1-CB 4.37Å; F116-M143 HydrophobicContact CE1-CG 3.89Å; F116-M143 HydrophobicContact CE2-CB 4.39Å; F116-M143 WeakPolarHBondContact CE2-O 3.47Å; F116-M143 HydrophobicContact CG-CB 3.78Å; F116-M143 HydrophobicContact CG-CG 3.83Å; F116-M143 HydrophobicContact CG-SD 4.14Å; F116-M143 HydrophobicContact CZ-CG 4.49Å; F116-I146 HydrophobicContact CE2-CB 4.25Å; F116-I146 HydrophobicContact CE2-CG2 4.03Å; F116-I146 HydrophobicContact CZ-CB 4.24Å; F116-I146 HydrophobicContact CZ-CG2 3.9Å; F116-S147 WeakPolarHBondContact CD2-OG 3.11Å; F116-S147 VanDerWaalsContact CE2-OG 3.3Å; F116-S147 WeakPolarHBondContact CE2-OG 3.42Å
117I90.6Very high88.4Confident4 Ų420.5 Ų20.52%0.02110%0.099CC..Hα-helixtrans-58.9-41.3169.2-69.8165.7000109.6T58 L61 I62 M65 H113 I119 D120 R121 L253T58-I117 HydrophobicContact CG2-CG2 4.42Å; L61-I117 HydrophobicContact CB-CD1 4.27Å; L61-I117 HydrophobicContact CB-CG1 3.65Å; L61-I117 HydrophobicContact CD1-CG1 4.11Å; I62-I117 HydrophobicContact CG1-CD1 3.98Å; M65-I117 HydrophobicContact CE-CD1 3.64Å; M65-I117 HydrophobicContact SD-CD1 4.23Å; H113-I117 WeakPolarHBondContact O-CB 3.29Å; H113-I117 WeakPolarHBondContact O-CG1 3.37Å; H113-I117 PolarHBondContact O-N 3.47Å; I117-I119 PolarHBondContact O-N 2.94Å; I117-D120 PolarHBondContact O-N 3.41Å; I117-R121 HydrophobicContact CG2-CG 4.49Å; I117-R121 VanDerWaalsContact O-CG 3.29Å; I117-R121 WeakPolarHBondContact O-CG 3.34Å; I117-R121 PolarHBondContact O-N 3.27Å; I117-L253 HydrophobicContact CG2-CD1 4.21Å; I117-L253 HydrophobicContact CG2-CD2 3.91Å
118S86.8Confident87.9Confident1 Ų123.9 Ų23.91%0.00712%0.12CC..Hα-helixtrans-59.3-45.7175.8-56.90000112.3L114 S115 F116 R121 Y122 I209 Y210L114-S118 WeakPolarHBondContact O-CB 3.22Å; L114-S118 PolarHBondContact O-N 3.3Å; L114-S118 PolarHBondContact O-OG 2.94Å; S115-S118 WeakPolarHBondContact O-CA 3.41Å; S115-S118 WeakPolarHBondContact O-CB 3.35Å; S115-S118 PolarHBondContact O-N 3.44Å; F116-S118 PolarHBondContact O-N 3.05Å; S118-R121 PolarHBondContact O-N 3.32Å; S118-Y122 PolarHBondContact O-N 2.86Å; S118-I209 WeakPolarHBondContact O-CG2 3.17Å; S118-Y210 VanDerWaalsContact CB-CE2 3.47Å; S118-Y210 VanDerWaalsContact OG-CE2 3.25Å; S118-Y210 WeakPolarHBondContact OG-CE2 3.33Å
119I89.6Confident87.4Confident40 Ų4031.6 Ų31.621%0.20516%0.16CC..Hα-helixtrans-65-45.3177.4-67164.8000111.4S115 F116 I117 R121 Y122 Y123 M143 I209S115-I119 WeakPolarHBondContact O-CG1 3.18Å; S115-I119 PolarHBondContact O-N 2.95Å; F116-I119 HydrophobicContact CD1-CD1 3.88Å; F116-I119 HydrophobicContact CE1-CD1 4.28Å; F116-I119 PolarHBondContact O-N 3.37Å; I117-I119 PolarHBondContact O-N 2.94Å; I119-R121 VanDerWaalsContact C-N 3.32Å; I119-R121 PolarHBondContact O-N 3.49Å; I119-Y122 WeakPolarHBondContact O-CB 3.44Å; I119-Y122 PolarHBondContact O-N 2.97Å; I119-Y123 HydrophobicContact CG2-CD2 3.91Å; I119-Y123 HydrophobicContact CG2-CE2 3.66Å; I119-Y123 VanDerWaalsContact O-CD2 3.26Å; I119-Y123 WeakPolarHBondContact O-CD2 2.96Å; I119-Y123 PolarHBondContact O-N 2.9Å; I119-Y123 VanDerWaalsContact O-N 3.13Å; I119-M143 HydrophobicContact CG2-CE 4Å; I119-I209 HydrophobicContact CG1-CD1 3.56Å
120D90.4Very high87Confident0 Ų039.3 Ų39.30%019%0.189CC..Hα-helixtrans-57.1-46.2176165.174.8000111.3T58 L61 F116 I117 Y122 Y123 A124 Y131T58-D120 WeakPolarHBondContact CB-OD2 3.44Å; T58-D120 WeakPolarHBondContact CG2-OD2 3.25Å; T58-D120 PolarHBondContact OG1-OD2 3.45Å; L61-D120 HydrophobicContact CD1-CB 4.21Å; F116-D120 PolarHBondContact O-N 3.25Å; I117-D120 PolarHBondContact O-N 3.41Å; D120-Y122 VanDerWaalsContact C-N 3.34Å; D120-Y122 PolarHBondContact O-N 3.03Å; D120-Y123 PolarHBondContact O-N 2.93Å; D120-A124 PolarHBondContact O-N 3.38Å; D120-Y131 WeakPolarHBondContact OD1-CE2 3.38Å; D120-Y131 PolarHBondContact OD1-OH 3.07Å
121R85.1Confident86.7Confident34 Ų3441 Ų4113%0.12820%0.196CC..Hα-helixtrans-64.6-38.4176.9-69.3-58.690.1-165.3-13.9113.1T58 I117 S118 I119 Y123 A124 V125 I213 L253T58-R121 VanDerWaalsContact OG1-CZ 3.27Å; T58-R121 PolarHBondContact OG1-NH2 3.43Å; I117-R121 HydrophobicContact CG2-CG 4.49Å; I117-R121 VanDerWaalsContact O-CG 3.29Å; I117-R121 WeakPolarHBondContact O-CG 3.34Å; I117-R121 PolarHBondContact O-N 3.27Å; S118-R121 PolarHBondContact O-N 3.32Å; I119-R121 VanDerWaalsContact C-N 3.32Å; I119-R121 PolarHBondContact O-N 3.49Å; R121-Y123 VanDerWaalsContact C-N 3.33Å; R121-Y123 PolarHBondContact O-N 2.87Å; R121-A124 PolarHBondContact O-N 3.42Å; R121-V125 WeakPolarHBondContact O-CG2 3.38Å; R121-V125 PolarHBondContact O-N 3.11Å; R121-I213 HydrophobicContact CB-CD1 4.3Å; R121-L253 HydrophobicContact CG-CD1 3.24Å
122Y85.3Confident86.6Confident86 Ų8649.7 Ų49.734%0.33723%0.233SC..Hα-helixtrans-55.8-50.2175.2174.7-96.5000110.9S118 I119 D120 A124 V125 C126 I209 R212 I213S118-Y122 PolarHBondContact O-N 2.86Å; I119-Y122 WeakPolarHBondContact O-CB 3.44Å; I119-Y122 PolarHBondContact O-N 2.97Å; D120-Y122 VanDerWaalsContact C-N 3.34Å; D120-Y122 PolarHBondContact O-N 3.03Å; Y122-A124 PolarHBondContact O-N 2.72Å; Y122-V125 PolarHBondContact O-N 3.06Å; Y122-C126 HydrophobicContact CD2-CB 4.34Å; Y122-C126 WeakPolarHBondContact CD2-SG 3.48Å; Y122-C126 HydrophobicContact CE1-CB 4.46Å; Y122-C126 HydrophobicContact CE2-CB 4.05Å; Y122-C126 WeakPolarHBondContact CE2-SG 3.04Å; Y122-C126 WeakPolarHBondContact O-CB 3.34Å; Y122-C126 PolarHBondContact O-N 3.5Å; Y122-C126 PolarHBondContact O-SG 3.39Å; Y122-I209 HydrophobicContact CD2-CG2 4.19Å; Y122-I209 HydrophobicContact CG-CG2 4.29Å; Y122-R212 HydrophobicContact CE2-CB 4.45Å; Y122-I213 HydrophobicContact CD2-CG1 4.34Å
123Y86.9Confident86.4Confident74 Ų7452.1 Ų52.129%0.2926%0.259SS..Hα-helixtrans-66.2-38.1178.5-75-69.1000112.6I119 D120 R121 V125 D127 K134 I135I119-Y123 HydrophobicContact CG2-CD2 3.91Å; I119-Y123 HydrophobicContact CG2-CE2 3.66Å; I119-Y123 VanDerWaalsContact O-CD2 3.26Å; I119-Y123 WeakPolarHBondContact O-CD2 2.96Å; I119-Y123 PolarHBondContact O-N 2.9Å; I119-Y123 VanDerWaalsContact O-N 3.13Å; D120-Y123 PolarHBondContact O-N 2.93Å; R121-Y123 VanDerWaalsContact C-N 3.33Å; R121-Y123 PolarHBondContact O-N 2.87Å; Y123-V125 PolarHBondContact O-N 3.17Å; Y123-D127 CarbonylContact O-C 3.56Å; Y123-D127 WeakPolarHBondContact O-CA 3.29Å; Y123-D127 PolarHBondContact O-N 2.82Å; Y123-K134 HydrophobicContact CD1-CD 3.75Å; Y123-K134 HydrophobicContact CE1-CD 3.73Å; Y123-I135 HydrophobicContact CD2-CD1 3.88Å; Y123-I135 HydrophobicContact CD2-CG1 4.23Å; Y123-I135 HydrophobicContact CE2-CD1 4.46Å; Y123-I135 HydrophobicContact CG-CD1 4.45Å; Y123-I135 HydrophobicContact CG-CG1 4.33Å
124A84.4Confident86.2Confident3 Ų356.1 Ų56.13%0.02528%0.277CS..Hα-helixtrans-61.2-43.5177.500000112.1D120 R121 Y122 Y131D120-A124 PolarHBondContact O-N 3.38Å; R121-A124 PolarHBondContact O-N 3.42Å; Y122-A124 PolarHBondContact O-N 2.72Å; A124-Y131 HydrophobicContact CB-CD2 3.92Å; A124-Y131 HydrophobicContact CB-CE2 3.85Å
125V77.7Confident86.4Confident19 Ų1956.3 Ų56.312%0.11528%0.278CS..Hα-helixtrans-84.8-41.7-175.6176.90000112.6R121 Y122 Y123 I213R121-V125 WeakPolarHBondContact O-CG2 3.38Å; R121-V125 PolarHBondContact O-N 3.11Å; Y122-V125 PolarHBondContact O-N 3.06Å; Y123-V125 PolarHBondContact O-N 3.17Å; V125-I213 HydrophobicContact CG1-CG2 4.37Å
126C78.1Confident86.4Confident39 Ų3959.1 Ų59.126%0.26429%0.292SS..Hα-helixtrans-90.7-24.5-170.9-52.40000113.1Y122 I216Y122-C126 HydrophobicContact CD2-CB 4.34Å; Y122-C126 WeakPolarHBondContact CD2-SG 3.48Å; Y122-C126 HydrophobicContact CE1-CB 4.46Å; Y122-C126 HydrophobicContact CE2-CB 4.05Å; Y122-C126 WeakPolarHBondContact CE2-SG 3.04Å; Y122-C126 WeakPolarHBondContact O-CB 3.34Å; Y122-C126 PolarHBondContact O-N 3.5Å; Y122-C126 PolarHBondContact O-SG 3.39Å; C126-I216 HydrophobicContact CB-CD1 4.21Å; C126-I216 WeakPolarHBondContact SG-CD1 3.45Å
127D80.9Confident86.3Confident37 Ų3764 Ų6420%0.19832%0.318CS..  trans-138.761.2179.9-166.2-3000111.7Y123 L129 R130 Y131 K134Y123-D127 CarbonylContact O-C 3.56Å; Y123-D127 WeakPolarHBondContact O-CA 3.29Å; Y123-D127 PolarHBondContact O-N 2.82Å; D127-L129 VanDerWaalsContact C-N 3.28Å; D127-L129 PolarHBondContact O-N 2.83Å; D127-R130 PolarHBondContact O-N 3.35Å; D127-R130 WeakPolarHBondContact OD1-CB 3.45Å; D127-R130 WeakPolarHBondContact OD1-CG 3.44Å; D127-R130 PolarHBondContact OD1-N 3.08Å; D127-R130 WeakPolarHBondContact OD2-CB 3.29Å; D127-Y131 PolarHBondContact O-N 3.4Å; D127-K134 IonicContact OD2-NZ 2.66Å; D127-K134 PolarHBondContact OD2-NZ 3.16Å
128P81.6Confident86.4Confident78 Ų7869.7 Ų69.751%0.50635%0.348SS..THydrogen-bonded Turntrans-62.4-32.4-171.923.6-34.2000113.3
129L82.9Confident86.9Confident169 Ų16971.7 Ų71.789%0.88536%0.36SS*.THydrogen-bonded Turntrans-72.4-32.8-178.4-65.2177.4000112.5D127D127-L129 VanDerWaalsContact C-N 3.28Å; D127-L129 PolarHBondContact O-N 2.83Å
130R85.8Confident87.1Confident161 Ų16170 Ų7061%0.60835%0.352SS*.THydrogen-bonded Turntrans-100-2.5177.8-57.6178.1154-170.2-7.7113D127 K132 A133 K134D127-R130 PolarHBondContact O-N 3.35Å; D127-R130 WeakPolarHBondContact OD1-CB 3.45Å; D127-R130 WeakPolarHBondContact OD1-CG 3.44Å; D127-R130 PolarHBondContact OD1-N 3.08Å; D127-R130 WeakPolarHBondContact OD2-CB 3.29Å; R130-K132 PolarHBondContact O-N 3.43Å; R130-A133 WeakPolarHBondContact O-CB 3.46Å; R130-A133 PolarHBondContact O-N 3.06Å; R130-K134 HydrophobicContact CB-CD 4.3Å; R130-K134 HydrophobicContact CB-CG 4.47Å; R130-K134 PolarHBondContact O-N 3.35Å
131Y87.7Confident87.4Confident37 Ų3773.4 Ų73.415%0.14537%0.374CS..Hα-helixtrans-49.6-52.6-179.3173.5-104.5000112.3D120 A124 D127 A133 K134 I135D120-Y131 WeakPolarHBondContact OD1-CE2 3.38Å; D120-Y131 PolarHBondContact OD1-OH 3.07Å; A124-Y131 HydrophobicContact CB-CD2 3.92Å; A124-Y131 HydrophobicContact CB-CE2 3.85Å; D127-Y131 PolarHBondContact O-N 3.4Å; Y131-A133 PolarHBondContact O-N 3.49Å; Y131-K134 PolarHBondContact O-N 3.07Å; Y131-K134 VanDerWaalsContact O-N 3.14Å; Y131-I135 HydrophobicContact CD2-CB 4.08Å; Y131-I135 HydrophobicContact CD2-CG1 3.94Å; Y131-I135 HydrophobicContact CE2-CB 3.67Å; Y131-I135 HydrophobicContact CE2-CG1 3.7Å; Y131-I135 HydrophobicContact CE2-CG2 3.98Å; Y131-I135 PolarHBondContact O-N 3.21Å
132K86Confident88Confident183 Ų18375.2 Ų75.280%0.79639%0.389SS*.Hα-helixtrans-64.4-27.3-178.8-68.5-173.3178.5-179.30113.9R130R130-K132 PolarHBondContact O-N 3.43Å
133A89.1Confident88.5Confident82 Ų8271.9 Ų71.968%0.67838%0.377SS*.Hα-helixtrans-79.4-34.4176.400000111.6R130 Y131R130-A133 WeakPolarHBondContact O-CB 3.46Å; R130-A133 PolarHBondContact O-N 3.06Å; Y131-A133 PolarHBondContact O-N 3.49Å
134K89.9Confident89Confident85 Ų8570.2 Ų70.237%0.3737%0.372SS..Hα-helixtrans-86.2-40.4-177.9-71.4-178.5171.8175.70113.7Y123 D127 R130 Y131Y123-K134 HydrophobicContact CD1-CD 3.75Å; Y123-K134 HydrophobicContact CE1-CD 3.73Å; D127-K134 IonicContact OD2-NZ 2.66Å; D127-K134 PolarHBondContact OD2-NZ 3.16Å; R130-K134 HydrophobicContact CB-CD 4.3Å; R130-K134 HydrophobicContact CB-CG 4.47Å; R130-K134 PolarHBondContact O-N 3.35Å; Y131-K134 PolarHBondContact O-N 3.07Å; Y131-K134 VanDerWaalsContact O-N 3.14Å
135I92.2Very high89.6Confident9 Ų977 Ų775%0.04640%0.401CS..SBendtrans-110.689.3-178.2-56.9-60.6000108.7P57 Y123 Y131 V139 I140 M143P57-I135 HydrophobicContact CB-CG2 3.99Å; P57-I135 HydrophobicContact CG-CG2 4.48Å; Y123-I135 HydrophobicContact CD2-CD1 3.88Å; Y123-I135 HydrophobicContact CD2-CG1 4.23Å; Y123-I135 HydrophobicContact CE2-CD1 4.46Å; Y123-I135 HydrophobicContact CG-CD1 4.45Å; Y123-I135 HydrophobicContact CG-CG1 4.33Å; Y131-I135 HydrophobicContact CD2-CB 4.08Å; Y131-I135 HydrophobicContact CD2-CG1 3.94Å; Y131-I135 HydrophobicContact CE2-CB 3.67Å; Y131-I135 HydrophobicContact CE2-CG1 3.7Å; Y131-I135 HydrophobicContact CE2-CG2 3.98Å; Y131-I135 PolarHBondContact O-N 3.21Å; I135-V139 HydrophobicContact CD1-CG1 4.13Å; I135-I140 HydrophobicContact CG2-CD1 3.87Å; I135-I140 HydrophobicContact CG2-CG1 4.25Å; I135-M143 HydrophobicContact CD1-CE 4.26Å
136N91.8Very high90.5Very high69 Ų6978.9 Ų78.937%0.36941%0.41SS..  trans-106.3176.1172.965.638.4000110.7L138 V139 I140N136-L138 VanDerWaalsContact C-N 3.28Å; N136-L138 PolarHBondContact O-N 2.95Å; N136-L138 WeakPolarHBondContact OD1-CB 3.49Å; N136-L138 PolarHBondContact OD1-N 3.09Å; N136-V139 PolarHBondContact O-N 3.15Å; N136-V139 PolarHBondContact OD1-N 3.1Å; N136-I140 PolarHBondContact O-N 3.43Å
137I89.6Confident91.3Very high133 Ų13377 Ų7768%0.68240%0.398SS*.Hα-helixtrans-60.1-38.3-177.9-65.2170.8000111.6V139 I140 C141I137-V139 VanDerWaalsContact C-N 3.35Å; I137-V139 PolarHBondContact O-N 3.26Å; I137-I140 PolarHBondContact O-N 3.12Å; I137-C141 PolarHBondContact O-N 3.02Å; I137-C141 PolarHBondContact O-SG 3.49Å; I137-C141 VanDerWaalsContact O-SG 3.32Å
138L93.8Very high92.2Very high125 Ų12578.5 Ų78.565%0.65440%0.4SS*.Hα-helixtrans-60.9-44.8178.117866.1000111.2N136 I140 C141 V142N136-L138 VanDerWaalsContact C-N 3.28Å; N136-L138 PolarHBondContact O-N 2.95Å; N136-L138 WeakPolarHBondContact OD1-CB 3.49Å; N136-L138 PolarHBondContact OD1-N 3.09Å; L138-I140 VanDerWaalsContact C-N 3.32Å; L138-I140 PolarHBondContact O-N 3.33Å; L138-C141 PolarHBondContact O-N 3.28Å; L138-V142 WeakPolarHBondContact O-CG2 3.17Å; L138-V142 PolarHBondContact O-N 3.3Å
139V95.6Very high92.9Very high43 Ų4376.3 Ų76.326%0.26139%0.387SS..Hα-helixtrans-60.8-42.3177.2173.70000111I135 N136 I137 V142 M143I135-V139 HydrophobicContact CD1-CG1 4.13Å; N136-V139 PolarHBondContact O-N 3.15Å; N136-V139 PolarHBondContact OD1-N 3.1Å; I137-V139 VanDerWaalsContact C-N 3.35Å; I137-V139 PolarHBondContact O-N 3.26Å; V139-V142 PolarHBondContact O-N 3.41Å; V139-M143 HydrophobicContact CG1-CE 3.73Å; V139-M143 HydrophobicContact CG1-CG 4.45Å; V139-M143 HydrophobicContact CG1-SD 4.22Å; V139-M143 VanDerWaalsContact O-CG 3.3Å; V139-M143 WeakPolarHBondContact O-CG 3.44Å; V139-M143 PolarHBondContact O-N 3.07Å
140I95.2Very high93.4Very high5 Ų571.2 Ų71.23%0.02636%0.363CS..Hα-helixtrans-64.1-44.2176.3-62-61.7000111.6P57 W60 L61 I135 N136 I137 L138 V142 M143 I144P57-I140 HydrophobicContact CB-CD1 3.81Å; P57-I140 HydrophobicContact CB-CG1 3.74Å; W60-I140 HydrophobicContact CB-CG2 4.03Å; L61-I140 HydrophobicContact CD1-CD1 3.9Å; L61-I140 HydrophobicContact CD2-CG2 4.18Å; L61-I140 HydrophobicContact CG-CD1 4.15Å; L61-I140 HydrophobicContact CG-CG2 4.2Å; I135-I140 HydrophobicContact CG2-CD1 3.87Å; I135-I140 HydrophobicContact CG2-CG1 4.25Å; N136-I140 PolarHBondContact O-N 3.43Å; I137-I140 PolarHBondContact O-N 3.12Å; L138-I140 VanDerWaalsContact C-N 3.32Å; L138-I140 PolarHBondContact O-N 3.33Å; I140-V142 VanDerWaalsContact C-N 3.29Å; I140-V142 PolarHBondContact O-N 2.92Å; I140-M143 HydrophobicContact CD1-SD 4.22Å; I140-M143 PolarHBondContact O-N 3.21Å; I140-I144 HydrophobicContact CG2-CD1 3.91Å; I140-I144 HydrophobicContact CG2-CG1 4.42Å; I140-I144 WeakPolarHBondContact O-CG1 3.5Å; I140-I144 PolarHBondContact O-N 2.96Å
141C95.9Very high93.9Very high71 Ų7163.8 Ų63.848%0.4834%0.335SS..Hα-helixtrans-59.5-40.7175.6-69.30000111.7I137 L138 I144 F145I137-C141 PolarHBondContact O-N 3.02Å; I137-C141 PolarHBondContact O-SG 3.49Å; I137-C141 VanDerWaalsContact O-SG 3.32Å; L138-C141 PolarHBondContact O-N 3.28Å; C141-I144 PolarHBondContact O-N 3.06Å; C141-F145 WeakPolarHBondContact O-CB 3.5Å; C141-F145 PolarHBondContact O-N 2.89Å
142V97.3Very high94.3Very high71 Ų7163.2 Ų63.243%0.4334%0.339SS..Hα-helixtrans-64.7-45.8175170.30000111.3L138 V139 I140 I144 F145 I146L138-V142 WeakPolarHBondContact O-CG2 3.17Å; L138-V142 PolarHBondContact O-N 3.3Å; V139-V142 PolarHBondContact O-N 3.41Å; I140-V142 VanDerWaalsContact C-N 3.29Å; I140-V142 PolarHBondContact O-N 2.92Å; V142-I144 VanDerWaalsContact C-N 3.33Å; V142-I144 PolarHBondContact O-N 3.07Å; V142-F145 PolarHBondContact O-N 3.35Å; V142-I146 HydrophobicContact CG1-CD1 3.76Å; V142-I146 HydrophobicContact CG1-CG1 4.41Å; V142-I146 VanDerWaalsContact O-CG1 3.32Å; V142-I146 WeakPolarHBondContact O-CG1 3.36Å; V142-I146 PolarHBondContact O-N 3.29Å
143M96.4Very high94.7Very high17 Ų1759.9 Ų59.98%0.08433%0.333CS..Hα-helixtrans-58.5-44.2176.1-72.2177.4171.900111.8L61 F116 I119 I135 V139 I140 S147L61-M143 HydrophobicContact CD1-SD 4.49Å; L61-M143 HydrophobicContact CD2-CB 4.14Å; F116-M143 HydrophobicContact CB-CB 4.12Å; F116-M143 HydrophobicContact CB-CG 4.25Å; F116-M143 HydrophobicContact CB-SD 3.97Å; F116-M143 HydrophobicContact CD1-CB 3.97Å; F116-M143 HydrophobicContact CD1-CE 4.04Å; F116-M143 HydrophobicContact CD1-CG 3.51Å; F116-M143 HydrophobicContact CD1-SD 3.86Å; F116-M143 HydrophobicContact CD2-CB 4.02Å; F116-M143 HydrophobicContact CD2-CG 4.46Å; F116-M143 HydrophobicContact CE1-CB 4.37Å; F116-M143 HydrophobicContact CE1-CG 3.89Å; F116-M143 HydrophobicContact CE2-CB 4.39Å; F116-M143 WeakPolarHBondContact CE2-O 3.47Å; F116-M143 HydrophobicContact CG-CB 3.78Å; F116-M143 HydrophobicContact CG-CG 3.83Å; F116-M143 HydrophobicContact CG-SD 4.14Å; F116-M143 HydrophobicContact CZ-CG 4.49Å; I119-M143 HydrophobicContact CG2-CE 4Å; I135-M143 HydrophobicContact CD1-CE 4.26Å; V139-M143 HydrophobicContact CG1-CE 3.73Å; V139-M143 HydrophobicContact CG1-CG 4.45Å; V139-M143 HydrophobicContact CG1-SD 4.22Å; V139-M143 VanDerWaalsContact O-CG 3.3Å; V139-M143 WeakPolarHBondContact O-CG 3.44Å; V139-M143 PolarHBondContact O-N 3.07Å; I140-M143 HydrophobicContact CD1-SD 4.22Å; I140-M143 PolarHBondContact O-N 3.21Å; M143-S147 WeakPolarHBondContact O-CB 3.2Å; M143-S147 PolarHBondContact O-N 3.28Å; M143-S147 PolarHBondContact O-OG 2.74Å
144I97.6Very high94.9Very high39 Ų3958.1 Ų58.120%0.231%0.31CS..Hα-helixtrans-61.8-51.7175.1-68.7171.3000109.6L61 I140 C141 V142 I146 S147 W148L61-I144 HydrophobicContact CD2-CD1 4.47Å; L61-I144 HydrophobicContact CD2-CG1 3.79Å; I140-I144 HydrophobicContact CG2-CD1 3.91Å; I140-I144 HydrophobicContact CG2-CG1 4.42Å; I140-I144 WeakPolarHBondContact O-CG1 3.5Å; I140-I144 PolarHBondContact O-N 2.96Å; C141-I144 PolarHBondContact O-N 3.06Å; V142-I144 VanDerWaalsContact C-N 3.33Å; V142-I144 PolarHBondContact O-N 3.07Å; I144-I146 VanDerWaalsContact C-N 3.31Å; I144-I146 PolarHBondContact O-N 2.65Å; I144-S147 WeakPolarHBondContact O-CB 3.24Å; I144-S147 PolarHBondContact O-N 3.2Å; I144-W148 VanDerWaalsContact O-CD1 3.23Å; I144-W148 PolarHBondContact O-N 3.44Å; I144-W148 VanDerWaalsContact O-N 3.13Å
