A0A087XTV9_POEFO Loading...

Prostaglandin I2 receptor

AlphaFold DB , UniProt , Accession A0A087XTV9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 355 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M27.6Very low56.9Low243 Ų24399.1 Ų99.1100%1.19754%0.542SS*.  093.40-79.5156141.900107.9S3M1-S3 PolarHBondContact O-N 3.47Å; M1-S3 VanDerWaalsContact O-N 3.12Å
2N31.6Very low58.6Low169 Ų16996.7 Ų96.790%0.90454%0.538SS*.  trans-74.792.2179.3-89-1.1000109.4S4N2-S4 PolarHBondContact O-N 3.22Å
3S34.2Very low60Low107 Ų10791.2 Ų91.275%0.74851%0.507SS*.  trans-74.1103.7161.9-169.30000107M1 S5M1-S3 PolarHBondContact O-N 3.47Å; M1-S3 VanDerWaalsContact O-N 3.12Å; S3-S5 PolarHBondContact O-N 3.5Å
4S45.4Very low60.6Low69 Ų6987.9 Ų87.948%0.48349%0.49SS..  trans-65.291.5166.1-66.60000107N2 K6 S288N2-S4 PolarHBondContact O-N 3.22Å; S4-K6 PolarHBondContact O-N 3.26Å; S4-S288 WeakPolarHBondContact CB-O 3.46Å; S4-S288 PolarHBondContact OG-O 3.08Å
5S53.7Low60.8Low48 Ų4885.9 Ų85.934%0.33650%0.496SS..  trans-69.195.4-174.953.50000109.4S3 C168S3-S5 PolarHBondContact O-N 3.5Å; S5-C168 PolarHBondContact O-SG 3.49Å
6K64.9Low60.2Low127 Ų12792.7 Ų92.755%0.55252%0.522SS*.  trans-73.6121.2165.9-69.3-175.9174.8-173.90107.9S4 H8 D179S4-K6 PolarHBondContact O-N 3.26Å; K6-H8 VanDerWaalsContact C-N 3.25Å; K6-H8 PolarHBondContact O-N 3.41Å; K6-D179 IonicContact NZ-OD2 3.7Å
7C69.8Low59.8Low0 Ų088.4 Ų88.40%050%0.504CS..  trans-89.811.8176.7-61.60000113.3G9 Q10 Q166 C168 D290C7-G9 PolarHBondContact O-N 3.31Å; C7-Q10 PolarHBondContact O-N 3.26Å; C7-Q166 PolarHBondContact O-OE1 2.89Å; C7-C168 HydrophobicContact CB-CB 3.95Å; C7-C168 WeakPolarHBondContact CB-SG 3.42Å; C7-C168 PolarHBondContact N-SG 3Å; C7-C168 VanDerWaalsContact N-SG 3.44Å; C7-C168 WeakPolarHBondContact SG-CA 3.43Å; C7-C168 WeakPolarHBondContact SG-CB 3.48Å; C7-C168 CovalentContact SG-SG 2.03Å; C7-C168 PolarHBondContact SG-SG 3.21Å; C7-D290 PolarHBondContact N-OD2 3.29Å
8H70.4Confident59.9Low92 Ų9288.7 Ų88.743%0.42650%0.503SS..THydrogen-bonded Turntrans-67.7120.1-177.8-168.260.2000111.1K6 Q10 R165K6-H8 VanDerWaalsContact C-N 3.25Å; K6-H8 PolarHBondContact O-N 3.41Å; H8-Q10 VanDerWaalsContact C-N 3.3Å; H8-Q10 PolarHBondContact O-N 3.48Å; H8-R165 WeakPolarHBondContact ND1-CG 3.12Å; H8-R165 PolarHBondContact ND1-NE 2.94Å
9G67.9Low60Low40 Ų4088.8 Ų88.841%0.41250%0.498SS..THydrogen-bonded Turntrans77.210.2176.600000114.8C7 H11C7-G9 PolarHBondContact O-N 3.31Å; G9-H11 PolarHBondContact O-CD2 2.85Å
10Q79.4Confident60.5Low69 Ų6988.7 Ų88.732%0.32250%0.501SS..  trans-81.2141.6174.2-77.4178.2-28.700111.3C7 H8 S85 Q166C7-Q10 PolarHBondContact O-N 3.26Å; H8-Q10 VanDerWaalsContact C-N 3.3Å; H8-Q10 PolarHBondContact O-N 3.48Å; Q10-S85 WeakPolarHBondContact O-CB 3.14Å; Q10-S85 PolarHBondContact O-OG 2.83Å; Q10-Q166 PolarHBondContact O-OE1 3.33Å
11H80.7Confident60.9Low126 Ų12687.9 Ų87.958%0.58349%0.494SS*.SBendtrans-94.3-11.8-177.8-69.1-102.6000113.6G9 S85G9-H11 PolarHBondContact O-CD2 2.85Å; H11-S85 WeakPolarHBondContact CA-OG 3.47Å; H11-S85 PolarHBondContact O-N 2.9Å
12S77.7Confident62.9Low70 Ų7078.3 Ų78.349%0.4945%0.45SS..BIsolated β-bridgetrans-115.9157.5177.953.60000111.6
13I77.1Confident64.7Low26 Ų2674.2 Ų74.213%0.13343%0.427CS..  trans-70129.6175.3-62.7-177.7000109.4C79 Y80 N83 M84 P169 T171I13-C79 HydrophobicContact CD1-CB 4.48Å; I13-C79 VanDerWaalsContact CD1-O 3.3Å; I13-C79 WeakPolarHBondContact CD1-O 3.41Å; I13-Y80 HydrophobicContact CD1-CD1 3.91Å; I13-Y80 HydrophobicContact CD1-CE1 4.26Å; I13-Y80 HydrophobicContact CD1-CG 4.41Å; I13-N83 PolarHBondContact N-O 2.92Å; I13-M84 WeakPolarHBondContact CG1-O 3.02Å; I13-P169 VanDerWaalsContact CA-O 3.29Å; I13-P169 WeakPolarHBondContact CA-O 3.46Å; I13-P169 HydrophobicContact CG2-CB 3.93Å; I13-P169 HydrophobicContact CG2-CG 4.44Å; I13-P169 WeakPolarHBondContact CG2-O 3.41Å; I13-T171 HydrophobicContact CD1-CG2 3.51Å; I13-T171 HydrophobicContact CG1-CG2 3.94Å
14V67.8Low66.6Low45 Ų4572.8 Ų72.827%0.27341%0.414SS..  trans-98123.7176.3172.90000111.2P169V14-P169 PolarHBondContact N-O 3.03Å; V14-P169 WeakPolarHBondContact O-CB 3.22Å
15G63.2Low67.9Low57 Ų5773.6 Ų73.659%0.58841%0.409SS*.SBendtrans87151.7-176.100000112.9G17G15-G17 VanDerWaalsContact C-N 3.3Å; G15-G17 PolarHBondContact O-N 3.44Å
16Q51.6Low68.7Low195 Ų19573.9 Ų73.991%0.91140%0.404SS*.  trans-70.290.2169.4-78-169.1-5.500108.5N18Q16-N18 PolarHBondContact O-N 3.37Å
17G54.1Low69.2Low20 Ų2070.6 Ų70.621%0.20640%0.397CS..  trans-57.9128.1165.300000108.7G15 K19G15-G17 VanDerWaalsContact C-N 3.3Å; G15-G17 PolarHBondContact O-N 3.44Å; G17-K19 PolarHBondContact O-N 3.37Å
18N61.9Low69.6Low93 Ų9374.1 Ų74.150%0.49742%0.416SS..  trans-65.381.2172.9-72.2-17.1000109.4Q16 P20 I21Q16-N18 PolarHBondContact O-N 3.37Å; N18-P20 VanDerWaalsContact C-N 3.26Å; N18-P20 VanDerWaalsContact O-N 3.12Å; N18-I21 HydrophobicContact CB-CB 4.28Å; N18-I21 HydrophobicContact CB-CD1 3.65Å; N18-I21 HydrophobicContact CB-CG1 3.94Å; N18-I21 WeakPolarHBondContact O-CB 3.48Å; N18-I21 PolarHBondContact O-N 3.4Å
19K61.3Low69.7Low92 Ų9269.8 Ų69.840%0.440%0.395SS..Hα-helixtrans-39.2-46.4176.6-61.9-177.5179.9-172.90113.1G17 I21 T22 I23 Y80 N83G17-K19 PolarHBondContact O-N 3.37Å; K19-I21 VanDerWaalsContact C-N 3.32Å; K19-I21 PolarHBondContact O-N 2.81Å; K19-T22 PolarHBondContact O-N 3.19Å; K19-I23 WeakPolarHBondContact O-CD1 3.48Å; K19-I23 WeakPolarHBondContact O-CG1 3.5Å; K19-I23 PolarHBondContact O-N 3.04Å; K19-Y80 HydrophobicContact CG-CD1 4.29Å; K19-N83 PolarHBondContact NZ-OD1 3.34Å; K19-N83 VanDerWaalsContact NZ-OD1 3.09Å
20P68.7Low70.1Confident86 Ų8669.1 Ų69.156%0.55838%0.384SS*.Hα-helixtrans-63.7-32.3-179.323.2-34.9000114.3N18 T24N18-P20 VanDerWaalsContact C-N 3.26Å; N18-P20 VanDerWaalsContact O-N 3.12Å; P20-T24 WeakPolarHBondContact O-CB 3.5Å; P20-T24 PolarHBondContact O-N 3.37Å; P20-T24 PolarHBondContact O-OG1 3.09Å
21I70.9Confident70.2Confident71 Ų7169.8 Ų69.836%0.36439%0.392SS..Hα-helixtrans-69.1-45.5-177.7-63.4179.3000110.2N18 K19 T24 F25N18-I21 HydrophobicContact CB-CB 4.28Å; N18-I21 HydrophobicContact CB-CD1 3.65Å; N18-I21 HydrophobicContact CB-CG1 3.94Å; N18-I21 WeakPolarHBondContact O-CB 3.48Å; N18-I21 PolarHBondContact O-N 3.4Å; K19-I21 VanDerWaalsContact C-N 3.32Å; K19-I21 PolarHBondContact O-N 2.81Å; I21-T24 PolarHBondContact O-N 3.43Å; I21-F25 HydrophobicContact CG2-CD2 3.61Å; I21-F25 HydrophobicContact CG2-CE2 3.2Å; I21-F25 HydrophobicContact CG2-CZ 4.02Å; I21-F25 VanDerWaalsContact O-CD2 3.29Å; I21-F25 WeakPolarHBondContact O-CD2 3.41Å; I21-F25 PolarHBondContact O-N 3.42Å
22T67.6Low69.9Low43 Ų4363.8 Ų63.826%0.26436%0.364SS..Hα-helixtrans-64.6-41.8177.9-49.30000111.9K19 T24 F26 V76 Y80K19-T22 PolarHBondContact O-N 3.19Å; T22-T24 VanDerWaalsContact C-N 3.32Å; T22-T24 PolarHBondContact O-N 3.37Å; T22-F26 WeakPolarHBondContact O-CB 3.23Å; T22-F26 PolarHBondContact O-N 3.03Å; T22-V76 HydrophobicContact CG2-CG1 4.13Å; T22-Y80 HydrophobicContact CG2-CD2 4.37Å; T22-Y80 HydrophobicContact CG2-CE2 3.81Å
23I70.3Confident70Confident82 Ų8260.5 Ų60.542%0.42134%0.341SS..Hα-helixtrans-61.7-42.1176.9-62.6163.8000110.6K19 S27 F77K19-I23 WeakPolarHBondContact O-CD1 3.48Å; K19-I23 WeakPolarHBondContact O-CG1 3.5Å; K19-I23 PolarHBondContact O-N 3.04Å; I23-S27 WeakPolarHBondContact O-CB 3.39Å; I23-S27 PolarHBondContact O-N 2.93Å; I23-S27 PolarHBondContact O-OG 2.76Å; I23-F77 HydrophobicContact CB-CE1 4.47Å; I23-F77 HydrophobicContact CG1-CE1 3.92Å
24T74.3Confident70.3Confident77 Ų7763.5 Ų63.547%0.47236%0.357SS..Hα-helixtrans-66.6-48.6-179.5-56.30000111.5P20 I21 T22 F26 S27 L28P20-T24 WeakPolarHBondContact O-CB 3.5Å; P20-T24 PolarHBondContact O-N 3.37Å; P20-T24 PolarHBondContact O-OG1 3.09Å; I21-T24 PolarHBondContact O-N 3.43Å; T22-T24 VanDerWaalsContact C-N 3.32Å; T22-T24 PolarHBondContact O-N 3.37Å; T24-F26 VanDerWaalsContact C-N 3.33Å; T24-F26 PolarHBondContact O-N 3.46Å; T24-S27 PolarHBondContact O-N 3.05Å; T24-L28 HydrophobicContact CG2-CD1 3.92Å; T24-L28 WeakPolarHBondContact O-CB 3.2Å; T24-L28 WeakPolarHBondContact O-CG 3.43Å; T24-L28 PolarHBondContact O-N 3.29Å
25F72.9Confident70.9Confident87 Ų8763.9 Ų63.938%0.38236%0.357SS..Hα-helixtrans-60.9-41.4178.2-74.3-40.4000112.7I21 G29 L302 I305I21-F25 HydrophobicContact CG2-CD2 3.61Å; I21-F25 HydrophobicContact CG2-CE2 3.2Å; I21-F25 HydrophobicContact CG2-CZ 4.02Å; I21-F25 VanDerWaalsContact O-CD2 3.29Å; I21-F25 WeakPolarHBondContact O-CD2 3.41Å; I21-F25 PolarHBondContact O-N 3.42Å; F25-G29 PolarHBondContact O-N 2.76Å; F25-L302 HydrophobicContact CD1-CD2 3.77Å; F25-L302 HydrophobicContact CE1-CD2 3.67Å; F25-L302 HydrophobicContact CG-CD2 4.3Å; F25-L302 HydrophobicContact CZ-CD2 4.07Å; F25-I305 HydrophobicContact CB-CD1 3.82Å; F25-I305 HydrophobicContact CG-CD1 4.47Å; F25-I305 WeakPolarHBondContact O-CD1 3.47Å
26F70.3Confident71.5Confident54 Ų5461.3 Ų61.324%0.23733%0.331CS..Hα-helixtrans-63.5-48175.5171.8-107.3000112.6T22 T24 L28 G29 V30 T69 S73 F77T22-F26 WeakPolarHBondContact O-CB 3.23Å; T22-F26 PolarHBondContact O-N 3.03Å; T24-F26 VanDerWaalsContact C-N 3.33Å; T24-F26 PolarHBondContact O-N 3.46Å; F26-L28 VanDerWaalsContact C-N 3.29Å; F26-L28 PolarHBondContact O-N 2.96Å; F26-G29 PolarHBondContact O-N 3.33Å; F26-G29 VanDerWaalsContact O-N 3.1Å; F26-V30 HydrophobicContact CD1-CG2 4.49Å; F26-V30 HydrophobicContact CD2-CG2 3.91Å; F26-V30 HydrophobicContact CE1-CG2 4.03Å; F26-V30 HydrophobicContact CE2-CG2 3.26Å; F26-V30 HydrophobicContact CZ-CG2 3.42Å; F26-V30 VanDerWaalsContact CZ-CG2 3.42Å; F26-V30 PolarHBondContact O-N 3.16Å; F26-T69 HydrophobicContact CD2-CG2 3.91Å; F26-T69 HydrophobicContact CE2-CG2 3.79Å; F26-S73 WeakPolarHBondContact CD2-OG 3.34Å; F26-S73 WeakPolarHBondContact CE2-OG 3.41Å; F26-F77 HydrophobicContact CB-CE2 3.95Å; F26-F77 HydrophobicContact CB-CZ 3.72Å; F26-F77 HydrophobicContact CD1-CD2 4.4Å; F26-F77 HydrophobicContact CD1-CE1 4.43Å; F26-F77 AromaticContact CD1-CE2 3.12Å; F26-F77 HydrophobicContact CD1-CE2 3.12Å; F26-F77 AromaticContact CD1-CZ 3.14Å; F26-F77 HydrophobicContact CD1-CZ 3.14Å; F26-F77 AromaticContact CD2-CE2 3.92Å; F26-F77 HydrophobicContact CD2-CE2 3.92Å; F26-F77 HydrophobicContact CD2-CZ 4.5Å; F26-F77 HydrophobicContact CE1-CD2 4.33Å; F26-F77 AromaticContact CE1-CE2 3.34Å; F26-F77 HydrophobicContact CE1-CE2 3.34Å; F26-F77 AromaticContact CE1-CZ 3.76Å; F26-F77 HydrophobicContact CE1-CZ 3.76Å; F26-F77 HydrophobicContact CE2-CE2 4.17Å; F26-F77 AromaticContact CG-CE2 3.35Å; F26-F77 HydrophobicContact CG-CE2 3.35Å; F26-F77 AromaticContact CG-CZ 3.52Å; F26-F77 HydrophobicContact CG-CZ 3.52Å; F26-F77 AromaticContact CZ-CE2 3.84Å; F26-F77 HydrophobicContact CZ-CE2 3.84Å
27S75.1Confident72.9Confident57 Ų5753.5 Ų53.540%0.39930%0.295SS..Hα-helixtrans-61.2-41.8-178.2-57.50000110.8I23 T24 V31I23-S27 WeakPolarHBondContact O-CB 3.39Å; I23-S27 PolarHBondContact O-N 2.93Å; I23-S27 PolarHBondContact O-OG 2.76Å; T24-S27 PolarHBondContact O-N 3.05Å; S27-V31 VanDerWaalsContact O-CB 3.3Å; S27-V31 WeakPolarHBondContact O-CB 3.31Å; S27-V31 WeakPolarHBondContact O-CG2 3.4Å; S27-V31 PolarHBondContact O-N 3.44Å
28L78.1Confident74.2Confident75 Ų7558.1 Ų58.139%0.39331%0.309SS..Hα-helixtrans-63-39.2174.2-76.4167.6000112.7T24 F26 G32 I305 W309T24-L28 HydrophobicContact CG2-CD1 3.92Å; T24-L28 WeakPolarHBondContact O-CB 3.2Å; T24-L28 WeakPolarHBondContact O-CG 3.43Å; T24-L28 PolarHBondContact O-N 3.29Å; F26-L28 VanDerWaalsContact C-N 3.29Å; F26-L28 PolarHBondContact O-N 2.96Å; L28-G32 PolarHBondContact O-N 2.96Å; L28-I305 HydrophobicContact CB-CG2 4.1Å; L28-W309 HydrophobicContact CD2-CZ2 4.01Å; L28-W309 PolarHBondContact O-NE1 3.18Å
29G72.4Confident74.8Confident0 Ų054.3 Ų54.30%029%0.289CS..Hα-helixtrans-65.5-48.9177.500000113F25 F26 N33F25-G29 PolarHBondContact O-N 2.76Å; F26-G29 PolarHBondContact O-N 3.33Å; F26-G29 VanDerWaalsContact O-N 3.1Å; G29-N33 WeakPolarHBondContact O-CB 3.4Å; G29-N33 PolarHBondContact O-N 3.48Å; G29-N33 PolarHBondContact O-ND2 3.31Å
30V76.9Confident75.4Confident27 Ų2750.5 Ų50.516%0.16427%0.273CS..Hα-helixtrans-67-48.7-179.7174.80000111.3F26 G32 N33 L34 T69F26-V30 HydrophobicContact CD1-CG2 4.49Å; F26-V30 HydrophobicContact CD2-CG2 3.91Å; F26-V30 HydrophobicContact CE1-CG2 4.03Å; F26-V30 HydrophobicContact CE2-CG2 3.26Å; F26-V30 HydrophobicContact CZ-CG2 3.42Å; F26-V30 VanDerWaalsContact CZ-CG2 3.42Å; F26-V30 PolarHBondContact O-N 3.16Å; V30-G32 VanDerWaalsContact C-N 3.34Å; V30-G32 PolarHBondContact O-N 2.97Å; V30-N33 PolarHBondContact O-N 3.49Å; V30-L34 HydrophobicContact CG1-CD1 3.73Å; V30-L34 HydrophobicContact CG1-CG 4.28Å; V30-L34 WeakPolarHBondContact O-CB 3.44Å; V30-L34 VanDerWaalsContact O-CG 3.31Å; V30-L34 WeakPolarHBondContact O-CG 3.45Å; V30-L34 PolarHBondContact O-N 3.42Å; V30-T69 HydrophobicContact CG2-CG2 3.6Å
31V80.8Confident75.8Confident83 Ų8350.7 Ų50.750%0.50327%0.269SS..Hα-helixtrans-62.6-43.8-179.5173.60000110.5S27 L35 W309S27-V31 VanDerWaalsContact O-CB 3.3Å; S27-V31 WeakPolarHBondContact O-CB 3.31Å; S27-V31 WeakPolarHBondContact O-CG2 3.4Å; S27-V31 PolarHBondContact O-N 3.44Å; V31-L35 WeakPolarHBondContact O-CB 3.41Å; V31-L35 PolarHBondContact O-N 3.47Å; V31-W309 HydrophobicContact CG1-CH2 4.45Å
32G75.2Confident76Confident0 Ų049.2 Ų49.20%026%0.263CS..Hα-helixtrans-60-50.8177.800000112.4L28 V30 L35 A36L28-G32 PolarHBondContact O-N 2.96Å; V30-G32 VanDerWaalsContact C-N 3.34Å; V30-G32 PolarHBondContact O-N 2.97Å; G32-L35 PolarHBondContact O-N 2.78Å; G32-A36 WeakPolarHBondContact O-CB 3.43Å; G32-A36 PolarHBondContact O-N 3.41Å
33N80.4Confident76.1Confident0 Ų049 Ų490%026%0.259CS..Hα-helixtrans-66.2-41.1-178.9-79.5-63000113G29 V30 A36 L37 V62 L66 P304 P308G29-N33 WeakPolarHBondContact O-CB 3.4Å; G29-N33 PolarHBondContact O-N 3.48Å; G29-N33 PolarHBondContact O-ND2 3.31Å; V30-N33 PolarHBondContact O-N 3.49Å; N33-A36 PolarHBondContact O-N 2.93Å; N33-L37 WeakPolarHBondContact O-CB 3.05Å; N33-L37 PolarHBondContact O-N 3.18Å; N33-V62 WeakPolarHBondContact O-CG1 3.46Å; N33-L66 HydrophobicContact CB-CB 4.03Å; N33-L66 HydrophobicContact CB-CD1 3.81Å; N33-L66 HydrophobicContact CB-CG 4.47Å; N33-P304 PolarHBondContact ND2-O 3.32Å; N33-P308 WeakPolarHBondContact OD1-CG 3.4Å
34L81.9Confident76.1Confident90 Ų9048.3 Ų48.347%0.47125%0.254SS..Hα-helixtrans-64-42.6175.3-72.6175.7000112V30 L37 F38 L66V30-L34 HydrophobicContact CG1-CD1 3.73Å; V30-L34 HydrophobicContact CG1-CG 4.28Å; V30-L34 WeakPolarHBondContact O-CB 3.44Å; V30-L34 VanDerWaalsContact O-CG 3.31Å; V30-L34 WeakPolarHBondContact O-CG 3.45Å; V30-L34 PolarHBondContact O-N 3.42Å; L34-L37 PolarHBondContact O-N 3.31Å; L34-F38 WeakPolarHBondContact O-CB 3.41Å; L34-F38 PolarHBondContact O-N 2.9Å; L34-L66 HydrophobicContact CD2-CD1 3.96Å; L34-L66 HydrophobicContact CD2-CD2 3.86Å; L34-L66 HydrophobicContact CG-CD1 4.02Å
35L80.9Confident75.9Confident53 Ų5353.4 Ų53.428%0.27727%0.27SS..Hα-helixtrans-64.4-43.8177.6-176.561.2000111V31 G32 F38 I39 I312V31-L35 WeakPolarHBondContact O-CB 3.41Å; V31-L35 PolarHBondContact O-N 3.47Å; G32-L35 PolarHBondContact O-N 2.78Å; L35-F38 PolarHBondContact O-N 3.42Å; L35-I39 HydrophobicContact CD1-CD1 3.89Å; L35-I39 HydrophobicContact CD1-CG1 4.39Å; L35-I39 HydrophobicContact CG-CD1 3.74Å; L35-I39 WeakPolarHBondContact O-CB 3.36Å; L35-I39 WeakPolarHBondContact O-CD1 3.26Å; L35-I39 VanDerWaalsContact O-CG1 3.23Å; L35-I39 WeakPolarHBondContact O-CG1 3.28Å; L35-I39 PolarHBondContact O-N 2.85Å; L35-I312 HydrophobicContact CB-CD1 4.05Å; L35-I312 HydrophobicContact CD2-CD1 3.98Å; L35-I312 HydrophobicContact CG-CD1 3.93Å
36A76.4Confident75.6Confident3 Ų355.5 Ų55.53%0.02528%0.28CS..Hα-helixtrans-60.7-46.1176.700000111.4G32 N33 I39 L40 V62 P308 I312G32-A36 WeakPolarHBondContact O-CB 3.43Å; G32-A36 PolarHBondContact O-N 3.41Å; N33-A36 PolarHBondContact O-N 2.93Å; A36-I39 PolarHBondContact O-N 3.44Å; A36-L40 WeakPolarHBondContact O-CB 3.26Å; A36-L40 VanDerWaalsContact O-CG 3.25Å; A36-L40 WeakPolarHBondContact O-CG 3.15Å; A36-L40 PolarHBondContact O-N 3.45Å; A36-V62 HydrophobicContact CB-CG1 4.06Å; A36-V62 HydrophobicContact CB-CG2 4.23Å; A36-P308 HydrophobicContact CB-CB 3.76Å; A36-I312 HydrophobicContact CB-CD1 3.93Å; A36-I312 HydrophobicContact CB-CG1 4.11Å
37L80.4Confident75Confident30 Ų3057.7 Ų57.716%0.15730%0.295CS..Hα-helixtrans-62-46.5177.5-174.764.5000111.5N33 L34 I39 L40 L41 T59 V62 L63 L66N33-L37 WeakPolarHBondContact O-CB 3.05Å; N33-L37 PolarHBondContact O-N 3.18Å; L34-L37 PolarHBondContact O-N 3.31Å; L37-I39 PolarHBondContact O-N 3.46Å; L37-L40 PolarHBondContact O-N 2.84Å; L37-L41 HydrophobicContact CD1-CD1 4.42Å; L37-L41 HydrophobicContact CD1-CG 4.44Å; L37-L41 HydrophobicContact CG-CD1 4.07Å; L37-L41 HydrophobicContact CG-CG 4.49Å; L37-L41 WeakPolarHBondContact O-CB 3.46Å; L37-L41 VanDerWaalsContact O-CG 3.28Å; L37-L41 WeakPolarHBondContact O-CG 3.49Å; L37-L41 PolarHBondContact O-N 3.4Å; L37-T59 HydrophobicContact CD1-CG2 4.49Å; L37-V62 HydrophobicContact CB-CG1 4.03Å; L37-L63 HydrophobicContact CD1-CD2 3.88Å; L37-L63 HydrophobicContact CD1-CG 4.24Å; L37-L63 HydrophobicContact CD2-CD2 3.91Å; L37-L66 HydrophobicContact CD2-CD2 4.14Å
38F81.2Confident73.9Confident117 Ų11766.4 Ų66.451%0.51332%0.319SS..Hα-helixtrans-57.2-48.8177.5175.9-101.9000111.7L34 L35 L40 L41 V42L34-F38 WeakPolarHBondContact O-CB 3.41Å; L34-F38 PolarHBondContact O-N 2.9Å; L35-F38 PolarHBondContact O-N 3.42Å; F38-L40 PolarHBondContact O-N 3.39Å; F38-L41 PolarHBondContact O-N 3.36Å; F38-V42 HydrophobicContact CD1-CG2 4.37Å; F38-V42 HydrophobicContact CD2-CG2 4.24Å; F38-V42 HydrophobicContact CE1-CG2 3.97Å; F38-V42 HydrophobicContact CE2-CG2 3.83Å; F38-V42 HydrophobicContact CZ-CG2 3.68Å; F38-V42 WeakPolarHBondContact O-CG2 3.01Å; F38-V42 PolarHBondContact O-N 3.44Å
39I75.3Confident72.5Confident13 Ų1366.4 Ų66.47%0.06733%0.325CS..Hα-helixtrans-61.9-43.1179.4-71.5162000111.3L35 A36 L37 H43 I312 V318 L322L35-I39 HydrophobicContact CD1-CD1 3.89Å; L35-I39 HydrophobicContact CD1-CG1 4.39Å; L35-I39 HydrophobicContact CG-CD1 3.74Å; L35-I39 WeakPolarHBondContact O-CB 3.36Å; L35-I39 WeakPolarHBondContact O-CD1 3.26Å; L35-I39 VanDerWaalsContact O-CG1 3.23Å; L35-I39 WeakPolarHBondContact O-CG1 3.28Å; L35-I39 PolarHBondContact O-N 2.85Å; A36-I39 PolarHBondContact O-N 3.44Å; L37-I39 PolarHBondContact O-N 3.46Å; I39-H43 VanDerWaalsContact O-CB 3.25Å; I39-H43 WeakPolarHBondContact O-CB 3.48Å; I39-H43 PolarHBondContact O-N 3.43Å; I39-I312 HydrophobicContact CD1-CG1 4.12Å; I39-I312 HydrophobicContact CD1-CG2 4.26Å; I39-V318 HydrophobicContact CD1-CG1 3.66Å; I39-V318 HydrophobicContact CG1-CG1 4.3Å; I39-V318 HydrophobicContact CG2-CB 4.05Å; I39-V318 HydrophobicContact CG2-CG1 3.58Å; I39-V318 HydrophobicContact CG2-CG2 3.39Å; I39-L322 HydrophobicContact CD1-CD1 4Å
40L74.4Confident71.5Confident12 Ų1277.5 Ų77.56%0.06337%0.367CS..Hα-helixtrans-62.8-43.2177.5-72.9171.3000111.7A36 L37 F38 Q44 V58 V62A36-L40 WeakPolarHBondContact O-CB 3.26Å; A36-L40 VanDerWaalsContact O-CG 3.25Å; A36-L40 WeakPolarHBondContact O-CG 3.15Å; A36-L40 PolarHBondContact O-N 3.45Å; L37-L40 PolarHBondContact O-N 2.84Å; F38-L40 PolarHBondContact O-N 3.39Å; L40-Q44 WeakPolarHBondContact O-CB 3.48Å; L40-Q44 VanDerWaalsContact O-CG 3.25Å; L40-Q44 WeakPolarHBondContact O-CG 3.07Å; L40-Q44 PolarHBondContact O-N 2.03Å; L40-V58 HydrophobicContact CD1-CG1 3.95Å; L40-V58 HydrophobicContact CD2-CG1 4.43Å; L40-V62 HydrophobicContact CD1-CG2 4.17Å
41L77.1Confident70.5Confident91 Ų9179 Ų7948%0.47638%0.378SS..Hα-helixtrans-66.4-44.2179.1-70.6173.9000112.3L37 F38 Q44 K45L37-L41 HydrophobicContact CD1-CD1 4.42Å; L37-L41 HydrophobicContact CD1-CG 4.44Å; L37-L41 HydrophobicContact CG-CD1 4.07Å; L37-L41 HydrophobicContact CG-CG 4.49Å; L37-L41 WeakPolarHBondContact O-CB 3.46Å; L37-L41 VanDerWaalsContact O-CG 3.28Å; L37-L41 WeakPolarHBondContact O-CG 3.49Å; L37-L41 PolarHBondContact O-N 3.4Å; F38-L41 PolarHBondContact O-N 3.36Å; L41-Q44 PolarHBondContact O-N 3.38Å; L41-K45 WeakPolarHBondContact O-CB 3.28Å; L41-K45 PolarHBondContact O-N 2.87Å
42V74.8Confident70.3Confident39 Ų3977.5 Ų77.524%0.23637%0.371CS..Hα-helixtrans-63.1-46.1176.9173.50000110.3F38 Q44 K45 E46 H321F38-V42 HydrophobicContact CD1-CG2 4.37Å; F38-V42 HydrophobicContact CD2-CG2 4.24Å; F38-V42 HydrophobicContact CE1-CG2 3.97Å; F38-V42 HydrophobicContact CE2-CG2 3.83Å; F38-V42 HydrophobicContact CZ-CG2 3.68Å; F38-V42 WeakPolarHBondContact O-CG2 3.01Å; F38-V42 PolarHBondContact O-N 3.44Å; V42-Q44 PolarHBondContact O-N 3.38Å; V42-K45 PolarHBondContact O-N 2.96Å; V42-K45 VanDerWaalsContact O-N 3.16Å; V42-E46 WeakPolarHBondContact O-CB 3.22Å; V42-E46 PolarHBondContact O-N 2.77Å; V42-H321 VanDerWaalsContact CG1-NE2 3.34Å; V42-H321 WeakPolarHBondContact CG1-NE2 3.47Å
43H68.9Low70.5Confident39 Ų3977.7 Ų77.718%0.18137%0.373CS..Hα-helixtrans-64-38.7178-176.7-80.4000112.6I39 K45 N47I39-H43 VanDerWaalsContact O-CB 3.25Å; I39-H43 WeakPolarHBondContact O-CB 3.48Å; I39-H43 PolarHBondContact O-N 3.43Å; H43-K45 VanDerWaalsContact C-N 3.32Å; H43-N47 PolarHBondContact NE2-ND2 3.29Å; H43-N47 VanDerWaalsContact O-CB 3.26Å; H43-N47 WeakPolarHBondContact O-CB 3.37Å; H43-N47 PolarHBondContact O-N 2.55Å; H43-N47 VanDerWaalsContact O-N 3.07Å
44Q69.6Low70.4Confident68 Ų6877.9 Ų77.932%0.31837%0.374SS..Hα-helixtrans-62.9-40.2174-78.7177.410.100111.8L40 L41 V42 C55 T59L40-Q44 WeakPolarHBondContact O-CB 3.48Å; L40-Q44 VanDerWaalsContact O-CG 3.25Å; L40-Q44 WeakPolarHBondContact O-CG 3.07Å; L40-Q44 PolarHBondContact O-N 2.03Å; L41-Q44 PolarHBondContact O-N 3.38Å; V42-Q44 PolarHBondContact O-N 3.38Å; Q44-C55 PolarHBondContact NE2-SG 3.05Å; Q44-T59 PolarHBondContact NE2-OG1 3.4Å
45K71.3Confident70.2Confident184 Ų18474.5 Ų74.580%0.836%0.357SS*.Hα-helixtrans-70.9-45.1-179.1-174.1178.1179.3-179.10112.5L41 V42 H43L41-K45 WeakPolarHBondContact O-CB 3.28Å; L41-K45 PolarHBondContact O-N 2.87Å; V42-K45 PolarHBondContact O-N 2.96Å; V42-K45 VanDerWaalsContact O-N 3.16Å; H43-K45 VanDerWaalsContact C-N 3.32Å
46E66.4Low70.5Confident130 Ų13073 Ų7361%0.60735%0.349SS*.Hα-helixtrans-73-44.8-176.8-175.7174.5-167.400111.8V42 R48 H321V42-E46 WeakPolarHBondContact O-CB 3.22Å; V42-E46 PolarHBondContact O-N 2.77Å; E46-R48 VanDerWaalsContact C-N 3.31Å; E46-R48 PolarHBondContact O-N 3.4Å; E46-H321 IonicContact OE2-CE1 2.73Å; E46-H321 PolarHBondContact OE2-CE1 3.04Å; E46-H321 IonicContact OE2-ND1 2.77Å; E46-H321 IonicContact OE2-NE2 3.19Å
47N57.7Low71Confident101 Ų10173 Ų7354%0.5435%0.349SS..SBendtrans-88.21-167.7-126.5-6.9000113.7H43 S49H43-N47 PolarHBondContact NE2-ND2 3.29Å; H43-N47 VanDerWaalsContact O-CB 3.26Å; H43-N47 WeakPolarHBondContact O-CB 3.37Å; H43-N47 PolarHBondContact O-N 2.55Å; H43-N47 VanDerWaalsContact O-N 3.07Å; N47-S49 VanDerWaalsContact O-CA 3.3Å; N47-S49 WeakPolarHBondContact O-CA 3.25Å; N47-S49 PolarHBondContact O-N 3.01Å
48R51.5Low71.2Confident240 Ų24071.8 Ų71.891%0.90634%0.343SS*.  trans3728.5-173.4-137.5-174.1-159.8179.96.6113.1E46 R50E46-R48 VanDerWaalsContact C-N 3.31Å; E46-R48 PolarHBondContact O-N 3.4Å; R48-R50 PolarHBondContact O-N 3.34Å
49S49.7Very low71.3Confident74 Ų7467.3 Ų67.352%0.51733%0.325SS..  trans-75.3132.7-161.8178.60000106.6N47 S51N47-S49 VanDerWaalsContact O-CA 3.3Å; N47-S49 WeakPolarHBondContact O-CA 3.25Å; N47-S49 PolarHBondContact O-N 3.01Å; S49-S51 PolarHBondContact O-N 2.9Å
50R49.8Very low72Confident234 Ų23467 Ų6788%0.88332%0.324SS*.  trans-43.9120.4173.4-92-179.6169.8158.7-2.8107.7R48 S52R48-R50 PolarHBondContact O-N 3.34Å; R50-S52 VanDerWaalsContact C-N 3.3Å; R50-S52 PolarHBondContact O-N 3.36Å
51S57Low72.7Confident58 Ų5866.4 Ų66.441%0.40632%0.321SS..  trans-56.595.8178-162.10000108.3S49 I56 P136S49-S51 PolarHBondContact O-N 2.9Å; S51-I56 VanDerWaalsContact OG-CG1 3.31Å; S51-I56 WeakPolarHBondContact OG-CG1 3.48Å; S51-P136 VanDerWaalsContact O-CG 3.23Å; S51-P136 WeakPolarHBondContact O-CG 3.32Å
52S75.5Confident73.1Confident51 Ų5162.1 Ų62.136%0.35730%0.299SS..  trans-72.4150.7-179.262.40000108.5R50 F54 C55 I56R50-S52 VanDerWaalsContact C-N 3.3Å; R50-S52 PolarHBondContact O-N 3.36Å; S52-F54 PolarHBondContact O-N 3.25Å; S52-C55 PolarHBondContact O-N 3Å; S52-C55 WeakPolarHBondContact OG-CB 3.4Å; S52-C55 PolarHBondContact OG-N 3.34Å; S52-I56 PolarHBondContact O-N 3.23Å; S52-I56 VanDerWaalsContact O-N 3.13Å
53V79.8Confident73.8Confident4 Ų463.5 Ų63.52%0.02431%0.305CS..Hα-helixtrans-51.7-44.1177.7-1790000110.1C55 I56 L57 E119 I134 A139V53-C55 PolarHBondContact O-N 2.95Å; V53-I56 PolarHBondContact O-N 3.48Å; V53-L57 HydrophobicContact CG1-CD1 4.07Å; V53-L57 WeakPolarHBondContact O-CG 3.19Å; V53-L57 PolarHBondContact O-N 3.44Å; V53-E119 HydrophobicContact CB-CG 4.08Å; V53-E119 HydrophobicContact CG1-CG 3.59Å; V53-I134 HydrophobicContact CB-CG2 4.47Å; V53-I134 HydrophobicContact CG1-CG2 4.44Å; V53-I134 HydrophobicContact CG2-CG2 3.72Å; V53-A139 HydrophobicContact CB-CB 4.29Å; V53-A139 HydrophobicContact CG1-CB 3.64Å
54F78.8Confident74.9Confident5 Ų561.7 Ų61.72%0.02230%0.297CS..Hα-helixtrans-55.1-47.2172.8-176.2-105.4000114.6S52 I56 L57 V58 R120 H257 M260 L261S52-F54 PolarHBondContact O-N 3.25Å; F54-I56 VanDerWaalsContact C-N 3.28Å; F54-I56 PolarHBondContact O-N 2.89Å; F54-L57 PolarHBondContact O-N 3.41Å; F54-V58 HydrophobicContact CD1-CG2 4.07Å; F54-V58 HydrophobicContact CD2-CG2 4.19Å; F54-V58 HydrophobicContact CE1-CG2 3.69Å; F54-V58 HydrophobicContact CE2-CG2 3.83Å; F54-V58 HydrophobicContact CG-CG2 4.3Å; F54-V58 HydrophobicContact CZ-CG2 3.56Å; F54-V58 WeakPolarHBondContact O-CB 3.26Å; F54-V58 VanDerWaalsContact O-CG2 3.29Å; F54-V58 WeakPolarHBondContact O-CG2 3.37Å; F54-V58 PolarHBondContact O-N 3.15Å; F54-R120 VanDerWaalsContact CD2-NH2 3.27Å; F54-H257 AromaticContact CD1-ND1 3.93Å; F54-H257 AromaticContact CE1-CE1 3.84Å; F54-H257 AromaticContact CE1-ND1 3.36Å; F54-H257 WeakPolarHBondContact CE1-ND1 3.24Å; F54-M260 HydrophobicContact CE1-CE 3.67Å; F54-M260 HydrophobicContact CZ-CE 3.31Å; F54-L261 HydrophobicContact CE2-CD1 4.48Å
55C78.5Confident75.8Confident19 Ų1958.8 Ų58.813%0.12828%0.283CS..Hα-helixtrans-64-37.6-179.2-167.90000111.5Q44 S52 V53 T59Q44-C55 PolarHBondContact NE2-SG 3.05Å; S52-C55 PolarHBondContact O-N 3Å; S52-C55 WeakPolarHBondContact OG-CB 3.4Å; S52-C55 PolarHBondContact OG-N 3.34Å; V53-C55 PolarHBondContact O-N 2.95Å; C55-T59 WeakPolarHBondContact O-CB 3.19Å; C55-T59 PolarHBondContact O-N 2.86Å; C55-T59 PolarHBondContact O-OG1 2.92Å
56I86.3Confident76.5Confident21 Ų2150.9 Ų50.911%0.10825%0.25CC..Hα-helixtrans-65.9-45.1176.9-62.7171.1000110.5S51 S52 V53 F54 T59 G60 P136 A139 K140 L143S51-I56 VanDerWaalsContact OG-CG1 3.31Å; S51-I56 WeakPolarHBondContact OG-CG1 3.48Å; S52-I56 PolarHBondContact O-N 3.23Å; S52-I56 VanDerWaalsContact O-N 3.13Å; V53-I56 PolarHBondContact O-N 3.48Å; F54-I56 VanDerWaalsContact C-N 3.28Å; F54-I56 PolarHBondContact O-N 2.89Å; I56-T59 PolarHBondContact O-N 3.43Å; I56-G60 PolarHBondContact O-N 3.48Å; I56-P136 HydrophobicContact CD1-CB 3.83Å; I56-A139 HydrophobicContact CB-CB 3.87Å; I56-A139 HydrophobicContact CD1-CB 4.1Å; I56-A139 HydrophobicContact CG2-CB 3.78Å; I56-K140 HydrophobicContact CG2-CG 4.33Å; I56-L143 HydrophobicContact CG2-CD1 3.89Å
57L87.4Confident77.7Confident4 Ų449.2 Ų49.22%0.02124%0.244CC..Hα-helixtrans-65.3-43.7179.1-68.3172.4000112.1V53 F54 G60 L61 I112 A115 M116 E119 A139 L143V53-L57 HydrophobicContact CG1-CD1 4.07Å; V53-L57 WeakPolarHBondContact O-CG 3.19Å; V53-L57 PolarHBondContact O-N 3.44Å; F54-L57 PolarHBondContact O-N 3.41Å; L57-G60 CarbonylContact O-C 3.55Å; L57-G60 WeakPolarHBondContact O-CA 3.08Å; L57-G60 PolarHBondContact O-N 3.25Å; L57-L61 PolarHBondContact O-N 3.46Å; L57-I112 WeakPolarHBondContact O-CG2 3.36Å; L57-A115 HydrophobicContact CD2-CB 4.35Å; L57-M116 HydrophobicContact CB-CG 3.5Å; L57-M116 VanDerWaalsContact CB-CG 3.5Å; L57-M116 HydrophobicContact CB-SD 4.06Å; L57-M116 HydrophobicContact CD1-CG 3.85Å; L57-M116 HydrophobicContact CG-CG 4.26Å; L57-E119 HydrophobicContact CD1-CB 4.28Å; L57-E119 HydrophobicContact CD1-CG 4.41Å; L57-A139 HydrophobicContact CG-CB 4.43Å; L57-L143 HydrophobicContact CD2-CD2 4.11Å; L57-L143 HydrophobicContact CD2-CG 4.15Å
58V83.7Confident79.1Confident4 Ų444.6 Ų44.62%0.02422%0.22CC..Hα-helixtrans-63.8-42.2176.2171.50000111.3L40 F54 G60 L61 V62 M116 F311L40-V58 HydrophobicContact CD1-CG1 3.95Å; L40-V58 HydrophobicContact CD2-CG1 4.43Å; F54-V58 HydrophobicContact CD1-CG2 4.07Å; F54-V58 HydrophobicContact CD2-CG2 4.19Å; F54-V58 HydrophobicContact CE1-CG2 3.69Å; F54-V58 HydrophobicContact CE2-CG2 3.83Å; F54-V58 HydrophobicContact CG-CG2 4.3Å; F54-V58 HydrophobicContact CZ-CG2 3.56Å; F54-V58 WeakPolarHBondContact O-CB 3.26Å; F54-V58 VanDerWaalsContact O-CG2 3.29Å; F54-V58 WeakPolarHBondContact O-CG2 3.37Å; F54-V58 PolarHBondContact O-N 3.15Å; V58-G60 VanDerWaalsContact C-N 3.31Å; V58-G60 PolarHBondContact O-N 3.46Å; V58-L61 PolarHBondContact O-N 3.41Å; V58-V62 WeakPolarHBondContact O-CG2 3.34Å; V58-V62 PolarHBondContact O-N 3.1Å; V58-M116 HydrophobicContact CG2-SD 3.63Å; V58-F311 HydrophobicContact CB-CE1 4.17Å; V58-F311 HydrophobicContact CB-CZ 4.41Å; V58-F311 HydrophobicContact CG1-CD1 3.85Å; V58-F311 HydrophobicContact CG1-CE1 3.48Å; V58-F311 VanDerWaalsContact CG1-CE1 3.48Å; V58-F311 HydrophobicContact CG1-CE2 4.46Å; V58-F311 HydrophobicContact CG1-CG 4.48Å; V58-F311 HydrophobicContact CG1-CZ 3.83Å; V58-F311 HydrophobicContact CG2-CE1 3.53Å; V58-F311 HydrophobicContact CG2-CZ 3.9Å
59T84.6Confident80.7Confident23 Ų2333.8 Ų33.814%0.14118%0.181CC..Hα-helixtrans-62.5-40.6173.4-63.90000111.1L37 Q44 C55 I56 L63L37-T59 HydrophobicContact CD1-CG2 4.49Å; Q44-T59 PolarHBondContact NE2-OG1 3.4Å; C55-T59 WeakPolarHBondContact O-CB 3.19Å; C55-T59 PolarHBondContact O-N 2.86Å; C55-T59 PolarHBondContact O-OG1 2.92Å; I56-T59 PolarHBondContact O-N 3.43Å; T59-L63 HydrophobicContact CG2-CD1 3.88Å; T59-L63 HydrophobicContact CG2-CG 4.31Å; T59-L63 WeakPolarHBondContact O-CB 3.42Å; T59-L63 VanDerWaalsContact O-CG 3.23Å; T59-L63 WeakPolarHBondContact O-CG 3.46Å; T59-L63 PolarHBondContact O-N 3.4Å
60G89.1Confident82.5Confident5 Ų533.3 Ų33.35%0.05218%0.177CC..Hα-helixtrans-58.4-45.5173.200000112.6I56 L57 V58 L63 T64I56-G60 PolarHBondContact O-N 3.48Å; L57-G60 CarbonylContact O-C 3.55Å; L57-G60 WeakPolarHBondContact O-CA 3.08Å; L57-G60 PolarHBondContact O-N 3.25Å; V58-G60 VanDerWaalsContact C-N 3.31Å; V58-G60 PolarHBondContact O-N 3.46Å; G60-L63 PolarHBondContact O-N 2.85Å; G60-T64 WeakPolarHBondContact O-CB 3.38Å; G60-T64 PolarHBondContact O-N 2.96Å; G60-T64 PolarHBondContact O-OG1 3.41Å
61L88.3Confident84.4Confident0 Ų026.7 Ų26.70%016%0.159CC..Hα-helixtrans-60.2-54.7176.7-178.464.8000111.4L57 V58 L63 T64 D65 I112 L113 M116 F311L57-L61 PolarHBondContact O-N 3.46Å; V58-L61 PolarHBondContact O-N 3.41Å; L61-L63 VanDerWaalsContact C-N 3.27Å; L61-L63 PolarHBondContact O-N 3.49Å; L61-T64 WeakPolarHBondContact O-CA 3.48Å; L61-T64 WeakPolarHBondContact O-CB 3.38Å; L61-T64 PolarHBondContact O-N 3.36Å; L61-D65 PolarHBondContact O-N 2.96Å; L61-I112 HydrophobicContact CB-CG2 3.88Å; L61-I112 HydrophobicContact CD1-CB 4.49Å; L61-I112 HydrophobicContact CD1-CG2 4.46Å; L61-L113 HydrophobicContact CD1-CG 4.32Å; L61-L113 HydrophobicContact CD2-CD2 4.07Å; L61-L113 HydrophobicContact CD2-CG 4.27Å; L61-M116 HydrophobicContact CD2-CE 3.58Å; L61-F311 HydrophobicContact CD2-CE2 3.75Å; L61-F311 HydrophobicContact CD2-CZ 4Å
62V87.1Confident85.8Confident1 Ų125.5 Ų25.51%0.00615%0.147CC..Hα-helixtrans-60.1-37.8-179.3174.20000111.7N33 A36 L37 L40 V58 L66N33-V62 WeakPolarHBondContact O-CG1 3.46Å; A36-V62 HydrophobicContact CB-CG1 4.06Å; A36-V62 HydrophobicContact CB-CG2 4.23Å; L37-V62 HydrophobicContact CB-CG1 4.03Å; L40-V62 HydrophobicContact CD1-CG2 4.17Å; V58-V62 WeakPolarHBondContact O-CG2 3.34Å; V58-V62 PolarHBondContact O-N 3.1Å; V62-L66 WeakPolarHBondContact O-CB 3.47Å; V62-L66 PolarHBondContact O-N 3.42Å
63L89.6Confident86.2Confident69 Ų6923.9 Ų23.936%0.36114%0.136SC..Hα-helixtrans-67.3-40.4174.4-73.4173.5000112.1L37 T59 G60 L61 L67L37-L63 HydrophobicContact CD1-CD2 3.88Å; L37-L63 HydrophobicContact CD1-CG 4.24Å; L37-L63 HydrophobicContact CD2-CD2 3.91Å; T59-L63 HydrophobicContact CG2-CD1 3.88Å; T59-L63 HydrophobicContact CG2-CG 4.31Å; T59-L63 WeakPolarHBondContact O-CB 3.42Å; T59-L63 VanDerWaalsContact O-CG 3.23Å; T59-L63 WeakPolarHBondContact O-CG 3.46Å; T59-L63 PolarHBondContact O-N 3.4Å; G60-L63 PolarHBondContact O-N 2.85Å; L61-L63 VanDerWaalsContact C-N 3.27Å; L61-L63 PolarHBondContact O-N 3.49Å; L63-L67 WeakPolarHBondContact O-CB 3.26Å; L63-L67 WeakPolarHBondContact O-CG 3.41Å; L63-L67 PolarHBondContact O-N 2.9Å
64T91.7Very high86.6Confident1 Ų126.6 Ų26.61%0.00615%0.154CC..Hα-helixtrans-62.2-49.2177.1-56.70000110.5G60 L61 L66 L67 G68 F105 A108 S109 I112 Y147G60-T64 WeakPolarHBondContact O-CB 3.38Å; G60-T64 PolarHBondContact O-N 2.96Å; G60-T64 PolarHBondContact O-OG1 3.41Å; L61-T64 WeakPolarHBondContact O-CA 3.48Å; L61-T64 WeakPolarHBondContact O-CB 3.38Å; L61-T64 PolarHBondContact O-N 3.36Å; T64-L66 PolarHBondContact O-N 3.43Å; T64-L67 PolarHBondContact O-N 2.94Å; T64-G68 PolarHBondContact O-N 3.04Å; T64-F105 HydrophobicContact CG2-CD1 3.67Å; T64-F105 HydrophobicContact CG2-CE1 4.41Å; T64-F105 WeakPolarHBondContact O-CD1 3.24Å; T64-A108 HydrophobicContact CG2-CB 3.94Å; T64-S109 VanDerWaalsContact CG2-OG 3.31Å; T64-S109 WeakPolarHBondContact CG2-OG 3.2Å; T64-I112 WeakPolarHBondContact OG1-CD1 3.48Å; T64-Y147 HydrophobicContact CG2-CE1 4.36Å; T64-Y147 PolarHBondContact OG1-OH 2.91Å
65D88.4Confident86.9Confident6 Ų627.5 Ų27.53%0.03216%0.161CC..Hα-helixtrans-66.5-39.1-179.5-65.4-22.5000111.8L61 T69 S109 P304L61-D65 PolarHBondContact O-N 2.96Å; D65-T69 VanDerWaalsContact O-CB 3.26Å; D65-T69 WeakPolarHBondContact O-CB 3.38Å; D65-T69 PolarHBondContact O-N 3.02Å; D65-T69 PolarHBondContact O-OG1 3.4Å; D65-S109 WeakPolarHBondContact OD1-CB 3.31Å; D65-S109 PolarHBondContact OD1-OG 3.29Å; D65-P304 HydrophobicContact CB-CB 3.76Å
66L86.4Confident87.2Confident19 Ų1927.6 Ų27.610%0.09916%0.16CC..Hα-helixtrans-63.7-49.4175-176.763.2000111.5N33 L34 L37 V62 T64 T69 C70N33-L66 HydrophobicContact CB-CB 4.03Å; N33-L66 HydrophobicContact CB-CD1 3.81Å; N33-L66 HydrophobicContact CB-CG 4.47Å; L34-L66 HydrophobicContact CD2-CD1 3.96Å; L34-L66 HydrophobicContact CD2-CD2 3.86Å; L34-L66 HydrophobicContact CG-CD1 4.02Å; L37-L66 HydrophobicContact CD2-CD2 4.14Å; V62-L66 WeakPolarHBondContact O-CB 3.47Å; V62-L66 PolarHBondContact O-N 3.42Å; T64-L66 PolarHBondContact O-N 3.43Å; L66-T69 PolarHBondContact O-N 2.87Å; L66-C70 WeakPolarHBondContact O-CB 3.21Å; L66-C70 PolarHBondContact O-N 2.96Å; L66-C70 PolarHBondContact O-SG 3.39Å
67L90.3Very high87Confident94 Ų9429.8 Ų29.849%0.49217%0.169SC..Hα-helixtrans-61.7-45.1178.9-73.9172.3000111.1L63 T64 T69 C70 L71 F105L63-L67 WeakPolarHBondContact O-CB 3.26Å; L63-L67 WeakPolarHBondContact O-CG 3.41Å; L63-L67 PolarHBondContact O-N 2.9Å; T64-L67 PolarHBondContact O-N 2.94Å; L67-T69 PolarHBondContact O-N 3.24Å; L67-C70 PolarHBondContact O-N 2.98Å; L67-L71 WeakPolarHBondContact O-CB 3.33Å; L67-L71 VanDerWaalsContact O-CG 3.26Å; L67-L71 WeakPolarHBondContact O-CG 3.36Å; L67-L71 PolarHBondContact O-N 2.86Å; L67-F105 HydrophobicContact CB-CE1 3.58Å; L67-F105 HydrophobicContact CB-CZ 3.83Å
68G88.4Confident86.9Confident4 Ų433 Ų334%0.04119%0.185CC..Hα-helixtrans-58.6-47.9174.900000111.8T64 C70 L71 L72T64-G68 PolarHBondContact O-N 3.04Å; G68-C70 PolarHBondContact O-N 3.47Å; G68-L71 PolarHBondContact O-N 3.4Å; G68-L72 VanDerWaalsContact O-CB 3.27Å; G68-L72 WeakPolarHBondContact O-CB 3.45Å; G68-L72 WeakPolarHBondContact O-CD1 3.42Å; G68-L72 WeakPolarHBondContact O-CG 3.33Å; G68-L72 PolarHBondContact O-N 3.25Å
69T85.4Confident86.9Confident14 Ų1432.8 Ų32.89%0.08618%0.184CC..Hα-helixtrans-61.8-45.2177.9-57.70000111.6F26 V30 D65 L66 L67 L71 S73F26-T69 HydrophobicContact CD2-CG2 3.91Å; F26-T69 HydrophobicContact CE2-CG2 3.79Å; V30-T69 HydrophobicContact CG2-CG2 3.6Å; D65-T69 VanDerWaalsContact O-CB 3.26Å; D65-T69 WeakPolarHBondContact O-CB 3.38Å; D65-T69 PolarHBondContact O-N 3.02Å; D65-T69 PolarHBondContact O-OG1 3.4Å; L66-T69 PolarHBondContact O-N 2.87Å; L67-T69 PolarHBondContact O-N 3.24Å; T69-L71 PolarHBondContact O-N 3.1Å; T69-S73 WeakPolarHBondContact O-CB 3.01Å; T69-S73 PolarHBondContact O-N 2.94Å; T69-S73 PolarHBondContact O-OG 3.48Å
70C86.4Confident86.7Confident63 Ų6332.9 Ų32.943%0.42618%0.182SC..Hα-helixtrans-66-34179.4-73.50000113.2L66 L67 G68 P74L66-C70 WeakPolarHBondContact O-CB 3.21Å; L66-C70 PolarHBondContact O-N 2.96Å; L66-C70 PolarHBondContact O-SG 3.39Å; L67-C70 PolarHBondContact O-N 2.98Å; G68-C70 PolarHBondContact O-N 3.47Å; C70-P74 WeakPolarHBondContact O-CD 3.22Å; C70-P74 WeakPolarHBondContact O-CG 3.17Å
71L89.5Confident86.4Confident96 Ų9636.2 Ų36.250%0.50321%0.21SC..Hα-helixtrans-81.8-38.5-179.9-70.7171.9000112.9L67 G68 T69 P75 V101 F105L67-L71 WeakPolarHBondContact O-CB 3.33Å; L67-L71 VanDerWaalsContact O-CG 3.26Å; L67-L71 WeakPolarHBondContact O-CG 3.36Å; L67-L71 PolarHBondContact O-N 2.86Å; G68-L71 PolarHBondContact O-N 3.4Å; T69-L71 PolarHBondContact O-N 3.1Å; L71-P75 WeakPolarHBondContact O-CD 3.47Å; L71-V101 HydrophobicContact CB-CG1 3.99Å; L71-F105 HydrophobicContact CD1-CE2 3.58Å; L71-F105 HydrophobicContact CD1-CZ 3.73Å
72L87.1Confident86.2Confident32 Ų3242.2 Ų42.217%0.16824%0.237CC..Hα-helixtrans-78-28.9-176-68.3171.8000113.1G68 P75 V76 F98 V101 V102G68-L72 VanDerWaalsContact O-CB 3.27Å; G68-L72 WeakPolarHBondContact O-CB 3.45Å; G68-L72 WeakPolarHBondContact O-CD1 3.42Å; G68-L72 WeakPolarHBondContact O-CG 3.33Å; G68-L72 PolarHBondContact O-N 3.25Å; L72-P75 WeakPolarHBondContact O-CD 3.29Å; L72-V76 WeakPolarHBondContact O-CG2 3.49Å; L72-F98 HydrophobicContact CB-CE2 4.24Å; L72-F98 HydrophobicContact CB-CZ 4.39Å; L72-F98 HydrophobicContact CD2-CD1 4.37Å; L72-F98 HydrophobicContact CD2-CD2 3.99Å; L72-F98 HydrophobicContact CD2-CE1 4.07Å; L72-F98 HydrophobicContact CD2-CE2 3.73Å; L72-F98 HydrophobicContact CD2-CG 4.31Å; L72-F98 HydrophobicContact CD2-CZ 3.75Å; L72-F98 WeakPolarHBondContact O-CE2 3.21Å; L72-V101 HydrophobicContact CD1-CG1 4.41Å; L72-V101 HydrophobicContact CD2-CB 3.81Å; L72-V101 HydrophobicContact CD2-CG1 3.36Å; L72-V101 HydrophobicContact CG-CG1 3.65Å; L72-V102 HydrophobicContact CD1-CB 4.48Å; L72-V102 HydrophobicContact CD1-CG2 3.85Å; L72-V102 HydrophobicContact CD2-CB 4.34Å; L72-V102 HydrophobicContact CD2-CG2 3.34Å; L72-V102 HydrophobicContact CG-CG2 4.23Å
73S84.1Confident86.1Confident17 Ų1746.5 Ų46.512%0.11926%0.26CS..Hα-helixtrans-82.4-41.7-165.6-54.90000115.5F26 T69 V76 F77F26-S73 WeakPolarHBondContact CD2-OG 3.34Å; F26-S73 WeakPolarHBondContact CE2-OG 3.41Å; T69-S73 WeakPolarHBondContact O-CB 3.01Å; T69-S73 PolarHBondContact O-N 2.94Å; T69-S73 PolarHBondContact O-OG 3.48Å; S73-V76 WeakPolarHBondContact O-CB 3.17Å; S73-V76 PolarHBondContact O-N 3.25Å; S73-F77 WeakPolarHBondContact O-CD2 3.27Å; S73-F77 PolarHBondContact O-N 3.4Å
74P87Confident85.9Confident62 Ų6246.3 Ų46.340%0.40326%0.258SS..Hα-helixtrans-54.4-45.3178.7-21.130.2000113.6C70 V76 F77 I78C70-P74 WeakPolarHBondContact O-CD 3.22Å; C70-P74 WeakPolarHBondContact O-CG 3.17Å; P74-V76 VanDerWaalsContact C-N 3.31Å; P74-V76 PolarHBondContact O-N 2.77Å; P74-F77 PolarHBondContact O-N 2.76Å; P74-I78 VanDerWaalsContact O-CG1 3.25Å; P74-I78 WeakPolarHBondContact O-CG1 3.34Å; P74-I78 PolarHBondContact O-N 3.39Å
75P86.2Confident85.7Confident24 Ų2446.3 Ų46.316%0.15626%0.258CS..Hα-helixtrans-56.5-42.5174-25.434.5000113.2L71 L72 I78 C79 F98L71-P75 WeakPolarHBondContact O-CD 3.47Å; L72-P75 WeakPolarHBondContact O-CD 3.29Å; P75-I78 PolarHBondContact O-N 3.5Å; P75-C79 WeakPolarHBondContact O-CB 3.35Å; P75-C79 PolarHBondContact O-N 3.29Å; P75-C79 PolarHBondContact O-SG 2.73Å; P75-C79 VanDerWaalsContact O-SG 3.34Å; P75-F98 HydrophobicContact CB-CD2 4.29Å; P75-F98 HydrophobicContact CB-CE2 4.48Å
76V83.9Confident85.5Confident21 Ų2146 Ų4613%0.12726%0.256CS..Hα-helixtrans-64.8-42.1178.9176.40000111.2T22 L72 S73 P74 C79 Y80 F98T22-V76 HydrophobicContact CG2-CG1 4.13Å; L72-V76 WeakPolarHBondContact O-CG2 3.49Å; S73-V76 WeakPolarHBondContact O-CB 3.17Å; S73-V76 PolarHBondContact O-N 3.25Å; P74-V76 VanDerWaalsContact C-N 3.31Å; P74-V76 PolarHBondContact O-N 2.77Å; V76-C79 PolarHBondContact O-N 3.46Å; V76-Y80 HydrophobicContact CG1-CD2 3.78Å; V76-Y80 HydrophobicContact CG1-CE2 3.62Å; V76-Y80 VanDerWaalsContact O-CD2 3.22Å; V76-Y80 WeakPolarHBondContact O-CD2 3.04Å; V76-Y80 PolarHBondContact O-N 3.06Å; V76-F98 HydrophobicContact CG2-CE2 3.8Å; V76-F98 HydrophobicContact CG2-CZ 3.92Å
77F82.4Confident85.5Confident66 Ų6646 Ų4629%0.28926%0.257SS..Hα-helixtrans-61.7-46.4175.5-81.8-73.3000112.7I23 F26 S73 P74 C79 Y80 A81I23-F77 HydrophobicContact CB-CE1 4.47Å; I23-F77 HydrophobicContact CG1-CE1 3.92Å; F26-F77 HydrophobicContact CB-CE2 3.95Å; F26-F77 HydrophobicContact CB-CZ 3.72Å; F26-F77 HydrophobicContact CD1-CD2 4.4Å; F26-F77 HydrophobicContact CD1-CE1 4.43Å; F26-F77 AromaticContact CD1-CE2 3.12Å; F26-F77 HydrophobicContact CD1-CE2 3.12Å; F26-F77 AromaticContact CD1-CZ 3.14Å; F26-F77 HydrophobicContact CD1-CZ 3.14Å; F26-F77 AromaticContact CD2-CE2 3.92Å; F26-F77 HydrophobicContact CD2-CE2 3.92Å; F26-F77 HydrophobicContact CD2-CZ 4.5Å; F26-F77 HydrophobicContact CE1-CD2 4.33Å; F26-F77 AromaticContact CE1-CE2 3.34Å; F26-F77 HydrophobicContact CE1-CE2 3.34Å; F26-F77 AromaticContact CE1-CZ 3.76Å; F26-F77 HydrophobicContact CE1-CZ 3.76Å; F26-F77 HydrophobicContact CE2-CE2 4.17Å; F26-F77 AromaticContact CG-CE2 3.35Å; F26-F77 HydrophobicContact CG-CE2 3.35Å; F26-F77 AromaticContact CG-CZ 3.52Å; F26-F77 HydrophobicContact CG-CZ 3.52Å; F26-F77 AromaticContact CZ-CE2 3.84Å; F26-F77 HydrophobicContact CZ-CE2 3.84Å; S73-F77 WeakPolarHBondContact O-CD2 3.27Å; S73-F77 PolarHBondContact O-N 3.4Å; P74-F77 PolarHBondContact O-N 2.76Å; F77-C79 VanDerWaalsContact C-N 3.29Å; F77-C79 PolarHBondContact O-N 2.93Å; F77-Y80 PolarHBondContact O-N 3.38Å; F77-A81 WeakPolarHBondContact O-CB 3.34Å; F77-A81 PolarHBondContact O-N 2.85Å
78I84.6Confident85.3Confident71 Ų7142.7 Ų42.736%0.36425%0.245SC..Hα-helixtrans-62.1-42.5-179.7-64.5164.7000109.7P74 P75 Y80 A81 H82 L89P74-I78 VanDerWaalsContact O-CG1 3.25Å; P74-I78 WeakPolarHBondContact O-CG1 3.34Å; P74-I78 PolarHBondContact O-N 3.39Å; P75-I78 PolarHBondContact O-N 3.5Å; I78-Y80 PolarHBondContact O-N 3.37Å; I78-A81 PolarHBondContact O-N 3.08Å; I78-H82 PolarHBondContact O-CD2 3.44Å; I78-H82 PolarHBondContact O-N 3.35Å; I78-L89 HydrophobicContact CB-CD2 3.97Å; I78-L89 HydrophobicContact CG2-CD1 3.61Å; I78-L89 HydrophobicContact CG2-CD2 3.6Å; I78-L89 HydrophobicContact CG2-CG 4.27Å