145F97.6Very high95.1Very high145 Ų14554 Ų5464%0.63629%0.293SS*.Hα-helixtrans-54.8-45.7-179.9178.1-98.1000112.4C141 V142 S147 W148 S149C141-F145 WeakPolarHBondContact O-CB 3.5Å; C141-F145 PolarHBondContact O-N 2.89Å; V142-F145 PolarHBondContact O-N 3.35Å; F145-S147 VanDerWaalsContact C-N 3.34Å; F145-S147 PolarHBondContact O-N 2.99Å; F145-W148 PolarHBondContact O-N 3.29Å; F145-S149 VanDerWaalsContact O-CB 3.3Å; F145-S149 WeakPolarHBondContact O-CB 3.39Å; F145-S149 PolarHBondContact O-N 3.37Å; F145-S149 PolarHBondContact O-OG 3.39Å
146I95.9Very high95.2Very high58 Ų5857 Ų5730%0.29731%0.305SS..Hα-helixtrans-61.9-43.2176-67.9168.2000111F112 F116 V142 I144 W148 S149 V150 P151F112-I146 HydrophobicContact CD1-CG2 4.4Å; F112-I146 HydrophobicContact CE1-CG2 4.49Å; F116-I146 HydrophobicContact CE2-CB 4.25Å; F116-I146 HydrophobicContact CE2-CG2 4.03Å; F116-I146 HydrophobicContact CZ-CB 4.24Å; F116-I146 HydrophobicContact CZ-CG2 3.9Å; V142-I146 HydrophobicContact CG1-CD1 3.76Å; V142-I146 HydrophobicContact CG1-CG1 4.41Å; V142-I146 VanDerWaalsContact O-CG1 3.32Å; V142-I146 WeakPolarHBondContact O-CG1 3.36Å; V142-I146 PolarHBondContact O-N 3.29Å; I144-I146 VanDerWaalsContact C-N 3.31Å; I144-I146 PolarHBondContact O-N 2.65Å; I146-W148 PolarHBondContact O-N 2.97Å; I146-S149 PolarHBondContact O-N 2.96Å; I146-V150 HydrophobicContact CG2-CG2 3.96Å; I146-V150 WeakPolarHBondContact O-CB 3.27Å; I146-V150 PolarHBondContact O-N 3.47Å; I146-V150 VanDerWaalsContact O-N 3.07Å; I146-P151 WeakPolarHBondContact O-CD 3.17Å
147S95.9Very high95.3Very high0 Ų054.8 Ų54.80%030%0.299CS..Hα-helixtrans-63.8-24-178.4-56.20000113.9A109 H113 F116 M143 I144 F145 P151A109-S147 WeakPolarHBondContact CA-O 3.44Å; A109-S147 VanDerWaalsContact CB-O 3.24Å; A109-S147 WeakPolarHBondContact CB-O 3.32Å; H113-S147 WeakPolarHBondContact CE1-CB 3.47Å; F116-S147 WeakPolarHBondContact CD2-OG 3.11Å; F116-S147 VanDerWaalsContact CE2-OG 3.3Å; F116-S147 WeakPolarHBondContact CE2-OG 3.42Å; M143-S147 WeakPolarHBondContact O-CB 3.2Å; M143-S147 PolarHBondContact O-N 3.28Å; M143-S147 PolarHBondContact O-OG 2.74Å; I144-S147 WeakPolarHBondContact O-CB 3.24Å; I144-S147 PolarHBondContact O-N 3.2Å; F145-S147 VanDerWaalsContact C-N 3.34Å; F145-S147 PolarHBondContact O-N 2.99Å; S147-P151 WeakPolarHBondContact O-CD 3.3Å; S147-P151 VanDerWaalsContact O-CG 3.32Å; S147-P151 WeakPolarHBondContact O-CG 3.41Å
148W97.8Very high95.5Very high68 Ų6849.1 Ų49.126%0.25827%0.27SS..Hα-helixtrans-93.4-49.1174-73.693.2000111.8S64 T67 V68 L71 L106 H113 I144 F145 I146 A152S64-W148 PolarHBondContact OG-NE1 3.33Å; T67-W148 HydrophobicContact CG2-CH2 4.25Å; T67-W148 HydrophobicContact CG2-CZ2 4.25Å; V68-W148 HydrophobicContact CB-CH2 4.45Å; V68-W148 HydrophobicContact CG2-CD2 4.49Å; V68-W148 HydrophobicContact CG2-CH2 3.52Å; V68-W148 HydrophobicContact CG2-CZ2 3.35Å; V68-W148 HydrophobicContact CG2-CZ3 4.17Å; L71-W148 HydrophobicContact CD1-CH2 3.83Å; L71-W148 HydrophobicContact CD1-CZ3 4.15Å; L106-W148 HydrophobicContact CD2-CZ3 4.09Å; H113-W148 AromaticContact CE1-CD1 3.99Å; H113-W148 AromaticContact CE1-NE1 3.66Å; H113-W148 AromaticContact NE2-NE1 3.71Å; I144-W148 VanDerWaalsContact O-CD1 3.23Å; I144-W148 PolarHBondContact O-N 3.44Å; I144-W148 VanDerWaalsContact O-N 3.13Å; F145-W148 PolarHBondContact O-N 3.29Å; I146-W148 PolarHBondContact O-N 2.97Å; W148-A152 WeakPolarHBondContact O-CB 3.41Å; W148-A152 PolarHBondContact O-N 3.36Å; W148-A152 VanDerWaalsContact O-N 3.1Å
149S96.8Very high95.5Very high33 Ų3343.6 Ų43.623%0.23124%0.241CC..Hα-helixtrans-70.2-45.8-170.356.90000113.4F145 I146 A152 V153F145-S149 VanDerWaalsContact O-CB 3.3Å; F145-S149 WeakPolarHBondContact O-CB 3.39Å; F145-S149 PolarHBondContact O-N 3.37Å; F145-S149 PolarHBondContact O-OG 3.39Å; I146-S149 PolarHBondContact O-N 2.96Å; S149-A152 PolarHBondContact O-N 2.86Å; S149-V153 WeakPolarHBondContact O-CG2 3.4Å; S149-V153 PolarHBondContact O-N 3.25Å
150V94.1Very high95.4Very high62 Ų6246 Ų4638%0.37625%0.248SC..Hα-helixtrans-64.4-50.2-177.2171.60000111.1F112 I146 A152 F154F112-V150 HydrophobicContact CE1-CB 4.4Å; F112-V150 HydrophobicContact CE1-CG1 4.14Å; F112-V150 HydrophobicContact CZ-CG1 4.03Å; I146-V150 HydrophobicContact CG2-CG2 3.96Å; I146-V150 WeakPolarHBondContact O-CB 3.27Å; I146-V150 PolarHBondContact O-N 3.47Å; I146-V150 VanDerWaalsContact O-N 3.07Å; V150-A152 VanDerWaalsContact C-N 3.32Å; V150-A152 PolarHBondContact O-N 2.68Å; V150-F154 VanDerWaalsContact O-CB 3.25Å; V150-F154 WeakPolarHBondContact O-CB 3.38Å; V150-F154 PolarHBondContact O-N 2.95Å
151P95.6Very high95.3Very high4 Ų451.7 Ų51.73%0.02628%0.278CS..Hα-helixtrans-59.2-38.1172.4-30.340.9000114.1M105 A109 F112 I146 S147 A155M105-P151 HydrophobicContact CG-CB 4.32Å; A109-P151 HydrophobicContact CB-CB 4.37Å; A109-P151 HydrophobicContact CB-CG 4.31Å; F112-P151 HydrophobicContact CD2-CG 4.03Å; F112-P151 HydrophobicContact CE2-CG 4.28Å; F112-P151 HydrophobicContact CG-CG 4.26Å; I146-P151 WeakPolarHBondContact O-CD 3.17Å; S147-P151 WeakPolarHBondContact O-CD 3.3Å; S147-P151 VanDerWaalsContact O-CG 3.32Å; S147-P151 WeakPolarHBondContact O-CG 3.41Å; P151-A155 WeakPolarHBondContact O-CB 3.21Å; P151-A155 PolarHBondContact O-N 3.3Å
152A96.3Very high95.1Very high26 Ų2652.4 Ų52.422%0.21527%0.274CS..Hα-helixtrans-65.1-52.4179.400000111.8M105 W148 S149 V150 F154 A155 F156M105-A152 HydrophobicContact CG-CB 4.03Å; M105-A152 HydrophobicContact SD-CB 3.55Å; M105-A152 VanDerWaalsContact SD-CB 3.55Å; W148-A152 WeakPolarHBondContact O-CB 3.41Å; W148-A152 PolarHBondContact O-N 3.36Å; W148-A152 VanDerWaalsContact O-N 3.1Å; S149-A152 PolarHBondContact O-N 2.86Å; V150-A152 VanDerWaalsContact C-N 3.32Å; V150-A152 PolarHBondContact O-N 2.68Å; A152-F154 PolarHBondContact O-N 3.36Å; A152-A155 PolarHBondContact O-N 3.43Å; A152-F156 WeakPolarHBondContact O-CB 3.39Å; A152-F156 WeakPolarHBondContact O-CD2 3.26Å; A152-F156 PolarHBondContact O-N 3.41Å
153V95.5Very high94.7Very high112 Ų11252.1 Ų52.168%0.67927%0.27SS*.Hα-helixtrans-58.3-43.3178.3171.60000110.2S149 G157S149-V153 WeakPolarHBondContact O-CG2 3.4Å; S149-V153 PolarHBondContact O-N 3.25Å; V153-G157 WeakPolarHBondContact O-CA 3.37Å; V153-G157 PolarHBondContact O-N 3.38Å
154F92.7Very high94.4Very high45 Ų4551.9 Ų51.920%0.19727%0.269CS..Hα-helixtrans-62.4-55.1178.1-173.9-98000112.4V150 A152 M158 A194 T197V150-F154 VanDerWaalsContact O-CB 3.25Å; V150-F154 WeakPolarHBondContact O-CB 3.38Å; V150-F154 PolarHBondContact O-N 2.95Å; A152-F154 PolarHBondContact O-N 3.36Å; F154-M158 HydrophobicContact CE1-CE 3.63Å; F154-M158 HydrophobicContact CE1-SD 3.8Å; F154-M158 HydrophobicContact CE2-CE 3.82Å; F154-M158 HydrophobicContact CZ-CE 3.11Å; F154-M158 HydrophobicContact CZ-SD 3.95Å; F154-M158 WeakPolarHBondContact O-CB 3.18Å; F154-M158 PolarHBondContact O-N 3.48Å; F154-A194 HydrophobicContact CE1-CB 4.07Å; F154-A194 VanDerWaalsContact CZ-CA 3.43Å; F154-A194 HydrophobicContact CZ-CB 4.1Å; F154-T197 HydrophobicContact CD2-CG2 4.43Å; F154-T197 HydrophobicContact CE2-CG2 4.48Å
155A94Very high93.9Very high0 Ų051.3 Ų51.30%027%0.265CS..Hα-helixtrans-69.3-42.3-172.800000113.2S101 I104 M105 P151 A152 I159S101-A155 VanDerWaalsContact O-CB 3.31Å; S101-A155 WeakPolarHBondContact O-CB 3.36Å; S101-A155 PolarHBondContact OG-O 2.92Å; I104-A155 HydrophobicContact CB-CB 3.86Å; I104-A155 HydrophobicContact CG2-CB 3.71Å; M105-A155 HydrophobicContact CB-CB 3.91Å; P151-A155 WeakPolarHBondContact O-CB 3.21Å; P151-A155 PolarHBondContact O-N 3.3Å; A152-A155 PolarHBondContact O-N 3.43Å; A155-I159 WeakPolarHBondContact O-CG1 3.34Å; A155-I159 PolarHBondContact O-N 2.99Å
156F95.1Very high93.5Very high70 Ų7050.8 Ų50.831%0.30726%0.262SS..Hα-helixtrans-72.5-43.9177.2-78.5-95.9000110.9M105 A152 M158 I159 F160M105-F156 HydrophobicContact CB-CE2 4.48Å; M105-F156 HydrophobicContact CE-CE2 4.5Å; M105-F156 HydrophobicContact SD-CD2 4.42Å; M105-F156 HydrophobicContact SD-CE2 3.8Å; A152-F156 WeakPolarHBondContact O-CB 3.39Å; A152-F156 WeakPolarHBondContact O-CD2 3.26Å; A152-F156 PolarHBondContact O-N 3.41Å; F156-M158 VanDerWaalsContact C-N 3.34Å; F156-M158 PolarHBondContact O-N 2.95Å; F156-I159 PolarHBondContact O-N 3.39Å; F156-F160 AromaticContact CD1-CD2 3.98Å; F156-F160 HydrophobicContact CD1-CD2 3.98Å; F156-F160 AromaticContact CD1-CE2 3.7Å; F156-F160 HydrophobicContact CD1-CE2 3.7Å; F156-F160 HydrophobicContact CE1-CE2 4.12Å; F156-F160 WeakPolarHBondContact O-CB 3.49Å; F156-F160 PolarHBondContact O-N 3.18Å
157G93.9Very high93Very high24 Ų2451.2 Ų51.225%0.24728%0.282CS..Hα-helixtrans-59.4-44.3175.900000112.2V153 I159 L161V153-G157 WeakPolarHBondContact O-CA 3.37Å; V153-G157 PolarHBondContact O-N 3.38Å; G157-I159 PolarHBondContact O-N 3.2Å; G157-L161 WeakPolarHBondContact O-CB 3.48Å; G157-L161 VanDerWaalsContact O-CG 3.31Å; G157-L161 WeakPolarHBondContact O-CG 3.34Å; G157-L161 PolarHBondContact O-N 3.47Å; G157-L161 VanDerWaalsContact O-N 3.13Å
158M92.3Very high92.5Very high13 Ų1351.7 Ų51.76%0.06429%0.286CS..Hα-helixtrans-62.4-39.7-178.9176.9168.3-82.500113.7F154 F156 L163 N164 F186 A194F154-M158 HydrophobicContact CE1-CE 3.63Å; F154-M158 HydrophobicContact CE1-SD 3.8Å; F154-M158 HydrophobicContact CE2-CE 3.82Å; F154-M158 HydrophobicContact CZ-CE 3.11Å; F154-M158 HydrophobicContact CZ-SD 3.95Å; F154-M158 WeakPolarHBondContact O-CB 3.18Å; F154-M158 PolarHBondContact O-N 3.48Å; F156-M158 VanDerWaalsContact C-N 3.34Å; F156-M158 PolarHBondContact O-N 2.95Å; M158-L163 PolarHBondContact O-N 3.25Å; M158-N164 HydrophobicContact CG-CB 3.99Å; M158-N164 PolarHBondContact O-N 2.82Å; M158-N164 VanDerWaalsContact O-N 3.12Å; M158-F186 HydrophobicContact CG-CE1 4.2Å; M158-F186 HydrophobicContact SD-CD1 4.09Å; M158-F186 HydrophobicContact SD-CE1 3.35Å; M158-F186 WeakPolarHBondContact SD-CE1 3.44Å; M158-F186 HydrophobicContact SD-CZ 4.16Å; M158-A194 HydrophobicContact CE-CB 3.95Å; M158-A194 HydrophobicContact SD-CB 3.93Å
159I93.8Very high92Very high9 Ų952.6 Ų52.65%0.04629%0.292CS..Hα-helixtrans-89.8-44.3-175.7-60.3-63.7000112K97 T100 S101 I104 A155 F156 G157 E162 N164K97-I159 HydrophobicContact CB-CG2 3.98Å; K97-I159 HydrophobicContact CG-CG2 4.06Å; T100-I159 HydrophobicContact CG2-CD1 3.82Å; T100-I159 HydrophobicContact CG2-CG1 4.2Å; S101-I159 VanDerWaalsContact OG-CB 3.26Å; S101-I159 WeakPolarHBondContact OG-CB 3.32Å; S101-I159 WeakPolarHBondContact OG-CG1 3.3Å; I104-I159 HydrophobicContact CD1-CD1 4.12Å; I104-I159 HydrophobicContact CD1-CG1 4.23Å; A155-I159 WeakPolarHBondContact O-CG1 3.34Å; A155-I159 PolarHBondContact O-N 2.99Å; F156-I159 PolarHBondContact O-N 3.39Å; G157-I159 PolarHBondContact O-N 3.2Å; I159-E162 PolarHBondContact O-N 2.87Å; I159-E162 VanDerWaalsContact O-N 3.11Å; I159-N164 HydrophobicContact CD1-CB 3.98Å
160F93.7Very high91.3Very high95 Ų9559.1 Ų59.142%0.41732%0.319SS..Hα-helixtrans-74.6-29.5-177.1-82.9-98.3000113.1K97 I98 F156K97-F160 HydrophobicContact CB-CE2 4.32Å; K97-F160 HydrophobicContact CB-CZ 4.25Å; I98-F160 HydrophobicContact CG1-CZ 3.91Å; F156-F160 AromaticContact CD1-CD2 3.98Å; F156-F160 HydrophobicContact CD1-CD2 3.98Å; F156-F160 AromaticContact CD1-CE2 3.7Å; F156-F160 HydrophobicContact CD1-CE2 3.7Å; F156-F160 HydrophobicContact CE1-CE2 4.12Å; F156-F160 WeakPolarHBondContact O-CB 3.49Å; F156-F160 PolarHBondContact O-N 3.18Å
161L93.1Very high90.8Very high123 Ų12359.6 Ų59.664%0.64432%0.319SS*.THydrogen-bonded Turntrans-866.7170.1-54.6175.3000112.3G157 L163G157-L161 WeakPolarHBondContact O-CB 3.48Å; G157-L161 VanDerWaalsContact O-CG 3.31Å; G157-L161 WeakPolarHBondContact O-CG 3.34Å; G157-L161 PolarHBondContact O-N 3.47Å; G157-L161 VanDerWaalsContact O-N 3.13Å; L161-L163 HydrophobicContact CB-CD1 4.16Å; L161-L163 HydrophobicContact CB-CG 3.88Å; L161-L163 HydrophobicContact CD1-CD1 4.29Å; L161-L163 PolarHBondContact O-N 2.79Å
162E91.1Very high90.2Very high86 Ų8661.8 Ų61.840%0.40233%0.327SS..THydrogen-bonded Turntrans56.125.3176-64.4-176.117100113.6K97 I159 N164 F165K97-E162 IonicContact NZ-OE1 2.67Å; K97-E162 PolarHBondContact NZ-OE1 2.69Å; I159-E162 PolarHBondContact O-N 2.87Å; I159-E162 VanDerWaalsContact O-N 3.11Å; E162-N164 PolarHBondContact O-N 3.47Å; E162-F165 HydrophobicContact CB-CE1 3.65Å; E162-F165 HydrophobicContact CB-CE2 4.32Å; E162-F165 HydrophobicContact CB-CZ 3.53Å; E162-F165 HydrophobicContact CG-CE1 3.83Å; E162-F165 HydrophobicContact CG-CZ 3.81Å
163L89.7Confident89.5Confident66 Ų6664.5 Ų64.535%0.34634%0.344SS..G310 helixtrans-69-24.7178.6-61.2175.5000111.1M158 L161 F165 K166 S190M158-L163 PolarHBondContact O-N 3.25Å; L161-L163 HydrophobicContact CB-CD1 4.16Å; L161-L163 HydrophobicContact CB-CG 3.88Å; L161-L163 HydrophobicContact CD1-CD1 4.29Å; L161-L163 PolarHBondContact O-N 2.79Å; L163-F165 VanDerWaalsContact C-N 3.25Å; L163-F165 PolarHBondContact O-N 3.13Å; L163-K166 HydrophobicContact CD2-CD 4.04Å; L163-K166 PolarHBondContact O-N 2.68Å; L163-S190 WeakPolarHBondContact O-CB 3.39Å; L163-S190 PolarHBondContact O-OG 2.92Å
164N89.4Confident88.5Confident11 Ų1167.3 Ų67.36%0.05935%0.347CS..G310 helixtrans-58.6-34.9-17868.5-66.4000112.7M158 I159 E162 F185 F186 S187 S190M158-N164 HydrophobicContact CG-CB 3.99Å; M158-N164 PolarHBondContact O-N 2.82Å; M158-N164 VanDerWaalsContact O-N 3.12Å; I159-N164 HydrophobicContact CD1-CB 3.98Å; E162-N164 PolarHBondContact O-N 3.47Å; N164-F185 WeakPolarHBondContact CB-O 3.25Å; N164-F185 PolarHBondContact ND2-O 2.86Å; N164-F186 HydrophobicContact CB-CD1 3.82Å; N164-F186 HydrophobicContact CB-CE1 3.88Å; N164-F186 CarbonylContact O-C 3.58Å; N164-F186 VanDerWaalsContact O-CA 3.26Å; N164-F186 WeakPolarHBondContact O-CA 3.28Å; N164-S187 PolarHBondContact O-N 3Å; N164-S190 WeakPolarHBondContact O-CB 3.34Å
165F88.5Confident87.7Confident27 Ų2771.8 Ų71.812%0.11837%0.368CS..G310 helixtrans-112.67179.462.1-98.3000114.4E162 L163 G167 A168 E169 Y172 F185E162-F165 HydrophobicContact CB-CE1 3.65Å; E162-F165 HydrophobicContact CB-CE2 4.32Å; E162-F165 HydrophobicContact CB-CZ 3.53Å; E162-F165 HydrophobicContact CG-CE1 3.83Å; E162-F165 HydrophobicContact CG-CZ 3.81Å; L163-F165 VanDerWaalsContact C-N 3.25Å; L163-F165 PolarHBondContact O-N 3.13Å; F165-G167 PolarHBondContact O-N 3.4Å; F165-A168 CarbonylContact O-C 3.57Å; F165-A168 WeakPolarHBondContact O-CA 3.49Å; F165-A168 PolarHBondContact O-N 3.21Å; F165-E169 HydrophobicContact CD2-CG 4.01Å; F165-E169 HydrophobicContact CE2-CG 4.19Å; F165-E169 PolarHBondContact O-N 3.46Å; F165-Y172 HydrophobicContact CB-CD2 4.46Å; F165-Y172 HydrophobicContact CB-CG 4.24Å; F165-Y172 HydrophobicContact CD1-CD1 4.42Å; F165-Y172 HydrophobicContact CD1-CE1 4.4Å; F165-Y172 HydrophobicContact CD2-CD1 4.39Å; F165-Y172 HydrophobicContact CE1-CE1 4.38Å; F165-Y172 HydrophobicContact CG-CD1 4.28Å; F165-Y172 HydrophobicContact CG-CG 4.27Å; F165-F185 HydrophobicContact CB-CD1 3.61Å; F165-F185 HydrophobicContact CB-CE1 3.73Å
166K88.4Confident86.9Confident134 Ų13473.6 Ų73.658%0.58338%0.379SS*.THydrogen-bonded Turntrans-56.2127.8178.3-171.8174.1-177.3176.10111.5L163 A168 E169 S187L163-K166 HydrophobicContact CD2-CD 4.04Å; L163-K166 PolarHBondContact O-N 2.68Å; K166-A168 VanDerWaalsContact C-N 3.31Å; K166-E169 WeakPolarHBondContact CA-OE1 3.44Å; K166-S187 WeakPolarHBondContact O-CB 3.47Å; K166-S187 PolarHBondContact O-OG 2.89Å
167G84.8Confident86.2Confident68 Ų6874.3 Ų74.370%0.70138%0.383SS*.THydrogen-bonded Turntrans78.87.8-173.900000115F165 E169F165-G167 PolarHBondContact O-N 3.4Å; G167-E169 VanDerWaalsContact C-OE2 3.32Å; G167-E169 VanDerWaalsContact CA-OE2 3.24Å; G167-E169 WeakPolarHBondContact CA-OE2 3.48Å; G167-E169 VanDerWaalsContact N-CD 3.26Å; G167-E169 PolarHBondContact N-OE1 3.27Å; G167-E169 PolarHBondContact N-OE2 3.1Å
168A86.6Confident85.7Confident10 Ų1075.2 Ų75.28%0.08339%0.385CS..  trans-139.126174.800000111.8F165 K166 E170 I171 Y172 F185F165-A168 CarbonylContact O-C 3.57Å; F165-A168 WeakPolarHBondContact O-CA 3.49Å; F165-A168 PolarHBondContact O-N 3.21Å; K166-A168 VanDerWaalsContact C-N 3.31Å; A168-E170 PolarHBondContact O-N 3.07Å; A168-I171 PolarHBondContact O-N 2.9Å; A168-Y172 PolarHBondContact O-N 3Å; A168-F185 HydrophobicContact CB-CE1 3.97Å; A168-F185 HydrophobicContact CB-CZ 4.09Å
169E86.3Confident85.1Confident86 Ų8680 Ų8040%0.40240%0.403SS..Hα-helixtrans-58.8-45.3-174-62.680179.900111.7F165 K166 G167 I171 Y172 C173F165-E169 HydrophobicContact CD2-CG 4.01Å; F165-E169 HydrophobicContact CE2-CG 4.19Å; F165-E169 PolarHBondContact O-N 3.46Å; K166-E169 WeakPolarHBondContact CA-OE1 3.44Å; G167-E169 VanDerWaalsContact C-OE2 3.32Å; G167-E169 VanDerWaalsContact CA-OE2 3.24Å; G167-E169 WeakPolarHBondContact CA-OE2 3.48Å; G167-E169 VanDerWaalsContact N-CD 3.26Å; G167-E169 PolarHBondContact N-OE1 3.27Å; G167-E169 PolarHBondContact N-OE2 3.1Å; E169-I171 VanDerWaalsContact C-N 3.34Å; E169-I171 PolarHBondContact O-N 3.23Å; E169-Y172 PolarHBondContact O-N 2.69Å; E169-C173 WeakPolarHBondContact O-CB 2.81Å; E169-C173 PolarHBondContact O-N 2.92Å; E169-C173 PolarHBondContact O-SG 2.75Å; E169-C173 VanDerWaalsContact O-SG 3.42Å
170E83.3Confident84.5Confident170 Ų17080.1 Ų80.179%0.79441%0.406SS*.Hα-helixtrans-62.9-40.1-179.1-67.3-174.6173.100112.4A168 K174A168-E170 PolarHBondContact O-N 3.07Å; E170-K174 VanDerWaalsContact O-CB 3.25Å; E170-K174 WeakPolarHBondContact O-CB 3.09Å; E170-K174 PolarHBondContact O-N 3.22Å; E170-K174 VanDerWaalsContact O-N 3.13Å
171I82.3Confident84Confident72 Ų7277 Ų7737%0.36940%0.401SS..Hα-helixtrans-67.2-45.9178.6-61.8174.6000109.5A168 E169 K174 H175 F185 Y279A168-I171 PolarHBondContact O-N 2.9Å; E169-I171 VanDerWaalsContact C-N 3.34Å; E169-I171 PolarHBondContact O-N 3.23Å; I171-K174 PolarHBondContact O-N 2.77Å; I171-H175 PolarHBondContact O-N 2.87Å; I171-F185 HydrophobicContact CG2-CE2 4.42Å; I171-F185 HydrophobicContact CG2-CZ 4.32Å; I171-Y279 HydrophobicContact CD1-CE2 4.09Å; I171-Y279 HydrophobicContact CG2-CD2 3.78Å; I171-Y279 HydrophobicContact CG2-CE2 3.78Å