79C83.9Confident85.2Confident0 Ų045.4 Ų45.40%026%0.258CS..Hα-helixtrans-57.6-47.3173.8-76.50000112.5I13 P75 V76 F77 A81 N83 M84 T171I13-C79 HydrophobicContact CD1-CB 4.48Å; I13-C79 VanDerWaalsContact CD1-O 3.3Å; I13-C79 WeakPolarHBondContact CD1-O 3.41Å; P75-C79 WeakPolarHBondContact O-CB 3.35Å; P75-C79 PolarHBondContact O-N 3.29Å; P75-C79 PolarHBondContact O-SG 2.73Å; P75-C79 VanDerWaalsContact O-SG 3.34Å; V76-C79 PolarHBondContact O-N 3.46Å; F77-C79 VanDerWaalsContact C-N 3.29Å; F77-C79 PolarHBondContact O-N 2.93Å; C79-A81 PolarHBondContact O-N 2.94Å; C79-N83 CarbonylContact O-C 3.58Å; C79-N83 VanDerWaalsContact O-CA 3.26Å; C79-N83 WeakPolarHBondContact O-CA 3.34Å; C79-N83 PolarHBondContact O-N 2.89Å; C79-M84 CarbonylContact C-O 3.42Å; C79-M84 VanDerWaalsContact CA-O 3.28Å; C79-M84 WeakPolarHBondContact CA-O 3.2Å; C79-M84 WeakPolarHBondContact CB-O 2.92Å; C79-M84 PolarHBondContact O-N 3.49Å; C79-M84 PolarHBondContact SG-O 2.92Å; C79-M84 VanDerWaalsContact SG-O 3.36Å; C79-T171 HydrophobicContact CB-CG2 3.97Å
80Y81.7Confident85.2Confident26 Ų2646.5 Ų46.510%0.10227%0.272CS..Hα-helixtrans-68-31.4177.1-81.5-64.9000114.1I13 K19 T22 V76 F77 I78 T171I13-Y80 HydrophobicContact CD1-CD1 3.91Å; I13-Y80 HydrophobicContact CD1-CE1 4.26Å; I13-Y80 HydrophobicContact CD1-CG 4.41Å; K19-Y80 HydrophobicContact CG-CD1 4.29Å; T22-Y80 HydrophobicContact CG2-CD2 4.37Å; T22-Y80 HydrophobicContact CG2-CE2 3.81Å; V76-Y80 HydrophobicContact CG1-CD2 3.78Å; V76-Y80 HydrophobicContact CG1-CE2 3.62Å; V76-Y80 VanDerWaalsContact O-CD2 3.22Å; V76-Y80 WeakPolarHBondContact O-CD2 3.04Å; V76-Y80 PolarHBondContact O-N 3.06Å; F77-Y80 PolarHBondContact O-N 3.38Å; I78-Y80 PolarHBondContact O-N 3.37Å; Y80-T171 HydrophobicContact CD2-CG2 4.27Å; Y80-T171 HydrophobicContact CE1-CG2 4.2Å; Y80-T171 HydrophobicContact CE2-CG2 3.88Å
81A83Confident85.3Confident75 Ų7544.9 Ų44.962%0.6227%0.266SS*.Hα-helixtrans-70.3-43.9177.600000111.5F77 I78 C79F77-A81 WeakPolarHBondContact O-CB 3.34Å; F77-A81 PolarHBondContact O-N 2.85Å; I78-A81 PolarHBondContact O-N 3.08Å; C79-A81 PolarHBondContact O-N 2.94Å
82H84.2Confident85.2Confident125 Ų12546.1 Ų46.158%0.57927%0.269SS*.Hα-helixtrans-91.6-0.4-179.4-68.8-84000113.9I78 M84I78-H82 PolarHBondContact O-CD2 3.44Å; I78-H82 PolarHBondContact O-N 3.35Å; H82-M84 HydrophobicContact CB-CB 4.43Å; H82-M84 HydrophobicContact CB-CE 3.93Å; H82-M84 HydrophobicContact CB-CG 4.02Å; H82-M84 WeakPolarHBondContact O-CG 2.9Å; H82-M84 PolarHBondContact O-N 3.48Å; H82-M84 VanDerWaalsContact O-N 3.15Å
83N83.8Confident85.4Confident91 Ų9153.2 Ų53.249%0.48730%0.299SS..THydrogen-bonded Turntrans50.230.3-170.1-59.6-52.7000113.5I13 K19 C79I13-N83 PolarHBondContact N-O 2.92Å; K19-N83 PolarHBondContact NZ-OD1 3.34Å; K19-N83 VanDerWaalsContact NZ-OD1 3.09Å; C79-N83 CarbonylContact O-C 3.58Å; C79-N83 VanDerWaalsContact O-CA 3.26Å; C79-N83 WeakPolarHBondContact O-CA 3.34Å; C79-N83 PolarHBondContact O-N 2.89Å
84M85.7Confident85.7Confident66 Ų6654.3 Ų54.333%0.32530%0.303SS..BIsolated β-bridgetrans-102.3149.3178.4-65.1-163-5900110.5I13 C79 H82 L89I13-M84 WeakPolarHBondContact CG1-O 3.02Å; C79-M84 CarbonylContact C-O 3.42Å; C79-M84 VanDerWaalsContact CA-O 3.28Å; C79-M84 WeakPolarHBondContact CA-O 3.2Å; C79-M84 WeakPolarHBondContact CB-O 2.92Å; C79-M84 PolarHBondContact O-N 3.49Å; C79-M84 PolarHBondContact SG-O 2.92Å; C79-M84 VanDerWaalsContact SG-O 3.36Å; H82-M84 HydrophobicContact CB-CB 4.43Å; H82-M84 HydrophobicContact CB-CE 3.93Å; H82-M84 HydrophobicContact CB-CG 4.02Å; H82-M84 WeakPolarHBondContact O-CG 2.9Å; H82-M84 PolarHBondContact O-N 3.48Å; H82-M84 VanDerWaalsContact O-N 3.15Å; M84-L89 HydrophobicContact CE-CD1 3.76Å
85S86.4Confident85.9Confident0 Ų051.6 Ų51.60%029%0.286CS..  trans-75.7166.5172.894.60000110.7Q10 H11 I87 G88 L89 Q166 G170Q10-S85 WeakPolarHBondContact O-CB 3.14Å; Q10-S85 PolarHBondContact O-OG 2.83Å; H11-S85 WeakPolarHBondContact CA-OG 3.47Å; H11-S85 PolarHBondContact O-N 2.9Å; S85-I87 VanDerWaalsContact C-N 3.28Å; S85-I87 PolarHBondContact O-N 3.29Å; S85-I87 PolarHBondContact OG-N 2.84Å; S85-G88 CarbonylContact O-C 3.6Å; S85-G88 WeakPolarHBondContact O-CA 3.3Å; S85-G88 PolarHBondContact O-N 2.94Å; S85-G88 PolarHBondContact OG-N 3.36Å; S85-L89 PolarHBondContact O-N 2.61Å; S85-Q166 PolarHBondContact OG-NE2 3.47Å; S85-G170 CarbonylContact C-O 3.58Å; S85-G170 WeakPolarHBondContact CA-O 3.25Å
86L85.4Confident86.2Confident0 Ų052.4 Ų52.40%029%0.289CS..Hα-helixtrans-59.8-39.7177.4-125.485000112.3G88 L89 G90 F98 G170 T171 C173L86-G88 VanDerWaalsContact C-N 3.35Å; L86-L89 PolarHBondContact O-N 3.31Å; L86-G90 PolarHBondContact O-N 3.2Å; L86-F98 HydrophobicContact CD2-CB 3.4Å; L86-F98 VanDerWaalsContact CD2-CB 3.4Å; L86-F98 HydrophobicContact CD2-CD1 3.9Å; L86-F98 HydrophobicContact CD2-CD2 3.61Å; L86-F98 HydrophobicContact CD2-CE2 4.34Å; L86-F98 HydrophobicContact CD2-CG 3.34Å; L86-G170 PolarHBondContact N-O 3Å; L86-T171 WeakPolarHBondContact CD1-O 3.38Å; L86-C173 HydrophobicContact CD2-CB 4.35Å
87I87Confident86.6Confident20 Ų2056 Ų5610%0.10331%0.307CS..Hα-helixtrans-68.5-36.7173.5-61.8-174.7000110.5S85 L89 G91 C95 Q166S85-I87 VanDerWaalsContact C-N 3.28Å; S85-I87 PolarHBondContact O-N 3.29Å; S85-I87 PolarHBondContact OG-N 2.84Å; I87-L89 VanDerWaalsContact C-N 3.29Å; I87-L89 PolarHBondContact O-N 3.46Å; I87-G91 WeakPolarHBondContact O-CA 3.39Å; I87-G91 PolarHBondContact O-N 3.49Å; I87-C95 HydrophobicContact CG1-CB 3.89Å; I87-Q166 HydrophobicContact CD1-CB 3.92Å; I87-Q166 HydrophobicContact CG1-CB 4.4Å
88G84.4Confident87Confident24 Ų2453.2 Ų53.225%0.24729%0.294CS..Hα-helixtrans-61.8-34.1173.500000113.7S85 L86S85-G88 CarbonylContact O-C 3.6Å; S85-G88 WeakPolarHBondContact O-CA 3.3Å; S85-G88 PolarHBondContact O-N 2.94Å; S85-G88 PolarHBondContact OG-N 3.36Å; L86-G88 VanDerWaalsContact C-N 3.35Å
89L87.3Confident87.3Confident60 Ų6049.8 Ų49.831%0.31428%0.277SS..Hα-helixtrans-80-40.9-177.8-176.664.4000113.6I78 M84 S85 L86 I87 L94I78-L89 HydrophobicContact CB-CD2 3.97Å; I78-L89 HydrophobicContact CG2-CD1 3.61Å; I78-L89 HydrophobicContact CG2-CD2 3.6Å; I78-L89 HydrophobicContact CG2-CG 4.27Å; M84-L89 HydrophobicContact CE-CD1 3.76Å; S85-L89 PolarHBondContact O-N 2.61Å; L86-L89 PolarHBondContact O-N 3.31Å; I87-L89 VanDerWaalsContact C-N 3.29Å; I87-L89 PolarHBondContact O-N 3.46Å; L89-L94 HydrophobicContact CB-CD2 4.11Å; L89-L94 HydrophobicContact CD2-CD2 3.99Å; L89-L94 HydrophobicContact CG-CD2 4.07Å
90G84.8Confident87.8Confident37 Ų3751.4 Ų51.438%0.38128%0.284SS..Hα-helixtrans-146.319.1-171.700000115L86 L94L86-G90 PolarHBondContact O-N 3.2Å; G90-L94 WeakPolarHBondContact O-CB 3.22Å; G90-L94 PolarHBondContact O-N 3.09Å
91G89.2Confident88.3Confident30 Ų3051 Ų5131%0.30928%0.284SS..Hα-helixtrans65.7-165.6179.800000113.8I87 K93 L94 C95I87-G91 WeakPolarHBondContact O-CA 3.39Å; I87-G91 PolarHBondContact O-N 3.49Å; G91-K93 PolarHBondContact O-N 2.86Å; G91-L94 PolarHBondContact O-N 3.38Å; G91-C95 PolarHBondContact O-N 2.99Å
92E87.8Confident88.7Confident121 Ų12147.7 Ų47.757%0.56526%0.257SS*.Hα-helixtrans-63.3-29.8178.9-63.4-164.6159.600112.8L94 C95 N96E92-L94 PolarHBondContact O-N 2.96Å; E92-C95 PolarHBondContact O-N 3.03Å; E92-N96 WeakPolarHBondContact O-CB 3.48Å; E92-N96 PolarHBondContact O-N 3.35Å; E92-N96 PolarHBondContact O-ND2 2.78Å
93K90.7Very high89Confident181 Ų18141.8 Ų41.879%0.78723%0.229SC*.Hα-helixtrans-62.3-44.3178.9-67.7-175.5-178.9179.20111.9G91 C95 N96 L97G91-K93 PolarHBondContact O-N 2.86Å; K93-C95 VanDerWaalsContact C-N 3.34Å; K93-N96 PolarHBondContact O-N 3.19Å; K93-L97 WeakPolarHBondContact O-CB 3.37Å; K93-L97 PolarHBondContact O-N 3.06Å
94L90.7Very high89.5Confident41 Ų4138.9 Ų38.922%0.21521%0.212CC..Hα-helixtrans-66.3-39.3177.1-174.964.1000111.2L89 G90 G91 E92 L97 F98L89-L94 HydrophobicContact CB-CD2 4.11Å; L89-L94 HydrophobicContact CD2-CD2 3.99Å; L89-L94 HydrophobicContact CG-CD2 4.07Å; G90-L94 WeakPolarHBondContact O-CB 3.22Å; G90-L94 PolarHBondContact O-N 3.09Å; G91-L94 PolarHBondContact O-N 3.38Å; E92-L94 PolarHBondContact O-N 2.96Å; L94-L97 PolarHBondContact O-N 3.1Å; L94-F98 WeakPolarHBondContact O-CB 3.34Å; L94-F98 PolarHBondContact O-N 2.92Å
95C90.6Very high89.8Confident4 Ų436.9 Ų36.93%0.02720%0.202CC..Hα-helixtrans-63.2-43.1175.4-174.30000112.5I87 G91 E92 K93 F98 G99 C173I87-C95 HydrophobicContact CG1-CB 3.89Å; G91-C95 PolarHBondContact O-N 2.99Å; E92-C95 PolarHBondContact O-N 3.03Å; K93-C95 VanDerWaalsContact C-N 3.34Å; C95-F98 PolarHBondContact O-N 3.27Å; C95-G99 PolarHBondContact O-N 3.48Å; C95-C173 WeakPolarHBondContact CA-SG 3.26Å; C95-C173 HydrophobicContact CB-CB 4.06Å; C95-C173 WeakPolarHBondContact CB-SG 3.37Å; C95-C173 VanDerWaalsContact O-CB 3.26Å; C95-C173 WeakPolarHBondContact O-CB 3.19Å; C95-C173 WeakPolarHBondContact SG-CB 3.32Å; C95-C173 CovalentContact SG-SG 2.03Å; C95-C173 PolarHBondContact SG-SG 3.01Å
96N91.8Very high90Very high42 Ų4237.5 Ų37.523%0.22521%0.208CC..Hα-helixtrans-65.9-43.8176.8-68.8-23.1000111.8E92 K93 G99 F100 F158 F164E92-N96 WeakPolarHBondContact O-CB 3.48Å; E92-N96 PolarHBondContact O-N 3.35Å; E92-N96 PolarHBondContact O-ND2 2.78Å; K93-N96 PolarHBondContact O-N 3.19Å; N96-G99 PolarHBondContact O-N 3.36Å; N96-F100 WeakPolarHBondContact O-CB 3.36Å; N96-F100 PolarHBondContact O-N 2.89Å; N96-F158 HydrophobicContact CB-CE1 4.12Å; N96-F158 HydrophobicContact CB-CZ 4.42Å; N96-F164 HydrophobicContact CB-CD2 4.19Å; N96-F164 WeakPolarHBondContact O-CD2 3.37Å
97L92.7Very high90.3Very high96 Ų9637.5 Ų37.550%0.50321%0.208SC..Hα-helixtrans-63.3-44.6175.7179.262.9000111.2K93 L94 F100 V101K93-L97 WeakPolarHBondContact O-CB 3.37Å; K93-L97 PolarHBondContact O-N 3.06Å; L94-L97 PolarHBondContact O-N 3.1Å; L97-F100 HydrophobicContact CD1-CD1 4.46Å; L97-F100 WeakPolarHBondContact O-CB 3.28Å; L97-F100 PolarHBondContact O-N 3.06Å; L97-V101 HydrophobicContact CD1-CG2 4.4Å; L97-V101 VanDerWaalsContact O-CG2 3.28Å; L97-V101 WeakPolarHBondContact O-CG2 3.35Å; L97-V101 PolarHBondContact O-N 3.29Å
98F91.9Very high90.7Very high7 Ų736.6 Ų36.63%0.03120%0.203CC..Hα-helixtrans-62.1-47.1177.8-174.7-78.5000111.2L72 P75 V76 L86 L94 C95 F100 V101 V102 W172 C173L72-F98 HydrophobicContact CB-CE2 4.24Å; L72-F98 HydrophobicContact CB-CZ 4.39Å; L72-F98 HydrophobicContact CD2-CD1 4.37Å; L72-F98 HydrophobicContact CD2-CD2 3.99Å; L72-F98 HydrophobicContact CD2-CE1 4.07Å; L72-F98 HydrophobicContact CD2-CE2 3.73Å; L72-F98 HydrophobicContact CD2-CG 4.31Å; L72-F98 HydrophobicContact CD2-CZ 3.75Å; L72-F98 WeakPolarHBondContact O-CE2 3.21Å; P75-F98 HydrophobicContact CB-CD2 4.29Å; P75-F98 HydrophobicContact CB-CE2 4.48Å; V76-F98 HydrophobicContact CG2-CE2 3.8Å; V76-F98 HydrophobicContact CG2-CZ 3.92Å; L86-F98 HydrophobicContact CD2-CB 3.4Å; L86-F98 VanDerWaalsContact CD2-CB 3.4Å; L86-F98 HydrophobicContact CD2-CD1 3.9Å; L86-F98 HydrophobicContact CD2-CD2 3.61Å; L86-F98 HydrophobicContact CD2-CE2 4.34Å; L86-F98 HydrophobicContact CD2-CG 3.34Å; L94-F98 WeakPolarHBondContact O-CB 3.34Å; L94-F98 PolarHBondContact O-N 2.92Å; C95-F98 PolarHBondContact O-N 3.27Å; F98-F100 VanDerWaalsContact C-N 3.31Å; F98-F100 PolarHBondContact O-N 2.8Å; F98-V101 PolarHBondContact O-N 3.48Å; F98-V102 HydrophobicContact CD1-CG2 3.76Å; F98-V102 HydrophobicContact CE1-CG2 3.27Å; F98-V102 HydrophobicContact CZ-CG2 3.95Å; F98-V102 WeakPolarHBondContact O-CG2 3.02Å; F98-V102 PolarHBondContact O-N 3.24Å; F98-W172 AromaticContact CE1-CD1 3.1Å; F98-W172 HydrophobicContact CE1-CG 4.25Å; F98-W172 AromaticContact CE1-NE1 3.43Å; F98-W172 AromaticContact CZ-CD1 3.36Å; F98-W172 AromaticContact CZ-NE1 3.64Å; F98-C173 HydrophobicContact CD1-CB 4.01Å
99G91.2Very high91Very high0 Ų035.6 Ų35.60%019%0.193CC..Hα-helixtrans-58-43.9175.300000112C95 N96 V102 N103 F164 C173C95-G99 PolarHBondContact O-N 3.48Å; N96-G99 PolarHBondContact O-N 3.36Å; G99-V102 PolarHBondContact O-N 3.42Å; G99-N103 WeakPolarHBondContact O-CB 3.48Å; G99-N103 PolarHBondContact O-N 3.28Å; G99-N103 VanDerWaalsContact O-N 3.08Å; G99-N103 PolarHBondContact O-ND2 2.97Å; G99-F164 VanDerWaalsContact C-CE1 3.49Å; G99-C173 WeakPolarHBondContact CA-O 3.46Å
100F93.6Very high91.1Very high33 Ų3332.8 Ų32.815%0.14518%0.178CC..Hα-helixtrans-57-49.9173.3168.8-95.9000112.1N96 L97 F98 N103 F104 L151 C154 L155 F158 F164N96-F100 WeakPolarHBondContact O-CB 3.36Å; N96-F100 PolarHBondContact O-N 2.89Å; L97-F100 HydrophobicContact CD1-CD1 4.46Å; L97-F100 WeakPolarHBondContact O-CB 3.28Å; L97-F100 PolarHBondContact O-N 3.06Å; F98-F100 VanDerWaalsContact C-N 3.31Å; F98-F100 PolarHBondContact O-N 2.8Å; F100-N103 PolarHBondContact O-N 3.21Å; F100-F104 HydrophobicContact CZ-CB 4.47Å; F100-F104 WeakPolarHBondContact O-CB 3.25Å; F100-F104 PolarHBondContact O-N 3.03Å; F100-L151 HydrophobicContact CE2-CD1 4.07Å; F100-L151 HydrophobicContact CZ-CD1 3.65Å; F100-C154 HydrophobicContact CD2-CB 3.68Å; F100-C154 WeakPolarHBondContact CD2-O 3.29Å; F100-C154 HydrophobicContact CE2-CB 3.66Å; F100-L155 HydrophobicContact CE2-CD2 3.91Å; F100-L155 HydrophobicContact CE2-CG 4.15Å; F100-F158 HydrophobicContact CB-CE2 3.88Å; F100-F158 HydrophobicContact CB-CZ 4Å; F100-F158 AromaticContact CD2-CE2 3.77Å; F100-F158 HydrophobicContact CD2-CE2 3.77Å; F100-F158 HydrophobicContact CG-CE2 4.03Å; F100-F158 HydrophobicContact CG-CZ 4.44Å; F100-F164 HydrophobicContact CB-CE2 4.16Å; F100-F164 HydrophobicContact CB-CZ 4.2Å
101V93.1Very high91.5Very high17 Ų1732.2 Ų32.210%0.10317%0.166CC..Hα-helixtrans-61.4-47.9-179.4172.60000110.8L71 L72 L97 F98 N103 F104 F105L71-V101 HydrophobicContact CB-CG1 3.99Å; L72-V101 HydrophobicContact CD1-CG1 4.41Å; L72-V101 HydrophobicContact CD2-CB 3.81Å; L72-V101 HydrophobicContact CD2-CG1 3.36Å; L72-V101 HydrophobicContact CG-CG1 3.65Å; L97-V101 HydrophobicContact CD1-CG2 4.4Å; L97-V101 VanDerWaalsContact O-CG2 3.28Å; L97-V101 WeakPolarHBondContact O-CG2 3.35Å; L97-V101 PolarHBondContact O-N 3.29Å; F98-V101 PolarHBondContact O-N 3.48Å; V101-N103 VanDerWaalsContact C-N 3.33Å; V101-N103 PolarHBondContact O-N 2.85Å; V101-F104 PolarHBondContact O-N 3.12Å; V101-F105 HydrophobicContact CG1-CD2 3.58Å; V101-F105 HydrophobicContact CG1-CE2 3.74Å; V101-F105 VanDerWaalsContact O-CD2 3.26Å; V101-F105 WeakPolarHBondContact O-CD2 3.34Å; V101-F105 PolarHBondContact O-N 3.07Å
102V90.3Very high91.7Very high7 Ų730.8 Ų30.84%0.04215%0.151CC..Hα-helixtrans-58-47.3179177.80000111.1L72 F98 G99 G106 F174L72-V102 HydrophobicContact CD1-CB 4.48Å; L72-V102 HydrophobicContact CD1-CG2 3.85Å; L72-V102 HydrophobicContact CD2-CB 4.34Å; L72-V102 HydrophobicContact CD2-CG2 3.34Å; L72-V102 HydrophobicContact CG-CG2 4.23Å; F98-V102 HydrophobicContact CD1-CG2 3.76Å; F98-V102 HydrophobicContact CE1-CG2 3.27Å; F98-V102 HydrophobicContact CZ-CG2 3.95Å; F98-V102 WeakPolarHBondContact O-CG2 3.02Å; F98-V102 PolarHBondContact O-N 3.24Å; G99-V102 PolarHBondContact O-N 3.42Å; V102-G106 PolarHBondContact O-N 3.31Å; V102-F174 HydrophobicContact CB-CD2 4.45Å; V102-F174 HydrophobicContact CG1-CD2 3.79Å; V102-F174 HydrophobicContact CG1-CE2 3.83Å
103N91.3Very high91.7Very high0 Ų025.1 Ų25.10%013%0.125CC..Hα-helixtrans-71.3-38.5-176.8-75.8-82.7000112.1G99 F100 V101 L107 C154 F174 M175G99-N103 WeakPolarHBondContact O-CB 3.48Å; G99-N103 PolarHBondContact O-N 3.28Å; G99-N103 VanDerWaalsContact O-N 3.08Å; G99-N103 PolarHBondContact O-ND2 2.97Å; F100-N103 PolarHBondContact O-N 3.21Å; V101-N103 VanDerWaalsContact C-N 3.33Å; V101-N103 PolarHBondContact O-N 2.85Å; N103-L107 VanDerWaalsContact O-CB 3.24Å; N103-L107 WeakPolarHBondContact O-CB 3.2Å; N103-L107 PolarHBondContact O-N 2.8Å; N103-C154 VanDerWaalsContact C-SG 3.54Å; N103-F174 WeakPolarHBondContact OD1-CE2 3.4Å; N103-F174 WeakPolarHBondContact OD1-CZ 3.4Å; N103-M175 PolarHBondContact OD1-SD 2.97Å
104F94.3Very high91.7Very high30 Ų3016.9 Ų16.913%0.1329%0.09CC..Hα-helixtrans-64.5-54.1179.7171.8-98.9000111.9F100 V101 G106 L107 A108 Y147 L151 C154F100-F104 HydrophobicContact CZ-CB 4.47Å; F100-F104 WeakPolarHBondContact O-CB 3.25Å; F100-F104 PolarHBondContact O-N 3.03Å; V101-F104 PolarHBondContact O-N 3.12Å; F104-G106 VanDerWaalsContact C-N 3.31Å; F104-G106 PolarHBondContact O-N 3.03Å; F104-L107 PolarHBondContact O-N 2.89Å; F104-A108 WeakPolarHBondContact O-CB 3.38Å; F104-A108 PolarHBondContact O-N 3.5Å; F104-Y147 AromaticContact CZ-CD1 3.93Å; F104-Y147 HydrophobicContact CZ-CD1 3.93Å; F104-L151 HydrophobicContact CD2-CB 4.37Å; F104-L151 HydrophobicContact CE2-CB 3.95Å; F104-C154 WeakPolarHBondContact CA-SG 3.48Å; F104-C154 HydrophobicContact CB-CB 4.27Å; F104-C154 PolarHBondContact N-SG 3.02Å; F104-C154 VanDerWaalsContact N-SG 3.4Å
105F92.3Very high91.6Very high25 Ų2516 Ų1611%0.119%0.089CC..Hα-helixtrans-66.2-38.4179.7-75.6-73000111T64 L67 L71 V101 A108 S109T64-F105 HydrophobicContact CG2-CD1 3.67Å; T64-F105 HydrophobicContact CG2-CE1 4.41Å; T64-F105 WeakPolarHBondContact O-CD1 3.24Å; L67-F105 HydrophobicContact CB-CE1 3.58Å; L67-F105 HydrophobicContact CB-CZ 3.83Å; L71-F105 HydrophobicContact CD1-CE2 3.58Å; L71-F105 HydrophobicContact CD1-CZ 3.73Å; V101-F105 HydrophobicContact CG1-CD2 3.58Å; V101-F105 HydrophobicContact CG1-CE2 3.74Å; V101-F105 VanDerWaalsContact O-CD2 3.26Å; V101-F105 WeakPolarHBondContact O-CD2 3.34Å; V101-F105 PolarHBondContact O-N 3.07Å; F105-A108 PolarHBondContact O-N 3.42Å; F105-S109 WeakPolarHBondContact O-CB 3.47Å; F105-S109 PolarHBondContact O-N 3.29Å; F105-S109 PolarHBondContact O-OG 2.92Å; F105-S109 VanDerWaalsContact O-OG 3.11Å
106G89.8Confident91.4Very high13 Ų1315.9 Ų15.913%0.1349%0.088CC..Hα-helixtrans-59.5-50.2174.700000113.8V102 F104 T110 Y300V102-G106 PolarHBondContact O-N 3.31Å; F104-G106 VanDerWaalsContact C-N 3.31Å; F104-G106 PolarHBondContact O-N 3.03Å; G106-T110 PolarHBondContact O-N 3.39Å; G106-T110 PolarHBondContact O-OG1 3.5Å; G106-T110 VanDerWaalsContact O-OG1 3.07Å; G106-Y300 WeakPolarHBondContact CA-OH 3.1Å; G106-Y300 PolarHBondContact O-OH 3.2Å
107L92.3Very high91.1Very high0 Ų013.9 Ų13.90%08%0.077CC..Hα-helixtrans-69-40.2179-177.558.8000112.1N103 F104 T110 L111 C153 Y198 L201 L205N103-L107 VanDerWaalsContact O-CB 3.24Å; N103-L107 WeakPolarHBondContact O-CB 3.2Å; N103-L107 PolarHBondContact O-N 2.8Å; F104-L107 PolarHBondContact O-N 2.89Å; L107-T110 PolarHBondContact O-N 3.42Å; L107-L111 HydrophobicContact CD1-CD1 4.19Å; L107-L111 HydrophobicContact CD1-CG 4.39Å; L107-L111 HydrophobicContact CG-CD1 3.97Å; L107-L111 WeakPolarHBondContact O-CB 3.32Å; L107-L111 WeakPolarHBondContact O-CG 3.39Å; L107-L111 PolarHBondContact O-N 3.39Å; L107-C153 HydrophobicContact CD2-CB 3.9Å; L107-Y198 HydrophobicContact CB-CE2 4.13Å; L107-Y198 HydrophobicContact CD1-CE2 4.46Å; L107-Y198 HydrophobicContact CD2-CE2 4.18Å; L107-Y198 HydrophobicContact CG-CE2 4.49Å; L107-L201 HydrophobicContact CD1-CD2 3.75Å; L107-L201 HydrophobicContact CD1-CG 4.25Å; L107-L201 HydrophobicContact CD2-CD2 4.07Å; L107-L205 HydrophobicContact CD1-CD1 4.16Å
108A94.3Very high90.8Very high0 Ų012.8 Ų12.80%07%0.072CC..Hα-helixtrans-59.9-49.6175.800000111.5T64 F104 F105 T110 L111 I112 V146 Y147 S150T64-A108 HydrophobicContact CG2-CB 3.94Å; F104-A108 WeakPolarHBondContact O-CB 3.38Å; F104-A108 PolarHBondContact O-N 3.5Å; F105-A108 PolarHBondContact O-N 3.42Å; A108-T110 VanDerWaalsContact C-N 3.35Å; A108-T110 PolarHBondContact O-N 2.95Å; A108-L111 PolarHBondContact O-N 2.87Å; A108-I112 VanDerWaalsContact O-CG1 3.25Å; A108-I112 WeakPolarHBondContact O-CG1 3.4Å; A108-I112 PolarHBondContact O-N 3.44Å; A108-V146 HydrophobicContact CB-CG1 4.48Å; A108-Y147 HydrophobicContact CB-CD1 4.07Å; A108-Y147 HydrophobicContact CB-CE1 4.12Å; A108-S150 WeakPolarHBondContact CA-OG 3.34Å; A108-S150 PolarHBondContact N-OG 2.87Å
109S91.1Very high90.5Very high3 Ų312.8 Ų12.82%0.0217%0.071CC..Hα-helixtrans-59.6-43.7178.1-64.90000111.9T64 D65 F105 L111 I112 L113T64-S109 VanDerWaalsContact CG2-OG 3.31Å; T64-S109 WeakPolarHBondContact CG2-OG 3.2Å; D65-S109 WeakPolarHBondContact OD1-CB 3.31Å; D65-S109 PolarHBondContact OD1-OG 3.29Å; F105-S109 WeakPolarHBondContact O-CB 3.47Å; F105-S109 PolarHBondContact O-N 3.29Å; F105-S109 PolarHBondContact O-OG 2.92Å; F105-S109 VanDerWaalsContact O-OG 3.11Å; S109-L111 PolarHBondContact O-N 2.9Å; S109-I112 PolarHBondContact O-N 3.42Å; S109-L113 WeakPolarHBondContact O-CB 3.21Å; S109-L113 WeakPolarHBondContact O-CD1 3.42Å; S109-L113 WeakPolarHBondContact O-CG 3Å; S109-L113 PolarHBondContact O-N 2.96Å
110T90.1Very high89.9Confident2 Ų214.6 Ų14.61%0.0128%0.078CC..Hα-helixtrans-59.3-43.8175-61.70000112.9G106 L107 A108 L113 C114 L205 F268G106-T110 PolarHBondContact O-N 3.39Å; G106-T110 PolarHBondContact O-OG1 3.5Å; G106-T110 VanDerWaalsContact O-OG1 3.07Å; L107-T110 PolarHBondContact O-N 3.42Å; A108-T110 VanDerWaalsContact C-N 3.35Å; A108-T110 PolarHBondContact O-N 2.95Å; T110-L113 WeakPolarHBondContact O-CB 3.05Å; T110-L113 PolarHBondContact O-N 3.2Å; T110-C114 PolarHBondContact O-N 3.41Å; T110-L205 HydrophobicContact CG2-CB 3.67Å; T110-L205 HydrophobicContact CG2-CD1 3.63Å; T110-L205 HydrophobicContact CG2-CG 4.26Å; T110-F268 HydrophobicContact CG2-CE1 4.26Å; T110-F268 HydrophobicContact CG2-CE2 3.96Å; T110-F268 HydrophobicContact CG2-CZ 3.37Å; T110-F268 WeakPolarHBondContact OG1-CE2 3.35Å
111L93.6Very high89.3Confident24 Ų2414 Ų1413%0.1268%0.078CC..Hα-helixtrans-68-37.6178.4-77.7164.7000112.2L107 A108 S109 L113 C114 A115 V146 F149 S150 L205L107-L111 HydrophobicContact CD1-CD1 4.19Å; L107-L111 HydrophobicContact CD1-CG 4.39Å; L107-L111 HydrophobicContact CG-CD1 3.97Å; L107-L111 WeakPolarHBondContact O-CB 3.32Å; L107-L111 WeakPolarHBondContact O-CG 3.39Å; L107-L111 PolarHBondContact O-N 3.39Å; A108-L111 PolarHBondContact O-N 2.87Å; S109-L111 PolarHBondContact O-N 2.9Å; L111-L113 VanDerWaalsContact C-N 3.34Å; L111-C114 PolarHBondContact O-N 2.98Å; L111-A115 WeakPolarHBondContact O-CB 2.94Å; L111-A115 PolarHBondContact O-N 2.82Å; L111-V146 HydrophobicContact CB-CB 4.31Å; L111-V146 HydrophobicContact CB-CG1 3.48Å; L111-V146 VanDerWaalsContact CB-CG1 3.48Å; L111-V146 HydrophobicContact CB-CG2 3.93Å; L111-V146 HydrophobicContact CD1-CG1 4.08Å; L111-V146 HydrophobicContact CG-CG1 4.43Å; L111-F149 HydrophobicContact CD1-CD1 3.66Å; L111-F149 HydrophobicContact CD1-CE1 4.18Å; L111-S150 WeakPolarHBondContact CD1-OG 3.46Å; L111-L205 HydrophobicContact CD2-CD1 3.66Å; L111-L205 HydrophobicContact CD2-CD2 3.64Å; L111-L205 HydrophobicContact CD2-CG 4.32Å; L111-L205 HydrophobicContact CG-CD1 3.9Å
112I91.8Very high88.7Confident0 Ų016 Ų160%09%0.087CC..Hα-helixtrans-63.1-43.4173.6-64.4168.3000110L57 L61 T64 A108 S109 C114 A115 M116 L143 V146 Y147L57-I112 WeakPolarHBondContact O-CG2 3.36Å; L61-I112 HydrophobicContact CB-CG2 3.88Å; L61-I112 HydrophobicContact CD1-CB 4.49Å; L61-I112 HydrophobicContact CD1-CG2 4.46Å; T64-I112 WeakPolarHBondContact OG1-CD1 3.48Å; A108-I112 VanDerWaalsContact O-CG1 3.25Å; A108-I112 WeakPolarHBondContact O-CG1 3.4Å; A108-I112 PolarHBondContact O-N 3.44Å; S109-I112 PolarHBondContact O-N 3.42Å; I112-C114 VanDerWaalsContact C-N 3.34Å; I112-C114 PolarHBondContact O-N 2.88Å; I112-A115 PolarHBondContact O-N 2.65Å; I112-M116 HydrophobicContact CG2-CE 4.36Å; I112-M116 WeakPolarHBondContact O-CG 3.23Å; I112-M116 PolarHBondContact O-N 3.45Å; I112-L143 HydrophobicContact CD1-CD2 3.89Å; I112-L143 HydrophobicContact CG1-CD2 3.76Å; I112-L143 HydrophobicContact CG2-CD2 4.42Å; I112-V146 HydrophobicContact CG1-CG1 4.03Å; I112-Y147 HydrophobicContact CD1-CE1 4.47Å
113L87.7Confident88.1Confident2 Ų216.7 Ų16.71%0.019%0.093CC..Hα-helixtrans-59.3-43.2174.6-77.6159.1000112.3L61 S109 T110 L111 M116 A117 I264 F268L61-L113 HydrophobicContact CD1-CG 4.32Å; L61-L113 HydrophobicContact CD2-CD2 4.07Å; L61-L113 HydrophobicContact CD2-CG 4.27Å; S109-L113 WeakPolarHBondContact O-CB 3.21Å; S109-L113 WeakPolarHBondContact O-CD1 3.42Å; S109-L113 WeakPolarHBondContact O-CG 3Å; S109-L113 PolarHBondContact O-N 2.96Å; T110-L113 WeakPolarHBondContact O-CB 3.05Å; T110-L113 PolarHBondContact O-N 3.2Å; L111-L113 VanDerWaalsContact C-N 3.34Å; L113-M116 HydrophobicContact CB-CE 4.43Å; L113-M116 HydrophobicContact CD2-CE 3.55Å; L113-M116 HydrophobicContact CG-CE 4.01Å; L113-M116 PolarHBondContact O-N 3.11Å; L113-A117 PolarHBondContact O-N 3.18Å; L113-I264 HydrophobicContact CD2-CG2 3.34Å; L113-F268 HydrophobicContact CD1-CB 4.3Å; L113-F268 HydrophobicContact CD1-CD2 3.43Å; L113-F268 VanDerWaalsContact CD1-CD2 3.43Å; L113-F268 HydrophobicContact CD1-CE2 3.95Å; L113-F268 HydrophobicContact CD1-CG 3.9Å
114C90.4Very high87.3Confident9 Ų919.1 Ų19.16%0.06111%0.106CC..Hα-helixtrans-61.7-46.1173.6-173.40000112.1T110 L111 I112 M116 A117 L118 L205 V209T110-C114 PolarHBondContact O-N 3.41Å; L111-C114 PolarHBondContact O-N 2.98Å; I112-C114 VanDerWaalsContact C-N 3.34Å; I112-C114 PolarHBondContact O-N 2.88Å; C114-M116 VanDerWaalsContact C-N 3.3Å; C114-M116 PolarHBondContact O-N 2.93Å; C114-A117 PolarHBondContact O-N 3.45Å; C114-A117 VanDerWaalsContact O-N 3.17Å; C114-L118 WeakPolarHBondContact O-CG 3.16Å; C114-L118 PolarHBondContact O-N 3.49Å; C114-L205 HydrophobicContact CB-CD2 3.99Å; C114-V209 HydrophobicContact CB-CG2 3.95Å
115A90.5Very high86.2Confident23 Ų2319.5 Ų19.519%0.1911%0.113CC..Hα-helixtrans-60.7-39.3176.300000112.2L57 L111 I112 E119L57-A115 HydrophobicContact CD2-CB 4.35Å; L111-A115 WeakPolarHBondContact O-CB 2.94Å; L111-A115 PolarHBondContact O-N 2.82Å; I112-A115 PolarHBondContact O-N 2.65Å; A115-E119 VanDerWaalsContact O-CB 3.25Å; A115-E119 WeakPolarHBondContact O-CB 3.13Å; A115-E119 PolarHBondContact O-N 3.1Å
116M86.5Confident85.5Confident0 Ų024.1 Ų24.10%013%0.134CC..Hα-helixtrans-64-43.6173.8-71.9-169-62.100112.2L57 V58 L61 I112 L113 C114 E119 R120 L261L57-M116 HydrophobicContact CB-CG 3.5Å; L57-M116 VanDerWaalsContact CB-CG 3.5Å; L57-M116 HydrophobicContact CB-SD 4.06Å; L57-M116 HydrophobicContact CD1-CG 3.85Å; L57-M116 HydrophobicContact CG-CG 4.26Å; V58-M116 HydrophobicContact CG2-SD 3.63Å; L61-M116 HydrophobicContact CD2-CE 3.58Å; I112-M116 HydrophobicContact CG2-CE 4.36Å; I112-M116 WeakPolarHBondContact O-CG 3.23Å; I112-M116 PolarHBondContact O-N 3.45Å; L113-M116 HydrophobicContact CB-CE 4.43Å; L113-M116 HydrophobicContact CD2-CE 3.55Å; L113-M116 HydrophobicContact CG-CE 4.01Å; L113-M116 PolarHBondContact O-N 3.11Å; C114-M116 VanDerWaalsContact C-N 3.3Å; C114-M116 PolarHBondContact O-N 2.93Å; M116-E119 PolarHBondContact O-N 2.88Å; M116-R120 VanDerWaalsContact O-CG 3.32Å; M116-R120 WeakPolarHBondContact O-CG 2.99Å; M116-R120 PolarHBondContact O-N 2.69Å; M116-R120 VanDerWaalsContact O-N 3.1Å; M116-L261 HydrophobicContact CB-CD1 4.17Å
117A84.4Confident84.8Confident0 Ų027 Ų270%015%0.151CC..Hα-helixtrans-63.6-42.3177.800000111.9L113 C114 R120 C121 V209 C212L113-A117 PolarHBondContact O-N 3.18Å; C114-A117 PolarHBondContact O-N 3.45Å; C114-A117 VanDerWaalsContact O-N 3.17Å; A117-R120 PolarHBondContact O-N 3.21Å; A117-C121 WeakPolarHBondContact O-CB 3.18Å; A117-C121 PolarHBondContact O-N 3.45Å; A117-V209 HydrophobicContact CB-CG1 4.46Å; A117-V209 HydrophobicContact CB-CG2 4.31Å; A117-C212 HydrophobicContact CB-CB 4.01Å
118L87.3Confident83.9Confident74 Ų7436.6 Ų36.639%0.38719%0.188SC..Hα-helixtrans-64.9-45.3176.5-74.1168.3000112.1C114 R120 C121 M122 V208 C212C114-L118 WeakPolarHBondContact O-CG 3.16Å; C114-L118 PolarHBondContact O-N 3.49Å; L118-R120 VanDerWaalsContact C-N 3.26Å; L118-R120 PolarHBondContact O-N 3Å; L118-C121 PolarHBondContact O-N 2.03Å; L118-M122 WeakPolarHBondContact O-CG 3.28Å; L118-M122 PolarHBondContact O-N 2.91Å; L118-V208 HydrophobicContact CD2-CG1 4.22Å; L118-V208 HydrophobicContact CG-CG1 4.42Å; L118-C212 VanDerWaalsContact CD2-SG 3.55Å
119E85.5Confident82.9Confident6 Ų641.6 Ų41.63%0.02821%0.21CC..Hα-helixtrans-55-45.1176.4-174.4-83.5160.900111.3V53 L57 A115 M116 M122 A123 Y130V53-E119 HydrophobicContact CB-CG 4.08Å; V53-E119 HydrophobicContact CG1-CG 3.59Å; L57-E119 HydrophobicContact CD1-CB 4.28Å; L57-E119 HydrophobicContact CD1-CG 4.41Å; A115-E119 VanDerWaalsContact O-CB 3.25Å; A115-E119 WeakPolarHBondContact O-CB 3.13Å; A115-E119 PolarHBondContact O-N 3.1Å; M116-E119 PolarHBondContact O-N 2.88Å; E119-M122 PolarHBondContact O-N 3.48Å; E119-A123 WeakPolarHBondContact O-CB 3.49Å; E119-A123 PolarHBondContact O-N 3.4Å; E119-Y130 HydrophobicContact CG-CE2 4.12Å; E119-Y130 VanDerWaalsContact OE1-CE2 3.26Å; E119-Y130 WeakPolarHBondContact OE1-CE2 3.31Å; E119-Y130 VanDerWaalsContact OE1-CZ 3.23Å; E119-Y130 PolarHBondContact OE1-OH 2.97Å
120R78.9Confident82.2Confident38 Ų3843.7 Ų43.714%0.14322%0.218CC..Hα-helixtrans-72.3-39.1179.2-67.2-61.1-173.3-172.68113.4F54 M116 A117 L118 M122 A123 I124 L261F54-R120 VanDerWaalsContact CD2-NH2 3.27Å; M116-R120 VanDerWaalsContact O-CG 3.32Å; M116-R120 WeakPolarHBondContact O-CG 2.99Å; M116-R120 PolarHBondContact O-N 2.69Å; M116-R120 VanDerWaalsContact O-N 3.1Å; A117-R120 PolarHBondContact O-N 3.21Å; L118-R120 VanDerWaalsContact C-N 3.26Å; L118-R120 PolarHBondContact O-N 3Å; R120-M122 VanDerWaalsContact C-N 3.32Å; R120-M122 PolarHBondContact O-N 2.88Å; R120-A123 PolarHBondContact O-N 3.01Å; R120-I124 WeakPolarHBondContact O-CG1 3.4Å; R120-I124 PolarHBondContact O-N 3.12Å; R120-I124 VanDerWaalsContact O-N 3.1Å; R120-L261 HydrophobicContact CB-CD2 3.58Å; R120-L261 HydrophobicContact CG-CD1 4.45Å; R120-L261 HydrophobicContact CG-CD2 3.64Å
121C79.2Confident81.4Confident22 Ų2247.8 Ų47.815%0.14925%0.246CC..Hα-helixtrans-59.4-45172.8-168.40000111A117 L118 S125 C212 V216A117-C121 WeakPolarHBondContact O-CB 3.18Å; A117-C121 PolarHBondContact O-N 3.45Å; L118-C121 PolarHBondContact O-N 2.03Å; C121-S125 VanDerWaalsContact O-CB 3.22Å; C121-S125 WeakPolarHBondContact O-CB 3.26Å; C121-S125 PolarHBondContact O-N 2.97Å; C121-S125 PolarHBondContact O-OG 3.27Å; C121-C212 HydrophobicContact CB-CB 4.13Å; C121-V216 HydrophobicContact CB-CG2 4.21Å
122M81.3Confident80.6Confident58 Ų5851.7 Ų51.729%0.28627%0.271SS..Hα-helixtrans-65.3-43.5177.4-71-173.6-68.800112.4L118 E119 R120 I124 H126 Y130 I134L118-M122 WeakPolarHBondContact O-CG 3.28Å; L118-M122 PolarHBondContact O-N 2.91Å; E119-M122 PolarHBondContact O-N 3.48Å; R120-M122 VanDerWaalsContact C-N 3.32Å; R120-M122 PolarHBondContact O-N 2.88Å; M122-I124 VanDerWaalsContact C-N 3.3Å; M122-I124 PolarHBondContact O-N 2.87Å; M122-H126 CarbonylContact O-C 3.3Å; M122-H126 VanDerWaalsContact O-C 3.31Å; M122-H126 WeakPolarHBondContact O-CA 3.07Å; M122-H126 PolarHBondContact O-N 3.5Å; M122-Y130 HydrophobicContact CB-CD2 4.34Å; M122-I134 HydrophobicContact CE-CD1 4.23Å
123A77.6Confident79.7Confident21 Ų2157 Ų5717%0.17430%0.296CS..Hα-helixtrans-59.8-39.5179.700000112.7E119 R120 Y130E119-A123 WeakPolarHBondContact O-CB 3.49Å; E119-A123 PolarHBondContact O-N 3.4Å; R120-A123 PolarHBondContact O-N 3.01Å; A123-Y130 HydrophobicContact CB-CD1 4.35Å; A123-Y130 HydrophobicContact CB-CD2 3.66Å; A123-Y130 HydrophobicContact CB-CE1 4.41Å; A123-Y130 HydrophobicContact CB-CE2 3.69Å; A123-Y130 HydrophobicContact CB-CG 4.01Å
124I73.8Confident79.1Confident51 Ų5158 Ų5826%0.26230%0.301SS..Hα-helixtrans-88.9-45.1-174.2-65.1171.1000111.6R120 M122 V216 V258R120-I124 WeakPolarHBondContact O-CG1 3.4Å; R120-I124 PolarHBondContact O-N 3.12Å; R120-I124 VanDerWaalsContact O-N 3.1Å; M122-I124 VanDerWaalsContact C-N 3.3Å; M122-I124 PolarHBondContact O-N 2.87Å; I124-V216 HydrophobicContact CD1-CB 4.38Å; I124-V216 HydrophobicContact CD1-CG1 3.51Å; I124-V216 HydrophobicContact CD1-CG2 4.13Å; I124-V258 HydrophobicContact CD1-CG2 3.66Å
125S72.8Confident78.6Confident39 Ų3966 Ų6627%0.27333%0.33SS..Hα-helixtrans-73.2-39.3-178.2-58.70000111.6C121C121-S125 VanDerWaalsContact O-CB 3.22Å; C121-S125 WeakPolarHBondContact O-CB 3.26Å; C121-S125 PolarHBondContact O-N 2.97Å; C121-S125 PolarHBondContact O-OG 3.27Å
126H76.1Confident78.1Confident121 Ų12167.6 Ų67.656%0.5634%0.338SS*.  trans-132.768.1-172.4-62.1-7.6000112.1M122 Y128 F129 Y130M122-H126 CarbonylContact O-C 3.3Å; M122-H126 VanDerWaalsContact O-C 3.31Å; M122-H126 WeakPolarHBondContact O-CA 3.07Å; M122-H126 PolarHBondContact O-N 3.5Å; H126-Y128 VanDerWaalsContact C-N 3.33Å; H126-Y128 PolarHBondContact O-N 2.94Å; H126-F129 HydrophobicContact CB-CB 4.15Å; H126-F129 PolarHBondContact O-N 2.96Å; H126-Y130 PolarHBondContact O-N 2.88Å
127P75.3Confident78Confident74 Ų7471.8 Ų71.848%0.48136%0.364SS..Hα-helixtrans-61.8-35.1-172.722.7-33.8000114S131P127-S131 PolarHBondContact O-N 3.44Å; P127-S131 PolarHBondContact O-OG 2.96Å
128Y72.9Confident78Confident202 Ų20276.9 Ų76.979%0.79239%0.386SS*.Hα-helixtrans-64-48.9176.5-77.2-80.9000111.8H126 Y130 S131 V132H126-Y128 VanDerWaalsContact C-N 3.33Å; H126-Y128 PolarHBondContact O-N 2.94Å; Y128-Y130 VanDerWaalsContact C-N 3.34Å; Y128-Y130 PolarHBondContact O-N 2.9Å; Y128-S131 PolarHBondContact O-N 3.46Å; Y128-S131 PolarHBondContact O-OG 3.38Å; Y128-V132 WeakPolarHBondContact O-CG2 3.39Å; Y128-V132 PolarHBondContact O-N 3.1Å
129F74.5Confident78Confident105 Ų10573.4 Ų73.446%0.46137%0.368SS..Hα-helixtrans-61.8-43.2177.9-176.6-98.4000111.7H126 S131 V132 H133H126-F129 HydrophobicContact CB-CB 4.15Å; H126-F129 PolarHBondContact O-N 2.96Å; F129-S131 PolarHBondContact O-N 2.72Å; F129-V132 PolarHBondContact O-N 3.01Å; F129-H133 AromaticContact CD2-CE1 3.91Å; F129-H133 AromaticContact CD2-ND1 3.57Å; F129-H133 HydrophobicContact CE1-CB 4.39Å; F129-H133 AromaticContact CE2-CE1 3.69Å; F129-H133 AromaticContact CE2-CG 3.9Å; F129-H133 AromaticContact CE2-ND1 3.49Å; F129-H133 WeakPolarHBondContact CE2-ND1 3.45Å; F129-H133 HydrophobicContact CZ-CB 4.28Å; F129-H133 PolarHBondContact O-N 3.2Å; F129-H133 PolarHBondContact O-ND1 3.06Å
130Y76.9Confident78.2Confident47 Ų4779.8 Ų79.818%0.18440%0.396CS..Hα-helixtrans-58.2-48.5177.3-178.4-85.3000111.8E119 M122 A123 H126 Y128 V132 I134E119-Y130 HydrophobicContact CG-CE2 4.12Å; E119-Y130 VanDerWaalsContact OE1-CE2 3.26Å; E119-Y130 WeakPolarHBondContact OE1-CE2 3.31Å; E119-Y130 VanDerWaalsContact OE1-CZ 3.23Å; E119-Y130 PolarHBondContact OE1-OH 2.97Å; M122-Y130 HydrophobicContact CB-CD2 4.34Å; A123-Y130 HydrophobicContact CB-CD1 4.35Å; A123-Y130 HydrophobicContact CB-CD2 3.66Å; A123-Y130 HydrophobicContact CB-CE1 4.41Å; A123-Y130 HydrophobicContact CB-CE2 3.69Å; A123-Y130 HydrophobicContact CB-CG 4.01Å; H126-Y130 PolarHBondContact O-N 2.88Å; Y128-Y130 VanDerWaalsContact C-N 3.34Å; Y128-Y130 PolarHBondContact O-N 2.9Å; Y130-V132 VanDerWaalsContact C-N 3.27Å; Y130-V132 PolarHBondContact O-N 2.76Å; Y130-I134 HydrophobicContact CD2-CB 3.79Å; Y130-I134 HydrophobicContact CD2-CG1 3.73Å; Y130-I134 HydrophobicContact CD2-CG2 3.93Å; Y130-I134 HydrophobicContact CE2-CB 3.88Å; Y130-I134 HydrophobicContact CE2-CG1 4.2Å; Y130-I134 HydrophobicContact CE2-CG2 3.49Å; Y130-I134 VanDerWaalsContact CE2-CG2 3.49Å; Y130-I134 HydrophobicContact CG-CB 4.13Å; Y130-I134 HydrophobicContact CG-CG1 4.21Å; Y130-I134 VanDerWaalsContact O-CB 3.28Å; Y130-I134 WeakPolarHBondContact O-CB 3.42Å; Y130-I134 PolarHBondContact O-N 3.32Å
131S72.7Confident78.8Confident87 Ų8781.1 Ų81.161%0.60841%0.408SS*.Hα-helixtrans-63.8-28.5-178.368.70000114.6P127 Y128 F129P127-S131 PolarHBondContact O-N 3.44Å; P127-S131 PolarHBondContact O-OG 2.96Å; Y128-S131 PolarHBondContact O-N 3.46Å; Y128-S131 PolarHBondContact O-OG 3.38Å; F129-S131 PolarHBondContact O-N 2.72Å
132V75.6Confident79.4Confident106 Ų10681 Ų8164%0.64241%0.409SS*.Hα-helixtrans-87.4-40.8-177.3176.20000111.7Y128 F129 Y130Y128-V132 WeakPolarHBondContact O-CG2 3.39Å; Y128-V132 PolarHBondContact O-N 3.1Å; F129-V132 PolarHBondContact O-N 3.01Å; Y130-V132 VanDerWaalsContact C-N 3.27Å; Y130-V132 PolarHBondContact O-N 2.76Å
133H74.1Confident80Confident113 Ų11379.2 Ų79.252%0.52340%0.4SS..Hα-helixtrans-104.1-29.8-170.4-66.584.1000114.2F129 R135F129-H133 AromaticContact CD2-CE1 3.91Å; F129-H133 AromaticContact CD2-ND1 3.57Å; F129-H133 HydrophobicContact CE1-CB 4.39Å; F129-H133 AromaticContact CE2-CE1 3.69Å; F129-H133 AromaticContact CE2-CG 3.9Å; F129-H133 AromaticContact CE2-ND1 3.49Å; F129-H133 WeakPolarHBondContact CE2-ND1 3.45Å; F129-H133 HydrophobicContact CZ-CB 4.28Å; F129-H133 PolarHBondContact O-N 3.2Å; F129-H133 PolarHBondContact O-ND1 3.06Å; H133-R135 PolarHBondContact O-N 3.46Å
134I75.4Confident80.8Confident22 Ų2284.3 Ų84.311%0.11342%0.419CS..  trans-91.696.3-169.6-56.2-61.2000110.2V53 M122 Y130V53-I134 HydrophobicContact CB-CG2 4.47Å; V53-I134 HydrophobicContact CG1-CG2 4.44Å; V53-I134 HydrophobicContact CG2-CG2 3.72Å; M122-I134 HydrophobicContact CE-CD1 4.23Å; Y130-I134 HydrophobicContact CD2-CB 3.79Å; Y130-I134 HydrophobicContact CD2-CG1 3.73Å; Y130-I134 HydrophobicContact CD2-CG2 3.93Å; Y130-I134 HydrophobicContact CE2-CB 3.88Å; Y130-I134 HydrophobicContact CE2-CG1 4.2Å; Y130-I134 HydrophobicContact CE2-CG2 3.49Å; Y130-I134 VanDerWaalsContact CE2-CG2 3.49Å; Y130-I134 HydrophobicContact CG-CB 4.13Å; Y130-I134 HydrophobicContact CG-CG1 4.21Å; Y130-I134 VanDerWaalsContact O-CB 3.28Å; Y130-I134 WeakPolarHBondContact O-CB 3.42Å; Y130-I134 PolarHBondContact O-N 3.32Å
135R79.1Confident81.9Confident176 Ų17687.8 Ų87.866%0.66443%0.432SS*.  trans-100.7157.9176.1-66.8-179.568.6146.8-0.8111.5H133 T137 F138H133-R135 PolarHBondContact O-N 3.46Å; R135-T137 PolarHBondContact O-N 3.45Å; R135-F138 WeakPolarHBondContact O-CB 3.17Å; R135-F138 PolarHBondContact O-N 3.28Å
136P79.8Confident83Confident57 Ų5786.8 Ų86.837%0.3743%0.425SS..Hα-helixtrans-55.4-27.3175.1-26.435.7000114.5S51 I56 F138 A139S51-P136 VanDerWaalsContact O-CG 3.23Å; S51-P136 WeakPolarHBondContact O-CG 3.32Å; I56-P136 HydrophobicContact CD1-CB 3.83Å; P136-F138 VanDerWaalsContact C-N 3.27Å; P136-F138 PolarHBondContact O-N 2.89Å; P136-A139 WeakPolarHBondContact O-CB 3.38Å; P136-A139 PolarHBondContact O-N 3.39Å
137T84.1Confident84Confident88 Ų8884.4 Ų84.454%0.5441%0.411SS..Hα-helixtrans-61.7-35174-43.90000112.1R135 A139 K140 V141R135-T137 PolarHBondContact O-N 3.45Å; T137-A139 VanDerWaalsContact C-N 3.29Å; T137-A139 PolarHBondContact O-N 2.72Å; T137-K140 PolarHBondContact O-N 3.24Å; T137-V141 HydrophobicContact CG2-CG2 4.43Å; T137-V141 WeakPolarHBondContact O-CG2 3.27Å; T137-V141 PolarHBondContact O-N 3.22Å
138F85.9Confident85Confident108 Ų10884.6 Ų84.647%0.47441%0.408SS..Hα-helixtrans-59.8-41176.7-178.1-94.1000111.3R135 P136 K140 V141 A142R135-F138 WeakPolarHBondContact O-CB 3.17Å; R135-F138 PolarHBondContact O-N 3.28Å; P136-F138 VanDerWaalsContact C-N 3.27Å; P136-F138 PolarHBondContact O-N 2.89Å; F138-K140 VanDerWaalsContact C-N 3.32Å; F138-K140 PolarHBondContact O-N 3.1Å; F138-V141 PolarHBondContact O-N 3.26Å; F138-A142 HydrophobicContact CE1-CB 4.47Å; F138-A142 VanDerWaalsContact O-CB 3.28Å; F138-A142 WeakPolarHBondContact O-CB 3.38Å; F138-A142 PolarHBondContact O-N 3.39Å
139A87.2Confident86.1Confident1 Ų179.3 Ų79.31%0.00839%0.389CS..Hα-helixtrans-58.9-44177.300000112V53 I56 L57 P136 T137 A142 L143V53-A139 HydrophobicContact CB-CB 4.29Å; V53-A139 HydrophobicContact CG1-CB 3.64Å; I56-A139 HydrophobicContact CB-CB 3.87Å; I56-A139 HydrophobicContact CD1-CB 4.1Å; I56-A139 HydrophobicContact CG2-CB 3.78Å; L57-A139 HydrophobicContact CG-CB 4.43Å; P136-A139 WeakPolarHBondContact O-CB 3.38Å; P136-A139 PolarHBondContact O-N 3.39Å; T137-A139 VanDerWaalsContact C-N 3.29Å; T137-A139 PolarHBondContact O-N 2.72Å; A139-A142 PolarHBondContact O-N 3.27Å; A139-L143 WeakPolarHBondContact O-CG 3.46Å; A139-L143 PolarHBondContact O-N 3.23Å
140K89.4Confident87.1Confident139 Ų13974.3 Ų74.360%0.60437%0.367SS*.Hα-helixtrans-67-42.9179.8-62.8-178.2-179.1-178.10111.7I56 T137 F138 L143 F144I56-K140 HydrophobicContact CG2-CG 4.33Å; T137-K140 PolarHBondContact O-N 3.24Å; F138-K140 VanDerWaalsContact C-N 3.32Å; F138-K140 PolarHBondContact O-N 3.1Å; K140-L143 PolarHBondContact O-N 3.39Å; K140-F144 PolarHBondContact O-N 2.98Å
141V91.5Very high88Confident67 Ų6775.2 Ų75.241%0.40638%0.375SS..Hα-helixtrans-64.5-43.6176.4173.30000110.6T137 F138 L143 F144 F145T137-V141 HydrophobicContact CG2-CG2 4.43Å; T137-V141 WeakPolarHBondContact O-CG2 3.27Å; T137-V141 PolarHBondContact O-N 3.22Å; F138-V141 PolarHBondContact O-N 3.26Å; V141-L143 PolarHBondContact O-N 2.97Å; V141-F144 WeakPolarHBondContact O-CB 3.46Å; V141-F144 PolarHBondContact O-N 3.29Å; V141-F145 HydrophobicContact CG1-CD2 3.68Å; V141-F145 HydrophobicContact CG1-CE2 3.43Å; V141-F145 VanDerWaalsContact CG1-CE2 3.43Å; V141-F145 WeakPolarHBondContact O-CD2 3.14Å; V141-F145 PolarHBondContact O-N 2.85Å
142A91.7Very high89Confident20 Ų2074.1 Ų74.117%0.16537%0.367CS..Hα-helixtrans-59.3-47.6175.100000111.4F138 A139 F144 F145 V146F138-A142 HydrophobicContact CE1-CB 4.47Å; F138-A142 VanDerWaalsContact O-CB 3.28Å; F138-A142 WeakPolarHBondContact O-CB 3.38Å; F138-A142 PolarHBondContact O-N 3.39Å; A139-A142 PolarHBondContact O-N 3.27Å; A142-F144 VanDerWaalsContact C-N 3.33Å; A142-F144 PolarHBondContact O-N 3.45Å; A142-F145 PolarHBondContact O-N 2.89Å; A142-V146 VanDerWaalsContact O-CG2 3.29Å; A142-V146 WeakPolarHBondContact O-CG2 3.11Å; A142-V146 PolarHBondContact O-N 2.78Å
143L93.9Very high89.8Confident20 Ų2070.2 Ų70.211%0.10534%0.344CS..Hα-helixtrans-58.2-43.6175.6-74174.4000112.2I56 L57 I112 A139 K140 V141 F145 V146 Y147I56-L143 HydrophobicContact CG2-CD1 3.89Å; L57-L143 HydrophobicContact CD2-CD2 4.11Å; L57-L143 HydrophobicContact CD2-CG 4.15Å; I112-L143 HydrophobicContact CD1-CD2 3.89Å; I112-L143 HydrophobicContact CG1-CD2 3.76Å; I112-L143 HydrophobicContact CG2-CD2 4.42Å; A139-L143 WeakPolarHBondContact O-CG 3.46Å; A139-L143 PolarHBondContact O-N 3.23Å; K140-L143 PolarHBondContact O-N 3.39Å; V141-L143 PolarHBondContact O-N 2.97Å; L143-F145 PolarHBondContact O-N 3.17Å; L143-V146 PolarHBondContact O-N 3Å; L143-Y147 HydrophobicContact CB-CE2 4.23Å; L143-Y147 WeakPolarHBondContact O-CD2 3.33Å; L143-Y147 PolarHBondContact O-N 2.85Å
144F95Very high90.6Very high128 Ų12864.9 Ų64.956%0.56132%0.319SS*.Hα-helixtrans-57.8-48.7176.5174.8-98.5000111.9K140 V141 A142 Y147 L148K140-F144 PolarHBondContact O-N 2.98Å; V141-F144 WeakPolarHBondContact O-CB 3.46Å; V141-F144 PolarHBondContact O-N 3.29Å; A142-F144 VanDerWaalsContact C-N 3.33Å; A142-F144 PolarHBondContact O-N 3.45Å; F144-Y147 PolarHBondContact O-N 2.89Å; F144-L148 HydrophobicContact CE1-CD2 4.12Å; F144-L148 HydrophobicContact CZ-CD2 4.4Å; F144-L148 WeakPolarHBondContact O-CB 3.2Å; F144-L148 PolarHBondContact O-N 3.42Å