172Y83.2Confident83.8Confident51 Ų5171.5 Ų71.520%0.237%0.372CS..Iπ-helixtrans-58.5-53178.2177.2-102.8000111.3F165 A168 E169 K174 V176 H177 F185F165-Y172 HydrophobicContact CB-CD2 4.46Å; F165-Y172 HydrophobicContact CB-CG 4.24Å; F165-Y172 HydrophobicContact CD1-CD1 4.42Å; F165-Y172 HydrophobicContact CD1-CE1 4.4Å; F165-Y172 HydrophobicContact CD2-CD1 4.39Å; F165-Y172 HydrophobicContact CE1-CE1 4.38Å; F165-Y172 HydrophobicContact CG-CD1 4.28Å; F165-Y172 HydrophobicContact CG-CG 4.27Å; A168-Y172 PolarHBondContact O-N 3Å; E169-Y172 PolarHBondContact O-N 2.69Å; Y172-K174 VanDerWaalsContact C-N 3.31Å; Y172-K174 PolarHBondContact O-N 3.46Å; Y172-V176 HydrophobicContact CD2-CB 3.96Å; Y172-V176 HydrophobicContact CD2-CG1 4Å; Y172-V176 HydrophobicContact CE2-CB 4.38Å; Y172-V176 HydrophobicContact CE2-CG1 4.04Å; Y172-V176 CarbonylContact O-C 3.41Å; Y172-V176 WeakPolarHBondContact O-CA 3.22Å; Y172-V176 WeakPolarHBondContact O-CB 3.32Å; Y172-V176 PolarHBondContact O-N 2.97Å; Y172-H177 HydrophobicContact CD1-CB 4.36Å; Y172-H177 HydrophobicContact CE1-CB 4.09Å; Y172-H177 WeakPolarHBondContact O-CB 3.26Å; Y172-H177 PolarHBondContact O-N 3.27Å; Y172-F185 HydrophobicContact CD2-CB 3.9Å; Y172-F185 AromaticContact CD2-CD1 3.78Å; Y172-F185 HydrophobicContact CD2-CD1 3.78Å; Y172-F185 HydrophobicContact CD2-CD2 4.39Å; Y172-F185 HydrophobicContact CD2-CE1 4.35Å; Y172-F185 AromaticContact CD2-CG 3.77Å; Y172-F185 HydrophobicContact CD2-CG 3.77Å; Y172-F185 HydrophobicContact CE2-CB 4.08Å; Y172-F185 HydrophobicContact CE2-CG 4.45Å; Y172-F185 HydrophobicContact CG-CD1 4.41Å
173C81.1Confident83.3Confident83 Ų8370.1 Ų70.156%0.56137%0.372SS*.Iπ-helixtrans-63.2-34-178.1-72.10000113.5E169E169-C173 WeakPolarHBondContact O-CB 2.81Å; E169-C173 PolarHBondContact O-N 2.92Å; E169-C173 PolarHBondContact O-SG 2.75Å; E169-C173 VanDerWaalsContact O-SG 3.42Å
174K76.4Confident82.9Confident170 Ų17069.1 Ų69.174%0.73937%0.369SS*.Iπ-helixtrans-89.2-32.9-173.7-171174177.7-179.40114.2E170 I171 Y172E170-K174 VanDerWaalsContact O-CB 3.25Å; E170-K174 WeakPolarHBondContact O-CB 3.09Å; E170-K174 PolarHBondContact O-N 3.22Å; E170-K174 VanDerWaalsContact O-N 3.13Å; I171-K174 PolarHBondContact O-N 2.77Å; Y172-K174 VanDerWaalsContact C-N 3.31Å; Y172-K174 PolarHBondContact O-N 3.46Å
175H74.2Confident82.7Confident139 Ų13969.1 Ų69.164%0.64437%0.368SS*.Iπ-helixtrans-117.8-19.3-170.8-60.388.8000114.3I171I171-H175 PolarHBondContact O-N 2.87Å
176V77.7Confident82.7Confident39 Ų3968.4 Ų68.424%0.23637%0.365CS..Iπ-helixtrans-118.9-41.1-170.5-174.50000111.6Y172 C178 F185Y172-V176 HydrophobicContact CD2-CB 3.96Å; Y172-V176 HydrophobicContact CD2-CG1 4Å; Y172-V176 HydrophobicContact CE2-CB 4.38Å; Y172-V176 HydrophobicContact CE2-CG1 4.04Å; Y172-V176 CarbonylContact O-C 3.41Å; Y172-V176 WeakPolarHBondContact O-CA 3.22Å; Y172-V176 WeakPolarHBondContact O-CB 3.32Å; Y172-V176 PolarHBondContact O-N 2.97Å; V176-C178 PolarHBondContact O-N 3.45Å; V176-F185 HydrophobicContact CB-CD2 4.45Å; V176-F185 HydrophobicContact CG1-CB 4.32Å; V176-F185 HydrophobicContact CG1-CD2 4.28Å; V176-F185 HydrophobicContact CG2-CD2 3.77Å; V176-F185 HydrophobicContact CG2-CE2 3.91Å
177H81.7Confident82.7Confident85 Ų8562.2 Ų62.239%0.39434%0.339SS..  trans-73114.7-179.9-173.9-90.7000110.6Y172Y172-H177 HydrophobicContact CD1-CB 4.36Å; Y172-H177 HydrophobicContact CE1-CB 4.09Å; Y172-H177 WeakPolarHBondContact O-CB 3.26Å; Y172-H177 PolarHBondContact O-N 3.27Å
178C81.5Confident82.8Confident43 Ų4363.9 Ų63.929%0.29133%0.327SS..  trans-142.6150169.155.30000109.6C13 V176 G180 G181C13-C178 VanDerWaalsContact CA-SG 3.55Å; C13-C178 HydrophobicContact CB-CB 4.08Å; C13-C178 WeakPolarHBondContact CB-SG 3.18Å; C13-C178 WeakPolarHBondContact SG-CB 3.41Å; C13-C178 PolarHBondContact SG-O 2.9Å; C13-C178 VanDerWaalsContact SG-O 3.33Å; C13-C178 CovalentContact SG-SG 2.02Å; C13-C178 PolarHBondContact SG-SG 3.47Å; V176-C178 PolarHBondContact O-N 3.45Å; C178-G180 PolarHBondContact O-N 2.94Å; C178-G181 PolarHBondContact O-N 3.45Å
179R80.5Confident82.9Confident114 Ų11469.4 Ų69.443%0.4335%0.353SS..BIsolated β-bridgetrans-67.4125.6179.7-168.3179.6-171.1-1432.4109.4I11 S12 C13I11-R179 HydrophobicContact CG2-CB 4.16Å; I11-R179 PolarHBondContact O-N 3.02Å; S12-R179 WeakPolarHBondContact CA-O 3.44Å; C13-R179 PolarHBondContact N-O 3.02Å
180G80.8Confident82.9Confident11 Ų1165.9 Ų65.911%0.11334%0.339CS..THydrogen-bonded Turntrans8320.8-173.100000113.3C88 W89 C178C88-G180 CarbonylContact C-O 3.21Å; W89-G180 PolarHBondContact N-O 3.32Å; W89-G180 VanDerWaalsContact O-CA 3.3Å; W89-G180 WeakPolarHBondContact O-CA 3.48Å; C178-G180 PolarHBondContact O-N 2.94Å
181G83.8Confident83.1Confident30 Ų3057.8 Ų57.831%0.30930%0.301SS..  trans-109.1148.8172.100000110.5C13 C178C13-G181 WeakPolarHBondContact SG-CA 3.33Å; C13-G181 PolarHBondContact SG-N 3.37Å; C178-G181 PolarHBondContact O-N 3.45Å
182C87.9Confident83.3Confident6 Ų657 Ų574%0.04130%0.299CS..  trans-148.182.8173-1760000108.9R83 W89 C96R83-C182 WeakPolarHBondContact CD-O 3.48Å; W89-C182 HydrophobicContact CB-CB 3.7Å; W89-C182 HydrophobicContact CD2-CB 3.42Å; W89-C182 VanDerWaalsContact CD2-CB 3.42Å; W89-C182 HydrophobicContact CE3-CB 3.74Å; W89-C182 HydrophobicContact CG-CB 3.42Å; W89-C182 VanDerWaalsContact CG-CB 3.42Å; W89-C182 HydrophobicContact CZ3-CB 4.48Å; C96-C182 WeakPolarHBondContact CA-SG 3.48Å; C96-C182 HydrophobicContact CB-CB 3.8Å; C96-C182 WeakPolarHBondContact CB-SG 3.35Å; C96-C182 WeakPolarHBondContact SG-CA 3.38Å; C96-C182 WeakPolarHBondContact SG-CB 3.46Å; C96-C182 CovalentContact SG-SG 2.03Å; C96-C182 PolarHBondContact SG-SG 2.68Å
183S81.6Confident83.5Confident58 Ų5859.1 Ų59.141%0.40631%0.313SS..  trans-117.6134-178.1-64.30000109.4F185S183-F185 PolarHBondContact O-N 3.11Å
184V81.1Confident83.6Confident45 Ų4555.3 Ų55.327%0.27329%0.288SS..  trans-67125.7172.5-1700000108.2T100 I104 F186T100-V184 HydrophobicContact CG2-CB 4.38Å; T100-V184 HydrophobicContact CG2-CG1 4.23Å; T100-V184 HydrophobicContact CG2-CG2 3.58Å; I104-V184 HydrophobicContact CD1-CG1 4.39Å; V184-F186 HydrophobicContact CG1-CD2 3.98Å; V184-F186 HydrophobicContact CG1-CE1 4.38Å; V184-F186 HydrophobicContact CG1-CE2 3.28Å; V184-F186 HydrophobicContact CG1-CZ 3.53Å
185F85.3Confident84Confident10 Ų1047.6 Ų47.64%0.04425%0.254CS..  trans-128.4135177.5177-88.6000109.1N164 F165 A168 I171 Y172 V176 S183 Y279N164-F185 WeakPolarHBondContact CB-O 3.25Å; N164-F185 PolarHBondContact ND2-O 2.86Å; F165-F185 HydrophobicContact CB-CD1 3.61Å; F165-F185 HydrophobicContact CB-CE1 3.73Å; A168-F185 HydrophobicContact CB-CE1 3.97Å; A168-F185 HydrophobicContact CB-CZ 4.09Å; I171-F185 HydrophobicContact CG2-CE2 4.42Å; I171-F185 HydrophobicContact CG2-CZ 4.32Å; Y172-F185 HydrophobicContact CD2-CB 3.9Å; Y172-F185 AromaticContact CD2-CD1 3.78Å; Y172-F185 HydrophobicContact CD2-CD1 3.78Å; Y172-F185 HydrophobicContact CD2-CD2 4.39Å; Y172-F185 HydrophobicContact CD2-CE1 4.35Å; Y172-F185 AromaticContact CD2-CG 3.77Å; Y172-F185 HydrophobicContact CD2-CG 3.77Å; Y172-F185 HydrophobicContact CE2-CB 4.08Å; Y172-F185 HydrophobicContact CE2-CG 4.45Å; Y172-F185 HydrophobicContact CG-CD1 4.41Å; V176-F185 HydrophobicContact CB-CD2 4.45Å; V176-F185 HydrophobicContact CG1-CB 4.32Å; V176-F185 HydrophobicContact CG1-CD2 4.28Å; V176-F185 HydrophobicContact CG2-CD2 3.77Å; V176-F185 HydrophobicContact CG2-CE2 3.91Å; S183-F185 PolarHBondContact O-N 3.11Å; F185-Y279 HydrophobicContact CD2-CD1 4.13Å; F185-Y279 AromaticContact CD2-CE1 3.85Å; F185-Y279 HydrophobicContact CD2-CE1 3.85Å; F185-Y279 AromaticContact CE2-CD1 3.58Å; F185-Y279 HydrophobicContact CE2-CD1 3.58Å; F185-Y279 HydrophobicContact CE2-CD2 4.25Å; F185-Y279 AromaticContact CE2-CE1 3.17Å; F185-Y279 HydrophobicContact CE2-CE1 3.17Å; F185-Y279 AromaticContact CE2-CE2 3.92Å; F185-Y279 HydrophobicContact CE2-CE2 3.92Å; F185-Y279 HydrophobicContact CE2-CG 4.09Å; F185-Y279 AromaticContact CE2-CZ 3.36Å; F185-Y279 HydrophobicContact CZ-CD1 4.41Å; F185-Y279 AromaticContact CZ-CE1 3.62Å; F185-Y279 HydrophobicContact CZ-CE1 3.62Å; F185-Y279 AromaticContact CZ-CE2 3.93Å; F185-Y279 HydrophobicContact CZ-CE2 3.93Å; F185-Y279 AromaticContact CZ-CZ 3.33Å; F185-Y279 VanDerWaalsContact CZ-OH 3.25Å; F185-Y279 WeakPolarHBondContact CZ-OH 3.39Å
186F87.3Confident84.5Confident12 Ų1245.3 Ų45.35%0.05325%0.245CC..  trans-126.5132.5175.9-68.1-64000110.6I104 M158 N164 V184 A194 F195 T271 P275 Y279I104-F186 HydrophobicContact CD1-CZ 3.87Å; M158-F186 HydrophobicContact CG-CE1 4.2Å; M158-F186 HydrophobicContact SD-CD1 4.09Å; M158-F186 HydrophobicContact SD-CE1 3.35Å; M158-F186 WeakPolarHBondContact SD-CE1 3.44Å; M158-F186 HydrophobicContact SD-CZ 4.16Å; N164-F186 HydrophobicContact CB-CD1 3.82Å; N164-F186 HydrophobicContact CB-CE1 3.88Å; N164-F186 CarbonylContact O-C 3.58Å; N164-F186 VanDerWaalsContact O-CA 3.26Å; N164-F186 WeakPolarHBondContact O-CA 3.28Å; V184-F186 HydrophobicContact CG1-CD2 3.98Å; V184-F186 HydrophobicContact CG1-CE1 4.38Å; V184-F186 HydrophobicContact CG1-CE2 3.28Å; V184-F186 HydrophobicContact CG1-CZ 3.53Å; F186-A194 HydrophobicContact CE1-CB 4.26Å; F186-A194 HydrophobicContact CZ-CB 4.31Å; F186-F195 HydrophobicContact CD2-CE2 4.03Å; F186-F195 AromaticContact CD2-CZ 3.75Å; F186-F195 HydrophobicContact CD2-CZ 3.75Å; F186-F195 AromaticContact CE2-CZ 3.86Å; F186-F195 HydrophobicContact CE2-CZ 3.86Å; F186-T271 HydrophobicContact CD2-CG2 4.36Å; F186-P275 WeakPolarHBondContact O-CG 3.36Å; F186-Y279 PolarHBondContact O-OH 3.35Å
187S89Confident84.7Confident5 Ų545.8 Ų45.84%0.03525%0.248CC..  trans-65.4164.916478.80000109.9N164 K166 I189 S190 G191N164-S187 PolarHBondContact O-N 3Å; K166-S187 WeakPolarHBondContact O-CB 3.47Å; K166-S187 PolarHBondContact O-OG 2.89Å; S187-I189 VanDerWaalsContact C-N 3.31Å; S187-I189 PolarHBondContact O-N 3.43Å; S187-S190 PolarHBondContact O-N 3.45Å; S187-S190 WeakPolarHBondContact OG-CB 3.11Å; S187-S190 PolarHBondContact OG-N 3.1Å; S187-S190 PolarHBondContact OG-OG 3.33Å; S187-G191 PolarHBondContact O-N 2.96Å
188K88.3Confident84.6Confident102 Ų10242.1 Ų42.144%0.44323%0.232SC..Hα-helixtrans-52-49-179.7-66.9176.3178.5179.50112.3V192 P275 F276K188-V192 VanDerWaalsContact O-CG2 3.3Å; K188-V192 WeakPolarHBondContact O-CG2 3.48Å; K188-V192 PolarHBondContact O-N 3.39Å; K188-P275 HydrophobicContact CB-CB 4.36Å; K188-P275 WeakPolarHBondContact CE-O 3.34Å; K188-P275 HydrophobicContact CG-CB 3.68Å; K188-F276 HydrophobicContact CB-CZ 4.39Å
189I87.7Confident84.6Confident126 Ų12640.5 Ų40.565%0.64622%0.22SC*.Hα-helixtrans-70.6-48.6-177.2-60.6174.6000110.1S187 G191 V192 L193S187-I189 VanDerWaalsContact C-N 3.31Å; S187-I189 PolarHBondContact O-N 3.43Å; I189-G191 VanDerWaalsContact C-N 3.31Å; I189-G191 PolarHBondContact O-N 3.32Å; I189-V192 PolarHBondContact O-N 3.08Å; I189-L193 HydrophobicContact CG2-CD1 3.95Å; I189-L193 HydrophobicContact CG2-CG 4.47Å; I189-L193 WeakPolarHBondContact O-CG 3.31Å; I189-L193 PolarHBondContact O-N 3.11Å
190S87.3Confident84.8Confident13 Ų1338.3 Ų38.39%0.09121%0.212CC..Hα-helixtrans-65.7-36-177-59.30000112.3L163 N164 S187 L193 A194L163-S190 WeakPolarHBondContact O-CB 3.39Å; L163-S190 PolarHBondContact O-OG 2.92Å; N164-S190 WeakPolarHBondContact O-CB 3.34Å; S187-S190 PolarHBondContact O-N 3.45Å; S187-S190 WeakPolarHBondContact OG-CB 3.11Å; S187-S190 PolarHBondContact OG-N 3.1Å; S187-S190 PolarHBondContact OG-OG 3.33Å; S190-L193 PolarHBondContact O-N 3.43Å; S190-A194 VanDerWaalsContact O-CB 3.24Å; S190-A194 WeakPolarHBondContact O-CB 3.47Å; S190-A194 PolarHBondContact O-N 3.16Å
191G86.6Confident85.1Confident0 Ų042.4 Ų42.40%023%0.23CC..Hα-helixtrans-62.3-52.8173.400000111.2S187 I189 L193 A194 F195S187-G191 PolarHBondContact O-N 2.96Å; I189-G191 VanDerWaalsContact C-N 3.31Å; I189-G191 PolarHBondContact O-N 3.32Å; G191-L193 VanDerWaalsContact C-N 3.3Å; G191-L193 PolarHBondContact O-N 3.37Å; G191-A194 WeakPolarHBondContact O-CB 3.44Å; G191-A194 PolarHBondContact O-N 3.22Å; G191-A194 VanDerWaalsContact O-N 3.14Å; G191-F195 WeakPolarHBondContact O-CD2 3.3Å; G191-F195 WeakPolarHBondContact O-CG 3.34Å; G191-F195 PolarHBondContact O-N 2.83Å
192V87Confident85.1Confident55 Ų5541.4 Ų41.433%0.33322%0.218SC..Hα-helixtrans-55.9-46.3177.3171.70000111.2K188 I189 M196 F276K188-V192 VanDerWaalsContact O-CG2 3.3Å; K188-V192 WeakPolarHBondContact O-CG2 3.48Å; K188-V192 PolarHBondContact O-N 3.39Å; I189-V192 PolarHBondContact O-N 3.08Å; V192-M196 HydrophobicContact CG1-CG 4.12Å; V192-M196 VanDerWaalsContact O-CB 3.22Å; V192-M196 WeakPolarHBondContact O-CB 3.46Å; V192-M196 WeakPolarHBondContact O-CG 3.39Å; V192-M196 PolarHBondContact O-N 3.4Å; V192-F276 HydrophobicContact CG2-CE2 4.13Å; V192-F276 HydrophobicContact CG2-CZ 3.94Å
193L86.1Confident84.9Confident95 Ų9541.4 Ų41.450%0.49722%0.219SC..Hα-helixtrans-62.2-43.8177.5-70.3172.9000112.5I189 S190 G191 T197I189-L193 HydrophobicContact CG2-CD1 3.95Å; I189-L193 HydrophobicContact CG2-CG 4.47Å; I189-L193 WeakPolarHBondContact O-CG 3.31Å; I189-L193 PolarHBondContact O-N 3.11Å; S190-L193 PolarHBondContact O-N 3.43Å; G191-L193 VanDerWaalsContact C-N 3.3Å; G191-L193 PolarHBondContact O-N 3.37Å; L193-T197 VanDerWaalsContact O-CB 3.31Å; L193-T197 WeakPolarHBondContact O-CB 3.49Å; L193-T197 PolarHBondContact O-N 3.3Å; L193-T197 VanDerWaalsContact O-N 3.15Å; L193-T197 PolarHBondContact O-OG1 2.88Å
194A84.8Confident85Confident3 Ų341.7 Ų41.73%0.02522%0.221CC..Hα-helixtrans-57.6-53.1176.300000112.5F154 M158 F186 S190 G191 S198F154-A194 HydrophobicContact CE1-CB 4.07Å; F154-A194 VanDerWaalsContact CZ-CA 3.43Å; F154-A194 HydrophobicContact CZ-CB 4.1Å; M158-A194 HydrophobicContact CE-CB 3.95Å; M158-A194 HydrophobicContact SD-CB 3.93Å; F186-A194 HydrophobicContact CE1-CB 4.26Å; F186-A194 HydrophobicContact CZ-CB 4.31Å; S190-A194 VanDerWaalsContact O-CB 3.24Å; S190-A194 WeakPolarHBondContact O-CB 3.47Å; S190-A194 PolarHBondContact O-N 3.16Å; G191-A194 WeakPolarHBondContact O-CB 3.44Å; G191-A194 PolarHBondContact O-N 3.22Å; G191-A194 VanDerWaalsContact O-N 3.14Å; A194-S198 WeakPolarHBondContact O-CB 3.45Å; A194-S198 PolarHBondContact O-N 3.03Å; A194-S198 PolarHBondContact O-OG 3.35Å
195F84.1Confident85.2Confident9 Ų943.2 Ų43.24%0.03923%0.227CC..Hα-helixtrans-78-32.2-172.8-60.2-57.5000112.8F186 G191 F199 Y200 F268 T271 V272F186-F195 HydrophobicContact CD2-CE2 4.03Å; F186-F195 AromaticContact CD2-CZ 3.75Å; F186-F195 HydrophobicContact CD2-CZ 3.75Å; F186-F195 AromaticContact CE2-CZ 3.86Å; F186-F195 HydrophobicContact CE2-CZ 3.86Å; G191-F195 WeakPolarHBondContact O-CD2 3.3Å; G191-F195 WeakPolarHBondContact O-CG 3.34Å; G191-F195 PolarHBondContact O-N 2.83Å; F195-F199 WeakPolarHBondContact O-CA 3.37Å; F195-F199 WeakPolarHBondContact O-CB 3.46Å; F195-F199 PolarHBondContact O-N 3Å; F195-Y200 HydrophobicContact CB-CD2 4.21Å; F195-Y200 HydrophobicContact CB-CE2 3.97Å; F195-Y200 WeakPolarHBondContact O-CD2 3.29Å; F195-Y200 PolarHBondContact O-N 3.33Å; F195-F268 AromaticContact CD1-CD1 3.39Å; F195-F268 HydrophobicContact CD1-CD1 3.39Å; F195-F268 AromaticContact CD1-CE1 3.81Å; F195-F268 HydrophobicContact CD1-CE1 3.81Å; F195-F268 HydrophobicContact CD1-CG 4.5Å; F195-F268 AromaticContact CE1-CD1 3.73Å; F195-F268 HydrophobicContact CE1-CD1 3.73Å; F195-F268 HydrophobicContact CE1-CE1 4.05Å; F195-F268 HydrophobicContact CG-CD1 4.44Å; F195-T271 HydrophobicContact CE1-CG2 4.27Å; F195-T271 HydrophobicContact CE2-CG2 3.79Å; F195-T271 VanDerWaalsContact CZ-CB 3.47Å; F195-T271 HydrophobicContact CZ-CG2 3.29Å; F195-V272 HydrophobicContact CB-CG2 3.42Å; F195-V272 VanDerWaalsContact CB-CG2 3.42Å; F195-V272 HydrophobicContact CD1-CG2 4.34Å; F195-V272 HydrophobicContact CD2-CB 4.14Å; F195-V272 HydrophobicContact CD2-CG2 3.18Å; F195-V272 HydrophobicContact CE2-CG2 4.08Å; F195-V272 HydrophobicContact CG-CG2 3.38Å
196M85.4Confident85.1Confident91 Ų9143 Ų4345%0.44823%0.226SC..Iπ-helixtrans-63.2-48.3172.6-75.4-62.7-153.200111.7V192 Y200 I201V192-M196 HydrophobicContact CG1-CG 4.12Å; V192-M196 VanDerWaalsContact O-CB 3.22Å; V192-M196 WeakPolarHBondContact O-CB 3.46Å; V192-M196 WeakPolarHBondContact O-CG 3.39Å; V192-M196 PolarHBondContact O-N 3.4Å; M196-Y200 HydrophobicContact SD-CD2 3.83Å; M196-Y200 HydrophobicContact SD-CG 4.08Å; M196-I201 HydrophobicContact CB-CD1 4.5Å; M196-I201 WeakPolarHBondContact O-CB 3.02Å; M196-I201 WeakPolarHBondContact O-CG1 3.42Å; M196-I201 PolarHBondContact O-N 2.94Å
197T80.8Confident84.9Confident49 Ų4946.7 Ų46.730%0.30125%0.246SC..Iπ-helixtrans-69.8-41.7-177.6-52.20000111.7F154 L193 P202F154-T197 HydrophobicContact CD2-CG2 4.43Å; F154-T197 HydrophobicContact CE2-CG2 4.48Å; L193-T197 VanDerWaalsContact O-CB 3.31Å; L193-T197 WeakPolarHBondContact O-CB 3.49Å; L193-T197 PolarHBondContact O-N 3.3Å; L193-T197 VanDerWaalsContact O-N 3.15Å; L193-T197 PolarHBondContact O-OG1 2.88Å; T197-P202 WeakPolarHBondContact O-CD 3.43Å; T197-P202 WeakPolarHBondContact O-CG 3.06Å
198S80.3Confident84.7Confident7 Ų750.3 Ų50.35%0.04927%0.271CS..Iπ-helixtrans-86.1-29.7-172.3-59.90000113.6S108 I111 A194S108-S198 WeakPolarHBondContact OG-CB 3.3Å; S108-S198 PolarHBondContact OG-OG 2.91Å; I111-S198 WeakPolarHBondContact CD1-O 3.38Å; A194-S198 WeakPolarHBondContact O-CB 3.45Å; A194-S198 PolarHBondContact O-N 3.03Å; A194-S198 PolarHBondContact O-OG 3.35Å