145F95.7Very high91.5Very high123 Ų12367.5 Ų67.554%0.53933%0.333SS..Hα-helixtrans-66.1-37.2177.7-76.3-64000112.9V141 A142 L143 L148 F149V141-F145 HydrophobicContact CG1-CD2 3.68Å; V141-F145 HydrophobicContact CG1-CE2 3.43Å; V141-F145 VanDerWaalsContact CG1-CE2 3.43Å; V141-F145 WeakPolarHBondContact O-CD2 3.14Å; V141-F145 PolarHBondContact O-N 2.85Å; A142-F145 PolarHBondContact O-N 2.89Å; L143-F145 PolarHBondContact O-N 3.17Å; F145-L148 PolarHBondContact O-N 3.27Å; F145-F149 WeakPolarHBondContact O-CB 3.37Å; F145-F149 PolarHBondContact O-N 3.32Å
146V96.2Very high92Very high19 Ų1962.3 Ų62.312%0.11532%0.319CS..Hα-helixtrans-58.8-51.3174.7165.80000110.5A108 L111 I112 A142 L143 L148 F149 S150A108-V146 HydrophobicContact CB-CG1 4.48Å; L111-V146 HydrophobicContact CB-CB 4.31Å; L111-V146 HydrophobicContact CB-CG1 3.48Å; L111-V146 VanDerWaalsContact CB-CG1 3.48Å; L111-V146 HydrophobicContact CB-CG2 3.93Å; L111-V146 HydrophobicContact CD1-CG1 4.08Å; L111-V146 HydrophobicContact CG-CG1 4.43Å; I112-V146 HydrophobicContact CG1-CG1 4.03Å; A142-V146 VanDerWaalsContact O-CG2 3.29Å; A142-V146 WeakPolarHBondContact O-CG2 3.11Å; A142-V146 PolarHBondContact O-N 2.78Å; L143-V146 PolarHBondContact O-N 3Å; V146-L148 PolarHBondContact O-N 2.83Å; V146-F149 PolarHBondContact O-N 3.31Å; V146-S150 WeakPolarHBondContact O-CB 3.47Å; V146-S150 PolarHBondContact O-N 3.23Å; V146-S150 PolarHBondContact O-OG 3.38Å; V146-S150 VanDerWaalsContact O-OG 3.1Å
147Y96.1Very high92.3Very high70 Ų7060.4 Ų60.428%0.27531%0.306SS..Hα-helixtrans-65.4-40.4178.9-66.2-56.5000112.5T64 F104 A108 I112 L143 F144 S150 L151T64-Y147 HydrophobicContact CG2-CE1 4.36Å; T64-Y147 PolarHBondContact OG1-OH 2.91Å; F104-Y147 AromaticContact CZ-CD1 3.93Å; F104-Y147 HydrophobicContact CZ-CD1 3.93Å; A108-Y147 HydrophobicContact CB-CD1 4.07Å; A108-Y147 HydrophobicContact CB-CE1 4.12Å; I112-Y147 HydrophobicContact CD1-CE1 4.47Å; L143-Y147 HydrophobicContact CB-CE2 4.23Å; L143-Y147 WeakPolarHBondContact O-CD2 3.33Å; L143-Y147 PolarHBondContact O-N 2.85Å; F144-Y147 PolarHBondContact O-N 2.89Å; Y147-S150 PolarHBondContact O-N 2.89Å; Y147-L151 WeakPolarHBondContact O-CB 3.36Å; Y147-L151 PolarHBondContact O-N 3.46Å
148L96.6Very high92.5Very high78 Ų7861.4 Ų61.441%0.40830%0.303SS..Hα-helixtrans-63.1-43.2178.2-178.363000111.7F144 F145 V146 S152F144-L148 HydrophobicContact CE1-CD2 4.12Å; F144-L148 HydrophobicContact CZ-CD2 4.4Å; F144-L148 WeakPolarHBondContact O-CB 3.2Å; F144-L148 PolarHBondContact O-N 3.42Å; F145-L148 PolarHBondContact O-N 3.27Å; V146-L148 PolarHBondContact O-N 2.83Å; L148-S152 WeakPolarHBondContact O-CB 3.23Å; L148-S152 PolarHBondContact O-N 3.43Å; L148-S152 PolarHBondContact O-OG 3.07Å
149F96.2Very high92.5Very high91 Ų9161.4 Ų61.440%0.39932%0.316SS..Hα-helixtrans-67.1-47.8177.6178.9-101.3000111.3L111 F145 V146 L151 S152 C153 L201L111-F149 HydrophobicContact CD1-CD1 3.66Å; L111-F149 HydrophobicContact CD1-CE1 4.18Å; F145-F149 WeakPolarHBondContact O-CB 3.37Å; F145-F149 PolarHBondContact O-N 3.32Å; V146-F149 PolarHBondContact O-N 3.31Å; F149-L151 VanDerWaalsContact C-N 3.3Å; F149-L151 PolarHBondContact O-N 3.14Å; F149-S152 WeakPolarHBondContact O-CB 3.31Å; F149-S152 PolarHBondContact O-N 2.96Å; F149-S152 VanDerWaalsContact O-N 3.16Å; F149-C153 PolarHBondContact O-N 3.47Å; F149-C153 PolarHBondContact O-SG 3.26Å; F149-L201 HydrophobicContact CE1-CD1 4.32Å; F149-L201 HydrophobicContact CE1-CD2 3.83Å; F149-L201 HydrophobicContact CZ-CD1 4.39Å; F149-L201 HydrophobicContact CZ-CD2 4.11Å
150S95.8Very high92.2Very high0 Ų063.5 Ų63.50%034%0.338CS..Hα-helixtrans-57.5-43.6175-65.60000112A108 L111 V146 Y147 S152 C153 C154A108-S150 WeakPolarHBondContact CA-OG 3.34Å; A108-S150 PolarHBondContact N-OG 2.87Å; L111-S150 WeakPolarHBondContact CD1-OG 3.46Å; V146-S150 WeakPolarHBondContact O-CB 3.47Å; V146-S150 PolarHBondContact O-N 3.23Å; V146-S150 PolarHBondContact O-OG 3.38Å; V146-S150 VanDerWaalsContact O-OG 3.1Å; Y147-S150 PolarHBondContact O-N 2.89Å; S150-S152 PolarHBondContact O-N 3.35Å; S150-C153 PolarHBondContact O-N 3.29Å; S150-C154 WeakPolarHBondContact O-CB 3.46Å; S150-C154 PolarHBondContact O-N 3.37Å; S150-C154 PolarHBondContact O-SG 3.22Å
151L95.4Very high92Very high67 Ų6760.7 Ų60.735%0.35132%0.324SS..Hα-helixtrans-60.3-47.1176.9179.963000110.9F100 F104 Y147 F149 C153 C154 L155F100-L151 HydrophobicContact CE2-CD1 4.07Å; F100-L151 HydrophobicContact CZ-CD1 3.65Å; F104-L151 HydrophobicContact CD2-CB 4.37Å; F104-L151 HydrophobicContact CE2-CB 3.95Å; Y147-L151 WeakPolarHBondContact O-CB 3.36Å; Y147-L151 PolarHBondContact O-N 3.46Å; F149-L151 VanDerWaalsContact C-N 3.3Å; F149-L151 PolarHBondContact O-N 3.14Å; L151-C153 PolarHBondContact O-N 3.32Å; L151-C154 PolarHBondContact O-N 3.28Å; L151-L155 HydrophobicContact CD1-CD1 3.89Å; L151-L155 HydrophobicContact CD1-CG 4.03Å; L151-L155 HydrophobicContact CG-CD1 3.84Å; L151-L155 HydrophobicContact CG-CG 4.36Å; L151-L155 WeakPolarHBondContact O-CB 3.48Å; L151-L155 VanDerWaalsContact O-CG 3.23Å; L151-L155 WeakPolarHBondContact O-CG 3.37Å; L151-L155 PolarHBondContact O-N 2.95Å
152S94.4Very high91.6Very high63 Ų6357.8 Ų57.844%0.44131%0.308SS..Hα-helixtrans-60.3-47.1179.9-57.80000111.4L148 F149 S150 L155L148-S152 WeakPolarHBondContact O-CB 3.23Å; L148-S152 PolarHBondContact O-N 3.43Å; L148-S152 PolarHBondContact O-OG 3.07Å; F149-S152 WeakPolarHBondContact O-CB 3.31Å; F149-S152 PolarHBondContact O-N 2.96Å; F149-S152 VanDerWaalsContact O-N 3.16Å; S150-S152 PolarHBondContact O-N 3.35Å; S152-L155 PolarHBondContact O-N 3.13Å
153C92.3Very high91.3Very high24 Ų2461.1 Ų61.116%0.16232%0.319CS..Hα-helixtrans-62.4-43.5177.3-68.30000112.3L107 F149 S150 L151 L155 L156 F194L107-C153 HydrophobicContact CD2-CB 3.9Å; F149-C153 PolarHBondContact O-N 3.47Å; F149-C153 PolarHBondContact O-SG 3.26Å; S150-C153 PolarHBondContact O-N 3.29Å; L151-C153 PolarHBondContact O-N 3.32Å; C153-L155 VanDerWaalsContact C-N 3.33Å; C153-L155 PolarHBondContact O-N 3Å; C153-L156 WeakPolarHBondContact O-CB 3.39Å; C153-L156 WeakPolarHBondContact O-CG 3.5Å; C153-L156 PolarHBondContact O-N 3.29Å; C153-F194 WeakPolarHBondContact O-CE2 3.39Å
154C91.8Very high91.1Very high1 Ų160.5 Ų60.51%0.00732%0.315CS..Hα-helixtrans-77.7-16.5-176.8-63.90000113.8F100 N103 F104 S150 L151 P157F100-C154 HydrophobicContact CD2-CB 3.68Å; F100-C154 WeakPolarHBondContact CD2-O 3.29Å; F100-C154 HydrophobicContact CE2-CB 3.66Å; N103-C154 VanDerWaalsContact C-SG 3.54Å; F104-C154 WeakPolarHBondContact CA-SG 3.48Å; F104-C154 HydrophobicContact CB-CB 4.27Å; F104-C154 PolarHBondContact N-SG 3.02Å; F104-C154 VanDerWaalsContact N-SG 3.4Å; S150-C154 WeakPolarHBondContact O-CB 3.46Å; S150-C154 PolarHBondContact O-N 3.37Å; S150-C154 PolarHBondContact O-SG 3.22Å; L151-C154 PolarHBondContact O-N 3.28Å; C154-P157 VanDerWaalsContact O-CD 3.31Å; C154-P157 WeakPolarHBondContact O-CD 3.5Å
155L92.7Very high90.6Very high77 Ų7755.1 Ų55.140%0.40329%0.291SS..Hα-helixtrans-79.8-19173.3-74.7174.9000113.4F100 L151 S152 C153 P157 F158F100-L155 HydrophobicContact CE2-CD2 3.91Å; F100-L155 HydrophobicContact CE2-CG 4.15Å; L151-L155 HydrophobicContact CD1-CD1 3.89Å; L151-L155 HydrophobicContact CD1-CG 4.03Å; L151-L155 HydrophobicContact CG-CD1 3.84Å; L151-L155 HydrophobicContact CG-CG 4.36Å; L151-L155 WeakPolarHBondContact O-CB 3.48Å; L151-L155 VanDerWaalsContact O-CG 3.23Å; L151-L155 WeakPolarHBondContact O-CG 3.37Å; L151-L155 PolarHBondContact O-N 2.95Å; S152-L155 PolarHBondContact O-N 3.13Å; C153-L155 VanDerWaalsContact C-N 3.33Å; C153-L155 PolarHBondContact O-N 3Å; L155-P157 VanDerWaalsContact C-CD 3.46Å; L155-F158 HydrophobicContact CD2-CD2 4.14Å; L155-F158 WeakPolarHBondContact O-CB 3.32Å; L155-F158 PolarHBondContact O-N 3.44Å
156L89.7Confident90.1Very high68 Ų6849.3 Ų49.336%0.35627%0.266SS..G310 helixtrans-52-41.5-178.9-69.4172.9000114.6C153 F158 S159 G160 Y161 F194C153-L156 WeakPolarHBondContact O-CB 3.39Å; C153-L156 WeakPolarHBondContact O-CG 3.5Å; C153-L156 PolarHBondContact O-N 3.29Å; L156-F158 VanDerWaalsContact C-N 3.25Å; L156-F158 PolarHBondContact O-N 3.25Å; L156-S159 PolarHBondContact O-N 2.86Å; L156-S159 VanDerWaalsContact O-N 3.08Å; L156-G160 PolarHBondContact O-N 2.92Å; L156-Y161 CarbonylContact C-O 3.57Å; L156-Y161 HydrophobicContact CB-CD1 4.1Å; L156-Y161 HydrophobicContact CD1-CD1 4.14Å; L156-Y161 PolarHBondContact O-N 3.12Å; L156-F194 HydrophobicContact CB-CD2 4.32Å; L156-F194 HydrophobicContact CB-CE2 4.13Å; L156-F194 HydrophobicContact CD1-CD2 4.4Å; L156-F194 HydrophobicContact CD1-CE2 4.32Å
157P87Confident89.5Confident16 Ų1648.6 Ų48.610%0.10426%0.261CS..G310 helixtrans-61.4-28.9176.6-26.838.3000114.2C154 L155 S159 G160 F164 F194C154-P157 VanDerWaalsContact O-CD 3.31Å; C154-P157 WeakPolarHBondContact O-CD 3.5Å; L155-P157 VanDerWaalsContact C-CD 3.46Å; P157-S159 VanDerWaalsContact C-N 3.3Å; P157-S159 PolarHBondContact O-N 3.17Å; P157-G160 PolarHBondContact O-N 2.89Å; P157-F164 HydrophobicContact CB-CD2 4.24Å; P157-F164 HydrophobicContact CB-CE2 3.77Å; P157-F164 HydrophobicContact CB-CZ 4.11Å; P157-F164 HydrophobicContact CG-CE1 4.41Å; P157-F164 HydrophobicContact CG-CE2 3.99Å; P157-F164 HydrophobicContact CG-CZ 3.79Å; P157-F194 HydrophobicContact CG-CD1 4.2Å; P157-F194 HydrophobicContact CG-CE1 3.59Å; P157-F194 HydrophobicContact CG-CE2 4.06Å; P157-F194 HydrophobicContact CG-CZ 3.52Å
158F87.6Confident88.5Confident110 Ų11045.9 Ų45.948%0.48225%0.252SS..G310 helixtrans-73.7-24177.1-64.2-82.7000112.6N96 F100 L155 L156 G160 F164N96-F158 HydrophobicContact CB-CE1 4.12Å; N96-F158 HydrophobicContact CB-CZ 4.42Å; F100-F158 HydrophobicContact CB-CE2 3.88Å; F100-F158 HydrophobicContact CB-CZ 4Å; F100-F158 AromaticContact CD2-CE2 3.77Å; F100-F158 HydrophobicContact CD2-CE2 3.77Å; F100-F158 HydrophobicContact CG-CE2 4.03Å; F100-F158 HydrophobicContact CG-CZ 4.44Å; L155-F158 HydrophobicContact CD2-CD2 4.14Å; L155-F158 WeakPolarHBondContact O-CB 3.32Å; L155-F158 PolarHBondContact O-N 3.44Å; L156-F158 VanDerWaalsContact C-N 3.25Å; L156-F158 PolarHBondContact O-N 3.25Å; F158-G160 VanDerWaalsContact C-N 3.26Å; F158-F164 HydrophobicContact CE2-CE2 4.04Å; F158-F164 HydrophobicContact CZ-CE2 4.23Å
159S86.6Confident87.5Confident107 Ų10742.7 Ų42.775%0.74824%0.236SC*.G310 helixtrans-85.23.3172.6-56.90000113L156 P157L156-S159 PolarHBondContact O-N 2.86Å; L156-S159 VanDerWaalsContact O-N 3.08Å; P157-S159 VanDerWaalsContact C-N 3.3Å; P157-S159 PolarHBondContact O-N 3.17Å
160G81.7Confident86.7Confident45 Ų4538.4 Ų38.446%0.46422%0.218SC..THydrogen-bonded Turntrans91.82.2-178.800000115.1L156 P157 F158 G162L156-G160 PolarHBondContact O-N 2.92Å; P157-G160 PolarHBondContact O-N 2.89Å; F158-G160 VanDerWaalsContact C-N 3.26Å; G160-G162 PolarHBondContact O-N 3.47Å
161Y83.5Confident86.1Confident80 Ų8038.7 Ų38.731%0.31422%0.22SC..SBendtrans-92.670.8174.9-167.1-88.9000110.1L156 L190 A193 F194L156-Y161 CarbonylContact C-O 3.57Å; L156-Y161 HydrophobicContact CB-CD1 4.1Å; L156-Y161 HydrophobicContact CD1-CD1 4.14Å; L156-Y161 PolarHBondContact O-N 3.12Å; Y161-L190 HydrophobicContact CD2-CB 4.45Å; Y161-L190 HydrophobicContact CD2-CD2 3.71Å; Y161-L190 HydrophobicContact CE2-CD2 3.78Å; Y161-A193 WeakPolarHBondContact OH-CB 3.44Å; Y161-F194 HydrophobicContact CD1-CB 3.85Å; Y161-F194 AromaticContact CD1-CD2 3.84Å; Y161-F194 HydrophobicContact CD1-CD2 3.84Å; Y161-F194 HydrophobicContact CD1-CG 4.25Å; Y161-F194 HydrophobicContact CE1-CB 3.81Å; Y161-F194 HydrophobicContact CE1-CD2 4.07Å; Y161-F194 HydrophobicContact CE1-CG 4.45Å; Y161-F194 WeakPolarHBondContact O-CG 3.33Å
162G84.3Confident85.5Confident7 Ų736.7 Ų36.77%0.07221%0.207CC..  trans119.4167.6-175.600000113.2G160G160-G162 PolarHBondContact O-N 3.47Å
163K85.9Confident85.2Confident89 Ų8933.7 Ų33.739%0.38719%0.186SC..  trans-142.7144176.5-169.3176.9178.8-177.40109.4D176 I191K163-D176 WeakPolarHBondContact O-CB 3.47Å; K163-D176 PolarHBondContact O-N 3Å; K163-I191 HydrophobicContact CB-CD1 4.08Å; K163-I191 HydrophobicContact CB-CG1 4.22Å
164F88.3Confident84.9Confident7 Ų732.6 Ų32.63%0.03118%0.179CC..EExtended strand (participates in β ladder)trans-89.6139.8167.7-62-66.9000110N96 G99 F100 P157 F158 F174 M175N96-F164 HydrophobicContact CB-CD2 4.19Å; N96-F164 WeakPolarHBondContact O-CD2 3.37Å; G99-F164 VanDerWaalsContact C-CE1 3.49Å; F100-F164 HydrophobicContact CB-CE2 4.16Å; F100-F164 HydrophobicContact CB-CZ 4.2Å; P157-F164 HydrophobicContact CB-CD2 4.24Å; P157-F164 HydrophobicContact CB-CE2 3.77Å; P157-F164 HydrophobicContact CB-CZ 4.11Å; P157-F164 HydrophobicContact CG-CE1 4.41Å; P157-F164 HydrophobicContact CG-CE2 3.99Å; P157-F164 HydrophobicContact CG-CZ 3.79Å; F158-F164 HydrophobicContact CE2-CE2 4.04Å; F158-F164 HydrophobicContact CZ-CE2 4.23Å; F164-F174 CarbonylContact C-O 3.33Å; F164-F174 WeakPolarHBondContact CA-O 3.4Å; F164-M175 HydrophobicContact CD1-CB 4.22Å; F164-M175 HydrophobicContact CE1-CB 4.23Å
165R85.8Confident84.7Confident16 Ų1632.6 Ų32.66%0.0618%0.179CC..EExtended strand (participates in β ladder)trans-131144.4-177.3171163.8175.2-173.1-7.1110.3H8 Y167 C173 F174 D176 D179H8-R165 WeakPolarHBondContact ND1-CG 3.12Å; H8-R165 PolarHBondContact ND1-NE 2.94Å; R165-Y167 WeakPolarHBondContact O-CD2 3.43Å; R165-C173 WeakPolarHBondContact O-CA 3.46Å; R165-F174 PolarHBondContact N-O 3.24Å; R165-F174 PolarHBondContact O-N 3.44Å; R165-F174 VanDerWaalsContact O-O 3.09Å; R165-D176 HydrophobicContact CB-CB 3.99Å; R165-D179 IonicContact CZ-OD2 3.68Å; R165-D179 VanDerWaalsContact NH1-CG 3.32Å; R165-D179 IonicContact NH1-OD2 3.63Å; R165-D179 PolarHBondContact NH1-OD2 2.98Å; R165-D179 IonicContact NH2-OD2 2.97Å; R165-D179 PolarHBondContact NH2-OD2 2.89Å
166Q85.2Confident84.3Confident0 Ų030 Ų300%017%0.165CC..EExtended strand (participates in β ladder)trans-77133.4171.4-175.5174.539.300111.5C7 Q10 S85 I87 G170 W172C7-Q166 PolarHBondContact O-OE1 2.89Å; Q10-Q166 PolarHBondContact O-OE1 3.33Å; S85-Q166 PolarHBondContact OG-NE2 3.47Å; I87-Q166 HydrophobicContact CD1-CB 3.92Å; I87-Q166 HydrophobicContact CG1-CB 4.4Å; Q166-G170 PolarHBondContact NE2-O 3.42Å; Q166-W172 WeakPolarHBondContact CA-O 3.39Å
167Y82Confident83.5Confident5 Ų527.1 Ų27.12%0.0215%0.15CC..EExtended strand (participates in β ladder)trans-112.9154.1177.1-73.6-88.7000111.3R165 G170 W172 F174 M175 M177 N293 F297R165-Y167 WeakPolarHBondContact O-CD2 3.43Å; Y167-G170 WeakPolarHBondContact O-CA 3.44Å; Y167-G170 PolarHBondContact O-N 3.42Å; Y167-W172 PolarHBondContact N-O 3.23Å; Y167-F174 HydrophobicContact CD2-CB 3.93Å; Y167-F174 HydrophobicContact CE2-CB 3.8Å; Y167-M175 PolarHBondContact OH-O 3.33Å; Y167-M177 PolarHBondContact OH-N 3.49Å; Y167-N293 HydrophobicContact CD1-CB 4.28Å; Y167-N293 HydrophobicContact CE1-CB 4.2Å; Y167-F297 AromaticContact CD1-CE2 3.69Å; Y167-F297 HydrophobicContact CD1-CE2 3.69Å; Y167-F297 HydrophobicContact CD1-CZ 4.26Å; Y167-F297 AromaticContact CD2-CE2 3.71Å; Y167-F297 HydrophobicContact CD2-CE2 3.71Å; Y167-F297 AromaticContact CD2-CZ 3.92Å; Y167-F297 HydrophobicContact CD2-CZ 3.92Å; Y167-F297 HydrophobicContact CE1-CE2 4.01Å; Y167-F297 HydrophobicContact CE1-CZ 4.14Å; Y167-F297 HydrophobicContact CE2-CE2 4.05Å; Y167-F297 AromaticContact CE2-CZ 3.81Å; Y167-F297 HydrophobicContact CE2-CZ 3.81Å; Y167-F297 AromaticContact CG-CE2 3.52Å; Y167-F297 HydrophobicContact CG-CE2 3.52Å; Y167-F297 HydrophobicContact CG-CZ 4.15Å; Y167-F297 AromaticContact CZ-CZ 3.91Å
168C76.8Confident82.4Confident13 Ų1327.1 Ų27.19%0.08815%0.153CC..THydrogen-bonded Turntrans-60.3140.1176.9-67.30000112.2S5 C7 D290 F294S5-C168 PolarHBondContact O-SG 3.49Å; C7-C168 HydrophobicContact CB-CB 3.95Å; C7-C168 WeakPolarHBondContact CB-SG 3.42Å; C7-C168 PolarHBondContact N-SG 3Å; C7-C168 VanDerWaalsContact N-SG 3.44Å; C7-C168 WeakPolarHBondContact SG-CA 3.43Å; C7-C168 WeakPolarHBondContact SG-CB 3.48Å; C7-C168 CovalentContact SG-SG 2.03Å; C7-C168 PolarHBondContact SG-SG 3.21Å; C168-D290 HydrophobicContact CB-CB 3.95Å; C168-F294 WeakPolarHBondContact O-CD2 3.37Å; C168-F294 WeakPolarHBondContact O-CG 3.46Å
169P75Confident80.8Confident10 Ų1023.7 Ų23.77%0.06514%0.14CC..THydrogen-bonded Turncis-88.217.410.138.2-39.9000114.9I13 V14 F294I13-P169 VanDerWaalsContact CA-O 3.29Å; I13-P169 WeakPolarHBondContact CA-O 3.46Å; I13-P169 HydrophobicContact CG2-CB 3.93Å; I13-P169 HydrophobicContact CG2-CG 4.44Å; I13-P169 WeakPolarHBondContact CG2-O 3.41Å; V14-P169 PolarHBondContact N-O 3.03Å; V14-P169 WeakPolarHBondContact O-CB 3.22Å; P169-F294 HydrophobicContact CG-CZ 4.35Å
170G80Confident79.1Confident2 Ų222.3 Ų22.32%0.02114%0.135CC..THydrogen-bonded Turntrans99.6-1.9-179.100000114.2S85 L86 Q166 Y167 W172S85-G170 CarbonylContact C-O 3.58Å; S85-G170 WeakPolarHBondContact CA-O 3.25Å; L86-G170 PolarHBondContact N-O 3Å; Q166-G170 PolarHBondContact NE2-O 3.42Å; Y167-G170 WeakPolarHBondContact O-CA 3.44Å; Y167-G170 PolarHBondContact O-N 3.42Å; G170-W172 VanDerWaalsContact C-N 3.29Å
171T81.7Confident77.3Confident6 Ų625.9 Ų25.94%0.03715%0.15CC..THydrogen-bonded Turntrans-90.87.5174.955.90000113I13 C79 Y80 L86I13-T171 HydrophobicContact CD1-CG2 3.51Å; I13-T171 HydrophobicContact CG1-CG2 3.94Å; C79-T171 HydrophobicContact CB-CG2 3.97Å; Y80-T171 HydrophobicContact CD2-CG2 4.27Å; Y80-T171 HydrophobicContact CE1-CG2 4.2Å; Y80-T171 HydrophobicContact CE2-CG2 3.88Å; L86-T171 WeakPolarHBondContact CD1-O 3.38Å
172W83Confident75.6Confident24 Ų2424.9 Ų24.99%0.09116%0.164CC..EExtended strand (participates in β ladder)trans-141.4135.5-173.9-136.822.9000113.1F98 Q166 Y167 G170 F294 F297 S301F98-W172 AromaticContact CE1-CD1 3.1Å; F98-W172 HydrophobicContact CE1-CG 4.25Å; F98-W172 AromaticContact CE1-NE1 3.43Å; F98-W172 AromaticContact CZ-CD1 3.36Å; F98-W172 AromaticContact CZ-NE1 3.64Å; Q166-W172 WeakPolarHBondContact CA-O 3.39Å; Y167-W172 PolarHBondContact N-O 3.23Å; G170-W172 VanDerWaalsContact C-N 3.29Å; W172-F294 AromaticContact CE3-CD2 3.99Å; W172-F294 HydrophobicContact CE3-CD2 3.99Å; W172-F294 AromaticContact CE3-CE2 3.97Å; W172-F294 HydrophobicContact CE3-CE2 3.97Å; W172-F294 HydrophobicContact CZ3-CD2 4.31Å; W172-F294 HydrophobicContact CZ3-CE2 4.27Å; W172-F297 HydrophobicContact CD2-CB 4.39Å; W172-F297 HydrophobicContact CE3-CB 3.47Å; W172-F297 VanDerWaalsContact CE3-CB 3.47Å; W172-F297 HydrophobicContact CE3-CD2 4.06Å; W172-F297 HydrophobicContact CE3-CG 4.06Å; W172-F297 HydrophobicContact CH2-CB 3.27Å; W172-F297 HydrophobicContact CH2-CG 4.38Å; W172-F297 WeakPolarHBondContact CH2-O 3.25Å; W172-F297 HydrophobicContact CZ2-CB 4.14Å; W172-F297 VanDerWaalsContact CZ3-C 3.48Å; W172-F297 HydrophobicContact CZ3-CB 2.91Å; W172-F297 HydrophobicContact CZ3-CD2 4.36Å; W172-F297 AromaticContact CZ3-CG 3.96Å; W172-F297 HydrophobicContact CZ3-CG 3.96Å; W172-S301 WeakPolarHBondContact CH2-OG 3.43Å; W172-S301 WeakPolarHBondContact CZ2-OG 3.47Å
173C88.7Confident73.7Confident0 Ų030.1 Ų30.10%020%0.195CC..EExtended strand (participates in β ladder)trans-123.9131176-70.20000109.1L86 C95 F98 G99 R165L86-C173 HydrophobicContact CD2-CB 4.35Å; C95-C173 WeakPolarHBondContact CA-SG 3.26Å; C95-C173 HydrophobicContact CB-CB 4.06Å; C95-C173 WeakPolarHBondContact CB-SG 3.37Å; C95-C173 VanDerWaalsContact O-CB 3.26Å; C95-C173 WeakPolarHBondContact O-CB 3.19Å; C95-C173 WeakPolarHBondContact SG-CB 3.32Å; C95-C173 CovalentContact SG-SG 2.03Å; C95-C173 PolarHBondContact SG-SG 3.01Å; F98-C173 HydrophobicContact CD1-CB 4.01Å; G99-C173 WeakPolarHBondContact CA-O 3.46Å; R165-C173 WeakPolarHBondContact O-CA 3.46Å
174F86.8Confident72Confident2 Ų236.9 Ų36.91%0.00922%0.218CC..EExtended strand (participates in β ladder)trans-141.5169.9-179.6-162.1-101.4000109.6V102 N103 F164 R165 Y167 D176 M177 Y198 L275 F297V102-F174 HydrophobicContact CB-CD2 4.45Å; V102-F174 HydrophobicContact CG1-CD2 3.79Å; V102-F174 HydrophobicContact CG1-CE2 3.83Å; N103-F174 WeakPolarHBondContact OD1-CE2 3.4Å; N103-F174 WeakPolarHBondContact OD1-CZ 3.4Å; F164-F174 CarbonylContact C-O 3.33Å; F164-F174 WeakPolarHBondContact CA-O 3.4Å; R165-F174 PolarHBondContact N-O 3.24Å; R165-F174 PolarHBondContact O-N 3.44Å; R165-F174 VanDerWaalsContact O-O 3.09Å; Y167-F174 HydrophobicContact CD2-CB 3.93Å; Y167-F174 HydrophobicContact CE2-CB 3.8Å; F174-D176 PolarHBondContact O-N 3.02Å; F174-M177 HydrophobicContact CD1-CE 3.54Å; F174-M177 HydrophobicContact CE1-CE 3.37Å; F174-M177 HydrophobicContact CZ-CE 4.49Å; F174-Y198 HydrophobicContact CZ-CE1 4.16Å; F174-L275 HydrophobicContact CE1-CD1 4.42Å; F174-L275 HydrophobicContact CZ-CD1 4.48Å; F174-L275 HydrophobicContact CZ-CD2 4.12Å; F174-F297 HydrophobicContact CB-CE1 3.92Å; F174-F297 HydrophobicContact CB-CZ 3.82Å; F174-F297 HydrophobicContact CD1-CD1 4.4Å; F174-F297 AromaticContact CD1-CE1 3.35Å; F174-F297 HydrophobicContact CD1-CE1 3.35Å; F174-F297 AromaticContact CD1-CZ 3.76Å; F174-F297 HydrophobicContact CD1-CZ 3.76Å; F174-F297 HydrophobicContact CD2-CE1 4.13Å; F174-F297 AromaticContact CE1-CE1 3.82Å; F174-F297 HydrophobicContact CE1-CE1 3.82Å; F174-F297 HydrophobicContact CG-CD1 4.3Å; F174-F297 AromaticContact CG-CE1 3.51Å; F174-F297 HydrophobicContact CG-CE1 3.51Å; F174-F297 AromaticContact CG-CZ 3.91Å; F174-F297 HydrophobicContact CG-CZ 3.91Å; F174-F297 HydrophobicContact CZ-CE1 4.39Å
175M87.2Confident70.9Confident1 Ų143 Ų431%0.00525%0.247CC..EExtended strand (participates in β ladder)trans-61.3138.5175.250-174.7-77.300110.5N103 F164 Y167 M177 F194 Y198N103-M175 PolarHBondContact OD1-SD 2.97Å; F164-M175 HydrophobicContact CD1-CB 4.22Å; F164-M175 HydrophobicContact CE1-CB 4.23Å; Y167-M175 PolarHBondContact OH-O 3.33Å; M175-M177 PolarHBondContact O-N 3.43Å; M175-M177 VanDerWaalsContact O-N 3.12Å; M175-F194 HydrophobicContact CB-CD1 4.28Å; M175-F194 HydrophobicContact CB-CE1 3.73Å; M175-F194 HydrophobicContact CE-CD1 3.78Å; M175-F194 HydrophobicContact CE-CE1 3.69Å; M175-F194 HydrophobicContact CE-CZ 4.47Å; M175-F194 HydrophobicContact CG-CE1 4.42Å; M175-F194 HydrophobicContact SD-CE1 3.86Å; M175-F194 HydrophobicContact SD-CZ 4.4Å; M175-Y198 VanDerWaalsContact CE-CB 3.41Å; M175-Y198 HydrophobicContact CE-CD1 3.86Å; M175-Y198 HydrophobicContact CE-CG 3.75Å; M175-Y198 HydrophobicContact SD-CD1 3.35Å; M175-Y198 WeakPolarHBondContact SD-CD1 3.23Å; M175-Y198 HydrophobicContact SD-CD2 4Å; M175-Y198 HydrophobicContact SD-CE1 3.82Å; M175-Y198 HydrophobicContact SD-CE2 4.41Å; M175-Y198 HydrophobicContact SD-CG 3.45Å
176D83.4Confident70Confident22 Ų2248.3 Ų48.312%0.11827%0.272CS..  trans-66.8111.7-175.9-166.2-16.3000110.1K163 R165 F174 G178 I191K163-D176 WeakPolarHBondContact O-CB 3.47Å; K163-D176 PolarHBondContact O-N 3Å; R165-D176 HydrophobicContact CB-CB 3.99Å; F174-D176 PolarHBondContact O-N 3.02Å; D176-G178 PolarHBondContact O-N 3.14Å; D176-G178 PolarHBondContact OD1-N 2.98Å; D176-I191 HydrophobicContact CB-CG2 3.85Å
177M74.1Confident69.3Low7 Ų757 Ų573%0.03431%0.305CS..  trans-80.63.7178.5-64.8-172.3-164.200113.8Y167 F174 M175 L275 N282 F297Y167-M177 PolarHBondContact OH-N 3.49Å; F174-M177 HydrophobicContact CD1-CE 3.54Å; F174-M177 HydrophobicContact CE1-CE 3.37Å; F174-M177 HydrophobicContact CZ-CE 4.49Å; M175-M177 PolarHBondContact O-N 3.43Å; M175-M177 VanDerWaalsContact O-N 3.12Å; M177-L275 HydrophobicContact CE-CD1 3.62Å; M177-N282 HydrophobicContact CB-CB 3.99Å; M177-N282 WeakPolarHBondContact O-CB 3.37Å; M177-F297 HydrophobicContact CE-CD1 4.43Å; M177-F297 HydrophobicContact CE-CE1 3.32Å; M177-F297 HydrophobicContact CE-CZ 3.65Å
178G62.6Low68.9Low17 Ų1758.7 Ų58.718%0.17532%0.324CS..  trans88.386.4172.300000112.7D176 A180D176-G178 PolarHBondContact O-N 3.14Å; D176-G178 PolarHBondContact OD1-N 2.98Å; G178-A180 PolarHBondContact O-N 3.39Å
179D55.2Low69.1Low37 Ų3763.6 Ų63.620%0.19834%0.344CS..  trans-77.8103.5143.9-80.1-20.9000106K6 R165 P181K6-D179 IonicContact NZ-OD2 3.7Å; R165-D179 IonicContact CZ-OD2 3.68Å; R165-D179 VanDerWaalsContact NH1-CG 3.32Å; R165-D179 IonicContact NH1-OD2 3.63Å; R165-D179 PolarHBondContact NH1-OD2 2.98Å; R165-D179 IonicContact NH2-OD2 2.97Å; R165-D179 PolarHBondContact NH2-OD2 2.89Å; D179-P181 WeakPolarHBondContact O-CD 3.28Å
180A50.4Low69.5Low79 Ų7966.2 Ų66.265%0.65336%0.357SS*.PPolyproline II helixtrans-64.5116.2176.600000110.6G178 P286G178-A180 PolarHBondContact O-N 3.39Å; A180-P286 HydrophobicContact CB-CG 4.25Å
181P44Very low69.6Low119 Ų11967.8 Ų67.877%0.77337%0.365SS*.PPolyproline II helixtrans-78137.2146.38.413.5000106.2D179D179-P181 WeakPolarHBondContact O-CD 3.28Å
182G46.6Very low69.7Low59 Ų5970.7 Ų70.761%0.60838%0.379SS*.PPolyproline II helixtrans-50.7154.5175.700000112.1
183T45Very low69.8Low118 Ų11871.1 Ų71.172%0.72439%0.388SS*.SBendtrans73.1110.3149.454.20000118.7E185T183-E185 PolarHBondContact O-N 2.98Å
184W51.4Low69.8Low231 Ų23171.4 Ų71.488%0.87539%0.389SS*.  trans67.422.5139.3-47119.1000121.9
185E64.2Low69.7Low134 Ų13471.3 Ų71.363%0.62639%0.389SS*.  trans-103.6124.4169-143.3174.7-175.300111.8T183 R187 G188T183-E185 PolarHBondContact O-N 2.98Å; E185-R187 PolarHBondContact O-N 3.25Å; E185-R187 VanDerWaalsContact O-N 3.09Å; E185-G188 PolarHBondContact O-N 3.28Å
186E67.8Low69.7Low129 Ų12974 Ų7460%0.60340%0.403SS*.Hα-helixtrans-53.3-31.3178.1-74.2-63.5121.800112.5G188 K189 L190E186-G188 PolarHBondContact O-N 3.49Å; E186-K189 PolarHBondContact O-N 3.06Å; E186-K189 IonicContact OE1-NZ 2.76Å; E186-K189 PolarHBondContact OE1-NZ 2.89Å; E186-L190 PolarHBondContact O-N 2.94Å
187R68.9Low70Confident182 Ų18275.4 Ų75.469%0.68742%0.415SS*.Hα-helixtrans-64.6-35175.8-74.8-175.1-178.81741.7113.7E185 K189 L190 I191E185-R187 PolarHBondContact O-N 3.25Å; E185-R187 VanDerWaalsContact O-N 3.09Å; R187-K189 VanDerWaalsContact C-N 3.35Å; R187-L190 PolarHBondContact O-N 3.31Å; R187-I191 WeakPolarHBondContact O-CG1 3.44Å; R187-I191 PolarHBondContact O-N 3.22Å
188G74.2Confident70.8Confident40 Ų4075.6 Ų75.641%0.41242%0.415SS..Hα-helixtrans-66.7-37.2179.300000112.4E185 E186 I191 L192E185-G188 PolarHBondContact O-N 3.28Å; E186-G188 PolarHBondContact O-N 3.49Å; G188-I191 PolarHBondContact O-N 2.91Å; G188-L192 PolarHBondContact O-N 2.86Å; G188-L192 VanDerWaalsContact O-N 3.1Å
189K80.6Confident72Confident116 Ų11675.1 Ų75.150%0.50441%0.409SS..Hα-helixtrans-63.5-41.9175.5-64.1176.8-173.2163.60111.8E186 R187 L192 A193E186-K189 PolarHBondContact O-N 3.06Å; E186-K189 IonicContact OE1-NZ 2.76Å; E186-K189 PolarHBondContact OE1-NZ 2.89Å; R187-K189 VanDerWaalsContact C-N 3.35Å; K189-L192 PolarHBondContact O-N 3.25Å; K189-A193 VanDerWaalsContact O-CB 3.24Å; K189-A193 WeakPolarHBondContact O-CB 3.31Å; K189-A193 PolarHBondContact O-N 3.36Å
190L83.9Confident73.7Confident65 Ų6576.1 Ų76.134%0.3442%0.419SS..Hα-helixtrans-66.4-38.3178.9-63.1175.3000112.3Y161 E186 R187 A193 F194Y161-L190 HydrophobicContact CD2-CB 4.45Å; Y161-L190 HydrophobicContact CD2-CD2 3.71Å; Y161-L190 HydrophobicContact CE2-CD2 3.78Å; E186-L190 PolarHBondContact O-N 2.94Å; R187-L190 PolarHBondContact O-N 3.31Å; L190-A193 PolarHBondContact O-N 2.87Å; L190-F194 WeakPolarHBondContact O-CB 3.32Å; L190-F194 PolarHBondContact O-N 3.16Å
191I83Confident75.7Confident36 Ų3674.1 Ų74.119%0.18540%0.397CS..Hα-helixtrans-63.2-47.8175.3-67.1166.8000110.8K163 D176 R187 G188 F194 S195K163-I191 HydrophobicContact CB-CD1 4.08Å; K163-I191 HydrophobicContact CB-CG1 4.22Å; D176-I191 HydrophobicContact CB-CG2 3.85Å; R187-I191 WeakPolarHBondContact O-CG1 3.44Å; R187-I191 PolarHBondContact O-N 3.22Å; G188-I191 PolarHBondContact O-N 2.91Å; I191-F194 PolarHBondContact O-N 2.99Å; I191-S195 PolarHBondContact O-N 2.99Å
192L82.5Confident77.9Confident66 Ų6668.6 Ų68.635%0.34636%0.361SS..Hα-helixtrans-63.6-43.1177.3-178.662.5000111.8G188 K189 F194 S195 L196 A283G188-L192 PolarHBondContact O-N 2.86Å; G188-L192 VanDerWaalsContact O-N 3.1Å; K189-L192 PolarHBondContact O-N 3.25Å; L192-F194 VanDerWaalsContact C-N 3.35Å; L192-F194 PolarHBondContact O-N 3.43Å; L192-S195 PolarHBondContact O-N 2.95Å; L192-L196 HydrophobicContact CD1-CD1 4.14Å; L192-L196 HydrophobicContact CD1-CG 4.23Å; L192-L196 HydrophobicContact CG-CD1 3.96Å; L192-L196 HydrophobicContact CG-CG 4.46Å; L192-L196 WeakPolarHBondContact O-CB 3.29Å; L192-L196 WeakPolarHBondContact O-CG 3.42Å; L192-L196 PolarHBondContact O-N 2.95Å; L192-A283 HydrophobicContact CD1-CB 3.81Å
193A86.2Confident80Confident34 Ų3467.1 Ų67.128%0.28134%0.343SS..Hα-helixtrans-63.1-41.1178.700000111.8Y161 K189 L190 S197Y161-A193 WeakPolarHBondContact OH-CB 3.44Å; K189-A193 VanDerWaalsContact O-CB 3.24Å; K189-A193 WeakPolarHBondContact O-CB 3.31Å; K189-A193 PolarHBondContact O-N 3.36Å; L190-A193 PolarHBondContact O-N 2.87Å; A193-S197 WeakPolarHBondContact O-CB 3.33Å; A193-S197 PolarHBondContact O-N 3.44Å; A193-S197 PolarHBondContact O-OG 2.94Å; A193-S197 VanDerWaalsContact O-OG 3.1Å
194F86.9Confident82.3Confident5 Ų566.3 Ų66.32%0.02233%0.334CS..Hα-helixtrans-61.4-49172.4-179.4-111.1000111.3C153 L156 P157 Y161 M175 L190 I191 L192 L196 S197 Y198C153-F194 WeakPolarHBondContact O-CE2 3.39Å; L156-F194 HydrophobicContact CB-CD2 4.32Å; L156-F194 HydrophobicContact CB-CE2 4.13Å; L156-F194 HydrophobicContact CD1-CD2 4.4Å; L156-F194 HydrophobicContact CD1-CE2 4.32Å; P157-F194 HydrophobicContact CG-CD1 4.2Å; P157-F194 HydrophobicContact CG-CE1 3.59Å; P157-F194 HydrophobicContact CG-CE2 4.06Å; P157-F194 HydrophobicContact CG-CZ 3.52Å; Y161-F194 HydrophobicContact CD1-CB 3.85Å; Y161-F194 AromaticContact CD1-CD2 3.84Å; Y161-F194 HydrophobicContact CD1-CD2 3.84Å; Y161-F194 HydrophobicContact CD1-CG 4.25Å; Y161-F194 HydrophobicContact CE1-CB 3.81Å; Y161-F194 HydrophobicContact CE1-CD2 4.07Å; Y161-F194 HydrophobicContact CE1-CG 4.45Å; Y161-F194 WeakPolarHBondContact O-CG 3.33Å; M175-F194 HydrophobicContact CB-CD1 4.28Å; M175-F194 HydrophobicContact CB-CE1 3.73Å; M175-F194 HydrophobicContact CE-CD1 3.78Å; M175-F194 HydrophobicContact CE-CE1 3.69Å; M175-F194 HydrophobicContact CE-CZ 4.47Å; M175-F194 HydrophobicContact CG-CE1 4.42Å; M175-F194 HydrophobicContact SD-CE1 3.86Å; M175-F194 HydrophobicContact SD-CZ 4.4Å; L190-F194 WeakPolarHBondContact O-CB 3.32Å; L190-F194 PolarHBondContact O-N 3.16Å; I191-F194 PolarHBondContact O-N 2.99Å; L192-F194 VanDerWaalsContact C-N 3.35Å; L192-F194 PolarHBondContact O-N 3.43Å; F194-L196 PolarHBondContact O-N 3.39Å; F194-S197 WeakPolarHBondContact CA-OG 3.38Å; F194-S197 PolarHBondContact O-N 3.41Å; F194-S197 PolarHBondContact O-OG 3.44Å; F194-Y198 PolarHBondContact O-N 2.97Å
195S86.5Confident84.2Confident1 Ų156 Ų561%0.00730%0.296CS..Hα-helixtrans-57-51.7178.8-167.90000113.1I191 L192 S197 Y198 S199I191-S195 PolarHBondContact O-N 2.99Å; L192-S195 PolarHBondContact O-N 2.95Å; S195-S197 PolarHBondContact O-N 2.98Å; S195-Y198 PolarHBondContact O-N 3.43Å; S195-S199 PolarHBondContact O-N 2.94Å; S195-S199 PolarHBondContact O-OG 3.28Å
196L86.6Confident85.3Confident57 Ų5750.1 Ų50.130%0.29827%0.269SS..Hα-helixtrans-60.2-46.3175.8-79.3173.1000112.3L192 F194 Y198 S199 S200 F280 A283L192-L196 HydrophobicContact CD1-CD1 4.14Å; L192-L196 HydrophobicContact CD1-CG 4.23Å; L192-L196 HydrophobicContact CG-CD1 3.96Å; L192-L196 HydrophobicContact CG-CG 4.46Å; L192-L196 WeakPolarHBondContact O-CB 3.29Å; L192-L196 WeakPolarHBondContact O-CG 3.42Å; L192-L196 PolarHBondContact O-N 2.95Å; F194-L196 PolarHBondContact O-N 3.39Å; L196-Y198 VanDerWaalsContact C-N 3.31Å; L196-Y198 PolarHBondContact O-N 2.9Å; L196-S199 PolarHBondContact O-N 3.45Å; L196-S200 VanDerWaalsContact O-CB 3.32Å; L196-S200 WeakPolarHBondContact O-CB 3.37Å; L196-S200 PolarHBondContact O-N 3.29Å; L196-S200 PolarHBondContact O-OG 2.96Å; L196-S200 VanDerWaalsContact O-OG 3.06Å; L196-F280 HydrophobicContact CD2-CD1 4.27Å; L196-A283 HydrophobicContact CD1-CB 4.28Å; L196-A283 HydrophobicContact CD2-CB 3.34Å; L196-A283 HydrophobicContact CG-CB 3.82Å
197S90Very high86.4Confident52 Ų5250.1 Ų50.136%0.36427%0.267SS..Hα-helixtrans-60.7-41.3-179.569.30000112.2A193 F194 S195 L201A193-S197 WeakPolarHBondContact O-CB 3.33Å; A193-S197 PolarHBondContact O-N 3.44Å; A193-S197 PolarHBondContact O-OG 2.94Å; A193-S197 VanDerWaalsContact O-OG 3.1Å; F194-S197 WeakPolarHBondContact CA-OG 3.38Å; F194-S197 PolarHBondContact O-N 3.41Å; F194-S197 PolarHBondContact O-OG 3.44Å; S195-S197 PolarHBondContact O-N 2.98Å; S197-L201 VanDerWaalsContact O-CB 3.26Å; S197-L201 WeakPolarHBondContact O-CB 3.33Å; S197-L201 PolarHBondContact O-N 3.36Å
198Y89.8Confident87.4Confident11 Ų1143.4 Ų43.44%0.04325%0.246CC..Hα-helixtrans-68.4-43.6177.1-174.5-94.3000111.9L107 F174 M175 F194 S195 L196 L201 N202L107-Y198 HydrophobicContact CB-CE2 4.13Å; L107-Y198 HydrophobicContact CD1-CE2 4.46Å; L107-Y198 HydrophobicContact CD2-CE2 4.18Å; L107-Y198 HydrophobicContact CG-CE2 4.49Å; F174-Y198 HydrophobicContact CZ-CE1 4.16Å; M175-Y198 VanDerWaalsContact CE-CB 3.41Å; M175-Y198 HydrophobicContact CE-CD1 3.86Å; M175-Y198 HydrophobicContact CE-CG 3.75Å; M175-Y198 HydrophobicContact SD-CD1 3.35Å; M175-Y198 WeakPolarHBondContact SD-CD1 3.23Å; M175-Y198 HydrophobicContact SD-CD2 4Å; M175-Y198 HydrophobicContact SD-CE1 3.82Å; M175-Y198 HydrophobicContact SD-CE2 4.41Å; M175-Y198 HydrophobicContact SD-CG 3.45Å; F194-Y198 PolarHBondContact O-N 2.97Å; S195-Y198 PolarHBondContact O-N 3.43Å; L196-Y198 VanDerWaalsContact C-N 3.31Å; L196-Y198 PolarHBondContact O-N 2.9Å; Y198-L201 PolarHBondContact O-N 2.97Å; Y198-N202 VanDerWaalsContact CD1-ND2 3.34Å; Y198-N202 WeakPolarHBondContact CD1-ND2 3.43Å; Y198-N202 WeakPolarHBondContact CE1-ND2 3.3Å; Y198-N202 VanDerWaalsContact CZ-ND2 3.33Å; Y198-N202 PolarHBondContact O-N 2.98Å; Y198-N202 PolarHBondContact O-ND2 3.42Å
199S89.3Confident88Confident7 Ų741.6 Ų41.65%0.04923%0.227CC..Hα-helixtrans-63.5-43.7175.8-66.30000112S195 L196 N202 A203 G279S195-S199 PolarHBondContact O-N 2.94Å; S195-S199 PolarHBondContact O-OG 3.28Å; L196-S199 PolarHBondContact O-N 3.45Å; S199-N202 PolarHBondContact O-N 3.3Å; S199-A203 WeakPolarHBondContact O-CB 3.39Å; S199-A203 PolarHBondContact O-N 3.38Å; S199-G279 WeakPolarHBondContact OG-CA 3.27Å
200S90.6Very high88.3Confident57 Ų5742.3 Ų42.340%0.39923%0.23SC..Hα-helixtrans-62.9-41.3175.3-65.90000112.4L196 A203 L204L196-S200 VanDerWaalsContact O-CB 3.32Å; L196-S200 WeakPolarHBondContact O-CB 3.37Å; L196-S200 PolarHBondContact O-N 3.29Å; L196-S200 PolarHBondContact O-OG 2.96Å; L196-S200 VanDerWaalsContact O-OG 3.06Å; S200-A203 PolarHBondContact O-N 2.96Å; S200-L204 WeakPolarHBondContact O-CB 3.16Å; S200-L204 PolarHBondContact O-N 3.02Å
201L92.6Very high88.5Confident37 Ų3742.7 Ų42.719%0.19424%0.235CC..Hα-helixtrans-61.8-48.9175.5177.262.7000111.4L107 F149 S197 Y198 A203 L204 L205L107-L201 HydrophobicContact CD1-CD2 3.75Å; L107-L201 HydrophobicContact CD1-CG 4.25Å; L107-L201 HydrophobicContact CD2-CD2 4.07Å; F149-L201 HydrophobicContact CE1-CD1 4.32Å; F149-L201 HydrophobicContact CE1-CD2 3.83Å; F149-L201 HydrophobicContact CZ-CD1 4.39Å; F149-L201 HydrophobicContact CZ-CD2 4.11Å; S197-L201 VanDerWaalsContact O-CB 3.26Å; S197-L201 WeakPolarHBondContact O-CB 3.33Å; S197-L201 PolarHBondContact O-N 3.36Å; Y198-L201 PolarHBondContact O-N 2.97Å; L201-A203 VanDerWaalsContact C-N 3.34Å; L201-A203 PolarHBondContact O-N 3.02Å; L201-L204 PolarHBondContact O-N 3Å; L201-L205 HydrophobicContact CD1-CD1 4.23Å; L201-L205 HydrophobicContact CD1-CG 4.45Å; L201-L205 HydrophobicContact CG-CD1 4.16Å; L201-L205 VanDerWaalsContact O-CG 3.27Å; L201-L205 WeakPolarHBondContact O-CG 3.35Å; L201-L205 PolarHBondContact O-N 3.03Å
202N89.8Confident88.6Confident4 Ų441.5 Ų41.52%0.02123%0.23CC..Hα-helixtrans-62.2-41.4176.9-80-81.8000111.9Y198 S199 L204 L205 I206Y198-N202 VanDerWaalsContact CD1-ND2 3.34Å; Y198-N202 WeakPolarHBondContact CD1-ND2 3.43Å; Y198-N202 WeakPolarHBondContact CE1-ND2 3.3Å; Y198-N202 VanDerWaalsContact CZ-ND2 3.33Å; Y198-N202 PolarHBondContact O-N 2.98Å; Y198-N202 PolarHBondContact O-ND2 3.42Å; S199-N202 PolarHBondContact O-N 3.3Å; N202-L204 PolarHBondContact O-N 3.01Å; N202-L205 PolarHBondContact O-N 3.32Å; N202-I206 WeakPolarHBondContact O-CB 3.48Å; N202-I206 VanDerWaalsContact O-CG1 3.22Å; N202-I206 WeakPolarHBondContact O-CG1 3.2Å; N202-I206 PolarHBondContact O-N 2.69Å
203A90Very high88.6Confident28 Ų2838.9 Ų38.923%0.23122%0.216CC..Hα-helixtrans-61.3-42.8175.700000112.6S199 S200 L201 I206 F207 T276 F280S199-A203 WeakPolarHBondContact O-CB 3.39Å; S199-A203 PolarHBondContact O-N 3.38Å; S200-A203 PolarHBondContact O-N 2.96Å; L201-A203 VanDerWaalsContact C-N 3.34Å; L201-A203 PolarHBondContact O-N 3.02Å; A203-I206 PolarHBondContact O-N 3.39Å; A203-F207 WeakPolarHBondContact O-CB 3.49Å; A203-F207 PolarHBondContact O-N 2.94Å; A203-T276 HydrophobicContact CB-CG2 3.71Å; A203-F280 HydrophobicContact CB-CE2 3.86Å; A203-F280 HydrophobicContact CB-CZ 4.22Å
204L93.1Very high88.3Confident101 Ų10138.7 Ų38.753%0.52922%0.217SC..Hα-helixtrans-61.9-44.3175.717965.3000110.9S200 L201 N202 F207 V208S200-L204 WeakPolarHBondContact O-CB 3.16Å; S200-L204 PolarHBondContact O-N 3.02Å; L201-L204 PolarHBondContact O-N 3Å; N202-L204 PolarHBondContact O-N 3.01Å; L204-F207 PolarHBondContact O-N 3.06Å; L204-V208 HydrophobicContact CD1-CG2 4.37Å; L204-V208 VanDerWaalsContact O-CG2 3.3Å; L204-V208 WeakPolarHBondContact O-CG2 3.3Å; L204-V208 PolarHBondContact O-N 3.33Å
205L91.6Very high88.1Confident15 Ų1540.5 Ų40.58%0.07923%0.231CC..Hα-helixtrans-64.1-45178.6-66.7170.1000111.7L107 T110 L111 C114 L201 N202 F207 V208 V209L107-L205 HydrophobicContact CD1-CD1 4.16Å; T110-L205 HydrophobicContact CG2-CB 3.67Å; T110-L205 HydrophobicContact CG2-CD1 3.63Å; T110-L205 HydrophobicContact CG2-CG 4.26Å; L111-L205 HydrophobicContact CD2-CD1 3.66Å; L111-L205 HydrophobicContact CD2-CD2 3.64Å; L111-L205 HydrophobicContact CD2-CG 4.32Å; L111-L205 HydrophobicContact CG-CD1 3.9Å; C114-L205 HydrophobicContact CB-CD2 3.99Å; L201-L205 HydrophobicContact CD1-CD1 4.23Å; L201-L205 HydrophobicContact CD1-CG 4.45Å; L201-L205 HydrophobicContact CG-CD1 4.16Å; L201-L205 VanDerWaalsContact O-CG 3.27Å; L201-L205 WeakPolarHBondContact O-CG 3.35Å; L201-L205 PolarHBondContact O-N 3.03Å; N202-L205 PolarHBondContact O-N 3.32Å; L205-F207 VanDerWaalsContact C-N 3.31Å; L205-F207 PolarHBondContact O-N 3Å; L205-V208 PolarHBondContact O-N 3.35Å; L205-V209 WeakPolarHBondContact O-CB 3.44Å; L205-V209 WeakPolarHBondContact O-CG2 3.39Å; L205-V209 PolarHBondContact O-N 2.93Å
206I88.1Confident87.5Confident9 Ų940.5 Ų40.55%0.04623%0.231CC..Hα-helixtrans-54.6-47.7171.9-74.8170000110.5N202 A203 V209 F210 F268 M269 L273 T276N202-I206 WeakPolarHBondContact O-CB 3.48Å; N202-I206 VanDerWaalsContact O-CG1 3.22Å; N202-I206 WeakPolarHBondContact O-CG1 3.2Å; N202-I206 PolarHBondContact O-N 2.69Å; A203-I206 PolarHBondContact O-N 3.39Å; I206-V209 PolarHBondContact O-N 3.26Å; I206-F210 WeakPolarHBondContact O-CB 3.43Å; I206-F210 PolarHBondContact O-N 3.35Å; I206-F268 HydrophobicContact CG1-CE1 3.56Å; I206-F268 HydrophobicContact CG1-CZ 3.92Å; I206-M269 HydrophobicContact CB-SD 4.23Å; I206-M269 HydrophobicContact CG2-CE 3.55Å; I206-M269 HydrophobicContact CG2-SD 3.32Å; I206-M269 WeakPolarHBondContact CG2-SD 3.34Å; I206-L273 HydrophobicContact CD1-CD2 4.39Å; I206-L273 HydrophobicContact CG2-CD2 3.88Å; I206-T276 WeakPolarHBondContact CD1-OG1 3.35Å
207F90Very high87Confident130 Ų13042 Ų4257%0.5724%0.238SC*.Hα-helixtrans-63.5-47.2179.3177.9-102.2000112.5A203 L204 L205 V209 F210 V211A203-F207 WeakPolarHBondContact O-CB 3.49Å; A203-F207 PolarHBondContact O-N 2.94Å; L204-F207 PolarHBondContact O-N 3.06Å; L205-F207 VanDerWaalsContact C-N 3.31Å; L205-F207 PolarHBondContact O-N 3Å; F207-V209 VanDerWaalsContact C-N 3.35Å; F207-V209 PolarHBondContact O-N 3.49Å; F207-F210 PolarHBondContact O-N 2.87Å; F207-V211 HydrophobicContact CD1-CG2 4.37Å; F207-V211 HydrophobicContact CD2-CG2 4.35Å; F207-V211 HydrophobicContact CE1-CG2 3.94Å; F207-V211 HydrophobicContact CE2-CG2 3.92Å; F207-V211 HydrophobicContact CZ-CG2 3.7Å; F207-V211 WeakPolarHBondContact O-CG2 3.21Å; F207-V211 PolarHBondContact O-N 2.89Å
208V90.5Very high86.5Confident41 Ų4143 Ų4325%0.24824%0.242CC..Hα-helixtrans-59.2-47.3177171.50000110.5L118 L204 L205 F210 V211 C212L118-V208 HydrophobicContact CD2-CG1 4.22Å; L118-V208 HydrophobicContact CG-CG1 4.42Å; L204-V208 HydrophobicContact CD1-CG2 4.37Å; L204-V208 VanDerWaalsContact O-CG2 3.3Å; L204-V208 WeakPolarHBondContact O-CG2 3.3Å; L204-V208 PolarHBondContact O-N 3.33Å; L205-V208 PolarHBondContact O-N 3.35Å; V208-F210 VanDerWaalsContact C-N 3.34Å; V208-F210 PolarHBondContact O-N 2.9Å; V208-V211 PolarHBondContact O-N 3.45Å; V208-C212 WeakPolarHBondContact O-CB 3.38Å; V208-C212 PolarHBondContact O-N 3.47Å; V208-C212 PolarHBondContact O-SG 2.93Å
209V87.1Confident85.8Confident1 Ų144.1 Ų44.11%0.00625%0.251CS..Hα-helixtrans-56.8-48.4175.9169.60000110.6C114 A117 L205 I206 F207 V211 C212 N213 T265C114-V209 HydrophobicContact CB-CG2 3.95Å; A117-V209 HydrophobicContact CB-CG1 4.46Å; A117-V209 HydrophobicContact CB-CG2 4.31Å; L205-V209 WeakPolarHBondContact O-CB 3.44Å; L205-V209 WeakPolarHBondContact O-CG2 3.39Å; L205-V209 PolarHBondContact O-N 2.93Å; I206-V209 PolarHBondContact O-N 3.26Å; F207-V209 VanDerWaalsContact C-N 3.35Å; F207-V209 PolarHBondContact O-N 3.49Å; V209-V211 PolarHBondContact O-N 2.9Å; V209-C212 PolarHBondContact O-N 2.91Å; V209-N213 VanDerWaalsContact CG1-ND2 3.32Å; V209-N213 WeakPolarHBondContact CG1-ND2 3.22Å; V209-N213 WeakPolarHBondContact O-CB 3.23Å; V209-N213 PolarHBondContact O-N 3.45Å; V209-N213 PolarHBondContact O-ND2 3.17Å; V209-T265 HydrophobicContact CG1-CG2 3.68Å
210F85.6Confident84.8Confident132 Ų13245.8 Ų45.858%0.57926%0.259SS*.Hα-helixtrans-59.3-48.1179.5-179.9-98.6000112.3I206 F207 V208 N213 G214 M269I206-F210 WeakPolarHBondContact O-CB 3.43Å; I206-F210 PolarHBondContact O-N 3.35Å; F207-F210 PolarHBondContact O-N 2.87Å; V208-F210 VanDerWaalsContact C-N 3.34Å; V208-F210 PolarHBondContact O-N 2.9Å; F210-N213 PolarHBondContact O-N 3.43Å; F210-G214 PolarHBondContact O-N 3.25Å; F210-M269 HydrophobicContact CB-CE 4.21Å; F210-M269 HydrophobicContact CB-SD 4.39Å; F210-M269 HydrophobicContact CD2-CE 4.11Å; F210-M269 HydrophobicContact CG-CE 4.43Å