199F81.7Confident84.4Confident9 Ų946.6 Ų46.64%0.03926%0.256CS..Iπ-helixtrans-129.6-59-170.1-179.6-110000114.3I111 F195 I201 G203 F260 L261 W264 C265 F268I111-F199 HydrophobicContact CD1-CD2 4.2Å; F195-F199 WeakPolarHBondContact O-CA 3.37Å; F195-F199 WeakPolarHBondContact O-CB 3.46Å; F195-F199 PolarHBondContact O-N 3Å; F199-I201 PolarHBondContact O-N 3.12Å; F199-G203 WeakPolarHBondContact O-CA 3.39Å; F199-G203 PolarHBondContact O-N 3.36Å; F199-F260 AromaticContact CD2-CE1 4Å; F199-F260 HydrophobicContact CD2-CE1 4Å; F199-F260 AromaticContact CD2-CZ 3.83Å; F199-F260 HydrophobicContact CD2-CZ 3.83Å; F199-F260 AromaticContact CE2-CE1 3.59Å; F199-F260 HydrophobicContact CE2-CE1 3.59Å; F199-F260 AromaticContact CE2-CZ 3.74Å; F199-F260 HydrophobicContact CE2-CZ 3.74Å; F199-L261 HydrophobicContact CE2-CD2 4.35Å; F199-L261 HydrophobicContact CZ-CD2 4.1Å; F199-W264 HydrophobicContact CE2-CB 4.11Å; F199-C265 HydrophobicContact CZ-CB 4.27Å; F199-F268 HydrophobicContact CB-CD1 4.19Å; F199-F268 HydrophobicContact CB-CD2 3.83Å; F199-F268 HydrophobicContact CB-CE1 4.11Å; F199-F268 HydrophobicContact CB-CE2 3.73Å; F199-F268 HydrophobicContact CB-CG 4.05Å; F199-F268 HydrophobicContact CB-CZ 3.89Å; F199-F268 HydrophobicContact CD1-CB 3.83Å; F199-F268 AromaticContact CD1-CD2 3.5Å; F199-F268 HydrophobicContact CD1-CD2 3.5Å; F199-F268 HydrophobicContact CD1-CE2 4.19Å; F199-F268 AromaticContact CD1-CG 3.75Å; F199-F268 HydrophobicContact CD1-CG 3.75Å; F199-F268 AromaticContact CD2-CD2 3.13Å; F199-F268 HydrophobicContact CD2-CD2 3.13Å; F199-F268 AromaticContact CD2-CE2 3.02Å; F199-F268 HydrophobicContact CD2-CE2 3.02Å; F199-F268 HydrophobicContact CD2-CG 4.12Å; F199-F268 AromaticContact CD2-CZ 3.97Å; F199-F268 HydrophobicContact CD2-CZ 3.97Å; F199-F268 HydrophobicContact CE1-CB 4Å; F199-F268 AromaticContact CE1-CD2 3.72Å; F199-F268 HydrophobicContact CE1-CD2 3.72Å; F199-F268 HydrophobicContact CE1-CG 4.17Å; F199-F268 AromaticContact CE2-CD2 3.34Å; F199-F268 HydrophobicContact CE2-CD2 3.34Å; F199-F268 AromaticContact CE2-CE2 3.53Å; F199-F268 HydrophobicContact CE2-CE2 3.53Å; F199-F268 HydrophobicContact CE2-CG 4.47Å; F199-F268 HydrophobicContact CG-CB 4.31Å; F199-F268 HydrophobicContact CG-CD1 4.34Å; F199-F268 AromaticContact CG-CD2 3.19Å; F199-F268 HydrophobicContact CG-CD2 3.19Å; F199-F268 AromaticContact CG-CE2 3.39Å; F199-F268 HydrophobicContact CG-CE2 3.39Å; F199-F268 AromaticContact CG-CG 3.71Å; F199-F268 HydrophobicContact CG-CG 3.71Å; F199-F268 HydrophobicContact CG-CZ 4.08Å; F199-F268 AromaticContact CZ-CD2 3.63Å; F199-F268 HydrophobicContact CZ-CD2 3.63Å; F199-F268 HydrophobicContact CZ-CE2 4.29Å; F199-F268 HydrophobicContact CZ-CG 4.5Å
200Y84.6Confident83.9Confident69 Ų6941.8 Ų41.827%0.27123%0.229SC..Iπ-helixtrans-67.9-43-168.7-68.2-70.1000113F195 M196 S204 V272F195-Y200 HydrophobicContact CB-CD2 4.21Å; F195-Y200 HydrophobicContact CB-CE2 3.97Å; F195-Y200 WeakPolarHBondContact O-CD2 3.29Å; F195-Y200 PolarHBondContact O-N 3.33Å; M196-Y200 HydrophobicContact SD-CD2 3.83Å; M196-Y200 HydrophobicContact SD-CG 4.08Å; Y200-S204 WeakPolarHBondContact O-CB 3.42Å; Y200-S204 PolarHBondContact O-N 3.45Å; Y200-S204 PolarHBondContact O-OG 3.25Å; Y200-V272 HydrophobicContact CE2-CG2 3.76Å
201I86.3Confident83.5Confident97 Ų9748 Ų4850%0.49725%0.252SS..Hα-helixtrans-67-54.8178-65.5168000110.6M196 F199 G203 S204 I205M196-I201 HydrophobicContact CB-CD1 4.5Å; M196-I201 WeakPolarHBondContact O-CB 3.02Å; M196-I201 WeakPolarHBondContact O-CG1 3.42Å; M196-I201 PolarHBondContact O-N 2.94Å; F199-I201 PolarHBondContact O-N 3.12Å; I201-G203 PolarHBondContact O-N 3.25Å; I201-S204 PolarHBondContact O-N 2.91Å; I201-I205 HydrophobicContact CG2-CD1 3.98Å; I201-I205 WeakPolarHBondContact O-CG1 3.5Å; I201-I205 PolarHBondContact O-N 2.99Å; I201-I205 VanDerWaalsContact O-N 3.07Å
202P84.5Confident83.3Confident8 Ų855.4 Ų55.45%0.05228%0.28CS..Hα-helixtrans-58.5-44.5177.1-25.335.4000113I111 F112 S115 T197 S204 I205 M206I111-P202 HydrophobicContact CG2-CB 3.64Å; I111-P202 HydrophobicContact CG2-CG 4.34Å; F112-P202 HydrophobicContact CD2-CG 4.44Å; F112-P202 HydrophobicContact CE2-CG 4.04Å; S115-P202 WeakPolarHBondContact OG-CB 3.21Å; S115-P202 PolarHBondContact OG-O 3.35Å; T197-P202 WeakPolarHBondContact O-CD 3.43Å; T197-P202 WeakPolarHBondContact O-CG 3.06Å; P202-S204 PolarHBondContact O-N 3.13Å; P202-I205 PolarHBondContact O-N 2.88Å; P202-M206 WeakPolarHBondContact O-CB 3.01Å; P202-M206 WeakPolarHBondContact O-CG 3.15Å; P202-M206 PolarHBondContact O-N 3.3Å
203G83.1Confident82.9Confident6 Ų653 Ų536%0.06227%0.265CS..Hα-helixtrans-63.3-37.6179.600000113.2F199 I201 M206 L207F199-G203 WeakPolarHBondContact O-CA 3.39Å; F199-G203 PolarHBondContact O-N 3.36Å; I201-G203 PolarHBondContact O-N 3.25Å; G203-M206 WeakPolarHBondContact O-CB 3.31Å; G203-M206 PolarHBondContact O-N 2.94Å; G203-L207 WeakPolarHBondContact O-CB 3.25Å; G203-L207 WeakPolarHBondContact O-CG 3.49Å; G203-L207 PolarHBondContact O-N 3.43Å
204S83.9Confident82.5Confident64 Ų6455.2 Ų55.245%0.44827%0.268SS..Hα-helixtrans-68.7-42.8175.1-60.80000111.8Y200 I201 P202 M206 L207 C208Y200-S204 WeakPolarHBondContact O-CB 3.42Å; Y200-S204 PolarHBondContact O-N 3.45Å; Y200-S204 PolarHBondContact O-OG 3.25Å; I201-S204 PolarHBondContact O-N 2.91Å; P202-S204 PolarHBondContact O-N 3.13Å; S204-M206 VanDerWaalsContact C-N 3.31Å; S204-M206 PolarHBondContact O-N 3.3Å; S204-L207 PolarHBondContact O-N 2.87Å; S204-C208 WeakPolarHBondContact O-CB 3.18Å; S204-C208 PolarHBondContact O-N 3.15Å; S204-C208 PolarHBondContact O-SG 3.02Å
205I84.8Confident82.2Confident78 Ų7857.9 Ų57.940%0.428%0.281SS..Hα-helixtrans-57.6-48.8174.8-69.1166.9000109.8I201 P202 C208 I209I201-I205 HydrophobicContact CG2-CD1 3.98Å; I201-I205 WeakPolarHBondContact O-CG1 3.5Å; I201-I205 PolarHBondContact O-N 2.99Å; I201-I205 VanDerWaalsContact O-N 3.07Å; P202-I205 PolarHBondContact O-N 2.88Å; I205-C208 PolarHBondContact O-N 3.2Å; I205-I209 HydrophobicContact CG2-CD1 3.69Å; I205-I209 WeakPolarHBondContact O-CB 3.1Å; I205-I209 VanDerWaalsContact O-CG1 3.27Å; I205-I209 WeakPolarHBondContact O-CG1 3.29Å; I205-I209 PolarHBondContact O-N 3.17Å
206M83.3Confident81.9Confident4 Ų459.7 Ų59.72%0.0229%0.291CS..Hα-helixtrans-53.9-54.7175.2-83.6-179.764.500112.5L114 S115 P202 G203 S204 C208 I209 Y210 M257L114-M206 HydrophobicContact CB-CE 3.57Å; L114-M206 HydrophobicContact CB-SD 3.72Å; L114-M206 HydrophobicContact CD1-CE 4.24Å; L114-M206 HydrophobicContact CG-CE 4.38Å; S115-M206 WeakPolarHBondContact OG-CG 3.44Å; S115-M206 PolarHBondContact OG-SD 2.95Å; P202-M206 WeakPolarHBondContact O-CB 3.01Å; P202-M206 WeakPolarHBondContact O-CG 3.15Å; P202-M206 PolarHBondContact O-N 3.3Å; G203-M206 WeakPolarHBondContact O-CB 3.31Å; G203-M206 PolarHBondContact O-N 2.94Å; S204-M206 VanDerWaalsContact C-N 3.31Å; S204-M206 PolarHBondContact O-N 3.3Å; M206-C208 PolarHBondContact O-N 3.1Å; M206-I209 PolarHBondContact O-N 3.06Å; M206-Y210 WeakPolarHBondContact O-CD2 3.41Å; M206-Y210 PolarHBondContact O-N 2.91Å; M206-M257 VanDerWaalsContact C-CE 3.47Å; M206-M257 HydrophobicContact CB-CE 3.46Å; M206-M257 VanDerWaalsContact CB-CE 3.46Å; M206-M257 HydrophobicContact CE-CB 4.19Å; M206-M257 HydrophobicContact CE-CE 3.57Å; M206-M257 HydrophobicContact CE-CG 3.55Å; M206-M257 HydrophobicContact CE-SD 4.33Å; M206-M257 HydrophobicContact CG-CE 4.09Å; M206-M257 VanDerWaalsContact O-CE 3.29Å; M206-M257 WeakPolarHBondContact O-CE 3.07Å
207L83.1Confident81.2Confident90 Ų9056 Ų5647%0.47128%0.275SS..Hα-helixtrans-58.5-47.1179.7-81.3168.5000112.2G203 S204 I209 Y210 Y211 L261G203-L207 WeakPolarHBondContact O-CB 3.25Å; G203-L207 WeakPolarHBondContact O-CG 3.49Å; G203-L207 PolarHBondContact O-N 3.43Å; S204-L207 PolarHBondContact O-N 2.87Å; L207-I209 VanDerWaalsContact C-N 3.35Å; L207-I209 PolarHBondContact O-N 3.19Å; L207-Y210 PolarHBondContact O-N 2.83Å; L207-Y211 WeakPolarHBondContact O-CB 3.32Å; L207-Y211 PolarHBondContact O-N 3.47Å; L207-L261 HydrophobicContact CD1-CD1 4.18Å; L207-L261 HydrophobicContact CD2-CD1 3.64Å; L207-L261 HydrophobicContact CG-CD1 4.04Å
208C84.8Confident80.9Confident82 Ų8257.7 Ų57.755%0.55428%0.278SS*.Hα-helixtrans-59.4-45.4178.2-75.50000111.9S204 I205 M206 R212S204-C208 WeakPolarHBondContact O-CB 3.18Å; S204-C208 PolarHBondContact O-N 3.15Å; S204-C208 PolarHBondContact O-SG 3.02Å; I205-C208 PolarHBondContact O-N 3.2Å; M206-C208 PolarHBondContact O-N 3.1Å; C208-R212 WeakPolarHBondContact O-CG 3.36Å; C208-R212 PolarHBondContact O-N 3.32Å; C208-R212 VanDerWaalsContact O-N 3.08Å
209I82.8Confident80.8Confident24 Ų2464 Ų6412%0.12331%0.307CS..Hα-helixtrans-62.3-45.9178.5-73.9170.4000110.9S118 I119 Y122 I205 M206 L207 R212 I213S118-I209 WeakPolarHBondContact O-CG2 3.17Å; I119-I209 HydrophobicContact CG1-CD1 3.56Å; Y122-I209 HydrophobicContact CD2-CG2 4.19Å; Y122-I209 HydrophobicContact CG-CG2 4.29Å; I205-I209 HydrophobicContact CG2-CD1 3.69Å; I205-I209 WeakPolarHBondContact O-CB 3.1Å; I205-I209 VanDerWaalsContact O-CG1 3.27Å; I205-I209 WeakPolarHBondContact O-CG1 3.29Å; I205-I209 PolarHBondContact O-N 3.17Å; M206-I209 PolarHBondContact O-N 3.06Å; L207-I209 VanDerWaalsContact C-N 3.35Å; L207-I209 PolarHBondContact O-N 3.19Å; I209-R212 WeakPolarHBondContact O-CB 3.4Å; I209-R212 PolarHBondContact O-N 2.63Å; I209-I213 HydrophobicContact CG2-CD1 3.76Å; I209-I213 HydrophobicContact CG2-CG1 4.39Å; I209-I213 WeakPolarHBondContact O-CG1 3.4Å; I209-I213 PolarHBondContact O-N 3.41Å
210Y76.1Confident80.2Confident24 Ų2467 Ų679%0.09432%0.321CS..Hα-helixtrans-72.4-33.8-177.5-89.7-102.9000113.3S118 M206 L207 R212 I213 Y214 L253 G254 M257S118-Y210 VanDerWaalsContact CB-CE2 3.47Å; S118-Y210 VanDerWaalsContact OG-CE2 3.25Å; S118-Y210 WeakPolarHBondContact OG-CE2 3.33Å; M206-Y210 WeakPolarHBondContact O-CD2 3.41Å; M206-Y210 PolarHBondContact O-N 2.91Å; L207-Y210 PolarHBondContact O-N 2.83Å; Y210-R212 VanDerWaalsContact C-N 3.29Å; Y210-R212 PolarHBondContact O-N 3.35Å; Y210-I213 HydrophobicContact CD2-CD1 4.43Å; Y210-I213 HydrophobicContact CE2-CD1 4.43Å; Y210-I213 PolarHBondContact O-N 3.42Å; Y210-Y214 VanDerWaalsContact O-CB 3.29Å; Y210-Y214 WeakPolarHBondContact O-CB 3.44Å; Y210-Y214 PolarHBondContact O-N 2.9Å; Y210-L253 HydrophobicContact CE1-CB 3.78Å; Y210-L253 WeakPolarHBondContact OH-CB 3.42Å; Y210-G254 VanDerWaalsContact CE1-N 3.32Å; Y210-M257 HydrophobicContact CD1-CE 4.37Å; Y210-M257 HydrophobicContact CD1-SD 3.43Å; Y210-M257 WeakPolarHBondContact CD1-SD 3.46Å; Y210-M257 HydrophobicContact CD2-CE 3.06Å; Y210-M257 HydrophobicContact CD2-SD 3.06Å; Y210-M257 WeakPolarHBondContact CD2-SD 3.04Å; Y210-M257 HydrophobicContact CE1-SD 3.42Å; Y210-M257 WeakPolarHBondContact CE1-SD 2.98Å; Y210-M257 HydrophobicContact CE2-CE 3.45Å; Y210-M257 VanDerWaalsContact CE2-CE 3.45Å; Y210-M257 HydrophobicContact CE2-SD 3.02Å; Y210-M257 WeakPolarHBondContact CE2-SD 3.29Å; Y210-M257 HydrophobicContact CG-CE 3.54Å; Y210-M257 HydrophobicContact CG-SD 3.21Å
211Y80.5Confident79.5Confident143 Ų14364.7 Ų64.756%0.56132%0.316SS*.Hα-helixtrans-58.2-45.6170.1-177.7-111.8000110.6L207 Y214 L215L207-Y211 WeakPolarHBondContact O-CB 3.32Å; L207-Y211 PolarHBondContact O-N 3.47Å; Y211-Y214 PolarHBondContact O-N 3.44Å; Y211-L215 HydrophobicContact CD1-CD1 4Å; Y211-L215 HydrophobicContact CE1-CD1 3.49Å; Y211-L215 VanDerWaalsContact CE1-CD1 3.49Å; Y211-L215 HydrophobicContact CE1-CG 4.22Å; Y211-L215 HydrophobicContact CE2-CD1 4.43Å; Y211-L215 HydrophobicContact CE2-CD2 4.36Å; Y211-L215 HydrophobicContact CE2-CG 4.32Å; Y211-L215 WeakPolarHBondContact O-CG 3.38Å; Y211-L215 PolarHBondContact O-N 3.05Å
212R82.2Confident78.8Confident156 Ų15667.3 Ų67.359%0.58932%0.32SS*.Hα-helixtrans-60.9-47174.5-69.8-72.2-174-173.30.5112.5Y122 C208 I209 Y210 Y214 L215 I216Y122-R212 HydrophobicContact CE2-CB 4.45Å; C208-R212 WeakPolarHBondContact O-CG 3.36Å; C208-R212 PolarHBondContact O-N 3.32Å; C208-R212 VanDerWaalsContact O-N 3.08Å; I209-R212 WeakPolarHBondContact O-CB 3.4Å; I209-R212 PolarHBondContact O-N 2.63Å; Y210-R212 VanDerWaalsContact C-N 3.29Å; Y210-R212 PolarHBondContact O-N 3.35Å; R212-Y214 VanDerWaalsContact C-N 3.32Å; R212-Y214 PolarHBondContact O-N 3.43Å; R212-L215 PolarHBondContact O-N 3.29Å; R212-I216 WeakPolarHBondContact O-CG1 3.18Å; R212-I216 PolarHBondContact O-N 2.99Å
213I77.7Confident78.1Confident4 Ų470.3 Ų70.32%0.02134%0.341CS..Hα-helixtrans-59.1-44.5177.5-68.1168.5000110.7R121 Y122 V125 I209 Y210 I216 A217 A250R121-I213 HydrophobicContact CB-CD1 4.3Å; Y122-I213 HydrophobicContact CD2-CG1 4.34Å; V125-I213 HydrophobicContact CG1-CG2 4.37Å; I209-I213 HydrophobicContact CG2-CD1 3.76Å; I209-I213 HydrophobicContact CG2-CG1 4.39Å; I209-I213 WeakPolarHBondContact O-CG1 3.4Å; I209-I213 PolarHBondContact O-N 3.41Å; Y210-I213 HydrophobicContact CD2-CD1 4.43Å; Y210-I213 HydrophobicContact CE2-CD1 4.43Å; Y210-I213 PolarHBondContact O-N 3.42Å; I213-I216 PolarHBondContact O-N 2.91Å; I213-A217 VanDerWaalsContact O-CB 3.25Å; I213-A217 WeakPolarHBondContact O-CB 3.35Å; I213-A217 PolarHBondContact O-N 3.29Å; I213-A250 HydrophobicContact CG2-CB 3.83Å
214Y78Confident77.2Confident143 Ų14373.6 Ų73.656%0.56136%0.356SS*.Hα-helixtrans-62-44.5178.7172.8-104.3000112Y210 Y211 R212 A217 K218Y210-Y214 VanDerWaalsContact O-CB 3.29Å; Y210-Y214 WeakPolarHBondContact O-CB 3.44Å; Y210-Y214 PolarHBondContact O-N 2.9Å; Y211-Y214 PolarHBondContact O-N 3.44Å; R212-Y214 VanDerWaalsContact C-N 3.32Å; R212-Y214 PolarHBondContact O-N 3.43Å; Y214-A217 PolarHBondContact O-N 2.9Å; Y214-K218 HydrophobicContact CE1-CD 4.44Å; Y214-K218 WeakPolarHBondContact O-CB 3.41Å; Y214-K218 PolarHBondContact O-N 3.05Å
215L78.4Confident76.2Confident59 Ų5976 Ų7631%0.30936%0.364SS..Hα-helixtrans-59.9-49.9176.9-72.1179.2000111.5Y211 R212 A217 K218 E219Y211-L215 HydrophobicContact CD1-CD1 4Å; Y211-L215 HydrophobicContact CE1-CD1 3.49Å; Y211-L215 VanDerWaalsContact CE1-CD1 3.49Å; Y211-L215 HydrophobicContact CE1-CG 4.22Å; Y211-L215 HydrophobicContact CE2-CD1 4.43Å; Y211-L215 HydrophobicContact CE2-CD2 4.36Å; Y211-L215 HydrophobicContact CE2-CG 4.32Å; Y211-L215 WeakPolarHBondContact O-CG 3.38Å; Y211-L215 PolarHBondContact O-N 3.05Å; R212-L215 PolarHBondContact O-N 3.29Å; L215-A217 VanDerWaalsContact C-N 3.34Å; L215-A217 PolarHBondContact O-N 2.83Å; L215-K218 WeakPolarHBondContact O-CB 3.38Å; L215-K218 PolarHBondContact O-N 3.5Å; L215-K218 VanDerWaalsContact O-N 3.1Å; L215-E219 WeakPolarHBondContact O-CB 3.38Å; L215-E219 PolarHBondContact O-N 3.1Å
216I76.9Confident75.1Confident47 Ų4777 Ų7724%0.24137%0.371CS..Hα-helixtrans-62.2-43.7179.7-66.6165.6000110.5C126 R212 I213 K218 E219 Q220C126-I216 HydrophobicContact CB-CD1 4.21Å; C126-I216 WeakPolarHBondContact SG-CD1 3.45Å; R212-I216 WeakPolarHBondContact O-CG1 3.18Å; R212-I216 PolarHBondContact O-N 2.99Å; I213-I216 PolarHBondContact O-N 2.91Å; I216-K218 PolarHBondContact O-N 2.87Å; I216-E219 PolarHBondContact O-N 2.84Å; I216-Q220 HydrophobicContact CG2-CG 4.38Å; I216-Q220 WeakPolarHBondContact O-CB 3.27Å; I216-Q220 WeakPolarHBondContact O-CG 3.5Å; I216-Q220 PolarHBondContact O-N 3.39Å
217A71.1Confident74Confident13 Ų1379.4 Ų79.411%0.10739%0.39CS..Hα-helixtrans-66.9-23.9177.500000113.5I213 Y214 L215 A221 R247I213-A217 VanDerWaalsContact O-CB 3.25Å; I213-A217 WeakPolarHBondContact O-CB 3.35Å; I213-A217 PolarHBondContact O-N 3.29Å; Y214-A217 PolarHBondContact O-N 2.9Å; L215-A217 VanDerWaalsContact C-N 3.34Å; L215-A217 PolarHBondContact O-N 2.83Å; A217-A221 WeakPolarHBondContact O-CB 3.26Å; A217-R247 HydrophobicContact CB-CG 4.34Å; A217-R247 PolarHBondContact O-NE 3.43Å; A217-R247 VanDerWaalsContact O-NE 3.09Å; A217-R247 PolarHBondContact O-NH2 3.01Å
218K74.8Confident72.6Confident84 Ų8480.4 Ų80.437%0.36540%0.397SS..Hα-helixtrans-79.9-42.7173.9-176.6177.5178.91800110.9Y214 L215 I216 A221 R222Y214-K218 HydrophobicContact CE1-CD 4.44Å; Y214-K218 WeakPolarHBondContact O-CB 3.41Å; Y214-K218 PolarHBondContact O-N 3.05Å; L215-K218 WeakPolarHBondContact O-CB 3.38Å; L215-K218 PolarHBondContact O-N 3.5Å; L215-K218 VanDerWaalsContact O-N 3.1Å; I216-K218 PolarHBondContact O-N 2.87Å; K218-A221 PolarHBondContact O-N 3.48Å; K218-R222 PolarHBondContact O-N 3.06Å
219E77.7Confident70.9Confident140 Ų14084.6 Ų84.665%0.65441%0.408SS*.Hα-helixtrans-64.3-46.6177.9-170.4168.3-162.400111.8L215 I216 A221 R222 S223L215-E219 WeakPolarHBondContact O-CB 3.38Å; L215-E219 PolarHBondContact O-N 3.1Å; I216-E219 PolarHBondContact O-N 2.84Å; E219-A221 VanDerWaalsContact C-N 3.28Å; E219-A221 PolarHBondContact O-N 3.01Å; E219-R222 PolarHBondContact O-N 2.89Å; E219-R222 VanDerWaalsContact O-N 3.15Å; E219-S223 PolarHBondContact O-N 2.95Å
220Q69.8Low69.3Low72 Ų7292.2 Ų92.234%0.33644%0.44SS..Hα-helixtrans-59.4-37174.2-72.7176.5-10.900112.6I216 S223 I224I216-Q220 HydrophobicContact CG2-CG 4.38Å; I216-Q220 WeakPolarHBondContact O-CB 3.27Å; I216-Q220 WeakPolarHBondContact O-CG 3.5Å; I216-Q220 PolarHBondContact O-N 3.39Å; Q220-S223 PolarHBondContact O-N 3.17Å; Q220-I224 WeakPolarHBondContact O-CD1 3.33Å; Q220-I224 VanDerWaalsContact O-CG1 3.22Å; Q220-I224 WeakPolarHBondContact O-CG1 3.31Å; Q220-I224 PolarHBondContact O-N 3.49Å
221A69.3Low68.1Low21 Ų2197.1 Ų97.117%0.17447%0.467CS..Hα-helixtrans-72.8-31.5177.800000113.6A217 K218 E219 N225 R247A217-A221 WeakPolarHBondContact O-CB 3.26Å; K218-A221 PolarHBondContact O-N 3.48Å; E219-A221 VanDerWaalsContact C-N 3.28Å; E219-A221 PolarHBondContact O-N 3.01Å; A221-N225 PolarHBondContact O-N 3.41Å; A221-N225 VanDerWaalsContact O-N 3.15Å; A221-R247 VanDerWaalsContact CB-CZ 3.48Å
222R72.5Confident66.5Low151 Ų15199.4 Ų99.457%0.5748%0.483SS*.Hα-helixtrans-66.8-48.5170.9-74.5177.1174.8-178.9-7.1110.4K218 E219 I224 N225 D226K218-R222 PolarHBondContact O-N 3.06Å; E219-R222 PolarHBondContact O-N 2.89Å; E219-R222 VanDerWaalsContact O-N 3.15Å; R222-I224 VanDerWaalsContact C-N 3.29Å; R222-I224 PolarHBondContact O-N 3.48Å; R222-N225 PolarHBondContact O-N 3.49Å; R222-N225 VanDerWaalsContact O-N 3.1Å; R222-D226 VanDerWaalsContact O-CG 3.23Å; R222-D226 PolarHBondContact O-N 3.35Å
223S68.9Low65Low72 Ų7299.2 Ų99.250%0.50349%0.492SS..Hα-helixtrans-60.5-35.4178.4127.10000113.1E219 Q220 A227E219-S223 PolarHBondContact O-N 2.95Å; Q220-S223 PolarHBondContact O-N 3.17Å; S223-A227 WeakPolarHBondContact O-CB 3.18Å; S223-A227 PolarHBondContact O-N 3.01Å
224I65.5Low63.5Low75 Ų75102 Ų10239%0.38552%0.522SS..Hα-helixtrans-70-41.2175.1-68.9164.2000111.3Q220 R222 A227 N228Q220-I224 WeakPolarHBondContact O-CD1 3.33Å; Q220-I224 VanDerWaalsContact O-CG1 3.22Å; Q220-I224 WeakPolarHBondContact O-CG1 3.31Å; Q220-I224 PolarHBondContact O-N 3.49Å; R222-I224 VanDerWaalsContact C-N 3.29Å; R222-I224 PolarHBondContact O-N 3.48Å; I224-A227 PolarHBondContact O-N 2.93Å; I224-N228 VanDerWaalsContact O-CB 3.3Å; I224-N228 WeakPolarHBondContact O-CB 3.21Å; I224-N228 VanDerWaalsContact O-CG 3.24Å; I224-N228 PolarHBondContact O-N 3.12Å; I224-N228 PolarHBondContact O-ND2 3.46Å
225N63Low61.8Low114 Ų114103.7 Ų103.761%0.6154%0.54SS*.Hα-helixtrans-65.3-40175.6-84.31.6000111.8A221 R222 N228 Q229A221-N225 PolarHBondContact O-N 3.41Å; A221-N225 VanDerWaalsContact O-N 3.15Å; R222-N225 PolarHBondContact O-N 3.49Å; R222-N225 VanDerWaalsContact O-N 3.1Å; N225-N228 PolarHBondContact O-N 3.27Å; N225-Q229 PolarHBondContact O-N 3.16Å