211V88.6Confident83.9Confident72 Ų7246.8 Ų46.844%0.43627%0.266SS..Hα-helixtrans-63.7-44.9179.2172.90000111.4F207 V208 V209 G214 S215F207-V211 HydrophobicContact CD1-CG2 4.37Å; F207-V211 HydrophobicContact CD2-CG2 4.35Å; F207-V211 HydrophobicContact CE1-CG2 3.94Å; F207-V211 HydrophobicContact CE2-CG2 3.92Å; F207-V211 HydrophobicContact CZ-CG2 3.7Å; F207-V211 WeakPolarHBondContact O-CG2 3.21Å; F207-V211 PolarHBondContact O-N 2.89Å; V208-V211 PolarHBondContact O-N 3.45Å; V209-V211 PolarHBondContact O-N 2.9Å; V211-G214 PolarHBondContact O-N 3.26Å; V211-S215 WeakPolarHBondContact O-CB 3.35Å; V211-S215 PolarHBondContact O-N 3.33Å
212C85.3Confident83.1Confident12 Ų1252 Ų528%0.08129%0.287CS..Hα-helixtrans-61-47.1178.1-73.60000111.9A117 L118 C121 V208 V209 S215 V216A117-C212 HydrophobicContact CB-CB 4.01Å; L118-C212 VanDerWaalsContact CD2-SG 3.55Å; C121-C212 HydrophobicContact CB-CB 4.13Å; V208-C212 WeakPolarHBondContact O-CB 3.38Å; V208-C212 PolarHBondContact O-N 3.47Å; V208-C212 PolarHBondContact O-SG 2.93Å; V209-C212 PolarHBondContact O-N 2.91Å; C212-S215 WeakPolarHBondContact O-CB 3.28Å; C212-S215 PolarHBondContact O-N 2.92Å; C212-V216 WeakPolarHBondContact O-CG2 3.32Å; C212-V216 PolarHBondContact O-N 2.5Å
213N81.6Confident82.1Confident10 Ų1055.9 Ų55.95%0.05331%0.306CS..Hα-helixtrans-66.6-38.2177.9-72.7-64.9000112.1V209 F210 S215 V216 I217 L261 T265V209-N213 VanDerWaalsContact CG1-ND2 3.32Å; V209-N213 WeakPolarHBondContact CG1-ND2 3.22Å; V209-N213 WeakPolarHBondContact O-CB 3.23Å; V209-N213 PolarHBondContact O-N 3.45Å; V209-N213 PolarHBondContact O-ND2 3.17Å; F210-N213 PolarHBondContact O-N 3.43Å; N213-S215 PolarHBondContact O-N 2.94Å; N213-V216 WeakPolarHBondContact O-CB 3.26Å; N213-V216 PolarHBondContact O-N 3.44Å; N213-I217 VanDerWaalsContact O-CG1 3.3Å; N213-I217 WeakPolarHBondContact O-CG1 3.38Å; N213-I217 PolarHBondContact O-N 2.93Å; N213-L261 WeakPolarHBondContact OD1-CD2 3.29Å; N213-T265 WeakPolarHBondContact ND2-CB 3.28Å; N213-T265 WeakPolarHBondContact ND2-CG2 3.48Å
214G80.5Confident81Confident30 Ų3060.3 Ų60.331%0.30932%0.322SS..Hα-helixtrans-59-45.2172.100000112.4F210 V211 V216 I217 V218F210-G214 PolarHBondContact O-N 3.25Å; V211-G214 PolarHBondContact O-N 3.26Å; G214-V216 VanDerWaalsContact C-N 3.34Å; G214-V216 PolarHBondContact O-N 2.96Å; G214-I217 PolarHBondContact O-N 3.1Å; G214-V218 WeakPolarHBondContact O-CG2 3.13Å; G214-V218 PolarHBondContact O-N 3.38Å
215S82.6Confident80Confident44 Ų4464.7 Ų64.731%0.30833%0.331SS..Hα-helixtrans-59.9-42.7175.3179.90000112.2V211 C212 N213 V218 S219V211-S215 WeakPolarHBondContact O-CB 3.35Å; V211-S215 PolarHBondContact O-N 3.33Å; C212-S215 WeakPolarHBondContact O-CB 3.28Å; C212-S215 PolarHBondContact O-N 2.92Å; N213-S215 PolarHBondContact O-N 2.94Å; S215-V218 PolarHBondContact O-N 3.14Å; S215-S219 VanDerWaalsContact O-CB 3.29Å; S215-S219 WeakPolarHBondContact O-CB 2.95Å; S215-S219 PolarHBondContact O-N 2.83Å; S215-S219 PolarHBondContact O-OG 3.28Å
216V75.1Confident78.9Confident1 Ų166.4 Ų66.41%0.00634%0.344CS..Hα-helixtrans-61.1-48.5175.9166.40000111.1C121 I124 C212 N213 G214 V218 S219 L220 V258C121-V216 HydrophobicContact CB-CG2 4.21Å; I124-V216 HydrophobicContact CD1-CB 4.38Å; I124-V216 HydrophobicContact CD1-CG1 3.51Å; I124-V216 HydrophobicContact CD1-CG2 4.13Å; C212-V216 WeakPolarHBondContact O-CG2 3.32Å; C212-V216 PolarHBondContact O-N 2.5Å; N213-V216 WeakPolarHBondContact O-CB 3.26Å; N213-V216 PolarHBondContact O-N 3.44Å; G214-V216 VanDerWaalsContact C-N 3.34Å; G214-V216 PolarHBondContact O-N 2.96Å; V216-V218 PolarHBondContact O-N 2.97Å; V216-S219 PolarHBondContact O-N 3.19Å; V216-L220 HydrophobicContact CG1-CD1 4.38Å; V216-L220 WeakPolarHBondContact O-CG 3.11Å; V216-L220 PolarHBondContact O-N 3.02Å; V216-V258 HydrophobicContact CG1-CG1 3.44Å; V216-V258 VanDerWaalsContact CG1-CG1 3.44Å; V216-V258 HydrophobicContact CG1-CG2 4.45Å
217I75.2Confident77.5Confident87 Ų8769.7 Ų69.745%0.44636%0.359SS..Hα-helixtrans-60.6-47.3178.4-67.2164.4000110.6N213 G214 S219 L220 C221N213-I217 VanDerWaalsContact O-CG1 3.3Å; N213-I217 WeakPolarHBondContact O-CG1 3.38Å; N213-I217 PolarHBondContact O-N 2.93Å; G214-I217 PolarHBondContact O-N 3.1Å; I217-S219 VanDerWaalsContact C-N 3.33Å; I217-S219 PolarHBondContact O-N 3.21Å; I217-L220 PolarHBondContact O-N 3.17Å; I217-C221 WeakPolarHBondContact O-CB 3.25Å; I217-C221 PolarHBondContact O-N 3.17Å; I217-C221 PolarHBondContact O-SG 3.3Å
218V79.8Confident76.2Confident75 Ų7567.9 Ų67.946%0.45536%0.355SS..Hα-helixtrans-61.8-42.4178.6170.60000111.2G214 S215 V216 L220 C221 K222G214-V218 WeakPolarHBondContact O-CG2 3.13Å; G214-V218 PolarHBondContact O-N 3.38Å; S215-V218 PolarHBondContact O-N 3.14Å; V216-V218 PolarHBondContact O-N 2.97Å; V218-L220 VanDerWaalsContact C-N 3.35Å; V218-C221 PolarHBondContact O-N 2.95Å; V218-K222 HydrophobicContact CG1-CD 4.2Å; V218-K222 HydrophobicContact CG1-CG 4.46Å; V218-K222 WeakPolarHBondContact O-CB 3.32Å; V218-K222 WeakPolarHBondContact O-CG 3.46Å; V218-K222 PolarHBondContact O-N 2.89Å
219S74.3Confident74.9Confident33 Ų3371.1 Ų71.123%0.23138%0.375CS..Hα-helixtrans-62.7-42.7178.1-61.20000111.3S215 V216 I217 K222 M223S215-S219 VanDerWaalsContact O-CB 3.29Å; S215-S219 WeakPolarHBondContact O-CB 2.95Å; S215-S219 PolarHBondContact O-N 2.83Å; S215-S219 PolarHBondContact O-OG 3.28Å; V216-S219 PolarHBondContact O-N 3.19Å; I217-S219 VanDerWaalsContact C-N 3.33Å; I217-S219 PolarHBondContact O-N 3.21Å; S219-K222 PolarHBondContact O-N 2.73Å; S219-M223 WeakPolarHBondContact O-CB 3.15Å; S219-M223 PolarHBondContact O-N 3.46Å
220L69.2Low73.5Confident42 Ų4280.1 Ų80.122%0.2241%0.409CS..Hα-helixtrans-65.3-43.3173.8-73.8-178000112.6V216 I217 V218 K222 M223 H224 V258V216-L220 HydrophobicContact CG1-CD1 4.38Å; V216-L220 WeakPolarHBondContact O-CG 3.11Å; V216-L220 PolarHBondContact O-N 3.02Å; I217-L220 PolarHBondContact O-N 3.17Å; V218-L220 VanDerWaalsContact C-N 3.35Å; L220-K222 PolarHBondContact O-N 2.88Å; L220-M223 HydrophobicContact CD2-CE 3.63Å; L220-M223 WeakPolarHBondContact O-CB 3.33Å; L220-M223 PolarHBondContact O-N 2.7Å; L220-H224 WeakPolarHBondContact O-CB 3.38Å; L220-H224 PolarHBondContact O-N 3.35Å; L220-V258 HydrophobicContact CD1-CB 4.05Å; L220-V258 HydrophobicContact CD1-CG1 3.46Å; L220-V258 VanDerWaalsContact CD1-CG1 3.46Å; L220-V258 HydrophobicContact CD1-CG2 4.3Å
221C71.5Confident72Confident78 Ų7880.4 Ų80.453%0.52741%0.406SS..Hα-helixtrans-62.3-42.2176.9-75.20000111.8I217 V218 H224 R225I217-C221 WeakPolarHBondContact O-CB 3.25Å; I217-C221 PolarHBondContact O-N 3.17Å; I217-C221 PolarHBondContact O-SG 3.3Å; V218-C221 PolarHBondContact O-N 2.95Å; C221-H224 PolarHBondContact O-N 3.15Å; C221-R225 VanDerWaalsContact O-CB 3.29Å; C221-R225 WeakPolarHBondContact O-CB 3.4Å; C221-R225 PolarHBondContact O-N 3.1Å
222K75.9Confident70.3Confident147 Ų14780.5 Ų80.564%0.63942%0.421SS*.Hα-helixtrans-62.6-45.2174.1-77.3179.2179.6176.80111.3V218 S219 L220 R225 S226V218-K222 HydrophobicContact CG1-CD 4.2Å; V218-K222 HydrophobicContact CG1-CG 4.46Å; V218-K222 WeakPolarHBondContact O-CB 3.32Å; V218-K222 WeakPolarHBondContact O-CG 3.46Å; V218-K222 PolarHBondContact O-N 2.89Å; S219-K222 PolarHBondContact O-N 2.73Å; L220-K222 PolarHBondContact O-N 2.88Å; K222-R225 PolarHBondContact O-N 3.21Å; K222-S226 WeakPolarHBondContact O-CB 3.35Å; K222-S226 PolarHBondContact O-N 3.46Å; K222-S226 PolarHBondContact O-OG 3.07Å
223M67.9Low68.8Low86 Ų8683.9 Ų83.942%0.42445%0.445SS..Hα-helixtrans-58.4-54.2174.5-174.5177.571.800110.1S219 L220 R225 S226 H227S219-M223 WeakPolarHBondContact O-CB 3.15Å; S219-M223 PolarHBondContact O-N 3.46Å; L220-M223 HydrophobicContact CD2-CE 3.63Å; L220-M223 WeakPolarHBondContact O-CB 3.33Å; L220-M223 PolarHBondContact O-N 2.7Å; M223-R225 VanDerWaalsContact C-N 3.34Å; M223-R225 PolarHBondContact O-N 3.42Å; M223-S226 PolarHBondContact O-N 3.29Å; M223-S226 VanDerWaalsContact O-N 3.16Å; M223-S226 PolarHBondContact O-OG 3.35Å; M223-H227 PolarHBondContact O-CD2 2.98Å; M223-H227 PolarHBondContact O-N 2.91Å
224H68.1Low67.5Low121 Ų12190 Ų9056%0.5648%0.483SS*.Hα-helixtrans-55.6-45.8179.2-170.3-100.8000112.5L220 C221 H227 L228L220-H224 WeakPolarHBondContact O-CB 3.38Å; L220-H224 PolarHBondContact O-N 3.35Å; C221-H224 PolarHBondContact O-N 3.15Å; H224-H227 PolarHBondContact O-N 3.07Å; H224-L228 WeakPolarHBondContact O-CG 3.27Å; H224-L228 PolarHBondContact O-N 3.29Å
225R72.8Confident66.3Low192 Ų19293 Ų9373%0.72550%0.495SS*.Hα-helixtrans-64.3-45.1177-171.6177.7175.2-172.9-1.7112.3C221 K222 M223 H227 L228 V229C221-R225 VanDerWaalsContact O-CB 3.29Å; C221-R225 WeakPolarHBondContact O-CB 3.4Å; C221-R225 PolarHBondContact O-N 3.1Å; K222-R225 PolarHBondContact O-N 3.21Å; M223-R225 VanDerWaalsContact C-N 3.34Å; M223-R225 PolarHBondContact O-N 3.42Å; R225-H227 PolarHBondContact O-N 3.22Å; R225-L228 PolarHBondContact O-N 3.44Å; R225-V229 WeakPolarHBondContact O-CG2 3.27Å; R225-V229 PolarHBondContact O-N 3.13Å
226S67.4Low64.9Low52 Ų5294.3 Ų94.336%0.36450%0.504SS..Hα-helixtrans-62.5-33.2177.873.70000112.6K222 M223 R230K222-S226 WeakPolarHBondContact O-CB 3.35Å; K222-S226 PolarHBondContact O-N 3.46Å; K222-S226 PolarHBondContact O-OG 3.07Å; M223-S226 PolarHBondContact O-N 3.29Å; M223-S226 VanDerWaalsContact O-N 3.16Å; M223-S226 PolarHBondContact O-OG 3.35Å; S226-R230 WeakPolarHBondContact O-CB 3.46Å; S226-R230 PolarHBondContact O-N 3.24Å
227H58.6Low64.1Low77 Ų77100.1 Ų100.136%0.35654%0.539SS..Hα-helixtrans-77.5-34.8176.8-82.2-83.8000113M223 H224 R225 V229 R230 R231M223-H227 PolarHBondContact O-CD2 2.98Å; M223-H227 PolarHBondContact O-N 2.91Å; H224-H227 PolarHBondContact O-N 3.07Å; R225-H227 PolarHBondContact O-N 3.22Å; H227-V229 VanDerWaalsContact C-N 3.34Å; H227-R230 PolarHBondContact O-N 2.87Å; H227-R231 WeakPolarHBondContact O-CG 3.22Å; H227-R231 PolarHBondContact O-N 2.97Å
228L62.5Low62.9Low93 Ų9399.9 Ų99.949%0.48755%0.55SS.*Hα-helixtrans-62.5-41.3170.4-75171000111.5H224 R225 R231H224-L228 WeakPolarHBondContact O-CG 3.27Å; H224-L228 PolarHBondContact O-N 3.29Å; R225-L228 PolarHBondContact O-N 3.44Å; L228-R231 PolarHBondContact O-N 3.02Å
229V64.1Low61.5Low108 Ų108104.8 Ų104.866%0.65556%0.561SS**Hα-helixtrans-66.9-42.3175.7175.20000111.3R225 H227 R231 G232R225-V229 WeakPolarHBondContact O-CG2 3.27Å; R225-V229 PolarHBondContact O-N 3.13Å; H227-V229 VanDerWaalsContact C-N 3.34Å; V229-R231 VanDerWaalsContact C-N 3.31Å; V229-R231 PolarHBondContact O-N 3.32Å; V229-G232 PolarHBondContact O-N 3.49Å
230R58.1Low60.3Low191 Ų191107.8 Ų107.872%0.72157%0.569SS**Hα-helixtrans-67.5-23.7175.3-89.8179.7169.5154-2.9114.4S226 H227 G232 S233S226-R230 WeakPolarHBondContact O-CB 3.46Å; S226-R230 PolarHBondContact O-N 3.24Å; H227-R230 PolarHBondContact O-N 2.87Å; R230-G232 PolarHBondContact O-N 3.44Å; R230-S233 PolarHBondContact O-N 3.36Å
231R52.3Low59.3Low137 Ų137113.6 Ų113.652%0.51759%0.593SS.*THydrogen-bonded Turntrans-66-19.4176-88.8-180170.2-177.9-1113.6H227 L228 V229H227-R231 WeakPolarHBondContact O-CG 3.22Å; H227-R231 PolarHBondContact O-N 2.97Å; L228-R231 PolarHBondContact O-N 3.02Å; V229-R231 VanDerWaalsContact C-N 3.31Å; V229-R231 PolarHBondContact O-N 3.32Å
232G53.3Low58Low74 Ų74118.3 Ų118.376%0.76361%0.605SS**THydrogen-bonded Turntrans-80.1-12.7176.900000115.4V229 R230V229-G232 PolarHBondContact O-N 3.49Å; R230-G232 PolarHBondContact O-N 3.44Å
233S55.1Low56.7Low84 Ų84120.3 Ų120.359%0.58761%0.608SS**SBendtrans-111.8100.7-176.4-175.50000112.2R230R230-S233 PolarHBondContact O-N 3.36Å
234V53.6Low55.7Low139 Ų139118.3 Ų118.384%0.84260%0.603SS**  trans38.280.2150.2-157.50000117.9
235V54.8Low54.6Low93 Ų93119 Ų11956%0.56461%0.609SS**  trans-145136.8157-177.50000110.5
236S54.6Low53.2Low70 Ų70113.1 Ų113.149%0.4960%0.602SS.*  trans-55.6136.6-172.259.50000115.7A238 R239 K240S236-A238 VanDerWaalsContact C-N 3.33Å; S236-A238 PolarHBondContact O-N 3.45Å; S236-R239 PolarHBondContact O-N 3.05Å; S236-K240 WeakPolarHBondContact O-CB 3.48Å; S236-K240 PolarHBondContact O-N 3.27Å; S236-K240 VanDerWaalsContact O-N 3.16Å
237V57Low52Low123 Ų123116.7 Ų116.775%0.74561%0.608SS**Hα-helixtrans-56.7-35.3-169.6179.80000114K240 K241V237-K240 VanDerWaalsContact O-CB 3.26Å; V237-K240 WeakPolarHBondContact O-CB 3.36Å; V237-K240 PolarHBondContact O-N 3Å; V237-K241 PolarHBondContact O-N 3.47Å
238A50.1Low51Low83 Ų83117.9 Ų117.969%0.68661%0.612SS**Hα-helixtrans-75.7-39.8-176.300000114.1S236 K240S236-A238 VanDerWaalsContact C-N 3.33Å; S236-A238 PolarHBondContact O-N 3.45Å; A238-K240 VanDerWaalsContact C-N 3.3Å
239R50.8Low50Low178 Ų178115.1 Ų115.167%0.67261%0.606SS**Hα-helixtrans-71.4-28.4170.2-92.8-177.3-171.61212.7111.7S236 R243S236-R239 PolarHBondContact O-N 3.05Å; R239-R243 WeakPolarHBondContact O-CB 3.46Å; R239-R243 PolarHBondContact O-N 3.22Å
240K49.2Very low48.8Very low95 Ų95118.8 Ų118.841%0.41361%0.608SS.*Hα-helixtrans-60.1-46.7175.9-132.3174.4-176175.70111.8S236 V237 A238 S244S236-K240 WeakPolarHBondContact O-CB 3.48Å; S236-K240 PolarHBondContact O-N 3.27Å; S236-K240 VanDerWaalsContact O-N 3.16Å; V237-K240 VanDerWaalsContact O-CB 3.26Å; V237-K240 WeakPolarHBondContact O-CB 3.36Å; V237-K240 PolarHBondContact O-N 3Å; A238-K240 VanDerWaalsContact C-N 3.3Å; K240-S244 WeakPolarHBondContact O-CB 3.29Å; K240-S244 PolarHBondContact O-N 3.37Å; K240-S244 PolarHBondContact O-OG 2.9Å
241K47.2Very low48.2Very low165 Ų165110.6 Ų110.672%0.71758%0.584SS**Hα-helixtrans-67.2-40-178.8-156.7176.9-174.5-178.40112.6V237 S244 L245V237-K241 PolarHBondContact O-N 3.47Å; K241-S244 PolarHBondContact O-OG 3.45Å; K241-L245 VanDerWaalsContact O-CB 3.22Å; K241-L245 WeakPolarHBondContact O-CB 3.04Å; K241-L245 PolarHBondContact O-N 2.91Å
242K45.8Very low48Very low177 Ų177107.6 Ų107.677%0.7758%0.575SS**Hα-helixtrans-74-39-179.7-153174.7-174.21790112.6A246K242-A246 VanDerWaalsContact O-CB 3.3Å; K242-A246 WeakPolarHBondContact O-CB 3.47Å; K242-A246 PolarHBondContact O-N 3.15Å; K242-A246 VanDerWaalsContact O-N 3.16Å
243R47.2Very low47.8Very low188 Ų188110.5 Ų110.571%0.70957%0.569SS**Hα-helixtrans-75.2-34.2173.4-76.8-174.7174.2174.5-1.9112.9R239 W247R239-R243 WeakPolarHBondContact O-CB 3.46Å; R239-R243 PolarHBondContact O-N 3.22Å; R243-W247 WeakPolarHBondContact O-CB 3.28Å; R243-W247 PolarHBondContact O-N 3.28Å
244S46.5Very low47.8Very low45 Ų45112.9 Ų112.932%0.31557%0.571SS.*Hα-helixtrans-70.9-35.417679.80000112.2K240 K241 F248K240-S244 WeakPolarHBondContact O-CB 3.29Å; K240-S244 PolarHBondContact O-N 3.37Å; K240-S244 PolarHBondContact O-OG 2.9Å; K241-S244 PolarHBondContact O-OG 3.45Å; S244-F248 WeakPolarHBondContact O-CB 3.47Å; S244-F248 PolarHBondContact O-N 2.9Å
245L44.7Very low47.8Very low134 Ų134111.1 Ų111.170%0.70256%0.555SS**Hα-helixtrans-73.5-41.8177.3-158.581.1000111.7K241 G249K241-L245 VanDerWaalsContact O-CB 3.22Å; K241-L245 WeakPolarHBondContact O-CB 3.04Å; K241-L245 PolarHBondContact O-N 2.91Å; L245-G249 PolarHBondContact O-N 3.4Å
246A44.7Very low48.2Very low70 Ų70108.2 Ų108.258%0.57954%0.536SS*.Hα-helixtrans-69.5-31.2175.100000113K242 R250K242-A246 VanDerWaalsContact O-CB 3.3Å; K242-A246 WeakPolarHBondContact O-CB 3.47Å; K242-A246 PolarHBondContact O-N 3.15Å; K242-A246 VanDerWaalsContact O-N 3.16Å; A246-R250 PolarHBondContact O-N 3.33Å
247W42.7Very low48.5Very low126 Ų126107.1 Ų107.148%0.47752%0.523SS..Hα-helixtrans-84.1-32174.4-174.584.2000113.2R243 G249 R250 G251R243-W247 WeakPolarHBondContact O-CB 3.28Å; R243-W247 PolarHBondContact O-N 3.28Å; W247-G249 VanDerWaalsContact C-N 3.31Å; W247-R250 PolarHBondContact O-N 3.35Å; W247-G251 WeakPolarHBondContact O-CA 3.42Å; W247-G251 PolarHBondContact O-N 3.28Å
248F37.6Very low48.8Very low102 Ų102102 Ų10245%0.44749%0.492SS..Hα-helixtrans-58.1-48.8165.3-111.8-100.6000108.9S244 R250 G251 E252S244-F248 WeakPolarHBondContact O-CB 3.47Å; S244-F248 PolarHBondContact O-N 2.9Å; F248-R250 PolarHBondContact O-N 2.95Å; F248-G251 PolarHBondContact O-N 3.48Å; F248-E252 HydrophobicContact CD1-CG 3.98Å; F248-E252 WeakPolarHBondContact O-CA 3.3Å; F248-E252 WeakPolarHBondContact O-CB 3.48Å; F248-E252 WeakPolarHBondContact O-CG 3.48Å; F248-E252 PolarHBondContact O-N 3.43Å
249G40.6Very low49.6Very low35 Ų35101.4 Ų101.436%0.36148%0.48SS..Hα-helixtrans-58.7-39.5177.800000114.7L245 W247 E253L245-G249 PolarHBondContact O-N 3.4Å; W247-G249 VanDerWaalsContact C-N 3.31Å; G249-E253 WeakPolarHBondContact O-CG 3.18Å
250R39.4Very low50.4Low185 Ų18593 Ų9370%0.69845%0.448SS*.Hα-helixtrans-86.5-32.4-178.7-152.8175.6-146.6-145.64.3114.1A246 W247 F248A246-R250 PolarHBondContact O-N 3.33Å; W247-R250 PolarHBondContact O-N 3.35Å; F248-R250 PolarHBondContact O-N 2.95Å
251G46Very low51.3Low20 Ų2088.6 Ų88.621%0.20643%0.429CS..Hα-helixtrans-80-28.7176.700000113W247 F248 M255W247-G251 WeakPolarHBondContact O-CA 3.42Å; W247-G251 PolarHBondContact O-N 3.28Å; F248-G251 PolarHBondContact O-N 3.48Å; G251-M255 WeakPolarHBondContact O-CB 3.44Å; G251-M255 PolarHBondContact O-N 2.91Å
252E46.6Very low52.2Low73 Ų7381.8 Ų81.834%0.34140%0.404SS..Hα-helixtrans-64.7-40.4171.4-78.2178.311800111.3F248 D256F248-E252 HydrophobicContact CD1-CG 3.98Å; F248-E252 WeakPolarHBondContact O-CA 3.3Å; F248-E252 WeakPolarHBondContact O-CB 3.48Å; F248-E252 WeakPolarHBondContact O-CG 3.48Å; F248-E252 PolarHBondContact O-N 3.43Å; E252-D256 VanDerWaalsContact O-CB 3.27Å; E252-D256 WeakPolarHBondContact O-CB 3.39Å; E252-D256 PolarHBondContact O-N 3.43Å
253E50.4Low53.4Low136 Ų13675.6 Ų75.664%0.63638%0.379SS*.Hα-helixtrans-66.5-40.4177.4-69.7-178.8171.500112.6G249 H257G249-E253 WeakPolarHBondContact O-CG 3.18Å; E253-H257 PolarHBondContact O-CD2 3.1Å; E253-H257 PolarHBondContact O-N 3.22Å
254E53.6Low54.5Low133 Ų13366.6 Ų66.662%0.62135%0.345SS*.Hα-helixtrans-74.5-35.8177.1-67.9-171.9175.100112.5H257 V258E254-H257 PolarHBondContact O-N 2.96Å; E254-V258 WeakPolarHBondContact O-CG2 3.43Å; E254-V258 PolarHBondContact O-N 3.43Å
255M55.5Low55.8Low102 Ų10265 Ų6550%0.50233%0.333SS..Hα-helixtrans-72-36.4177.9-165.9174.872.700111.9G251 H257 V258 V259G251-M255 WeakPolarHBondContact O-CB 3.44Å; G251-M255 PolarHBondContact O-N 2.91Å; M255-H257 VanDerWaalsContact C-N 3.3Å; M255-H257 PolarHBondContact O-N 2.91Å; M255-V258 PolarHBondContact O-N 2.96Å; M255-V258 VanDerWaalsContact O-N 3.15Å; M255-V259 HydrophobicContact CG-CG2 4.45Å; M255-V259 WeakPolarHBondContact O-CG2 3.21Å; M255-V259 PolarHBondContact O-N 3.46Å
256D61.1Low57.1Low32 Ų3263.4 Ų63.417%0.17132%0.324CS..Hα-helixtrans-61-39174.4-77.1-8.6000111E252 V258 M260 K316E252-D256 VanDerWaalsContact O-CB 3.27Å; E252-D256 WeakPolarHBondContact O-CB 3.39Å; E252-D256 PolarHBondContact O-N 3.43Å; D256-V258 VanDerWaalsContact C-N 3.35Å; D256-V258 PolarHBondContact O-N 2.73Å; D256-M260 VanDerWaalsContact O-CB 3.27Å; D256-M260 WeakPolarHBondContact O-CB 3.39Å; D256-M260 PolarHBondContact O-N 2.92Å; D256-K316 IonicContact OD1-NZ 3.1Å; D256-K316 PolarHBondContact OD1-NZ 3.36Å; D256-K316 VanDerWaalsContact OD1-NZ 3.1Å; D256-K316 WeakPolarHBondContact OD2-CD 3.26Å; D256-K316 IonicContact OD2-NZ 3.86Å
257H62.5Low58.6Low48 Ų4861.7 Ų61.722%0.22231%0.305CS..Hα-helixtrans-64.6-36.3174.4-79.1-56.1000113.2F54 E253 E254 M255 L261F54-H257 AromaticContact CD1-ND1 3.93Å; F54-H257 AromaticContact CE1-CE1 3.84Å; F54-H257 AromaticContact CE1-ND1 3.36Å; F54-H257 WeakPolarHBondContact CE1-ND1 3.24Å; E253-H257 PolarHBondContact O-CD2 3.1Å; E253-H257 PolarHBondContact O-N 3.22Å; E254-H257 PolarHBondContact O-N 2.96Å; M255-H257 VanDerWaalsContact C-N 3.3Å; M255-H257 PolarHBondContact O-N 2.91Å; H257-L261 WeakPolarHBondContact O-CB 3.36Å; H257-L261 PolarHBondContact O-N 3.37Å; H257-L261 VanDerWaalsContact O-N 3.08Å
258V63.4Low60.3Low14 Ų1455.7 Ų55.79%0.08528%0.282CS..Hα-helixtrans-76.4-40.3179.2178.40000112I124 V216 L220 E254 M255 D256 M260 L261 A262I124-V258 HydrophobicContact CD1-CG2 3.66Å; V216-V258 HydrophobicContact CG1-CG1 3.44Å; V216-V258 VanDerWaalsContact CG1-CG1 3.44Å; V216-V258 HydrophobicContact CG1-CG2 4.45Å; L220-V258 HydrophobicContact CD1-CB 4.05Å; L220-V258 HydrophobicContact CD1-CG1 3.46Å; L220-V258 VanDerWaalsContact CD1-CG1 3.46Å; L220-V258 HydrophobicContact CD1-CG2 4.3Å; E254-V258 WeakPolarHBondContact O-CG2 3.43Å; E254-V258 PolarHBondContact O-N 3.43Å; M255-V258 PolarHBondContact O-N 2.96Å; M255-V258 VanDerWaalsContact O-N 3.15Å; D256-V258 VanDerWaalsContact C-N 3.35Å; D256-V258 PolarHBondContact O-N 2.73Å; V258-M260 VanDerWaalsContact C-N 3.31Å; V258-M260 PolarHBondContact O-N 3.42Å; V258-L261 PolarHBondContact O-N 3.38Å; V258-A262 WeakPolarHBondContact O-CB 3.25Å; V258-A262 PolarHBondContact O-N 3.08Å
259V65.9Low62.2Low71 Ų7152.6 Ų52.643%0.4327%0.27SS..Hα-helixtrans-61.7-43.8174.6171.10000110.2M255 A262 L263M255-V259 HydrophobicContact CG-CG2 4.45Å; M255-V259 WeakPolarHBondContact O-CG2 3.21Å; M255-V259 PolarHBondContact O-N 3.46Å; V259-A262 PolarHBondContact O-N 3.34Å; V259-L263 HydrophobicContact CG1-CD1 4.06Å; V259-L263 VanDerWaalsContact O-CG 3.31Å; V259-L263 WeakPolarHBondContact O-CG 3.44Å; V259-L263 PolarHBondContact O-N 2.75Å