226D60.1Low60.3Low100 Ų100109 Ų10954%0.53556%0.563SS.*Hα-helixtrans-70.4-33.5177.5-63.2-20.4000111.8R222R222-D226 VanDerWaalsContact O-CG 3.23Å; R222-D226 PolarHBondContact O-N 3.35Å
227A60Low58.9Low53 Ų53113.1 Ų113.144%0.43858%0.583SS.*Hα-helixtrans-74.5-36.6174.700000112.9S223 I224 Q229 K230 L231S223-A227 WeakPolarHBondContact O-CB 3.18Å; S223-A227 PolarHBondContact O-N 3.01Å; I224-A227 PolarHBondContact O-N 2.93Å; A227-Q229 PolarHBondContact O-N 3.01Å; A227-K230 PolarHBondContact O-N 3.31Å; A227-L231 PolarHBondContact O-N 3.29Å; A227-L231 VanDerWaalsContact O-N 3.15Å
228N53.8Low57.5Low112 Ų112121.7 Ų121.760%0.59962%0.617SS**Hα-helixtrans-66.7-21174.5-78.7-18.2000112.8I224 N225 K230I224-N228 VanDerWaalsContact O-CB 3.3Å; I224-N228 WeakPolarHBondContact O-CB 3.21Å; I224-N228 VanDerWaalsContact O-CG 3.24Å; I224-N228 PolarHBondContact O-N 3.12Å; I224-N228 PolarHBondContact O-ND2 3.46Å; N225-N228 PolarHBondContact O-N 3.27Å; N228-K230 VanDerWaalsContact C-N 3.3Å
229Q50.8Low56Low169 Ų169124.3 Ų124.379%0.7964%0.636SS**THydrogen-bonded Turntrans-78-15170.7-155.5172.210.100112.7N225 A227N225-Q229 PolarHBondContact O-N 3.16Å; A227-Q229 PolarHBondContact O-N 3.01Å
230K48.7Very low54.3Low184 Ų184120.3 Ų120.380%0.863%0.632SS**THydrogen-bonded Turntrans-108.2-15.2-177.4-76-174.2177.61800115.6A227 N228A227-K230 PolarHBondContact O-N 3.31Å; N228-K230 VanDerWaalsContact C-N 3.3Å
231L50.1Low53.2Low127 Ų127121.2 Ų121.267%0.66564%0.638SS**  trans-134.387-176.8-126.991000111.9A227 I233A227-L231 PolarHBondContact O-N 3.29Å; A227-L231 VanDerWaalsContact O-N 3.15Å; L231-I233 VanDerWaalsContact C-N 3.35Å
232Q47.6Very low52.1Low192 Ų192123.7 Ų123.790%0.89765%0.654SS**  trans-91.915.8169.7-133.3-161.114.200113.6
233I50.6Low50.8Low152 Ų152121.2 Ų121.278%0.77965%0.649SS**SBendtrans-139.8110.7-178.7-55.1179.8000110.3L231L231-I233 VanDerWaalsContact C-N 3.35Å
234G45.9Very low49.8Very low62 Ų62120.7 Ų120.764%0.63965%0.645SS**SBendtrans102.611414800000117
235L42.6Very low49.1Very low179 Ų179123 Ų12394%0.93765%0.652SS**  trans89.676.4161.3-58.2166.2000116.3
236E46.8Very low48.7Very low171 Ų171120.3 Ų120.380%0.79964%0.636SS**  trans-56.5153.5163.1-57.8-175.2134.100113.4
237M47.6Very low48.5Very low133 Ų133121.8 Ų121.866%0.65563%0.634SS**  trans76.871.5135.6-153.8-176.2-16.400118.1
238K41.7Very low48.4Very low192 Ų192126.3 Ų126.384%0.83564%0.644SS**SBendtrans-150.7-25.3144.3-122.2168.2-177.8176.40117.6
239N43.5Very low48.6Very low140 Ų140121.9 Ų121.975%0.74962%0.623SS**SBendtrans-113.2-9.6-174.1-75.3-10.3000116.7I241N239-I241 PolarHBondContact O-N 2.91Å
240G42.4Very low49Very low55 Ų55114.4 Ų114.457%0.56759%0.59SS**Hα-helixtrans-76.1-16.4-179.100000115.8S244G240-S244 WeakPolarHBondContact O-CB 3.12Å; G240-S244 PolarHBondContact O-N 3.45Å
241I46.4Very low49.8Very low91 Ų91112.8 Ų112.847%0.46758%0.583SS.*Hα-helixtrans-80.7-31.3-174-60.6171.8000111.7N239 K245N239-I241 PolarHBondContact O-N 2.91Å; I241-K245 HydrophobicContact CG2-CD 4.4Å; I241-K245 WeakPolarHBondContact O-CG 3.32Å; I241-K245 PolarHBondContact O-N 3.46Å
242S46.3Very low50.4Low73 Ų73107 Ų10751%0.5155%0.553SS.*Hα-helixtrans-68.2-49.3177.9-170.10000111.4S244 K245 E246S242-S244 PolarHBondContact O-N 2.98Å; S242-K245 PolarHBondContact O-N 3.13Å; S242-E246 PolarHBondContact O-N 3.2Å
243Q44.7Very low51.2Low99 Ų9998.1 Ų98.146%0.46351%0.511SS..Hα-helixtrans-65.4-36.6-178.8-72.2-179.4-14.700112.8E246 R247Q243-E246 PolarHBondContact O-N 3.25Å; Q243-R247 WeakPolarHBondContact O-CB 3.32Å; Q243-R247 PolarHBondContact O-N 3.4Å
244S48Very low52Low62 Ų6292.3 Ų92.343%0.43449%0.489SS..Hα-helixtrans-62.9-41.6174.8161.50000113.1G240 S242 K248G240-S244 WeakPolarHBondContact O-CB 3.12Å; G240-S244 PolarHBondContact O-N 3.45Å; S242-S244 PolarHBondContact O-N 2.98Å; S244-K248 PolarHBondContact O-N 3.43Å
245K51.4Low53.2Low123 Ų12392.3 Ų92.354%0.53547%0.474SS..Hα-helixtrans-69.3-41.8177.3-74.3178179.9178.40111.7I241 S242 K248 A249I241-K245 HydrophobicContact CG2-CD 4.4Å; I241-K245 WeakPolarHBondContact O-CG 3.32Å; I241-K245 PolarHBondContact O-N 3.46Å; S242-K245 PolarHBondContact O-N 3.13Å; K245-K248 PolarHBondContact O-N 3.15Å; K245-A249 PolarHBondContact O-N 2.88Å
246E53.8Low54.5Low58 Ų5883.9 Ų83.927%0.27143%0.43SS..Hα-helixtrans-66.2-37.3176.6-71.7-171.6168.900112.5S242 Q243 K248 A249 A250S242-E246 PolarHBondContact O-N 3.2Å; Q243-E246 PolarHBondContact O-N 3.25Å; E246-K248 PolarHBondContact O-N 2.94Å; E246-A249 PolarHBondContact O-N 3Å; E246-A250 PolarHBondContact O-N 2.79Å
247R55.2Low55.6Low131 Ų13176.2 Ų76.249%0.49439%0.394SS..Hα-helixtrans-64.8-37.4175.2-161.2172.3-174.2-127.3-4.6112.8A217 A221 Q243 K251A217-R247 HydrophobicContact CB-CG 4.34Å; A217-R247 PolarHBondContact O-NE 3.43Å; A217-R247 VanDerWaalsContact O-NE 3.09Å; A217-R247 PolarHBondContact O-NH2 3.01Å; A221-R247 VanDerWaalsContact CB-CZ 3.48Å; Q243-R247 WeakPolarHBondContact O-CB 3.32Å; Q243-R247 PolarHBondContact O-N 3.4Å; R247-K251 PolarHBondContact O-N 2.97Å; R247-K251 VanDerWaalsContact O-N 3.12Å
248K58.7Low56.9Low148 Ų14871.1 Ų71.164%0.64338%0.376SS*.Hα-helixtrans-67.4-39.3172.1-78.2179.5178.9176.80112S244 K245 E246 K251 T252S244-K248 PolarHBondContact O-N 3.43Å; K245-K248 PolarHBondContact O-N 3.15Å; E246-K248 PolarHBondContact O-N 2.94Å; K248-K251 PolarHBondContact O-N 3.45Å; K248-T252 PolarHBondContact O-N 3.21Å; K248-T252 VanDerWaalsContact O-N 3.14Å; K248-T252 PolarHBondContact O-OG1 2.96Å
249A57Low58.7Low19 Ų1963.6 Ų63.616%0.15735%0.346CS..Hα-helixtrans-66.4-39.3175.500000112.3K245 E246 T252 L253K245-A249 PolarHBondContact O-N 2.88Å; E246-A249 PolarHBondContact O-N 3Å; A249-T252 WeakPolarHBondContact O-CB 3.25Å; A249-T252 PolarHBondContact O-N 2.99Å; A249-L253 WeakPolarHBondContact O-CG 3.4Å; A249-L253 PolarHBondContact O-N 3.01Å
250A59.8Low60.3Low11 Ų1157 Ų579%0.09131%0.311CS..Hα-helixtrans-64.4-41.7174.800000112.7I213 E246 T252 L253 G254I213-A250 HydrophobicContact CG2-CB 3.83Å; E246-A250 PolarHBondContact O-N 2.79Å; A250-T252 VanDerWaalsContact C-N 3.32Å; A250-T252 PolarHBondContact O-N 3.42Å; A250-L253 PolarHBondContact O-N 3.35Å; A250-G254 PolarHBondContact O-N 3.37Å
251K66.5Low62Low151 Ų15156.5 Ų56.566%0.65730%0.295SS*.Hα-helixtrans-59.8-42.5174.6-176.2179.8179.7-179.10112.1R247 K248 L253 G254 I255R247-K251 PolarHBondContact O-N 2.97Å; R247-K251 VanDerWaalsContact O-N 3.12Å; K248-K251 PolarHBondContact O-N 3.45Å; K251-L253 VanDerWaalsContact C-N 3.35Å; K251-G254 PolarHBondContact O-N 2.86Å; K251-I255 WeakPolarHBondContact O-CG1 3.04Å; K251-I255 PolarHBondContact O-N 3.41Å
252T62.7Low63.8Low5 Ų557.4 Ų57.43%0.03130%0.3CS..Hα-helixtrans-58.7-47.7178.4-59.60000111.5K248 A249 A250 I255 V256 V303 F307 Y308K248-T252 PolarHBondContact O-N 3.21Å; K248-T252 VanDerWaalsContact O-N 3.14Å; K248-T252 PolarHBondContact O-OG1 2.96Å; A249-T252 WeakPolarHBondContact O-CB 3.25Å; A249-T252 PolarHBondContact O-N 2.99Å; A250-T252 VanDerWaalsContact C-N 3.32Å; A250-T252 PolarHBondContact O-N 3.42Å; T252-I255 WeakPolarHBondContact O-CB 3.47Å; T252-I255 PolarHBondContact O-N 2.89Å; T252-I255 VanDerWaalsContact O-N 3.16Å; T252-V256 PolarHBondContact O-N 3.02Å; T252-V303 HydrophobicContact CG2-CG1 4.47Å; T252-F307 HydrophobicContact CG2-CB 3.09Å; T252-F307 HydrophobicContact CG2-CD1 4.32Å; T252-F307 HydrophobicContact CG2-CD2 3.78Å; T252-F307 HydrophobicContact CG2-CG 3.49Å; T252-F307 VanDerWaalsContact CG2-CG 3.49Å; T252-F307 WeakPolarHBondContact OG1-CB 3.38Å; T252-F307 WeakPolarHBondContact OG1-CD1 3.37Å; T252-F307 WeakPolarHBondContact OG1-CG 3.43Å; T252-Y308 HydrophobicContact CG2-CE2 4.13Å
253L64.5Low65.5Low5 Ų554 Ų543%0.02628%0.276CS..Hα-helixtrans-75.1-29.6-175.9-64.8163.2000112.2I117 R121 Y210 A249 A250 K251 I255 V256 M257I117-L253 HydrophobicContact CG2-CD1 4.21Å; I117-L253 HydrophobicContact CG2-CD2 3.91Å; R121-L253 HydrophobicContact CG-CD1 3.24Å; Y210-L253 HydrophobicContact CE1-CB 3.78Å; Y210-L253 WeakPolarHBondContact OH-CB 3.42Å; A249-L253 WeakPolarHBondContact O-CG 3.4Å; A249-L253 PolarHBondContact O-N 3.01Å; A250-L253 PolarHBondContact O-N 3.35Å; K251-L253 VanDerWaalsContact C-N 3.35Å; L253-I255 PolarHBondContact O-N 3.34Å; L253-V256 HydrophobicContact CD2-CG2 4.29Å; L253-V256 WeakPolarHBondContact O-CB 3.24Å; L253-V256 PolarHBondContact O-N 3.32Å; L253-M257 WeakPolarHBondContact O-CG 3.3Å; L253-M257 PolarHBondContact O-N 3.21Å
254G67.6Low67.3Low31 Ų3149.9 Ų49.932%0.3226%0.256SS..Hα-helixtrans-60.4-31.2168.500000112.9Y210 A250 K251 G258Y210-G254 VanDerWaalsContact CE1-N 3.32Å; A250-G254 PolarHBondContact O-N 3.37Å; K251-G254 PolarHBondContact O-N 2.86Å; G254-G258 PolarHBondContact O-N 3Å
255I70.5Confident69Low62 Ų6249.3 Ų49.332%0.31825%0.252SS..Hα-helixtrans-74.9-44173.9-65.6168.1000111.1K251 T252 L253 M257 G258 V259 F307K251-I255 WeakPolarHBondContact O-CG1 3.04Å; K251-I255 PolarHBondContact O-N 3.41Å; T252-I255 WeakPolarHBondContact O-CB 3.47Å; T252-I255 PolarHBondContact O-N 2.89Å; T252-I255 VanDerWaalsContact O-N 3.16Å; L253-I255 PolarHBondContact O-N 3.34Å; I255-M257 PolarHBondContact O-N 3.11Å; I255-G258 PolarHBondContact O-N 3.45Å; I255-G258 VanDerWaalsContact O-N 3.13Å; I255-V259 HydrophobicContact CG2-CG2 4.42Å; I255-V259 WeakPolarHBondContact O-CG2 3.47Å; I255-V259 PolarHBondContact O-N 2.02Å; I255-F307 HydrophobicContact CB-CE2 4.32Å; I255-F307 HydrophobicContact CB-CZ 4.46Å; I255-F307 HydrophobicContact CD1-CE1 3.75Å; I255-F307 HydrophobicContact CD1-CE2 3.97Å; I255-F307 HydrophobicContact CD1-CZ 3.27Å; I255-F307 HydrophobicContact CG1-CZ 4.43Å; I255-F307 HydrophobicContact CG2-CE2 3.99Å; I255-F307 HydrophobicContact CG2-CZ 4.29Å
256V69.3Low70.6Confident2 Ų245.8 Ų45.81%0.01224%0.241CC..Hα-helixtrans-51.4-44.8172.7178.90000110.1L114 T252 L253 V259 F260 V303L114-V256 HydrophobicContact CD2-CG1 3.58Å; T252-V256 PolarHBondContact O-N 3.02Å; L253-V256 HydrophobicContact CD2-CG2 4.29Å; L253-V256 WeakPolarHBondContact O-CB 3.24Å; L253-V256 PolarHBondContact O-N 3.32Å; V256-V259 PolarHBondContact O-N 3.27Å; V256-F260 WeakPolarHBondContact O-CB 3.18Å; V256-F260 PolarHBondContact O-N 3.25Å; V256-V303 HydrophobicContact CB-CG1 4.35Å; V256-V303 HydrophobicContact CG2-CB 4.05Å; V256-V303 HydrophobicContact CG2-CG1 3.27Å
257M70.9Confident72Confident9 Ų944.1 Ų44.14%0.04423%0.233CC..Hα-helixtrans-71.1-37.6180-62.3164.684.100113.7M206 Y210 L253 I255 V259 F260 L261M206-M257 VanDerWaalsContact C-CE 3.47Å; M206-M257 HydrophobicContact CB-CE 3.46Å; M206-M257 VanDerWaalsContact CB-CE 3.46Å; M206-M257 HydrophobicContact CE-CB 4.19Å; M206-M257 HydrophobicContact CE-CE 3.57Å; M206-M257 HydrophobicContact CE-CG 3.55Å; M206-M257 HydrophobicContact CE-SD 4.33Å; M206-M257 HydrophobicContact CG-CE 4.09Å; M206-M257 VanDerWaalsContact O-CE 3.29Å; M206-M257 WeakPolarHBondContact O-CE 3.07Å; Y210-M257 HydrophobicContact CD1-CE 4.37Å; Y210-M257 HydrophobicContact CD1-SD 3.43Å; Y210-M257 WeakPolarHBondContact CD1-SD 3.46Å; Y210-M257 HydrophobicContact CD2-CE 3.06Å; Y210-M257 HydrophobicContact CD2-SD 3.06Å; Y210-M257 WeakPolarHBondContact CD2-SD 3.04Å; Y210-M257 HydrophobicContact CE1-SD 3.42Å; Y210-M257 WeakPolarHBondContact CE1-SD 2.98Å; Y210-M257 HydrophobicContact CE2-CE 3.45Å; Y210-M257 VanDerWaalsContact CE2-CE 3.45Å; Y210-M257 HydrophobicContact CE2-SD 3.02Å; Y210-M257 WeakPolarHBondContact CE2-SD 3.29Å; Y210-M257 HydrophobicContact CG-CE 3.54Å; Y210-M257 HydrophobicContact CG-SD 3.21Å; L253-M257 WeakPolarHBondContact O-CG 3.3Å; L253-M257 PolarHBondContact O-N 3.21Å; I255-M257 PolarHBondContact O-N 3.11Å; M257-V259 VanDerWaalsContact C-N 3.33Å; M257-F260 WeakPolarHBondContact O-CB 3.41Å; M257-F260 PolarHBondContact O-N 3Å; M257-L261 WeakPolarHBondContact O-CG 3.42Å; M257-L261 PolarHBondContact O-N 3.18Å
258G74.9Confident73.2Confident27 Ų2738.4 Ų38.428%0.27821%0.212SC..Hα-helixtrans-61-44.8173.700000111.3G254 I255 L261 I262G254-G258 PolarHBondContact O-N 3Å; I255-G258 PolarHBondContact O-N 3.45Å; I255-G258 VanDerWaalsContact O-N 3.13Å; G258-L261 PolarHBondContact O-N 3.48Å; G258-I262 WeakPolarHBondContact O-CB 3.09Å; G258-I262 WeakPolarHBondContact O-CD1 3.48Å; G258-I262 WeakPolarHBondContact O-CG1 2.88Å; G258-I262 PolarHBondContact O-N 3.31Å
259V78.3Confident74.4Confident34 Ų3434 Ų3421%0.20620%0.198CC..Hα-helixtrans-60-47.4174173.20000110.5I255 V256 M257 L261 I262 C263 F299I255-V259 HydrophobicContact CG2-CG2 4.42Å; I255-V259 WeakPolarHBondContact O-CG2 3.47Å; I255-V259 PolarHBondContact O-N 2.02Å; V256-V259 PolarHBondContact O-N 3.27Å; M257-V259 VanDerWaalsContact C-N 3.33Å; V259-L261 PolarHBondContact O-N 2.87Å; V259-I262 PolarHBondContact O-N 2.95Å; V259-C263 WeakPolarHBondContact O-CB 3.49Å; V259-C263 PolarHBondContact O-N 2.66Å; V259-C263 PolarHBondContact O-SG 3.3Å; V259-C263 VanDerWaalsContact O-SG 3.36Å; V259-F299 HydrophobicContact CG1-CB 3.92Å; V259-F299 HydrophobicContact CG1-CD2 3.65Å; V259-F299 HydrophobicContact CG1-CG 4.19Å
260F77.3Confident75.6Confident1 Ų134.7 Ų34.70%0.00420%0.201CC..Hα-helixtrans-54.9-51.3176.4170.8-98.6000112.5I111 L114 F199 V256 M257 I262 C263 W264 N296I111-F260 HydrophobicContact CB-CZ 4.21Å; I111-F260 HydrophobicContact CD1-CE2 4.03Å; I111-F260 HydrophobicContact CD1-CZ 3.6Å; I111-F260 HydrophobicContact CG1-CE2 3.55Å; I111-F260 HydrophobicContact CG1-CZ 3.4Å; I111-F260 VanDerWaalsContact CG1-CZ 3.4Å; I111-F260 HydrophobicContact CG2-CE1 4.35Å; I111-F260 HydrophobicContact CG2-CZ 3.94Å; L114-F260 HydrophobicContact CD1-CB 3.85Å; L114-F260 HydrophobicContact CD1-CD1 4.19Å; L114-F260 HydrophobicContact CD1-CD2 3.52Å; L114-F260 HydrophobicContact CD1-CE2 4.19Å; L114-F260 HydrophobicContact CD1-CG 3.54Å; F199-F260 AromaticContact CD2-CE1 4Å; F199-F260 HydrophobicContact CD2-CE1 4Å; F199-F260 AromaticContact CD2-CZ 3.83Å; F199-F260 HydrophobicContact CD2-CZ 3.83Å; F199-F260 AromaticContact CE2-CE1 3.59Å; F199-F260 HydrophobicContact CE2-CE1 3.59Å; F199-F260 AromaticContact CE2-CZ 3.74Å; F199-F260 HydrophobicContact CE2-CZ 3.74Å; V256-F260 WeakPolarHBondContact O-CB 3.18Å; V256-F260 PolarHBondContact O-N 3.25Å; M257-F260 WeakPolarHBondContact O-CB 3.41Å; M257-F260 PolarHBondContact O-N 3Å; F260-I262 VanDerWaalsContact C-N 3.34Å; F260-I262 PolarHBondContact O-N 3.41Å; F260-C263 PolarHBondContact O-N 2.93Å; F260-W264 AromaticContact CD2-CD1 3.43Å; F260-W264 VanDerWaalsContact CD2-CD1 3.43Å; F260-W264 HydrophobicContact CD2-CG 4.28Å; F260-W264 HydrophobicContact CE2-CB 4.21Å; F260-W264 AromaticContact CE2-CD1 3.26Å; F260-W264 AromaticContact CE2-CG 3.78Å; F260-W264 HydrophobicContact CE2-CG 3.78Å; F260-W264 AromaticContact CE2-NE1 3.8Å; F260-W264 HydrophobicContact CZ-CB 4.28Å; F260-W264 HydrophobicContact CZ-CG 4.27Å; F260-W264 WeakPolarHBondContact O-CB 3.37Å; F260-W264 PolarHBondContact O-N 2.92Å; F260-N296 VanDerWaalsContact CA-OD1 3.31Å; F260-N296 WeakPolarHBondContact CA-OD1 3.45Å
261L78Confident76.5Confident44 Ų4435 Ų3523%0.2320%0.201CC..Hα-helixtrans-63-41.3179.5-71.8170.8000111.7F199 L207 M257 G258 V259 C265F199-L261 HydrophobicContact CE2-CD2 4.35Å; F199-L261 HydrophobicContact CZ-CD2 4.1Å; L207-L261 HydrophobicContact CD1-CD1 4.18Å; L207-L261 HydrophobicContact CD2-CD1 3.64Å; L207-L261 HydrophobicContact CG-CD1 4.04Å; M257-L261 WeakPolarHBondContact O-CG 3.42Å; M257-L261 PolarHBondContact O-N 3.18Å; G258-L261 PolarHBondContact O-N 3.48Å; V259-L261 PolarHBondContact O-N 2.87Å; L261-C265 WeakPolarHBondContact O-CA 3.17Å; L261-C265 WeakPolarHBondContact O-CB 3.2Å; L261-C265 PolarHBondContact O-N 2.96Å
262I84.2Confident77.4Confident111 Ų11128.9 Ų28.957%0.56918%0.177SC*.Hα-helixtrans-63.3-47.3178-70.4164.9000110.3G258 V259 F260 P266 F292G258-I262 WeakPolarHBondContact O-CB 3.09Å; G258-I262 WeakPolarHBondContact O-CD1 3.48Å; G258-I262 WeakPolarHBondContact O-CG1 2.88Å; G258-I262 PolarHBondContact O-N 3.31Å; V259-I262 PolarHBondContact O-N 2.95Å; F260-I262 VanDerWaalsContact C-N 3.34Å; F260-I262 PolarHBondContact O-N 3.41Å; I262-P266 WeakPolarHBondContact O-CD 3.42Å; I262-P266 WeakPolarHBondContact O-CG 3.5Å; I262-F292 HydrophobicContact CG2-CE1 4.41Å; I262-F292 HydrophobicContact CG2-CZ 4.13Å; I262-F292 WeakPolarHBondContact O-CE1 3.05Å
263C82.1Confident78.4Confident2 Ų232.2 Ų32.21%0.01419%0.194CC..Hα-helixtrans-64.9-42-178.5-740000112.8V259 F260 F292 N296V259-C263 WeakPolarHBondContact O-CB 3.49Å; V259-C263 PolarHBondContact O-N 2.66Å; V259-C263 PolarHBondContact O-SG 3.3Å; V259-C263 VanDerWaalsContact O-SG 3.36Å; F260-C263 PolarHBondContact O-N 2.93Å; C263-F292 WeakPolarHBondContact CB-O 3.15Å; C263-F292 WeakPolarHBondContact O-CD1 3.11Å; C263-N296 HydrophobicContact CB-CB 4.07Å
264W82.4Confident79.4Confident11 Ų1133.4 Ų33.44%0.04220%0.2CC..Hα-helixtrans-100.4-28.7-168.7-81.6101.1000115.1S107 F199 F260 P266 F267 F268 G293S107-W264 WeakPolarHBondContact OG-CH2 3.45Å; F199-W264 HydrophobicContact CE2-CB 4.11Å; F260-W264 AromaticContact CD2-CD1 3.43Å; F260-W264 VanDerWaalsContact CD2-CD1 3.43Å; F260-W264 HydrophobicContact CD2-CG 4.28Å; F260-W264 HydrophobicContact CE2-CB 4.21Å; F260-W264 AromaticContact CE2-CD1 3.26Å; F260-W264 AromaticContact CE2-CG 3.78Å; F260-W264 HydrophobicContact CE2-CG 3.78Å; F260-W264 AromaticContact CE2-NE1 3.8Å; F260-W264 HydrophobicContact CZ-CB 4.28Å; F260-W264 HydrophobicContact CZ-CG 4.27Å; F260-W264 WeakPolarHBondContact O-CB 3.37Å; F260-W264 PolarHBondContact O-N 2.92Å; W264-P266 VanDerWaalsContact C-CD 3.49Å; W264-F267 AromaticContact CE3-CD1 3.93Å; W264-F267 HydrophobicContact CE3-CD1 3.93Å; W264-F267 AromaticContact CZ3-CD1 3.83Å; W264-F267 HydrophobicContact CZ3-CD1 3.83Å; W264-F267 HydrophobicContact CZ3-CE1 4.17Å; W264-F267 PolarHBondContact O-N 3.42Å; W264-F268 HydrophobicContact CB-CD2 3.76Å; W264-F268 HydrophobicContact CB-CE2 3.53Å; W264-F268 AromaticContact CD2-CE2 3.86Å; W264-F268 HydrophobicContact CD2-CE2 3.86Å; W264-F268 HydrophobicContact CD2-CZ 4.18Å; W264-F268 HydrophobicContact CE3-CD2 4.24Å; W264-F268 HydrophobicContact CE3-CE1 4.26Å; W264-F268 AromaticContact CE3-CE2 3.49Å; W264-F268 HydrophobicContact CE3-CE2 3.49Å; W264-F268 VanDerWaalsContact CE3-CE2 3.49Å; W264-F268 AromaticContact CE3-CZ 3.5Å; W264-F268 HydrophobicContact CE3-CZ 3.5Å; W264-F268 AromaticContact CG-CE2 3.92Å; W264-F268 HydrophobicContact CG-CE2 3.92Å; W264-F268 HydrophobicContact CZ3-CE2 4.45Å; W264-F268 HydrophobicContact CZ3-CZ 4.04Å; W264-F268 WeakPolarHBondContact O-CD2 3.32Å; W264-F268 PolarHBondContact O-N 2.91Å; W264-G293 PolarHBondContact NE1-O 2.72Å; W264-G293 VanDerWaalsContact NE1-O 3.12Å
265C83.7Confident80.2Confident51 Ų5132 Ų3235%0.34519%0.185SC..Hα-helixtrans-55.9-44.1-178.1-176.60000113.1F199 L261 F267 F268 V269F199-C265 HydrophobicContact CZ-CB 4.27Å; L261-C265 WeakPolarHBondContact O-CA 3.17Å; L261-C265 WeakPolarHBondContact O-CB 3.2Å; L261-C265 PolarHBondContact O-N 2.96Å; C265-F267 PolarHBondContact O-N 2.97Å; C265-F268 PolarHBondContact O-N 2.9Å; C265-V269 WeakPolarHBondContact O-CB 2.97Å; C265-V269 VanDerWaalsContact O-CG2 3.3Å; C265-V269 WeakPolarHBondContact O-CG2 3.1Å; C265-V269 PolarHBondContact O-N 2.92Å
266P84.9Confident80.9Confident48 Ų4834.2 Ų34.231%0.31219%0.193SC..Hα-helixtrans-58.6-45.7178.7-27.237.9000113I262 W264 C270 L289 F292I262-P266 WeakPolarHBondContact O-CD 3.42Å; I262-P266 WeakPolarHBondContact O-CG 3.5Å; W264-P266 VanDerWaalsContact C-CD 3.49Å; P266-C270 WeakPolarHBondContact O-CB 3.39Å; P266-C270 PolarHBondContact O-N 3.29Å; P266-C270 VanDerWaalsContact O-N 3.11Å; P266-C270 PolarHBondContact O-SG 2.95Å; P266-C270 VanDerWaalsContact O-SG 3.42Å; P266-L289 HydrophobicContact CB-CD2 3.7Å; P266-F292 HydrophobicContact CG-CD1 4.43Å; P266-F292 HydrophobicContact CG-CE1 4.24Å
267F82.6Confident81.7Confident24 Ų2438.2 Ų38.211%0.10521%0.214CC..Hα-helixtrans-60.1-52.3176.3176.1-108.2000110.9W264 C265 V269 C270 T271 N286 L289 I290W264-F267 AromaticContact CE3-CD1 3.93Å; W264-F267 HydrophobicContact CE3-CD1 3.93Å; W264-F267 AromaticContact CZ3-CD1 3.83Å; W264-F267 HydrophobicContact CZ3-CD1 3.83Å; W264-F267 HydrophobicContact CZ3-CE1 4.17Å; W264-F267 PolarHBondContact O-N 3.42Å; C265-F267 PolarHBondContact O-N 2.97Å; F267-V269 PolarHBondContact O-N 3.35Å; F267-C270 PolarHBondContact O-N 3.45Å; F267-T271 VanDerWaalsContact CE2-OG1 3.31Å; F267-T271 WeakPolarHBondContact CE2-OG1 3.36Å; F267-T271 PolarHBondContact O-N 2.94Å; F267-T271 PolarHBondContact O-OG1 3.25Å; F267-N286 VanDerWaalsContact CE2-OD1 3.29Å; F267-N286 WeakPolarHBondContact CE2-OD1 3.3Å; F267-L289 HydrophobicContact CB-CB 3.99Å; F267-L289 HydrophobicContact CD2-CB 3.91Å; F267-L289 HydrophobicContact CG-CB 4.45Å; F267-I290 HydrophobicContact CD2-CG1 3.61Å; F267-I290 HydrophobicContact CE2-CB 4.4Å; F267-I290 HydrophobicContact CE2-CD1 3.76Å; F267-I290 HydrophobicContact CE2-CG1 3.1Å; F267-I290 HydrophobicContact CZ-CD1 4.18Å; F267-I290 HydrophobicContact CZ-CG1 3.66Å
268F80.5Confident82.3Confident10 Ų1044.9 Ų44.94%0.04424%0.244CC..Hα-helixtrans-63-41.9-176.7-70.7-52.9000113.3I111 F195 F199 W264 C265 C270 T271 V272I111-F268 HydrophobicContact CD1-CE2 4.21Å; I111-F268 HydrophobicContact CD1-CZ 4.04Å; F195-F268 AromaticContact CD1-CD1 3.39Å; F195-F268 HydrophobicContact CD1-CD1 3.39Å; F195-F268 AromaticContact CD1-CE1 3.81Å; F195-F268 HydrophobicContact CD1-CE1 3.81Å; F195-F268 HydrophobicContact CD1-CG 4.5Å; F195-F268 AromaticContact CE1-CD1 3.73Å; F195-F268 HydrophobicContact CE1-CD1 3.73Å; F195-F268 HydrophobicContact CE1-CE1 4.05Å; F195-F268 HydrophobicContact CG-CD1 4.44Å; F199-F268 HydrophobicContact CB-CD1 4.19Å; F199-F268 HydrophobicContact CB-CD2 3.83Å; F199-F268 HydrophobicContact CB-CE1 4.11Å; F199-F268 HydrophobicContact CB-CE2 3.73Å; F199-F268 HydrophobicContact CB-CG 4.05Å; F199-F268 HydrophobicContact CB-CZ 3.89Å; F199-F268 HydrophobicContact CD1-CB 3.83Å; F199-F268 AromaticContact CD1-CD2 3.5Å; F199-F268 HydrophobicContact CD1-CD2 3.5Å; F199-F268 HydrophobicContact CD1-CE2 4.19Å; F199-F268 AromaticContact CD1-CG 3.75Å; F199-F268 HydrophobicContact CD1-CG 3.75Å; F199-F268 AromaticContact CD2-CD2 3.13Å; F199-F268 HydrophobicContact CD2-CD2 3.13Å; F199-F268 AromaticContact CD2-CE2 3.02Å; F199-F268 HydrophobicContact CD2-CE2 3.02Å; F199-F268 HydrophobicContact CD2-CG 4.12Å; F199-F268 AromaticContact CD2-CZ 3.97Å; F199-F268 HydrophobicContact CD2-CZ 3.97Å; F199-F268 HydrophobicContact CE1-CB 4Å; F199-F268 AromaticContact CE1-CD2 3.72Å; F199-F268 HydrophobicContact CE1-CD2 3.72Å; F199-F268 HydrophobicContact CE1-CG 4.17Å; F199-F268 AromaticContact CE2-CD2 3.34Å; F199-F268 HydrophobicContact CE2-CD2 3.34Å; F199-F268 AromaticContact CE2-CE2 3.53Å; F199-F268 HydrophobicContact CE2-CE2 3.53Å; F199-F268 HydrophobicContact CE2-CG 4.47Å; F199-F268 HydrophobicContact CG-CB 4.31Å; F199-F268 HydrophobicContact CG-CD1 4.34Å; F199-F268 AromaticContact CG-CD2 3.19Å; F199-F268 HydrophobicContact CG-CD2 3.19Å; F199-F268 AromaticContact CG-CE2 3.39Å; F199-F268 HydrophobicContact CG-CE2 3.39Å; F199-F268 AromaticContact CG-CG 3.71Å; F199-F268 HydrophobicContact CG-CG 3.71Å; F199-F268 HydrophobicContact CG-CZ 4.08Å; F199-F268 AromaticContact CZ-CD2 3.63Å; F199-F268 HydrophobicContact CZ-CD2 3.63Å; F199-F268 HydrophobicContact CZ-CE2 4.29Å; F199-F268 HydrophobicContact CZ-CG 4.5Å; W264-F268 HydrophobicContact CB-CD2 3.76Å; W264-F268 HydrophobicContact CB-CE2 3.53Å; W264-F268 AromaticContact CD2-CE2 3.86Å; W264-F268 HydrophobicContact CD2-CE2 3.86Å; W264-F268 HydrophobicContact CD2-CZ 4.18Å; W264-F268 HydrophobicContact CE3-CD2 4.24Å; W264-F268 HydrophobicContact CE3-CE1 4.26Å; W264-F268 AromaticContact CE3-CE2 3.49Å; W264-F268 HydrophobicContact CE3-CE2 3.49Å; W264-F268 VanDerWaalsContact CE3-CE2 3.49Å; W264-F268 AromaticContact CE3-CZ 3.5Å; W264-F268 HydrophobicContact CE3-CZ 3.5Å; W264-F268 AromaticContact CG-CE2 3.92Å; W264-F268 HydrophobicContact CG-CE2 3.92Å; W264-F268 HydrophobicContact CZ3-CE2 4.45Å; W264-F268 HydrophobicContact CZ3-CZ 4.04Å; W264-F268 WeakPolarHBondContact O-CD2 3.32Å; W264-F268 PolarHBondContact O-N 2.91Å; C265-F268 PolarHBondContact O-N 2.9Å; F268-C270 PolarHBondContact O-N 3.39Å; F268-T271 PolarHBondContact O-N 2.89Å; F268-V272 VanDerWaalsContact O-CB 3.32Å; F268-V272 WeakPolarHBondContact O-CB 3.38Å; F268-V272 WeakPolarHBondContact O-CG2 3.34Å; F268-V272 PolarHBondContact O-N 3.46Å
269V84.1Confident82.6Confident57 Ų5746 Ų4635%0.34524%0.24SC..Hα-helixtrans-60.6-47.4175.8170.70000110.6C265 F267 I273C265-V269 WeakPolarHBondContact O-CB 2.97Å; C265-V269 VanDerWaalsContact O-CG2 3.3Å; C265-V269 WeakPolarHBondContact O-CG2 3.1Å; C265-V269 PolarHBondContact O-N 2.92Å; F267-V269 PolarHBondContact O-N 3.35Å; V269-I273 HydrophobicContact CG1-CD1 3.69Å; V269-I273 WeakPolarHBondContact O-CB 2.97Å; V269-I273 WeakPolarHBondContact O-CD1 3.43Å; V269-I273 VanDerWaalsContact O-CG1 3.25Å; V269-I273 WeakPolarHBondContact O-CG1 3.4Å; V269-I273 PolarHBondContact O-N 2.72Å; V269-I273 VanDerWaalsContact O-N 3.17Å
270C83.8Confident82.9Confident33 Ų3348.9 Ų48.922%0.22326%0.259CS..Hα-helixtrans-61.4-51.1178.6-77.50000111.9P266 F267 F268 V272 I273 D274 I281 L289P266-C270 WeakPolarHBondContact O-CB 3.39Å; P266-C270 PolarHBondContact O-N 3.29Å; P266-C270 VanDerWaalsContact O-N 3.11Å; P266-C270 PolarHBondContact O-SG 2.95Å; P266-C270 VanDerWaalsContact O-SG 3.42Å; F267-C270 PolarHBondContact O-N 3.45Å; F268-C270 PolarHBondContact O-N 3.39Å; C270-V272 VanDerWaalsContact C-N 3.34Å; C270-V272 PolarHBondContact O-N 2.92Å; C270-I273 PolarHBondContact O-N 3.34Å; C270-D274 WeakPolarHBondContact O-CB 3.35Å; C270-D274 PolarHBondContact O-N 3.03Å; C270-I281 HydrophobicContact CB-CD1 3.67Å; C270-I281 WeakPolarHBondContact O-CD1 3.15Å; C270-L289 HydrophobicContact CB-CD1 3.71Å; C270-L289 VanDerWaalsContact SG-CD1 3.57Å
271T78.3Confident83.2Confident17 Ų1750.3 Ų50.310%0.10427%0.266CS..Hα-helixtrans-71.2-27.7-174.9-400000113.3F186 F195 F267 F268 P275F186-T271 HydrophobicContact CD2-CG2 4.36Å; F195-T271 HydrophobicContact CE1-CG2 4.27Å; F195-T271 HydrophobicContact CE2-CG2 3.79Å; F195-T271 VanDerWaalsContact CZ-CB 3.47Å; F195-T271 HydrophobicContact CZ-CG2 3.29Å; F267-T271 VanDerWaalsContact CE2-OG1 3.31Å; F267-T271 WeakPolarHBondContact CE2-OG1 3.36Å; F267-T271 PolarHBondContact O-N 2.94Å; F267-T271 PolarHBondContact O-OG1 3.25Å; F268-T271 PolarHBondContact O-N 2.89Å; T271-P275 VanDerWaalsContact O-CD 3.3Å; T271-P275 WeakPolarHBondContact O-CD 3.11Å
272V84.3Confident83.6Confident23 Ų2351.7 Ų51.714%0.13928%0.277CS..Hα-helixtrans-68.8-40.7172.21710000111.2F195 Y200 F268 C270 P275 F276F195-V272 HydrophobicContact CB-CG2 3.42Å; F195-V272 VanDerWaalsContact CB-CG2 3.42Å; F195-V272 HydrophobicContact CD1-CG2 4.34Å; F195-V272 HydrophobicContact CD2-CB 4.14Å; F195-V272 HydrophobicContact CD2-CG2 3.18Å; F195-V272 HydrophobicContact CE2-CG2 4.08Å; F195-V272 HydrophobicContact CG-CG2 3.38Å; Y200-V272 HydrophobicContact CE2-CG2 3.76Å; F268-V272 VanDerWaalsContact O-CB 3.32Å; F268-V272 WeakPolarHBondContact O-CB 3.38Å; F268-V272 WeakPolarHBondContact O-CG2 3.34Å; F268-V272 PolarHBondContact O-N 3.46Å; C270-V272 VanDerWaalsContact C-N 3.34Å; C270-V272 PolarHBondContact O-N 2.92Å; V272-P275 WeakPolarHBondContact O-CD 3.44Å; V272-F276 WeakPolarHBondContact O-CD2 3.46Å; V272-F276 VanDerWaalsContact O-CE2 3.25Å; V272-F276 WeakPolarHBondContact O-CE2 3.43Å
273I85.3Confident83.4Confident75 Ų7549.5 Ų49.539%0.38527%0.27SS..Hα-helixtrans-81.7-28.7-174.2-68.8173.1000111.6V269 C270 F276 L277V269-I273 HydrophobicContact CG1-CD1 3.69Å; V269-I273 WeakPolarHBondContact O-CB 2.97Å; V269-I273 WeakPolarHBondContact O-CD1 3.43Å; V269-I273 VanDerWaalsContact O-CG1 3.25Å; V269-I273 WeakPolarHBondContact O-CG1 3.4Å; V269-I273 PolarHBondContact O-N 2.72Å; V269-I273 VanDerWaalsContact O-N 3.17Å; C270-I273 PolarHBondContact O-N 3.34Å; I273-F276 CarbonylContact O-C 3.57Å; I273-F276 WeakPolarHBondContact O-CA 3.4Å; I273-F276 WeakPolarHBondContact O-CB 3.38Å; I273-F276 PolarHBondContact O-N 2.88Å; I273-L277 HydrophobicContact CG2-CD1 3.43Å; I273-L277 VanDerWaalsContact CG2-CD1 3.43Å; I273-L277 HydrophobicContact CG2-CD2 4.39Å; I273-L277 HydrophobicContact CG2-CG 3.54Å; I273-L277 PolarHBondContact O-N 3.49Å
274D83.9Confident83.6Confident29 Ų2952.2 Ų52.216%0.15529%0.287CS..G310 helixtrans-51.7-45.2-175.6-164.339.2000114.4C270 F276 L277 H278 Y279 T280 I281C270-D274 WeakPolarHBondContact O-CB 3.35Å; C270-D274 PolarHBondContact O-N 3.03Å; D274-F276 PolarHBondContact O-N 2.9Å; D274-L277 CarbonylContact O-C 3.47Å; D274-L277 PolarHBondContact O-N 3.04Å; D274-L277 VanDerWaalsContact O-N 3.09Å; D274-H278 PolarHBondContact O-N 3.49Å; D274-Y279 PolarHBondContact O-N 2.93Å; D274-Y279 VanDerWaalsContact OD1-CA 3.23Å; D274-Y279 WeakPolarHBondContact OD1-CA 3.27Å; D274-T280 PolarHBondContact OD1-N 3.33Å; D274-I281 HydrophobicContact CB-CB 4.48Å; D274-I281 HydrophobicContact CB-CD1 3.77Å; D274-I281 HydrophobicContact CB-CG1 4.15Å; D274-I281 VanDerWaalsContact OD1-CB 3.25Å; D274-I281 WeakPolarHBondContact OD1-CB 3.31Å; D274-I281 WeakPolarHBondContact OD1-CG1 3.31Å; D274-I281 PolarHBondContact OD1-N 2.03Å
275P84.1Confident83.8Confident3 Ų355.3 Ų55.32%0.01930%0.304CS..G310 helixtrans-64.3-24.4175.9-22.235.5000113.8F186 K188 T271 V272 Y279F186-P275 WeakPolarHBondContact O-CG 3.36Å; K188-P275 HydrophobicContact CB-CB 4.36Å; K188-P275 WeakPolarHBondContact CE-O 3.34Å; K188-P275 HydrophobicContact CG-CB 3.68Å; T271-P275 VanDerWaalsContact O-CD 3.3Å; T271-P275 WeakPolarHBondContact O-CD 3.11Å; V272-P275 WeakPolarHBondContact O-CD 3.44Å; P275-Y279 HydrophobicContact CB-CE1 3.96Å; P275-Y279 HydrophobicContact CG-CE1 3.98Å
276F86.1Confident83.8Confident107 Ų10754.4 Ų54.447%0.46930%0.296SS..G310 helixtrans-85-22.8176.3-59.7-88.6000112.4K188 V192 V272 I273 D274 H278K188-F276 HydrophobicContact CB-CZ 4.39Å; V192-F276 HydrophobicContact CG2-CE2 4.13Å; V192-F276 HydrophobicContact CG2-CZ 3.94Å; V272-F276 WeakPolarHBondContact O-CD2 3.46Å; V272-F276 VanDerWaalsContact O-CE2 3.25Å; V272-F276 WeakPolarHBondContact O-CE2 3.43Å; I273-F276 CarbonylContact O-C 3.57Å; I273-F276 WeakPolarHBondContact O-CA 3.4Å; I273-F276 WeakPolarHBondContact O-CB 3.38Å; I273-F276 PolarHBondContact O-N 2.88Å; D274-F276 PolarHBondContact O-N 2.9Å; F276-H278 VanDerWaalsContact C-N 3.33Å
277L86.1Confident83.9Confident87 Ų8752.8 Ų52.846%0.45529%0.285SS..G310 helixtrans-95.822.2173.4-61.7-178.5000113I273 D274 Y279 T280I273-L277 HydrophobicContact CG2-CD1 3.43Å; I273-L277 VanDerWaalsContact CG2-CD1 3.43Å; I273-L277 HydrophobicContact CG2-CD2 4.39Å; I273-L277 HydrophobicContact CG2-CG 3.54Å; I273-L277 PolarHBondContact O-N 3.49Å; D274-L277 CarbonylContact O-C 3.47Å; D274-L277 PolarHBondContact O-N 3.04Å; D274-L277 VanDerWaalsContact O-N 3.09Å; L277-Y279 VanDerWaalsContact C-N 3.27Å; L277-Y279 PolarHBondContact O-N 2.79Å; L277-T280 WeakPolarHBondContact CB-OG1 3.07Å; L277-T280 WeakPolarHBondContact O-CG2 3.35Å; L277-T280 PolarHBondContact O-N 3.45Å; L277-T280 PolarHBondContact O-OG1 2.93Å
278H82.8Confident84.3Confident148 Ų14855.9 Ų55.969%0.68531%0.305SS*.THydrogen-bonded Turntrans56.237.1179.4-59.3-86.4000114.1D274 F276 T280D274-H278 PolarHBondContact O-N 3.49Å; F276-H278 VanDerWaalsContact C-N 3.33Å; H278-T280 PolarHBondContact O-N 3.43Å
279Y83.1Confident84.7Confident50 Ų5056.3 Ų56.320%0.19631%0.308CS..SBendtrans59.944.9175.7-50.4-80.1000113.4I171 F185 F186 D274 P275 L277I171-Y279 HydrophobicContact CD1-CE2 4.09Å; I171-Y279 HydrophobicContact CG2-CD2 3.78Å; I171-Y279 HydrophobicContact CG2-CE2 3.78Å; F185-Y279 HydrophobicContact CD2-CD1 4.13Å; F185-Y279 AromaticContact CD2-CE1 3.85Å; F185-Y279 HydrophobicContact CD2-CE1 3.85Å; F185-Y279 AromaticContact CE2-CD1 3.58Å; F185-Y279 HydrophobicContact CE2-CD1 3.58Å; F185-Y279 HydrophobicContact CE2-CD2 4.25Å; F185-Y279 AromaticContact CE2-CE1 3.17Å; F185-Y279 HydrophobicContact CE2-CE1 3.17Å; F185-Y279 AromaticContact CE2-CE2 3.92Å; F185-Y279 HydrophobicContact CE2-CE2 3.92Å; F185-Y279 HydrophobicContact CE2-CG 4.09Å; F185-Y279 AromaticContact CE2-CZ 3.36Å; F185-Y279 HydrophobicContact CZ-CD1 4.41Å; F185-Y279 AromaticContact CZ-CE1 3.62Å; F185-Y279 HydrophobicContact CZ-CE1 3.62Å; F185-Y279 AromaticContact CZ-CE2 3.93Å; F185-Y279 HydrophobicContact CZ-CE2 3.93Å; F185-Y279 AromaticContact CZ-CZ 3.33Å; F185-Y279 VanDerWaalsContact CZ-OH 3.25Å; F185-Y279 WeakPolarHBondContact CZ-OH 3.39Å; F186-Y279 PolarHBondContact O-OH 3.35Å; D274-Y279 PolarHBondContact O-N 2.93Å; D274-Y279 VanDerWaalsContact OD1-CA 3.23Å; D274-Y279 WeakPolarHBondContact OD1-CA 3.27Å; P275-Y279 HydrophobicContact CB-CE1 3.96Å; P275-Y279 HydrophobicContact CG-CE1 3.98Å; L277-Y279 VanDerWaalsContact C-N 3.27Å; L277-Y279 PolarHBondContact O-N 2.79Å
280T84.3Confident85Confident96 Ų9654 Ų5459%0.58929%0.293SS*.  trans-87.5-9.8-178.5450000113.2D274 L277 H278 P282D274-T280 PolarHBondContact OD1-N 3.33Å; L277-T280 WeakPolarHBondContact CB-OG1 3.07Å; L277-T280 WeakPolarHBondContact O-CG2 3.35Å; L277-T280 PolarHBondContact O-N 3.45Å; L277-T280 PolarHBondContact O-OG1 2.93Å; H278-T280 PolarHBondContact O-N 3.43Å; T280-P282 WeakPolarHBondContact O-CD 3.45Å
281I83.8Confident85.4Confident31 Ų3153.3 Ų53.316%0.15929%0.286CS..SBendtrans-69.6124-179.8-64.1-174.7000110.1C270 D274 L285C270-I281 HydrophobicContact CB-CD1 3.67Å; C270-I281 WeakPolarHBondContact O-CD1 3.15Å; D274-I281 HydrophobicContact CB-CB 4.48Å; D274-I281 HydrophobicContact CB-CD1 3.77Å; D274-I281 HydrophobicContact CB-CG1 4.15Å; D274-I281 VanDerWaalsContact OD1-CB 3.25Å; D274-I281 WeakPolarHBondContact OD1-CB 3.31Å; D274-I281 WeakPolarHBondContact OD1-CG1 3.31Å; D274-I281 PolarHBondContact OD1-N 2.03Å; I281-L285 HydrophobicContact CG2-CB 4.4Å; I281-L285 HydrophobicContact CG2-CD2 4.21Å; I281-L285 HydrophobicContact CG2-CG 4.42Å
282P85.4Confident86.1Confident72 Ų7256 Ų5647%0.46830%0.296SS..  trans-62.9139179.9-23.333.6000111.9T280 T284 L285 N286T280-P282 WeakPolarHBondContact O-CD 3.45Å; P282-T284 PolarHBondContact O-N 3.4Å; P282-T284 VanDerWaalsContact O-N 3.13Å; P282-L285 HydrophobicContact CB-CB 4.43Å; P282-L285 WeakPolarHBondContact O-CB 3.31Å; P282-L285 PolarHBondContact O-N 3.45Å; P282-N286 PolarHBondContact O-N 2.98Å; P282-N286 VanDerWaalsContact O-N 3.13Å
283P81Confident86.3Confident65 Ų6554.9 Ų54.942%0.42229%0.29SS..Hα-helixtrans-59.4-30.1179.4-24.231.5000113.9N286 D287P283-N286 PolarHBondContact O-N 3.31Å; P283-D287 PolarHBondContact O-N 2.93Å
284T84.4Confident86.7Confident60 Ų6051.3 Ų51.337%0.36827%0.271SS..Hα-helixtrans-64.3-40.8174.6-49.70000111.4R87 P282 N286 D287 V288R87-T284 VanDerWaalsContact NH2-N 3.16Å; R87-T284 PolarHBondContact NH2-OG1 3.27Å; P282-T284 PolarHBondContact O-N 3.4Å; P282-T284 VanDerWaalsContact O-N 3.13Å; T284-N286 VanDerWaalsContact C-N 3.34Å; T284-D287 PolarHBondContact O-N 3.42Å; T284-V288 VanDerWaalsContact O-CG2 3.32Å; T284-V288 WeakPolarHBondContact O-CG2 3.24Å; T284-V288 PolarHBondContact O-N 2.95Å
285L86.9Confident87Confident76 Ų7651.6 Ų51.640%0.39827%0.273SS..Hα-helixtrans-66.3-42.7177.6178.757.8000109.8I281 P282 D287 V288 L289I281-L285 HydrophobicContact CG2-CB 4.4Å; I281-L285 HydrophobicContact CG2-CD2 4.21Å; I281-L285 HydrophobicContact CG2-CG 4.42Å; P282-L285 HydrophobicContact CB-CB 4.43Å; P282-L285 WeakPolarHBondContact O-CB 3.31Å; P282-L285 PolarHBondContact O-N 3.45Å; L285-D287 VanDerWaalsContact C-N 3.32Å; L285-D287 PolarHBondContact O-N 2.94Å; L285-V288 PolarHBondContact O-N 3.07Å; L285-L289 HydrophobicContact CD1-CD1 4.18Å; L285-L289 HydrophobicContact CD1-CG 4.13Å; L285-L289 HydrophobicContact CG-CD1 4.02Å; L285-L289 HydrophobicContact CG-CG 4.41Å; L285-L289 WeakPolarHBondContact O-CB 3.28Å; L285-L289 VanDerWaalsContact O-CG 3.24Å; L285-L289 WeakPolarHBondContact O-CG 3.32Å; L285-L289 PolarHBondContact O-N 2.67Å
286N84.6Confident87.3Confident32 Ų3251.5 Ų51.517%0.17127%0.272CS..Hα-helixtrans-58.3-44.7175.6-161.637.4000111.8F267 P282 P283 T284 L289 I290F267-N286 VanDerWaalsContact CE2-OD1 3.29Å; F267-N286 WeakPolarHBondContact CE2-OD1 3.3Å; P282-N286 PolarHBondContact O-N 2.98Å; P282-N286 VanDerWaalsContact O-N 3.13Å; P283-N286 PolarHBondContact O-N 3.31Å; T284-N286 VanDerWaalsContact C-N 3.34Å; N286-L289 PolarHBondContact O-N 3.11Å; N286-I290 VanDerWaalsContact O-CG1 3.3Å; N286-I290 WeakPolarHBondContact O-CG1 3.34Å; N286-I290 PolarHBondContact O-N 3.41Å
287D87.3Confident87.5Confident14 Ų1446.5 Ų46.58%0.07525%0.25CS..Hα-helixtrans-61.9-45176-77.9-21.3000112.8R83 P283 T284 L285 L289 I290 W291R83-D287 IonicContact CZ-OD1 3.22Å; R83-D287 VanDerWaalsContact CZ-OD1 3.22Å; R83-D287 IonicContact NH1-OD1 2.66Å; R83-D287 PolarHBondContact NH1-OD1 2.94Å; R83-D287 IonicContact NH1-OD2 3.74Å; R83-D287 IonicContact NH2-OD1 2.95Å; R83-D287 PolarHBondContact NH2-OD1 2.93Å; P283-D287 PolarHBondContact O-N 2.93Å; T284-D287 PolarHBondContact O-N 3.42Å; L285-D287 VanDerWaalsContact C-N 3.32Å; L285-D287 PolarHBondContact O-N 2.94Å; D287-L289 VanDerWaalsContact C-N 3.3Å; D287-L289 PolarHBondContact O-N 3.34Å; D287-I290 PolarHBondContact O-N 3.3Å; D287-W291 VanDerWaalsContact O-CD1 3.25Å; D287-W291 PolarHBondContact O-N 3.08Å
288V89.5Confident87.8Confident89 Ų8942.7 Ų42.754%0.53923%0.231SC..Hα-helixtrans-59.6-43.2176.6169.20000110.9T284 L285 W291 F292T284-V288 VanDerWaalsContact O-CG2 3.32Å; T284-V288 WeakPolarHBondContact O-CG2 3.24Å; T284-V288 PolarHBondContact O-N 2.95Å; L285-V288 PolarHBondContact O-N 3.07Å; V288-W291 PolarHBondContact O-N 2.87Å; V288-F292 WeakPolarHBondContact O-CB 3.49Å; V288-F292 PolarHBondContact O-N 3.13Å
289L90.4Very high88Confident19 Ų1938.8 Ų38.810%0.09921%0.212CC..Hα-helixtrans-67.9-38.5179.2-67.2174.4000112.4P266 F267 C270 L285 N286 D287 F292 G293P266-L289 HydrophobicContact CB-CD2 3.7Å; F267-L289 HydrophobicContact CB-CB 3.99Å; F267-L289 HydrophobicContact CD2-CB 3.91Å; F267-L289 HydrophobicContact CG-CB 4.45Å; C270-L289 HydrophobicContact CB-CD1 3.71Å; C270-L289 VanDerWaalsContact SG-CD1 3.57Å; L285-L289 HydrophobicContact CD1-CD1 4.18Å; L285-L289 HydrophobicContact CD1-CG 4.13Å; L285-L289 HydrophobicContact CG-CD1 4.02Å; L285-L289 HydrophobicContact CG-CG 4.41Å; L285-L289 WeakPolarHBondContact O-CB 3.28Å; L285-L289 VanDerWaalsContact O-CG 3.24Å; L285-L289 WeakPolarHBondContact O-CG 3.32Å; L285-L289 PolarHBondContact O-N 2.67Å; N286-L289 PolarHBondContact O-N 3.11Å; D287-L289 VanDerWaalsContact C-N 3.3Å; D287-L289 PolarHBondContact O-N 3.34Å; L289-F292 WeakPolarHBondContact O-CB 3.4Å; L289-F292 PolarHBondContact O-N 3.11Å; L289-G293 PolarHBondContact O-N 3.25Å
290I89.6Confident88.2Confident7 Ų736.5 Ų36.54%0.03620%0.203CC..Hα-helixtrans-61.7-48.3173.4-71.2169.5000110.5F267 N286 D287 F292 G293 Y294F267-I290 HydrophobicContact CD2-CG1 3.61Å; F267-I290 HydrophobicContact CE2-CB 4.4Å; F267-I290 HydrophobicContact CE2-CD1 3.76Å; F267-I290 HydrophobicContact CE2-CG1 3.1Å; F267-I290 HydrophobicContact CZ-CD1 4.18Å; F267-I290 HydrophobicContact CZ-CG1 3.66Å; N286-I290 VanDerWaalsContact O-CG1 3.3Å; N286-I290 WeakPolarHBondContact O-CG1 3.34Å; N286-I290 PolarHBondContact O-N 3.41Å; D287-I290 PolarHBondContact O-N 3.3Å; I290-F292 VanDerWaalsContact C-N 3.25Å; I290-F292 PolarHBondContact O-N 3.12Å; I290-G293 CarbonylContact O-C 3.59Å; I290-G293 WeakPolarHBondContact O-CA 3.24Å; I290-G293 PolarHBondContact O-N 3Å; I290-Y294 HydrophobicContact CG2-CD1 4.36Å; I290-Y294 HydrophobicContact CG2-CD2 4.19Å; I290-Y294 HydrophobicContact CG2-CE1 3.78Å; I290-Y294 HydrophobicContact CG2-CE2 3.59Å; I290-Y294 WeakPolarHBondContact CG2-OH 3.02Å; I290-Y294 PolarHBondContact O-N 2.84Å
291W93.3Very high88.3Confident19 Ų1932.3 Ų32.37%0.07218%0.178CC..Hα-helixtrans-62.2-35.2177.3-8697.7000112.1M30 I33 I34 M77 M81 S84 D287 V288 G293 Y294 L295M30-W291 HydrophobicContact CB-CH2 3.62Å; M30-W291 HydrophobicContact CB-CZ2 4.02Å; M30-W291 HydrophobicContact CB-CZ3 4.02Å; M30-W291 HydrophobicContact CE-CD2 4.24Å; M30-W291 HydrophobicContact CE-CG 4.38Å; M30-W291 HydrophobicContact CE-CZ2 4.23Å; M30-W291 HydrophobicContact CG-CD2 4.18Å; M30-W291 HydrophobicContact CG-CE3 4.19Å; M30-W291 HydrophobicContact CG-CH2 3.65Å; M30-W291 HydrophobicContact CG-CZ2 3.64Å; M30-W291 HydrophobicContact CG-CZ3 3.93Å; M30-W291 HydrophobicContact SD-CD2 4.47Å; M30-W291 HydrophobicContact SD-CH2 4.13Å; M30-W291 HydrophobicContact SD-CZ2 3.51Å; M30-W291 VanDerWaalsContact SD-CZ2 3.51Å; I33-W291 HydrophobicContact CB-CZ3 4.31Å; I33-W291 HydrophobicContact CD1-CE3 4.25Å; I33-W291 HydrophobicContact CD1-CZ3 4.46Å; I33-W291 HydrophobicContact CG2-CE3 4.39Å; I33-W291 HydrophobicContact CG2-CZ3 4.04Å; I34-W291 HydrophobicContact CD1-CH2 4.21Å; I34-W291 HydrophobicContact CG1-CH2 4.31Å; M77-W291 HydrophobicContact CB-CH2 4.27Å; M81-W291 HydrophobicContact CB-CH2 4.17Å; M81-W291 HydrophobicContact CB-CZ2 3.84Å; S84-W291 PolarHBondContact OG-NE1 2.77Å; S84-W291 VanDerWaalsContact OG-NE1 3.11Å; D287-W291 VanDerWaalsContact O-CD1 3.25Å; D287-W291 PolarHBondContact O-N 3.08Å; V288-W291 PolarHBondContact O-N 2.87Å; W291-G293 VanDerWaalsContact C-N 3.34Å; W291-Y294 HydrophobicContact CD2-CD2 4.09Å; W291-Y294 HydrophobicContact CE3-CD2 4.06Å; W291-Y294 HydrophobicContact CG-CD2 4.48Å; W291-Y294 HydrophobicContact CZ3-CD2 4.41Å; W291-Y294 WeakPolarHBondContact O-CB 3.29Å; W291-Y294 PolarHBondContact O-N 3.13Å; W291-L295 PolarHBondContact O-N 3.39Å; W291-L295 VanDerWaalsContact O-N 3.16Å
292F91.1Very high88.3Confident73 Ų7334.5 Ų34.532%0.3219%0.188SC..Hα-helixtrans-65.4-37172.4-168.4-119.2000112.4I262 C263 P266 V288 L289 I290 L295I262-F292 HydrophobicContact CG2-CE1 4.41Å; I262-F292 HydrophobicContact CG2-CZ 4.13Å; I262-F292 WeakPolarHBondContact O-CE1 3.05Å; C263-F292 WeakPolarHBondContact CB-O 3.15Å; C263-F292 WeakPolarHBondContact O-CD1 3.11Å; P266-F292 HydrophobicContact CG-CD1 4.43Å; P266-F292 HydrophobicContact CG-CE1 4.24Å; V288-F292 WeakPolarHBondContact O-CB 3.49Å; V288-F292 PolarHBondContact O-N 3.13Å; L289-F292 WeakPolarHBondContact O-CB 3.4Å; L289-F292 PolarHBondContact O-N 3.11Å; I290-F292 VanDerWaalsContact C-N 3.25Å; I290-F292 PolarHBondContact O-N 3.12Å; F292-L295 HydrophobicContact CD2-CD1 3.93Å; F292-L295 HydrophobicContact CE2-CD1 4.44Å; F292-L295 WeakPolarHBondContact O-CB 3.32Å; F292-L295 PolarHBondContact O-N 3.13Å
293G89.5Confident88.1Confident0 Ų031.6 Ų31.60%017%0.169CC..Hα-helixtrans-61.8-45.9169.400000112.5W264 L289 I290 W291 L295 N296W264-G293 PolarHBondContact NE1-O 2.72Å; W264-G293 VanDerWaalsContact NE1-O 3.12Å; L289-G293 PolarHBondContact O-N 3.25Å; I290-G293 CarbonylContact O-C 3.59Å; I290-G293 WeakPolarHBondContact O-CA 3.24Å; I290-G293 PolarHBondContact O-N 3Å; W291-G293 VanDerWaalsContact C-N 3.34Å; G293-L295 PolarHBondContact O-N 2.94Å; G293-N296 WeakPolarHBondContact O-CB 3.3Å; G293-N296 PolarHBondContact O-N 3.11Å
294Y93.2Very high88.1Confident0 Ų028.7 Ų28.70%015%0.15CC..Hα-helixtrans-58.7-30.8177.2-69.6-15.1000113.6L72 V76 M77 S80 D103 I290 W291 N296 S297L72-Y294 HydrophobicContact CD1-CE1 4.26Å; L72-Y294 HydrophobicContact CD2-CD1 4.04Å; V76-Y294 HydrophobicContact CG1-CE1 4.38Å; V76-Y294 VanDerWaalsContact CG1-OH 3.29Å; V76-Y294 WeakPolarHBondContact CG1-OH 3.35Å; M77-Y294 HydrophobicContact CE-CG 4.08Å; M77-Y294 HydrophobicContact CG-CD2 3.97Å; M77-Y294 HydrophobicContact CG-CE2 4.28Å; M77-Y294 HydrophobicContact CG-CG 4.34Å; S80-Y294 PolarHBondContact OG-OH 3.33Å; D103-Y294 VanDerWaalsContact CG-OH 3.32Å; D103-Y294 WeakPolarHBondContact OD1-CE1 3.31Å; D103-Y294 PolarHBondContact OD2-OH 3.41Å; I290-Y294 HydrophobicContact CG2-CD1 4.36Å; I290-Y294 HydrophobicContact CG2-CD2 4.19Å; I290-Y294 HydrophobicContact CG2-CE1 3.78Å; I290-Y294 HydrophobicContact CG2-CE2 3.59Å; I290-Y294 WeakPolarHBondContact CG2-OH 3.02Å; I290-Y294 PolarHBondContact O-N 2.84Å; W291-Y294 HydrophobicContact CD2-CD2 4.09Å; W291-Y294 HydrophobicContact CE3-CD2 4.06Å; W291-Y294 HydrophobicContact CG-CD2 4.48Å; W291-Y294 HydrophobicContact CZ3-CD2 4.41Å; W291-Y294 WeakPolarHBondContact O-CB 3.29Å; W291-Y294 PolarHBondContact O-N 3.13Å; Y294-N296 PolarHBondContact O-N 2.94Å; Y294-N296 VanDerWaalsContact O-N 3.11Å; Y294-S297 PolarHBondContact O-N 3.35Å
295L91.4Very high87.8Confident35 Ų3527 Ų2718%0.18314%0.142CC..Hα-helixtrans-58.9-22.7175.1-70.6175.5000113I33 W291 F292 G293 S297 T298 F299I33-L295 HydrophobicContact CD1-CD2 3.94Å; I33-L295 HydrophobicContact CG1-CD2 3.98Å; I33-L295 HydrophobicContact CG2-CD2 4.01Å; W291-L295 PolarHBondContact O-N 3.39Å; W291-L295 VanDerWaalsContact O-N 3.16Å; F292-L295 HydrophobicContact CD2-CD1 3.93Å; F292-L295 HydrophobicContact CE2-CD1 4.44Å; F292-L295 WeakPolarHBondContact O-CB 3.32Å; F292-L295 PolarHBondContact O-N 3.13Å; G293-L295 PolarHBondContact O-N 2.94Å; L295-S297 VanDerWaalsContact C-N 3.31Å; L295-S297 PolarHBondContact O-N 3.26Å; L295-T298 CarbonylContact O-C 3.44Å; L295-T298 WeakPolarHBondContact O-CA 3.45Å; L295-T298 WeakPolarHBondContact O-CB 3.45Å; L295-T298 PolarHBondContact O-N 2.02Å; L295-T298 VanDerWaalsContact O-N 3.08Å; L295-F299 HydrophobicContact CB-CD2 4.15Å; L295-F299 HydrophobicContact CB-CE2 3.7Å; L295-F299 HydrophobicContact CB-CZ 4.1Å; L295-F299 HydrophobicContact CD1-CE2 4.41Å; L295-F299 HydrophobicContact CD1-CZ 4.29Å; L295-F299 WeakPolarHBondContact O-CD2 3.47Å; L295-F299 VanDerWaalsContact O-CG 3.26Å; L295-F299 WeakPolarHBondContact O-CG 3.19Å; L295-F299 PolarHBondContact O-N 2.95Å
296N89.3Confident87.2Confident1 Ų130.9 Ų30.91%0.00516%0.156CC..Hα-helixtrans-54.1-48.6171.9179.464000111.8F260 C263 G293 Y294 T298 F299 N300F260-N296 VanDerWaalsContact CA-OD1 3.31Å; F260-N296 WeakPolarHBondContact CA-OD1 3.45Å; C263-N296 HydrophobicContact CB-CB 4.07Å; G293-N296 WeakPolarHBondContact O-CB 3.3Å; G293-N296 PolarHBondContact O-N 3.11Å; Y294-N296 PolarHBondContact O-N 2.94Å; Y294-N296 VanDerWaalsContact O-N 3.11Å; N296-T298 PolarHBondContact O-N 3.33Å; N296-F299 PolarHBondContact O-N 2.89Å; N296-N300 PolarHBondContact O-N 3.42Å; N296-N300 VanDerWaalsContact O-N 3.07Å; N296-N300 PolarHBondContact O-OD1 3.49Å
297S91.1Very high86.5Confident2 Ų232.7 Ų32.71%0.01416%0.163CC..Hα-helixtrans-66.6-27.3178.3-62.10000112.3N41 D69 L72 Y294 L295N41-S297 PolarHBondContact ND2-O 3.44Å; D69-S297 WeakPolarHBondContact OD1-CB 2.87Å; D69-S297 PolarHBondContact OD1-OG 3.06Å; L72-S297 WeakPolarHBondContact CD2-OG 3.34Å; Y294-S297 PolarHBondContact O-N 3.35Å; L295-S297 VanDerWaalsContact C-N 3.31Å; L295-S297 PolarHBondContact O-N 3.26Å
298T91.3Very high85.9Confident7 Ų733.1 Ų33.14%0.04316%0.163CC..Hα-helixtrans-73.9-38.7172.7-44.70000112T36 T37 L295 N296 M302T36-T298 HydrophobicContact CG2-CG2 3.65Å; T37-T298 PolarHBondContact OG1-OG1 3.08Å; L295-T298 CarbonylContact O-C 3.44Å; L295-T298 WeakPolarHBondContact O-CA 3.45Å; L295-T298 WeakPolarHBondContact O-CB 3.45Å; L295-T298 PolarHBondContact O-N 2.02Å; L295-T298 VanDerWaalsContact O-N 3.08Å; N296-T298 PolarHBondContact O-N 3.33Å; T298-M302 HydrophobicContact CG2-CE 4.26Å
299F88.4Confident85.4Confident67 Ų6732 Ų3229%0.29416%0.158SC..Hα-helixtrans-77.4-25.4-177.4-65.5-37.4000113.1V259 L295 N296 M302 V303V259-F299 HydrophobicContact CG1-CB 3.92Å; V259-F299 HydrophobicContact CG1-CD2 3.65Å; V259-F299 HydrophobicContact CG1-CG 4.19Å; L295-F299 HydrophobicContact CB-CD2 4.15Å; L295-F299 HydrophobicContact CB-CE2 3.7Å; L295-F299 HydrophobicContact CB-CZ 4.1Å; L295-F299 HydrophobicContact CD1-CE2 4.41Å; L295-F299 HydrophobicContact CD1-CZ 4.29Å; L295-F299 WeakPolarHBondContact O-CD2 3.47Å; L295-F299 VanDerWaalsContact O-CG 3.26Å; L295-F299 WeakPolarHBondContact O-CG 3.19Å; L295-F299 PolarHBondContact O-N 2.95Å; N296-F299 PolarHBondContact O-N 2.89Å; F299-M302 HydrophobicContact CD1-CE 4.49Å; F299-M302 HydrophobicContact CD1-SD 3.85Å; F299-M302 HydrophobicContact CE1-SD 4.39Å; F299-M302 WeakPolarHBondContact O-CA 3.26Å; F299-M302 WeakPolarHBondContact O-CB 3.49Å; F299-M302 PolarHBondContact O-N 3.49Å; F299-V303 WeakPolarHBondContact O-CG2 3.19Å; F299-V303 PolarHBondContact O-N 2.79Å
300N86.2Confident85Confident1 Ų131.4 Ų31.41%0.00515%0.154CC..Hα-helixtrans-49-55.5179.9-78.9-19.5000113.5D69 N296 M302 V303 Y304D69-N300 PolarHBondContact OD2-ND2 2.91Å; N296-N300 PolarHBondContact O-N 3.42Å; N296-N300 VanDerWaalsContact O-N 3.07Å; N296-N300 PolarHBondContact O-OD1 3.49Å; N300-M302 VanDerWaalsContact C-N 3.3Å; N300-M302 PolarHBondContact O-N 3.49Å; N300-V303 PolarHBondContact O-N 3.26Å; N300-Y304 HydrophobicContact CB-CE2 4.42Å; N300-Y304 WeakPolarHBondContact O-CD1 3.35Å; N300-Y304 WeakPolarHBondContact O-CD2 3.41Å; N300-Y304 VanDerWaalsContact O-CG 3.25Å; N300-Y304 PolarHBondContact O-N 3.22Å
301P86.3Confident84.7Confident9 Ų931.3 Ų31.36%0.05815%0.154CC..Hα-helixtrans-59.1-35173.8-25.633.8000114.6N41 V44 Y304 A305N41-P301 WeakPolarHBondContact OD1-CG 3.47Å; V44-P301 HydrophobicContact CG2-CB 4.19Å; V44-P301 HydrophobicContact CG2-CG 4.26Å; P301-Y304 PolarHBondContact O-N 3.4Å; P301-A305 PolarHBondContact O-N 2.9Å
302M84.5Confident84.3Confident77 Ų7736.4 Ų36.438%0.37917%0.173SC..Hα-helixtrans-66-46.5178.1-58.3-173-174.700110.6T36 T298 F299 N300 Y304 A305 F306T36-M302 HydrophobicContact CG2-CE 3.82Å; T298-M302 HydrophobicContact CG2-CE 4.26Å; F299-M302 HydrophobicContact CD1-CE 4.49Å; F299-M302 HydrophobicContact CD1-SD 3.85Å; F299-M302 HydrophobicContact CE1-SD 4.39Å; F299-M302 WeakPolarHBondContact O-CA 3.26Å; F299-M302 WeakPolarHBondContact O-CB 3.49Å; F299-M302 PolarHBondContact O-N 3.49Å; N300-M302 VanDerWaalsContact C-N 3.3Å; N300-M302 PolarHBondContact O-N 3.49Å; M302-Y304 PolarHBondContact O-N 2.98Å; M302-A305 WeakPolarHBondContact O-CB 3.44Å; M302-A305 PolarHBondContact O-N 3.29Å; M302-F306 HydrophobicContact CB-CE2 4.5Å; M302-F306 WeakPolarHBondContact O-CD2 3.49Å; M302-F306 PolarHBondContact O-N 3.4Å
303V80.6Confident84Confident11 Ų1136.8 Ų36.87%0.06717%0.174CC..Hα-helixtrans-58.1-42.6175.1-174.60000109.2T252 V256 F299 N300 A305 F306 F307T252-V303 HydrophobicContact CG2-CG1 4.47Å; V256-V303 HydrophobicContact CB-CG1 4.35Å; V256-V303 HydrophobicContact CG2-CB 4.05Å; V256-V303 HydrophobicContact CG2-CG1 3.27Å; F299-V303 WeakPolarHBondContact O-CG2 3.19Å; F299-V303 PolarHBondContact O-N 2.79Å; N300-V303 PolarHBondContact O-N 3.26Å; V303-A305 PolarHBondContact O-N 2.84Å; V303-F306 PolarHBondContact O-N 2.76Å; V303-F307 HydrophobicContact CG1-CD2 3.55Å; V303-F307 HydrophobicContact CG1-CE2 3.88Å; V303-F307 WeakPolarHBondContact O-CB 3.24Å; V303-F307 WeakPolarHBondContact O-CD2 3.21Å; V303-F307 PolarHBondContact O-N 3.14Å; V303-F307 VanDerWaalsContact O-N 3.11Å
304Y80.6Confident83.8Confident3 Ų336.8 Ų36.81%0.01217%0.174CC..Hα-helixtrans-62.4-40.6175.3-54.9-25.8000113.4V44 I62 N300 P301 M302 F306 F307 Y308V44-Y304 HydrophobicContact CG1-CD2 4.26Å; V44-Y304 HydrophobicContact CG1-CE2 4.2Å; V44-Y304 HydrophobicContact CG2-CD2 3.74Å; V44-Y304 HydrophobicContact CG2-CE2 4.19Å; I62-Y304 HydrophobicContact CG2-CD2 4.37Å; I62-Y304 HydrophobicContact CG2-CE1 4.46Å; I62-Y304 HydrophobicContact CG2-CE2 3.65Å; N300-Y304 HydrophobicContact CB-CE2 4.42Å; N300-Y304 WeakPolarHBondContact O-CD1 3.35Å; N300-Y304 WeakPolarHBondContact O-CD2 3.41Å; N300-Y304 VanDerWaalsContact O-CG 3.25Å; N300-Y304 PolarHBondContact O-N 3.22Å; P301-Y304 PolarHBondContact O-N 3.4Å; M302-Y304 PolarHBondContact O-N 2.98Å; Y304-F306 PolarHBondContact O-N 3.32Å; Y304-F307 PolarHBondContact O-N 3Å; Y304-Y308 AromaticContact CD1-CD2 3.85Å; Y304-Y308 HydrophobicContact CD1-CD2 3.85Å; Y304-Y308 AromaticContact CD1-CE2 3.61Å; Y304-Y308 HydrophobicContact CD1-CE2 3.61Å; Y304-Y308 HydrophobicContact CE1-CE2 4.26Å; Y304-Y308 HydrophobicContact CG-CD2 4.15Å; Y304-Y308 HydrophobicContact CG-CE2 4.34Å; Y304-Y308 WeakPolarHBondContact O-CA 3.22Å; Y304-Y308 VanDerWaalsContact O-CB 3.31Å; Y304-Y308 WeakPolarHBondContact O-CB 3.36Å; Y304-Y308 PolarHBondContact O-N 2.66Å
305A79.3Confident83.5Confident26 Ų2638.9 Ų38.922%0.21519%0.185CC..Hα-helixtrans-62.9-40.5176.700000113.7P301 M302 V303 F311 R312P301-A305 PolarHBondContact O-N 2.9Å; M302-A305 WeakPolarHBondContact O-CB 3.44Å; M302-A305 PolarHBondContact O-N 3.29Å; V303-A305 PolarHBondContact O-N 2.84Å; A305-F311 HydrophobicContact CB-CD1 3.86Å; A305-F311 HydrophobicContact CB-CE1 3.86Å; A305-R312 WeakPolarHBondContact O-CD 3.2Å; A305-R312 WeakPolarHBondContact O-CG 3.43Å; A305-R312 PolarHBondContact O-NE 2.93Å
306F73.6Confident83.2Confident157 Ų15743.7 Ų43.769%0.68921%0.205SC*.Hα-helixtrans-69.3-37.8178.6-77.2-69.1000112.2M302 V303 Y304M302-F306 HydrophobicContact CB-CE2 4.5Å; M302-F306 WeakPolarHBondContact O-CD2 3.49Å; M302-F306 PolarHBondContact O-N 3.4Å; V303-F306 PolarHBondContact O-N 2.76Å; Y304-F306 PolarHBondContact O-N 3.32Å
307F70.4Confident83.1Confident70 Ų7044.5 Ų44.531%0.30721%0.209SC..Hα-helixtrans-109.9-23.5-164.5-69.8-67.5000115.8T252 I255 V303 Y304 P309T252-F307 HydrophobicContact CG2-CB 3.09Å; T252-F307 HydrophobicContact CG2-CD1 4.32Å; T252-F307 HydrophobicContact CG2-CD2 3.78Å; T252-F307 HydrophobicContact CG2-CG 3.49Å; T252-F307 VanDerWaalsContact CG2-CG 3.49Å; T252-F307 WeakPolarHBondContact OG1-CB 3.38Å; T252-F307 WeakPolarHBondContact OG1-CD1 3.37Å; T252-F307 WeakPolarHBondContact OG1-CG 3.43Å; I255-F307 HydrophobicContact CB-CE2 4.32Å; I255-F307 HydrophobicContact CB-CZ 4.46Å; I255-F307 HydrophobicContact CD1-CE1 3.75Å; I255-F307 HydrophobicContact CD1-CE2 3.97Å; I255-F307 HydrophobicContact CD1-CZ 3.27Å; I255-F307 HydrophobicContact CG1-CZ 4.43Å; I255-F307 HydrophobicContact CG2-CE2 3.99Å; I255-F307 HydrophobicContact CG2-CZ 4.29Å; V303-F307 HydrophobicContact CG1-CD2 3.55Å; V303-F307 HydrophobicContact CG1-CE2 3.88Å; V303-F307 WeakPolarHBondContact O-CB 3.24Å; V303-F307 WeakPolarHBondContact O-CD2 3.21Å; V303-F307 PolarHBondContact O-N 3.14Å; V303-F307 VanDerWaalsContact O-N 3.11Å; Y304-F307 PolarHBondContact O-N 3Å; F307-P309 VanDerWaalsContact O-CD 3.31Å; F307-P309 WeakPolarHBondContact O-CD 3.23Å
308Y75.2Confident83Confident22 Ų2246.3 Ų46.39%0.08622%0.218CC..  trans-99.4108176.7-69.7-67.4000110.9T252 Y304 W310 F311 R312T252-Y308 HydrophobicContact CG2-CE2 4.13Å; Y304-Y308 AromaticContact CD1-CD2 3.85Å; Y304-Y308 HydrophobicContact CD1-CD2 3.85Å; Y304-Y308 AromaticContact CD1-CE2 3.61Å; Y304-Y308 HydrophobicContact CD1-CE2 3.61Å; Y304-Y308 HydrophobicContact CE1-CE2 4.26Å; Y304-Y308 HydrophobicContact CG-CD2 4.15Å; Y304-Y308 HydrophobicContact CG-CE2 4.34Å; Y304-Y308 WeakPolarHBondContact O-CA 3.22Å; Y304-Y308 VanDerWaalsContact O-CB 3.31Å; Y304-Y308 WeakPolarHBondContact O-CB 3.36Å; Y304-Y308 PolarHBondContact O-N 2.66Å; Y308-W310 AromaticContact CD1-CD1 3.81Å; Y308-W310 AromaticContact CD1-CE2 3.93Å; Y308-W310 HydrophobicContact CD1-CZ2 4.36Å; Y308-W310 AromaticContact CD1-NE1 3.09Å; Y308-W310 HydrophobicContact CD2-CZ2 4.26Å; Y308-W310 AromaticContact CE1-NE1 3.92Å; Y308-W310 AromaticContact CG-CE2 3.79Å; Y308-W310 HydrophobicContact CG-CZ2 4.01Å; Y308-W310 AromaticContact CG-NE1 3.38Å; Y308-W310 PolarHBondContact O-N 2.87Å; Y308-F311 WeakPolarHBondContact O-CB 3.25Å; Y308-F311 PolarHBondContact O-N 3.31Å; Y308-F311 VanDerWaalsContact O-N 3.1Å; Y308-R312 PolarHBondContact O-N 3.48Å
309P79.3Confident82.8Confident66 Ų6651.7 Ų51.743%0.42925%0.246SC..Hα-helixtrans-59.9-35.2176.2-22.533.9000112.7F307 F311 R312 K313F307-P309 VanDerWaalsContact O-CD 3.31Å; F307-P309 WeakPolarHBondContact O-CD 3.23Å; P309-F311 VanDerWaalsContact C-N 3.28Å; P309-F311 PolarHBondContact O-N 2.93Å; P309-R312 PolarHBondContact O-N 3.15Å; P309-K313 PolarHBondContact O-N 3.01Å
310W81.1Confident82.9Confident6 Ų655.7 Ų55.72%0.02326%0.263CS..Hα-helixtrans-62.2-37.4176.966.2-104.1000111.6I48 L54 Y308 K313 A314 L333 F334I48-W310 HydrophobicContact CD1-CH2 4.26Å; I48-W310 HydrophobicContact CG1-CH2 4.04Å; I48-W310 HydrophobicContact CG1-CZ3 4.34Å; L54-W310 HydrophobicContact CD1-CD2 4.2Å; L54-W310 HydrophobicContact CD1-CE3 3.33Å; L54-W310 HydrophobicContact CD1-CH2 4.3Å; L54-W310 HydrophobicContact CD1-CZ3 3.4Å; L54-W310 VanDerWaalsContact CD1-CZ3 3.4Å; L54-W310 HydrophobicContact CD2-CB 4.02Å; L54-W310 HydrophobicContact CD2-CD2 3.44Å; L54-W310 VanDerWaalsContact CD2-CD2 3.44Å; L54-W310 HydrophobicContact CD2-CE3 3.48Å; L54-W310 VanDerWaalsContact CD2-CE3 3.48Å; L54-W310 HydrophobicContact CD2-CG 3.71Å; L54-W310 HydrophobicContact CD2-CZ3 4.15Å; L54-W310 HydrophobicContact CG-CD2 4.48Å; L54-W310 HydrophobicContact CG-CE3 4.06Å; L54-W310 HydrophobicContact CG-CZ3 4.4Å; Y308-W310 AromaticContact CD1-CD1 3.81Å; Y308-W310 AromaticContact CD1-CE2 3.93Å; Y308-W310 HydrophobicContact CD1-CZ2 4.36Å; Y308-W310 AromaticContact CD1-NE1 3.09Å; Y308-W310 HydrophobicContact CD2-CZ2 4.26Å; Y308-W310 AromaticContact CE1-NE1 3.92Å; Y308-W310 AromaticContact CG-CE2 3.79Å; Y308-W310 HydrophobicContact CG-CZ2 4.01Å; Y308-W310 AromaticContact CG-NE1 3.38Å; Y308-W310 PolarHBondContact O-N 2.87Å; W310-K313 PolarHBondContact O-N 3.26Å; W310-A314 WeakPolarHBondContact O-CB 3.25Å; W310-A314 PolarHBondContact O-N 3.01Å; W310-L333 HydrophobicContact CB-CB 3.92Å; W310-F334 HydrophobicContact CB-CD1 4.36Å; W310-F334 HydrophobicContact CB-CE1 4.03Å; W310-F334 HydrophobicContact CB-CE2 4.48Å; W310-F334 HydrophobicContact CB-CZ 4.09Å; W310-F334 AromaticContact CD1-CE1 3.62Å; W310-F334 AromaticContact CD1-CZ 3.76Å; W310-F334 HydrophobicContact CG-CE1 4.15Å; W310-F334 HydrophobicContact CG-CZ 4.11Å
311F83.5Confident82.8Confident6 Ų657 Ų573%0.02628%0.278CS..Hα-helixtrans-67.6-43.3-179.4-175.4-95.9000111I43 V44 A305 Y308 P309 K313 A314 L315I43-F311 HydrophobicContact CG2-CE2 4.04Å; I43-F311 HydrophobicContact CG2-CZ 3.83Å; V44-F311 HydrophobicContact CB-CE2 4.23Å; V44-F311 HydrophobicContact CG2-CD2 4.43Å; V44-F311 HydrophobicContact CG2-CE2 3.46Å; V44-F311 VanDerWaalsContact CG2-CE2 3.46Å; V44-F311 HydrophobicContact CG2-CZ 3.82Å; A305-F311 HydrophobicContact CB-CD1 3.86Å; A305-F311 HydrophobicContact CB-CE1 3.86Å; Y308-F311 WeakPolarHBondContact O-CB 3.25Å; Y308-F311 PolarHBondContact O-N 3.31Å; Y308-F311 VanDerWaalsContact O-N 3.1Å; P309-F311 VanDerWaalsContact C-N 3.28Å; P309-F311 PolarHBondContact O-N 2.93Å; F311-K313 VanDerWaalsContact C-N 3.27Å; F311-K313 PolarHBondContact O-N 3.33Å; F311-A314 PolarHBondContact O-N 2.99Å; F311-L315 VanDerWaalsContact O-CB 3.29Å; F311-L315 WeakPolarHBondContact O-CB 3.46Å; F311-L315 PolarHBondContact O-N 3.24Å
312R85Confident82.8Confident126 Ų12661.3 Ų61.348%0.47530%0.295SS..Hα-helixtrans-59.5-37.9174.6-69.9-177.2-78.6168.6-4.1112.6A305 Y308 P309 K316A305-R312 WeakPolarHBondContact O-CD 3.2Å; A305-R312 WeakPolarHBondContact O-CG 3.43Å; A305-R312 PolarHBondContact O-NE 2.93Å; Y308-R312 PolarHBondContact O-N 3.48Å; P309-R312 PolarHBondContact O-N 3.15Å; R312-K316 WeakPolarHBondContact O-CG 3.5Å; R312-K316 PolarHBondContact O-N 2.91Å; R312-K316 VanDerWaalsContact O-N 3.12Å
313K84.5Confident82.9Confident80 Ų8058.8 Ų58.835%0.34828%0.283SS..Hα-helixtrans-72-42.8177.6-171164.5174.4-177.20111.6P309 W310 F311 K316 M317 K332 L333P309-K313 PolarHBondContact O-N 3.01Å; W310-K313 PolarHBondContact O-N 3.26Å; F311-K313 VanDerWaalsContact C-N 3.27Å; F311-K313 PolarHBondContact O-N 3.33Å; K313-K316 PolarHBondContact O-N 2.6Å; K313-M317 WeakPolarHBondContact O-CG 3.43Å; K313-M317 PolarHBondContact O-N 3.23Å; K313-K332 VanDerWaalsContact CE-O 3.29Å; K313-K332 WeakPolarHBondContact CE-O 3.48Å; K313-K332 PolarHBondContact NZ-O 3.34Å; K313-L333 HydrophobicContact CB-CD2 4.06Å; K313-L333 HydrophobicContact CD-CD2 4.36Å; K313-L333 HydrophobicContact CG-CD2 3.9Å
314A84.5Confident83.2Confident0 Ų067 Ų670%032%0.318CS..Hα-helixtrans-59.5-47.2173.800000111.5F51 W310 F311 K316 M317 I318 L333F51-A314 HydrophobicContact CD2-CB 3.98Å; F51-A314 HydrophobicContact CE2-CB 3.58Å; F51-A314 HydrophobicContact CZ-CB 4.41Å; W310-A314 WeakPolarHBondContact O-CB 3.25Å; W310-A314 PolarHBondContact O-N 3.01Å; F311-A314 PolarHBondContact O-N 2.99Å; A314-K316 PolarHBondContact O-N 3.01Å; A314-M317 WeakPolarHBondContact O-CB 3.39Å; A314-M317 PolarHBondContact O-N 3.4Å; A314-I318 WeakPolarHBondContact O-CG1 3.36Å; A314-I318 PolarHBondContact O-N 3.04Å; A314-L333 HydrophobicContact CB-CD1 4.21Å; A314-L333 HydrophobicContact CB-CD2 4.23Å
315L86.8Confident83.4Confident45 Ų4572.5 Ų72.524%0.23634%0.344CS..Hα-helixtrans-54.8-48.9175.2177.466.3000111.6I43 F311 M317 I318 L319I43-L315 HydrophobicContact CD1-CD1 3.85Å; I43-L315 HydrophobicContact CG2-CD1 3.91Å; F311-L315 VanDerWaalsContact O-CB 3.29Å; F311-L315 WeakPolarHBondContact O-CB 3.46Å; F311-L315 PolarHBondContact O-N 3.24Å; L315-M317 VanDerWaalsContact C-N 3.32Å; L315-M317 PolarHBondContact O-N 3.17Å; L315-I318 PolarHBondContact O-N 3.42Å; L315-L319 HydrophobicContact CD1-CD1 3.91Å; L315-L319 HydrophobicContact CD1-CG 4.07Å; L315-L319 HydrophobicContact CG-CD1 3.85Å; L315-L319 HydrophobicContact CG-CG 4.37Å; L315-L319 WeakPolarHBondContact O-CB 3.14Å; L315-L319 VanDerWaalsContact O-CG 3.28Å; L315-L319 WeakPolarHBondContact O-CG 3.25Å; L315-L319 PolarHBondContact O-N 3.32Å
316K86.8Confident83.5Confident136 Ų13680.5 Ų80.559%0.59137%0.374SS*.Hα-helixtrans-59.1-43.5175-74.3179.6-179.3-174.30111.6R312 K313 A314 I318 L319 F320R312-K316 WeakPolarHBondContact O-CG 3.5Å; R312-K316 PolarHBondContact O-N 2.91Å; R312-K316 VanDerWaalsContact O-N 3.12Å; K313-K316 PolarHBondContact O-N 2.6Å; A314-K316 PolarHBondContact O-N 3.01Å; K316-I318 VanDerWaalsContact C-N 3.33Å; K316-I318 PolarHBondContact O-N 2.9Å; K316-L319 PolarHBondContact O-N 3.3Å; K316-F320 HydrophobicContact CB-CD2 4.25Å; K316-F320 HydrophobicContact CB-CE2 4.34Å; K316-F320 HydrophobicContact CG-CE2 4.49Å; K316-F320 WeakPolarHBondContact O-CB 3.46Å; K316-F320 WeakPolarHBondContact O-CD2 3.25Å; K316-F320 PolarHBondContact O-N 3.41Å
317M85.8Confident83.9Confident18 Ų1877.8 Ų77.89%0.08937%0.367CS..Hα-helixtrans-64-38.1179-72.4-175.266.800112.9F51 K313 A314 L315 G321 K322 I323 C331 L333F51-M317 HydrophobicContact CE1-CE 3.68Å; F51-M317 HydrophobicContact CE1-SD 3.7Å; F51-M317 HydrophobicContact CZ-CB 4.06Å; F51-M317 HydrophobicContact CZ-CE 3.93Å; F51-M317 HydrophobicContact CZ-SD 3.74Å; K313-M317 WeakPolarHBondContact O-CG 3.43Å; K313-M317 PolarHBondContact O-N 3.23Å; A314-M317 WeakPolarHBondContact O-CB 3.39Å; A314-M317 PolarHBondContact O-N 3.4Å; L315-M317 VanDerWaalsContact C-N 3.32Å; L315-M317 PolarHBondContact O-N 3.17Å; M317-G321 PolarHBondContact O-N 3.23Å; M317-K322 HydrophobicContact CB-CB 4.38Å; M317-K322 HydrophobicContact CE-CB 4.45Å; M317-K322 PolarHBondContact O-N 3.41Å; M317-I323 PolarHBondContact O-N 2.79Å; M317-C331 HydrophobicContact CE-CB 3.9Å; M317-C331 HydrophobicContact SD-CB 4.13Å; M317-L333 HydrophobicContact SD-CD2 4.06Å
318I88.7Confident84.6Confident39 Ų3974.9 Ų74.920%0.236%0.355CS..Hα-helixtrans-67.1-51.1175.8-68.1165.5000110I43 V46 S47 A314 L315 K316 F320 G321 I323I43-I318 HydrophobicContact CG2-CD1 4.07Å; V46-I318 HydrophobicContact CG1-CD1 4.05Å; V46-I318 HydrophobicContact CG1-CG1 4.48Å; S47-I318 WeakPolarHBondContact OG-CD1 3.3Å; A314-I318 WeakPolarHBondContact O-CG1 3.36Å; A314-I318 PolarHBondContact O-N 3.04Å; L315-I318 PolarHBondContact O-N 3.42Å; K316-I318 VanDerWaalsContact C-N 3.33Å; K316-I318 PolarHBondContact O-N 2.9Å; I318-F320 VanDerWaalsContact C-N 3.32Å; I318-F320 PolarHBondContact O-N 3.27Å; I318-G321 PolarHBondContact O-N 3.19Å; I318-I323 HydrophobicContact CG1-CD1 4Å
319L87.8Confident85Confident121 Ų12175.2 Ų75.263%0.63436%0.36SS*.Hα-helixtrans-61.6-36.9-178.4-70.4174.3000113.1L315 K316 G321L315-L319 HydrophobicContact CD1-CD1 3.91Å; L315-L319 HydrophobicContact CD1-CG 4.07Å; L315-L319 HydrophobicContact CG-CD1 3.85Å; L315-L319 HydrophobicContact CG-CG 4.37Å; L315-L319 WeakPolarHBondContact O-CB 3.14Å; L315-L319 VanDerWaalsContact O-CG 3.28Å; L315-L319 WeakPolarHBondContact O-CG 3.25Å; L315-L319 PolarHBondContact O-N 3.32Å; K316-L319 PolarHBondContact O-N 3.3Å; L319-G321 VanDerWaalsContact C-N 3.3Å; L319-G321 PolarHBondContact O-N 3.05Å
320F89.5Confident85.2Confident150 Ų15080.6 Ų80.666%0.65837%0.372SS*.THydrogen-bonded Turntrans-87.910177.6-67.8-61.8000113.7K316 I318 K322K316-F320 HydrophobicContact CB-CD2 4.25Å; K316-F320 HydrophobicContact CB-CE2 4.34Å; K316-F320 HydrophobicContact CG-CE2 4.49Å; K316-F320 WeakPolarHBondContact O-CB 3.46Å; K316-F320 WeakPolarHBondContact O-CD2 3.25Å; K316-F320 PolarHBondContact O-N 3.41Å; I318-F320 VanDerWaalsContact C-N 3.32Å; I318-F320 PolarHBondContact O-N 3.27Å; F320-K322 HydrophobicContact CB-CD 4.45Å; F320-K322 HydrophobicContact CB-CG 4.12Å; F320-K322 PolarHBondContact O-N 3.41Å
321G85Confident85.3Confident30 Ų3082.7 Ų82.731%0.30939%0.387SS..THydrogen-bonded Turntrans64.110.1179.300000114.8M317 I318 L319 I323 F324M317-G321 PolarHBondContact O-N 3.23Å; I318-G321 PolarHBondContact O-N 3.19Å; L319-G321 VanDerWaalsContact C-N 3.3Å; L319-G321 PolarHBondContact O-N 3.05Å; G321-I323 PolarHBondContact O-N 3.31Å; G321-I323 VanDerWaalsContact O-N 3.16Å; G321-F324 WeakPolarHBondContact O-CD2 3.3Å; G321-F324 PolarHBondContact O-N 2.79Å
322K85.7Confident85.1Confident99 Ų9987.7 Ų87.743%0.4341%0.409SS..G310 helixtrans-68.9-13-179.9-63.4-173.4179-175.70112.5M317 F320 F324 Q325 S328M317-K322 HydrophobicContact CB-CB 4.38Å; M317-K322 HydrophobicContact CE-CB 4.45Å; M317-K322 PolarHBondContact O-N 3.41Å; F320-K322 HydrophobicContact CB-CD 4.45Å; F320-K322 HydrophobicContact CB-CG 4.12Å; F320-K322 PolarHBondContact O-N 3.41Å; K322-F324 PolarHBondContact O-N 3.32Å; K322-Q325 WeakPolarHBondContact O-CB 3.43Å; K322-Q325 PolarHBondContact O-N 3.27Å; K322-S328 WeakPolarHBondContact O-CB 3.4Å
323I87.9Confident84.7Confident23 Ų2381.8 Ų81.812%0.11839%0.387CS..G310 helixtrans-62-28.2172.7-161.5169000112.6V46 H50 M317 I318 G321 Q325 S328V46-I323 HydrophobicContact CG1-CD1 3.73Å; H50-I323 HydrophobicContact CB-CD1 4.05Å; H50-I323 WeakPolarHBondContact NE2-CG1 3.37Å; M317-I323 PolarHBondContact O-N 2.79Å; I318-I323 HydrophobicContact CG1-CD1 4Å; G321-I323 PolarHBondContact O-N 3.31Å; G321-I323 VanDerWaalsContact O-N 3.16Å; I323-Q325 VanDerWaalsContact C-N 3.29Å; I323-Q325 PolarHBondContact O-N 3.41Å; I323-S328 WeakPolarHBondContact O-CB 3.04Å; I323-S328 PolarHBondContact O-OG 3.49Å
324F85.4Confident84.2Confident183 Ų18382 Ų8280%0.80339%0.388SS*.G310 helixtrans-82.1-4179.3-57.5-67.1000113.9G321 K322G321-F324 WeakPolarHBondContact O-CD2 3.3Å; G321-F324 PolarHBondContact O-N 2.79Å; K322-F324 PolarHBondContact O-N 3.32Å
325Q86Confident82.9Confident120 Ų12088.5 Ų88.556%0.56142%0.422SS*.SBendtrans-72.1148.1176.6-64.7-179.2-1500111.1K322 I323 D327 S328K322-Q325 WeakPolarHBondContact O-CB 3.43Å; K322-Q325 PolarHBondContact O-N 3.27Å; I323-Q325 VanDerWaalsContact C-N 3.29Å; I323-Q325 PolarHBondContact O-N 3.41Å; Q325-D327 PolarHBondContact O-N 3.32Å; Q325-S328 VanDerWaalsContact O-CB 3.22Å; Q325-S328 WeakPolarHBondContact O-CB 3.42Å; Q325-S328 PolarHBondContact O-N 3.06Å; Q325-S328 PolarHBondContact O-OG 2.86Å; Q325-S328 VanDerWaalsContact O-OG 3.13Å
326K81.1Confident80.8Confident194 Ų19493 Ų9384%0.84344%0.442SS*.THydrogen-bonded Turntrans-57.5137.1175.1-164.3177.8178.2179.70109.9S328K326-S328 PolarHBondContact O-N 3.15Å
327D82.6Confident78.5Confident100 Ų10091.1 Ų91.154%0.53545%0.446SS..THydrogen-bonded Turntrans63.312.5-178.4-60.5-58.4000116.7Q325 S329 R330Q325-D327 PolarHBondContact O-N 3.32Å; D327-S329 PolarHBondContact O-N 2.88Å; D327-S329 VanDerWaalsContact O-N 3.11Å; D327-R330 PolarHBondContact O-N 3.17Å
328S84.8Confident75.9Confident8 Ų895.4 Ų95.46%0.05648%0.477CS..G310 helixtrans-56.6-29.7178.165.10000113.7H50 F51 K322 I323 Q325 K326 R330 C331H50-S328 PolarHBondContact CE1-OG 2.88Å; H50-S328 VanDerWaalsContact CE1-OG 3.24Å; H50-S328 PolarHBondContact NE2-OG 3.49Å; F51-S328 WeakPolarHBondContact CD1-O 3.36Å; F51-S328 WeakPolarHBondContact CE1-O 3.37Å; K322-S328 WeakPolarHBondContact O-CB 3.4Å; I323-S328 WeakPolarHBondContact O-CB 3.04Å; I323-S328 PolarHBondContact O-OG 3.49Å; Q325-S328 VanDerWaalsContact O-CB 3.22Å; Q325-S328 WeakPolarHBondContact O-CB 3.42Å; Q325-S328 PolarHBondContact O-N 3.06Å; Q325-S328 PolarHBondContact O-OG 2.86Å; Q325-S328 VanDerWaalsContact O-OG 3.13Å; K326-S328 PolarHBondContact O-N 3.15Å; S328-R330 PolarHBondContact O-N 3.35Å; S328-C331 WeakPolarHBondContact O-CB 3.15Å; S328-C331 PolarHBondContact O-N 2.91Å
329S83.6Confident73.2Confident29 Ų29102 Ų10220%0.20353%0.527CS..G310 helixtrans-64-19.2176.460.90000114.1H50 K52 D327H50-S329 PolarHBondContact NE2-N 3.49Å; H50-S329 WeakPolarHBondContact O-CA 3.25Å; H50-S329 WeakPolarHBondContact O-CB 3.24Å; K52-S329 PolarHBondContact N-O 2.99Å; D327-S329 PolarHBondContact O-N 2.88Å; D327-S329 VanDerWaalsContact O-N 3.11Å
330R84.1Confident72.4Confident179 Ų179101.1 Ų101.168%0.67552%0.522SS*.G310 helixtrans-100.10.7178.3-60-175.3-174.8-137.53.4113.3D327 S328 K332D327-R330 PolarHBondContact O-N 3.17Å; S328-R330 PolarHBondContact O-N 3.35Å; R330-K332 PolarHBondContact O-N 3.31Å
331C82.1Confident71.5Confident51 Ų5198.5 Ų98.535%0.34552%0.515SS..  trans-58.8133.6179.4-83.90000111.9F51 M317 S328 L333F51-C331 HydrophobicContact CE1-CB 4.4Å; M317-C331 HydrophobicContact CE-CB 3.9Å; M317-C331 HydrophobicContact SD-CB 4.13Å; S328-C331 WeakPolarHBondContact O-CB 3.15Å; S328-C331 PolarHBondContact O-N 2.91Å; C331-L333 PolarHBondContact O-N 3.21Å; C331-L333 VanDerWaalsContact O-N 3.16Å
332K78.8Confident70.8Confident111 Ų111102.3 Ų102.348%0.48353%0.526SS..  trans-68111.1173.8-67.3-172.1-173.5178.80109.7K313 R330 E336K313-K332 VanDerWaalsContact CE-O 3.29Å; K313-K332 WeakPolarHBondContact CE-O 3.48Å; K313-K332 PolarHBondContact NZ-O 3.34Å; R330-K332 PolarHBondContact O-N 3.31Å; K332-E336 IonicContact NZ-OE1 2.79Å; K332-E336 PolarHBondContact NZ-OE1 3.09Å; K332-E336 IonicContact NZ-OE2 3.93Å; K332-E336 PolarHBondContact NZ-OE2 3.42Å
333L77.4Confident69.9Low2 Ų2102.5 Ų102.51%0.0153%0.532CS..  trans-87.2-26.3178-70.7179.7000113.5F51 L54 W310 K313 A314 M317 C331F51-L333 HydrophobicContact CB-CD1 3.6Å; F51-L333 HydrophobicContact CB-CG 4.46Å; F51-L333 HydrophobicContact CD1-CD1 3.96Å; F51-L333 HydrophobicContact CD1-CD2 4.2Å; F51-L333 HydrophobicContact CD1-CG 4.1Å; F51-L333 HydrophobicContact CD2-CD1 3.67Å; F51-L333 HydrophobicContact CE1-CD2 4.08Å; F51-L333 HydrophobicContact CE1-CG 4.48Å; F51-L333 HydrophobicContact CE2-CD1 4.32Å; F51-L333 HydrophobicContact CE2-CD2 4.42Å; F51-L333 HydrophobicContact CG-CD1 3.48Å; F51-L333 VanDerWaalsContact CG-CD1 3.48Å; F51-L333 HydrophobicContact CG-CD2 4.43Å; F51-L333 HydrophobicContact CG-CG 4.13Å; F51-L333 HydrophobicContact CZ-CD2 4.2Å; L54-L333 HydrophobicContact CD1-CD1 3.63Å; L54-L333 HydrophobicContact CD2-CD1 3.96Å; L54-L333 HydrophobicContact CG-CD1 3.74Å; W310-L333 HydrophobicContact CB-CB 3.92Å; K313-L333 HydrophobicContact CB-CD2 4.06Å; K313-L333 HydrophobicContact CD-CD2 4.36Å; K313-L333 HydrophobicContact CG-CD2 3.9Å; A314-L333 HydrophobicContact CB-CD1 4.21Å; A314-L333 HydrophobicContact CB-CD2 4.23Å; M317-L333 HydrophobicContact SD-CD2 4.06Å; C331-L333 PolarHBondContact O-N 3.21Å; C331-L333 VanDerWaalsContact O-N 3.16Å
334F73.7Confident68.8Low83 Ų83107.4 Ų107.436%0.36456%0.558SS.*SBendtrans-81.3134171.4-59.5-86.2000109.1Q53 L54 W310 E336Q53-F334 VanDerWaalsContact CD-CD2 3.48Å; Q53-F334 HydrophobicContact CG-CD2 4.06Å; Q53-F334 HydrophobicContact CG-CE2 4.03Å; L54-F334 HydrophobicContact CD2-CE2 4.3Å; L54-F334 HydrophobicContact CD2-CZ 4.34Å; W310-F334 HydrophobicContact CB-CD1 4.36Å; W310-F334 HydrophobicContact CB-CE1 4.03Å; W310-F334 HydrophobicContact CB-CE2 4.48Å; W310-F334 HydrophobicContact CB-CZ 4.09Å; W310-F334 AromaticContact CD1-CE1 3.62Å; W310-F334 AromaticContact CD1-CZ 3.76Å; W310-F334 HydrophobicContact CG-CE1 4.15Å; W310-F334 HydrophobicContact CG-CZ 4.11Å; F334-E336 PolarHBondContact O-N 2.86Å
335L56.7Low67.7Low137 Ų137102.4 Ų102.472%0.71754%0.541SS*.  trans-63.2119.2168.6-72.1165000107.8S337L335-S337 PolarHBondContact O-N 3.02Å
336E44.2Very low66.4Low140 Ų140101.1 Ų101.165%0.65454%0.54SS*.  trans-62.3111148.9-89.3164.4169.200104.7K332 F334 S338K332-E336 IonicContact NZ-OE1 2.79Å; K332-E336 PolarHBondContact NZ-OE1 3.09Å; K332-E336 IonicContact NZ-OE2 3.93Å; K332-E336 PolarHBondContact NZ-OE2 3.42Å; F334-E336 PolarHBondContact O-N 2.86Å; E336-S338 PolarHBondContact O-N 3.28Å
337S37.6Very low65.2Low96 Ų9694 Ų9467%0.67152%0.516SS*.  trans-58.9113.4159.247.20000104.8L335 S339L335-S337 PolarHBondContact O-N 3.02Å; S337-S339 PolarHBondContact O-N 3.13Å
338S31.1Very low63.8Low108 Ų10893.5 Ų93.576%0.75552%0.515SS*.  trans-42.9123.8168.6430000108.7E336E336-S338 PolarHBondContact O-N 3.28Å
339S31.5Very low61.9Low178 Ų178101.3 Ų101.3100%1.24556%0.557SS**  trans-15.60167.352.10000116S337S337-S339 PolarHBondContact O-N 3.13Å

Retrieved 339 of 339 residues in 152.6 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).