260M67.4Low64Low3 Ų355 Ų552%0.01528%0.277CS..Hα-helixtrans-61-45.5175.6-169.8-175.972.800111.6F54 D256 V258 A262 L263 I264 F311 R315F54-M260 HydrophobicContact CE1-CE 3.67Å; F54-M260 HydrophobicContact CZ-CE 3.31Å; D256-M260 VanDerWaalsContact O-CB 3.27Å; D256-M260 WeakPolarHBondContact O-CB 3.39Å; D256-M260 PolarHBondContact O-N 2.92Å; V258-M260 VanDerWaalsContact C-N 3.31Å; V258-M260 PolarHBondContact O-N 3.42Å; M260-A262 PolarHBondContact O-N 2.96Å; M260-L263 PolarHBondContact O-N 3.26Å; M260-I264 HydrophobicContact CE-CD1 4.47Å; M260-I264 HydrophobicContact CG-CD1 3.9Å; M260-I264 VanDerWaalsContact O-CD1 3.29Å; M260-I264 WeakPolarHBondContact O-CD1 3.36Å; M260-I264 VanDerWaalsContact O-CG1 3.23Å; M260-I264 WeakPolarHBondContact O-CG1 3.48Å; M260-I264 PolarHBondContact O-N 3.34Å; M260-F311 HydrophobicContact CE-CD1 3.42Å; M260-F311 VanDerWaalsContact CE-CD1 3.42Å; M260-F311 HydrophobicContact CE-CE1 3.49Å; M260-F311 VanDerWaalsContact CE-CE1 3.49Å; M260-F311 HydrophobicContact CG-CD1 4.19Å; M260-F311 HydrophobicContact SD-CB 4.47Å; M260-F311 HydrophobicContact SD-CD1 3.47Å; M260-F311 WeakPolarHBondContact SD-CD1 3.42Å; M260-F311 HydrophobicContact SD-CE1 4.14Å; M260-F311 HydrophobicContact SD-CG 4.34Å; M260-R315 HydrophobicContact SD-CB 4.24Å
261L68Low65.9Low1 Ų146.5 Ų46.51%0.00525%0.246CC..Hα-helixtrans-59-45.5175.4-172.779.1000111.7F54 M116 R120 N213 H257 V258 L263 I264 T265F54-L261 HydrophobicContact CE2-CD1 4.48Å; M116-L261 HydrophobicContact CB-CD1 4.17Å; R120-L261 HydrophobicContact CB-CD2 3.58Å; R120-L261 HydrophobicContact CG-CD1 4.45Å; R120-L261 HydrophobicContact CG-CD2 3.64Å; N213-L261 WeakPolarHBondContact OD1-CD2 3.29Å; H257-L261 WeakPolarHBondContact O-CB 3.36Å; H257-L261 PolarHBondContact O-N 3.37Å; H257-L261 VanDerWaalsContact O-N 3.08Å; V258-L261 PolarHBondContact O-N 3.38Å; L261-L263 PolarHBondContact O-N 3.45Å; L261-I264 PolarHBondContact O-N 3.37Å; L261-T265 HydrophobicContact CG-CG2 4.45Å; L261-T265 WeakPolarHBondContact O-CB 3.22Å; L261-T265 WeakPolarHBondContact O-CG2 3.38Å; L261-T265 PolarHBondContact O-N 3.42Å; L261-T265 PolarHBondContact O-OG1 3.3Å; L261-T265 VanDerWaalsContact O-OG1 3.08Å
262A67.8Low67.4Low22 Ų2245.6 Ų45.618%0.18224%0.237CC..Hα-helixtrans-59.9-44.7177.700000111.6V258 V259 M260 T265 I266V258-A262 WeakPolarHBondContact O-CB 3.25Å; V258-A262 PolarHBondContact O-N 3.08Å; V259-A262 PolarHBondContact O-N 3.34Å; M260-A262 PolarHBondContact O-N 2.96Å; A262-T265 WeakPolarHBondContact CA-OG1 3.36Å; A262-T265 PolarHBondContact O-N 2.83Å; A262-T265 PolarHBondContact O-OG1 3.07Å; A262-I266 WeakPolarHBondContact O-CG1 3.44Å; A262-I266 PolarHBondContact O-N 2.97Å
263L69.3Low69Low47 Ų4745.2 Ų45.225%0.24624%0.237CC..Hα-helixtrans-64.4-44.9177.9-69.5171.5000112.6V259 M260 L261 T265 I266 I267 V310 F314V259-L263 HydrophobicContact CG1-CD1 4.06Å; V259-L263 VanDerWaalsContact O-CG 3.31Å; V259-L263 WeakPolarHBondContact O-CG 3.44Å; V259-L263 PolarHBondContact O-N 2.75Å; M260-L263 PolarHBondContact O-N 3.26Å; L261-L263 PolarHBondContact O-N 3.45Å; L263-T265 PolarHBondContact O-N 3.47Å; L263-I266 PolarHBondContact O-N 3.32Å; L263-I267 WeakPolarHBondContact O-CG1 3.41Å; L263-I267 PolarHBondContact O-N 3.15Å; L263-I267 VanDerWaalsContact O-N 3.07Å; L263-V310 HydrophobicContact CB-CG1 3.76Å; L263-F314 HydrophobicContact CD1-CB 4.05Å; L263-F314 HydrophobicContact CD1-CD1 3.49Å; L263-F314 VanDerWaalsContact CD1-CD1 3.49Å; L263-F314 HydrophobicContact CD1-CD2 3.71Å; L263-F314 HydrophobicContact CD1-CE1 3.77Å; L263-F314 HydrophobicContact CD1-CE2 3.98Å; L263-F314 HydrophobicContact CD1-CG 3.45Å; L263-F314 VanDerWaalsContact CD1-CG 3.45Å; L263-F314 HydrophobicContact CD1-CZ 4Å
264I72.1Confident70.5Confident0 Ų040.6 Ų40.60%022%0.218CC..Hα-helixtrans-58.8-41.7175-67.3156.8000110L113 M260 L261 I267 F268 V310 F311L113-I264 HydrophobicContact CD2-CG2 3.34Å; M260-I264 HydrophobicContact CE-CD1 4.47Å; M260-I264 HydrophobicContact CG-CD1 3.9Å; M260-I264 VanDerWaalsContact O-CD1 3.29Å; M260-I264 WeakPolarHBondContact O-CD1 3.36Å; M260-I264 VanDerWaalsContact O-CG1 3.23Å; M260-I264 WeakPolarHBondContact O-CG1 3.48Å; M260-I264 PolarHBondContact O-N 3.34Å; L261-I264 PolarHBondContact O-N 3.37Å; I264-I267 PolarHBondContact O-N 3.43Å; I264-F268 WeakPolarHBondContact O-CB 3.43Å; I264-F268 PolarHBondContact O-N 2.96Å; I264-V310 HydrophobicContact CG1-CB 4.3Å; I264-V310 HydrophobicContact CG1-CG1 3.78Å; I264-F311 HydrophobicContact CD1-CD1 3.78Å; I264-F311 HydrophobicContact CD1-CD2 4.07Å; I264-F311 HydrophobicContact CD1-CE1 3.27Å; I264-F311 HydrophobicContact CD1-CE2 3.57Å; I264-F311 HydrophobicContact CD1-CG 4.14Å; I264-F311 HydrophobicContact CD1-CZ 3.15Å; I264-F311 HydrophobicContact CG1-CE2 4.18Å; I264-F311 HydrophobicContact CG1-CZ 4.2Å
265T72.6Confident71.7Confident11 Ų1134.6 Ų34.67%0.06719%0.19CC..Hα-helixtrans-71-36.4-178.358.80000112.6V209 N213 L261 A262 L263 I267 F268 M269V209-T265 HydrophobicContact CG1-CG2 3.68Å; N213-T265 WeakPolarHBondContact ND2-CB 3.28Å; N213-T265 WeakPolarHBondContact ND2-CG2 3.48Å; L261-T265 HydrophobicContact CG-CG2 4.45Å; L261-T265 WeakPolarHBondContact O-CB 3.22Å; L261-T265 WeakPolarHBondContact O-CG2 3.38Å; L261-T265 PolarHBondContact O-N 3.42Å; L261-T265 PolarHBondContact O-OG1 3.3Å; L261-T265 VanDerWaalsContact O-OG1 3.08Å; A262-T265 WeakPolarHBondContact CA-OG1 3.36Å; A262-T265 PolarHBondContact O-N 2.83Å; A262-T265 PolarHBondContact O-OG1 3.07Å; L263-T265 PolarHBondContact O-N 3.47Å; T265-I267 VanDerWaalsContact C-N 3.31Å; T265-I267 PolarHBondContact O-N 3.13Å; T265-F268 PolarHBondContact O-N 3.29Å; T265-M269 WeakPolarHBondContact O-CG 3.03Å; T265-M269 PolarHBondContact O-N 2.84Å
266I72.8Confident72.8Confident100 Ų10030.2 Ų30.251%0.51317%0.169SC..Hα-helixtrans-60.8-44.6172.4-70.2164.8000110.3A262 L263 M269 V270A262-I266 WeakPolarHBondContact O-CG1 3.44Å; A262-I266 PolarHBondContact O-N 2.97Å; L263-I266 PolarHBondContact O-N 3.32Å; I266-M269 PolarHBondContact O-N 3.48Å; I266-V270 VanDerWaalsContact O-CG2 3.32Å; I266-V270 WeakPolarHBondContact O-CG2 3.41Å; I266-V270 PolarHBondContact O-N 2.94Å
267I76.1Confident73.7Confident35 Ų3533 Ų3318%0.17918%0.183CC..Hα-helixtrans-66.4-44.7179.9-71.4166.5000110.7L263 I264 T265 M269 V270 C271 M306 V310L263-I267 WeakPolarHBondContact O-CG1 3.41Å; L263-I267 PolarHBondContact O-N 3.15Å; L263-I267 VanDerWaalsContact O-N 3.07Å; I264-I267 PolarHBondContact O-N 3.43Å; T265-I267 VanDerWaalsContact C-N 3.31Å; T265-I267 PolarHBondContact O-N 3.13Å; I267-M269 VanDerWaalsContact C-N 3.3Å; I267-M269 PolarHBondContact O-N 2.87Å; I267-V270 PolarHBondContact O-N 3.1Å; I267-V270 VanDerWaalsContact O-N 3.15Å; I267-C271 WeakPolarHBondContact O-CB 3.48Å; I267-C271 PolarHBondContact O-N 3.38Å; I267-C271 PolarHBondContact O-SG 3.08Å; I267-M306 HydrophobicContact CG2-CB 3.76Å; I267-V310 HydrophobicContact CD1-CB 4.32Å; I267-V310 HydrophobicContact CD1-CG1 4.36Å; I267-V310 HydrophobicContact CD1-CG2 3.11Å
268F78.2Confident74.4Confident0 Ų031 Ų310%018%0.175CC..Hα-helixtrans-55.8-43.8174.2175.4-105.7000112.5T110 L113 I206 I264 T265 S272 N303T110-F268 HydrophobicContact CG2-CE1 4.26Å; T110-F268 HydrophobicContact CG2-CE2 3.96Å; T110-F268 HydrophobicContact CG2-CZ 3.37Å; T110-F268 WeakPolarHBondContact OG1-CE2 3.35Å; L113-F268 HydrophobicContact CD1-CB 4.3Å; L113-F268 HydrophobicContact CD1-CD2 3.43Å; L113-F268 VanDerWaalsContact CD1-CD2 3.43Å; L113-F268 HydrophobicContact CD1-CE2 3.95Å; L113-F268 HydrophobicContact CD1-CG 3.9Å; I206-F268 HydrophobicContact CG1-CE1 3.56Å; I206-F268 HydrophobicContact CG1-CZ 3.92Å; I264-F268 WeakPolarHBondContact O-CB 3.43Å; I264-F268 PolarHBondContact O-N 2.96Å; T265-F268 PolarHBondContact O-N 3.29Å; F268-S272 WeakPolarHBondContact CD2-OG 3.34Å; F268-S272 WeakPolarHBondContact CE2-OG 3.32Å; F268-S272 WeakPolarHBondContact O-CB 3.12Å; F268-S272 PolarHBondContact O-N 3.12Å; F268-S272 PolarHBondContact O-OG 3.18Å; F268-N303 WeakPolarHBondContact CA-OD1 3.3Å
269M76.8Confident75Confident37 Ų3730.3 Ų30.318%0.18217%0.171CC..Hα-helixtrans-62.5-49.4175.3-63.8-74.2-67.400110.9I206 F210 T265 I266 I267 C271 S272 L273I206-M269 HydrophobicContact CB-SD 4.23Å; I206-M269 HydrophobicContact CG2-CE 3.55Å; I206-M269 HydrophobicContact CG2-SD 3.32Å; I206-M269 WeakPolarHBondContact CG2-SD 3.34Å; F210-M269 HydrophobicContact CB-CE 4.21Å; F210-M269 HydrophobicContact CB-SD 4.39Å; F210-M269 HydrophobicContact CD2-CE 4.11Å; F210-M269 HydrophobicContact CG-CE 4.43Å; T265-M269 WeakPolarHBondContact O-CG 3.03Å; T265-M269 PolarHBondContact O-N 2.84Å; I266-M269 PolarHBondContact O-N 3.48Å; I267-M269 VanDerWaalsContact C-N 3.3Å; I267-M269 PolarHBondContact O-N 2.87Å; M269-C271 VanDerWaalsContact C-N 3.31Å; M269-C271 PolarHBondContact O-N 3.17Å; M269-S272 PolarHBondContact O-N 3.06Å; M269-L273 HydrophobicContact CB-CD1 4.2Å; M269-L273 HydrophobicContact CE-CD1 4.19Å; M269-L273 HydrophobicContact CE-CD2 4.45Å; M269-L273 WeakPolarHBondContact O-CB 3.37Å; M269-L273 WeakPolarHBondContact O-CD1 3.15Å; M269-L273 WeakPolarHBondContact O-CG 3.06Å; M269-L273 PolarHBondContact O-N 3.28Å
270V78Confident75.6Confident85 Ų8530.7 Ų30.752%0.51517%0.167SC..Hα-helixtrans-62.3-38.4-179.4171.70000111.9I266 I267 P274I266-V270 VanDerWaalsContact O-CG2 3.32Å; I266-V270 WeakPolarHBondContact O-CG2 3.41Å; I266-V270 PolarHBondContact O-N 2.94Å; I267-V270 PolarHBondContact O-N 3.1Å; I267-V270 VanDerWaalsContact O-N 3.15Å; V270-P274 WeakPolarHBondContact O-CD 3.46Å
271C79.1Confident75.9Confident7 Ų734.9 Ų34.95%0.04719%0.187CC..Hα-helixtrans-78.8-32.8-179.1-72.20000113.3I267 M269 F299 Y300 N303I267-C271 WeakPolarHBondContact O-CB 3.48Å; I267-C271 PolarHBondContact O-N 3.38Å; I267-C271 PolarHBondContact O-SG 3.08Å; M269-C271 VanDerWaalsContact C-N 3.31Å; M269-C271 PolarHBondContact O-N 3.17Å; C271-F299 VanDerWaalsContact CB-O 3.27Å; C271-F299 WeakPolarHBondContact CB-O 3.46Å; C271-F299 CarbonylContact O-C 3.59Å; C271-F299 PolarHBondContact SG-O 3.3Å; C271-Y300 WeakPolarHBondContact O-CA 3.28Å; C271-Y300 PolarHBondContact O-N 3.02Å; C271-N303 HydrophobicContact CB-CB 3.82Å
272S78.3Confident76.1Confident1 Ų135 Ų351%0.00719%0.188CC..Hα-helixtrans-100.7-24.2-171.5-54.10000114.6F268 M269 L275 T276F268-S272 WeakPolarHBondContact CD2-OG 3.34Å; F268-S272 WeakPolarHBondContact CE2-OG 3.32Å; F268-S272 WeakPolarHBondContact O-CB 3.12Å; F268-S272 PolarHBondContact O-N 3.12Å; F268-S272 PolarHBondContact O-OG 3.18Å; M269-S272 PolarHBondContact O-N 3.06Å; S272-L275 PolarHBondContact O-N 2.76Å; S272-T276 PolarHBondContact O-N 2.81Å; S272-T276 VanDerWaalsContact O-N 3.14Å; S272-T276 PolarHBondContact O-OG1 3.27Å
273L79.8Confident76.1Confident65 Ų6535.3 Ų35.334%0.3419%0.191SC..Hα-helixtrans-60.5-45.2177.7-77171.6000113.3I206 M269 L275 T276 I277I206-L273 HydrophobicContact CD1-CD2 4.39Å; I206-L273 HydrophobicContact CG2-CD2 3.88Å; M269-L273 HydrophobicContact CB-CD1 4.2Å; M269-L273 HydrophobicContact CE-CD1 4.19Å; M269-L273 HydrophobicContact CE-CD2 4.45Å; M269-L273 WeakPolarHBondContact O-CB 3.37Å; M269-L273 WeakPolarHBondContact O-CD1 3.15Å; M269-L273 WeakPolarHBondContact O-CG 3.06Å; M269-L273 PolarHBondContact O-N 3.28Å; L273-L275 VanDerWaalsContact C-N 3.28Å; L273-L275 PolarHBondContact O-N 3.11Å; L273-T276 PolarHBondContact O-N 2.87Å; L273-T276 VanDerWaalsContact O-N 3.17Å; L273-I277 WeakPolarHBondContact O-CB 3.1Å; L273-I277 VanDerWaalsContact O-CG1 3.28Å; L273-I277 WeakPolarHBondContact O-CG1 3.46Å; L273-I277 PolarHBondContact O-N 3.4Å
274P81.9Confident76Confident38 Ų3839.3 Ų39.325%0.24722%0.217CC..Hα-helixtrans-58.6-40.1-179.6-25.235.5000112.7V270 A278 A296 F299V270-P274 WeakPolarHBondContact O-CD 3.46Å; P274-A278 WeakPolarHBondContact O-CB 3.32Å; P274-A278 PolarHBondContact O-N 3.41Å; P274-A296 HydrophobicContact CB-CB 4.24Å; P274-F299 HydrophobicContact CB-CB 4.4Å; P274-F299 HydrophobicContact CG-CB 4.09Å; P274-F299 HydrophobicContact CG-CD2 4.38Å; P274-F299 HydrophobicContact CG-CG 4.22Å
275L79.3Confident75.8Confident8 Ų847.2 Ų47.24%0.04225%0.251CS..Hα-helixtrans-65.9-44.4177.3-176.568.6000111.9F174 M177 S272 L273 A278 G279 F297 Y300F174-L275 HydrophobicContact CE1-CD1 4.42Å; F174-L275 HydrophobicContact CZ-CD1 4.48Å; F174-L275 HydrophobicContact CZ-CD2 4.12Å; M177-L275 HydrophobicContact CE-CD1 3.62Å; S272-L275 PolarHBondContact O-N 2.76Å; L273-L275 VanDerWaalsContact C-N 3.28Å; L273-L275 PolarHBondContact O-N 3.11Å; L275-A278 PolarHBondContact O-N 2.83Å; L275-G279 PolarHBondContact O-N 3.32Å; L275-F297 HydrophobicContact CD1-CD1 3.37Å; L275-F297 HydrophobicContact CD1-CE1 3.5Å; L275-Y300 HydrophobicContact CB-CD2 4.36Å; L275-Y300 HydrophobicContact CD2-CD1 3.76Å; L275-Y300 HydrophobicContact CD2-CD2 3.47Å; L275-Y300 VanDerWaalsContact CD2-CD2 3.47Å; L275-Y300 HydrophobicContact CD2-CE1 3.96Å; L275-Y300 HydrophobicContact CD2-CE2 3.7Å; L275-Y300 HydrophobicContact CD2-CG 3.49Å; L275-Y300 VanDerWaalsContact CD2-CG 3.49Å
276T79.1Confident75.3Confident10 Ų1049.3 Ų49.36%0.06127%0.265CS..Hα-helixtrans-64.2-44-179.4-55.60000110.8A203 I206 S272 L273 G279 F280A203-T276 HydrophobicContact CB-CG2 3.71Å; I206-T276 WeakPolarHBondContact CD1-OG1 3.35Å; S272-T276 PolarHBondContact O-N 2.81Å; S272-T276 VanDerWaalsContact O-N 3.14Å; S272-T276 PolarHBondContact O-OG1 3.27Å; L273-T276 PolarHBondContact O-N 2.87Å; L273-T276 VanDerWaalsContact O-N 3.17Å; T276-G279 PolarHBondContact O-N 2.88Å; T276-F280 HydrophobicContact CG2-CD2 4.06Å; T276-F280 HydrophobicContact CG2-CE2 3.78Å; T276-F280 VanDerWaalsContact O-CD2 3.23Å; T276-F280 WeakPolarHBondContact O-CD2 3.29Å; T276-F280 PolarHBondContact O-N 3.37Å; T276-F280 VanDerWaalsContact O-N 3.17Å
277I80.2Confident74.8Confident90 Ų9046.2 Ų46.246%0.46225%0.248SC..Hα-helixtrans-61.2-45.3175-67.7166.5000110.3L273 G279 F280 M281L273-I277 WeakPolarHBondContact O-CB 3.1Å; L273-I277 VanDerWaalsContact O-CG1 3.28Å; L273-I277 WeakPolarHBondContact O-CG1 3.46Å; L273-I277 PolarHBondContact O-N 3.4Å; I277-G279 VanDerWaalsContact C-N 3.32Å; I277-G279 PolarHBondContact O-N 3.49Å; I277-F280 PolarHBondContact O-N 2.8Å; I277-M281 HydrophobicContact CG2-CG 4.01Å; I277-M281 HydrophobicContact CG2-SD 3.53Å; I277-M281 VanDerWaalsContact CG2-SD 3.53Å; I277-M281 WeakPolarHBondContact O-CB 3.23Å; I277-M281 VanDerWaalsContact O-CG 3.29Å; I277-M281 WeakPolarHBondContact O-CG 3.42Å; I277-M281 PolarHBondContact O-N 3.36Å
278A77.4Confident73.8Confident6 Ų649.7 Ų49.75%0.0528%0.276CS..Hα-helixtrans-59.5-41.4177.900000112.2P274 L275 M281 N282 F287 A296P274-A278 WeakPolarHBondContact O-CB 3.32Å; P274-A278 PolarHBondContact O-N 3.41Å; L275-A278 PolarHBondContact O-N 2.83Å; A278-M281 PolarHBondContact O-N 3.31Å; A278-N282 WeakPolarHBondContact O-CB 3.39Å; A278-N282 PolarHBondContact O-N 2.89Å; A278-N282 PolarHBondContact O-ND2 2.76Å; A278-F287 HydrophobicContact CB-CE2 4.44Å; A278-A296 HydrophobicContact CB-CB 4.01Å
279G74.9Confident73Confident0 Ų051 Ų510%029%0.289CS..Hα-helixtrans-62.1-44.6176.300000113.4S199 L275 T276 I277 A283S199-G279 WeakPolarHBondContact OG-CA 3.27Å; L275-G279 PolarHBondContact O-N 3.32Å; T276-G279 PolarHBondContact O-N 2.88Å; I277-G279 VanDerWaalsContact C-N 3.32Å; I277-G279 PolarHBondContact O-N 3.49Å; G279-A283 PolarHBondContact O-N 2.88Å
280F78.5Confident72.5Confident78 Ų7849.6 Ų49.634%0.34228%0.282SS..Hα-helixtrans-68-41.9175.1-77.4-67.3000113L196 A203 T276 I277 A283 V284L196-F280 HydrophobicContact CD2-CD1 4.27Å; A203-F280 HydrophobicContact CB-CE2 3.86Å; A203-F280 HydrophobicContact CB-CZ 4.22Å; T276-F280 HydrophobicContact CG2-CD2 4.06Å; T276-F280 HydrophobicContact CG2-CE2 3.78Å; T276-F280 VanDerWaalsContact O-CD2 3.23Å; T276-F280 WeakPolarHBondContact O-CD2 3.29Å; T276-F280 PolarHBondContact O-N 3.37Å; T276-F280 VanDerWaalsContact O-N 3.17Å; I277-F280 PolarHBondContact O-N 2.8Å; F280-A283 WeakPolarHBondContact O-CB 3.47Å; F280-A283 PolarHBondContact O-N 3.45Å; F280-V284 PolarHBondContact O-N 3.49Å
281M74.9Confident72Confident91 Ų9152.6 Ų52.645%0.44829%0.291SS..Hα-helixtrans-63.4-45.2179.6-75.2-175.869.500110.9I277 A278 A283 V284 K285 F287I277-M281 HydrophobicContact CG2-CG 4.01Å; I277-M281 HydrophobicContact CG2-SD 3.53Å; I277-M281 VanDerWaalsContact CG2-SD 3.53Å; I277-M281 WeakPolarHBondContact O-CB 3.23Å; I277-M281 VanDerWaalsContact O-CG 3.29Å; I277-M281 WeakPolarHBondContact O-CG 3.42Å; I277-M281 PolarHBondContact O-N 3.36Å; A278-M281 PolarHBondContact O-N 3.31Å; M281-A283 PolarHBondContact O-N 3.29Å; M281-V284 PolarHBondContact O-N 2.89Å; M281-V284 VanDerWaalsContact O-N 3.1Å; M281-K285 CarbonylContact O-C 3.31Å; M281-K285 VanDerWaalsContact O-C 3.3Å; M281-K285 PolarHBondContact O-N 3Å; M281-F287 HydrophobicContact CB-CE2 3.75Å; M281-F287 HydrophobicContact CB-CZ 3.73Å; M281-F287 HydrophobicContact CE-CE1 3.52Å; M281-F287 HydrophobicContact CE-CE2 4.44Å; M281-F287 HydrophobicContact CE-CZ 3.32Å; M281-F287 HydrophobicContact CG-CZ 4.29Å; M281-F287 HydrophobicContact SD-CE1 4.4Å; M281-F287 HydrophobicContact SD-CE2 4.46Å; M281-F287 HydrophobicContact SD-CZ 3.62Å
282N70.6Confident71.6Confident5 Ų557.5 Ų57.53%0.02731%0.313CS..Hα-helixtrans-62.7-29.4176.7-76-55.8000112.9M177 A278 F287 N293M177-N282 HydrophobicContact CB-CB 3.99Å; M177-N282 WeakPolarHBondContact O-CB 3.37Å; A278-N282 WeakPolarHBondContact O-CB 3.39Å; A278-N282 PolarHBondContact O-N 2.89Å; A278-N282 PolarHBondContact O-ND2 2.76Å; N282-F287 WeakPolarHBondContact OD1-CD2 3.13Å; N282-F287 PolarHBondContact OD1-N 2.9Å; N282-F287 VanDerWaalsContact OD1-N 3.14Å; N282-N293 PolarHBondContact ND2-OD1 2.82Å
283A68.6Low71.3Confident28 Ų2857.7 Ų57.723%0.23131%0.314CS..Hα-helixtrans-71.2-29.9175.100000114L192 L196 G279 F280 M281L192-A283 HydrophobicContact CD1-CB 3.81Å; L196-A283 HydrophobicContact CD1-CB 4.28Å; L196-A283 HydrophobicContact CD2-CB 3.34Å; L196-A283 HydrophobicContact CG-CB 3.82Å; G279-A283 PolarHBondContact O-N 2.88Å; F280-A283 WeakPolarHBondContact O-CB 3.47Å; F280-A283 PolarHBondContact O-N 3.45Å; M281-A283 PolarHBondContact O-N 3.29Å
284V67.8Low70.9Confident131 Ų13156.2 Ų56.279%0.79431%0.305SS*.Hα-helixtrans-93.4-44.1-179.5178.30000111.6F280 M281F280-V284 PolarHBondContact O-N 3.49Å; M281-V284 PolarHBondContact O-N 2.89Å; M281-V284 VanDerWaalsContact O-N 3.1Å
285K66.6Low70.5Confident165 Ų16561.9 Ų61.972%0.71732%0.321SS*.SBendtrans-147.1103179.4-172.8178.5-179.6-178.10108.7M281 F287M281-K285 CarbonylContact O-C 3.31Å; M281-K285 VanDerWaalsContact O-C 3.3Å; M281-K285 PolarHBondContact O-N 3Å; K285-F287 PolarHBondContact O-N 3.46Å
286P63.4Low70.3Confident55 Ų5561.8 Ų61.836%0.35732%0.322SS..  trans-53.3130.9178.8-2533.1000110.8A180 S288A180-P286 HydrophobicContact CB-CG 4.25Å; P286-S288 PolarHBondContact O-N 3.34Å
287F61.2Low70.1Confident35 Ų3561.4 Ų61.415%0.15432%0.319CS..  trans-62.3137.6172.9-72.4-69.3000109.6A278 M281 N282 K285 G289 E292A278-F287 HydrophobicContact CB-CE2 4.44Å; M281-F287 HydrophobicContact CB-CE2 3.75Å; M281-F287 HydrophobicContact CB-CZ 3.73Å; M281-F287 HydrophobicContact CE-CE1 3.52Å; M281-F287 HydrophobicContact CE-CE2 4.44Å; M281-F287 HydrophobicContact CE-CZ 3.32Å; M281-F287 HydrophobicContact CG-CZ 4.29Å; M281-F287 HydrophobicContact SD-CE1 4.4Å; M281-F287 HydrophobicContact SD-CE2 4.46Å; M281-F287 HydrophobicContact SD-CZ 3.62Å; N282-F287 WeakPolarHBondContact OD1-CD2 3.13Å; N282-F287 PolarHBondContact OD1-N 2.9Å; N282-F287 VanDerWaalsContact OD1-N 3.14Å; K285-F287 PolarHBondContact O-N 3.46Å; F287-G289 PolarHBondContact O-N 3.27Å; F287-E292 WeakPolarHBondContact CD1-OE2 3.27Å; F287-E292 WeakPolarHBondContact CE1-OE2 3.44Å
288S54.8Low70Confident109 Ų10963 Ų6376%0.76232%0.319SS*.SBendtrans-73.313.1177.943.80000113.8S4 P286S4-S288 WeakPolarHBondContact CB-O 3.46Å; S4-S288 PolarHBondContact OG-O 3.08Å; P286-S288 PolarHBondContact O-N 3.34Å
289G61.6Low69.9Low28 Ų2866.7 Ų66.729%0.28933%0.334SS..SBendtrans-169.7152.2177.700000115.1F287 E291F287-G289 PolarHBondContact O-N 3.27Å; G289-E291 VanDerWaalsContact C-N 3.29Å; G289-E291 PolarHBondContact O-N 2.94Å
290D66.6Low70.1Confident7 Ų767.3 Ų67.34%0.03734%0.337CS..Hα-helixtrans-75-10.7-176.8-73.8-27.4000114C7 C168 F294C7-D290 PolarHBondContact N-OD2 3.29Å; C168-D290 HydrophobicContact CB-CB 3.95Å; D290-F294 WeakPolarHBondContact O-CB 3.19Å; D290-F294 PolarHBondContact O-N 3.48Å
291E67.2Low70Confident147 Ų14765.8 Ų65.869%0.68734%0.336SS*.Hα-helixtrans-69.4-38.9-175.5-72.8-138.3147.600114.1G289 F294 R295G289-E291 VanDerWaalsContact C-N 3.29Å; G289-E291 PolarHBondContact O-N 2.94Å; E291-F294 PolarHBondContact O-N 3.28Å; E291-R295 PolarHBondContact O-N 3.46Å
292E70.2Confident70Confident111 Ų11163.3 Ų63.352%0.51932%0.324SS..Hα-helixtrans-69.6-41.1179.3-65.3-168.6-173.600110.9F287 F294 R295 A296F287-E292 WeakPolarHBondContact CD1-OE2 3.27Å; F287-E292 WeakPolarHBondContact CE1-OE2 3.44Å; E292-F294 VanDerWaalsContact C-N 3.31Å; E292-F294 PolarHBondContact O-N 2.89Å; E292-R295 PolarHBondContact O-N 3.3Å; E292-A296 PolarHBondContact O-N 3.48Å
293N72.2Confident70.4Confident4 Ų463.4 Ų63.42%0.02133%0.325CS..Hα-helixtrans-59.7-42.9171.7-67.9-33.4000110.8Y167 N282 R295 A296 F297Y167-N293 HydrophobicContact CD1-CB 4.28Å; Y167-N293 HydrophobicContact CE1-CB 4.2Å; N282-N293 PolarHBondContact ND2-OD1 2.82Å; N293-R295 PolarHBondContact O-N 3.5Å; N293-A296 WeakPolarHBondContact O-CB 3.28Å; N293-A296 PolarHBondContact O-N 3.41Å; N293-F297 HydrophobicContact CB-CE2 4.03Å; N293-F297 HydrophobicContact CB-CZ 4.5Å; N293-F297 WeakPolarHBondContact O-CD2 3.26Å; N293-F297 WeakPolarHBondContact O-CG 3.39Å; N293-F297 PolarHBondContact O-N 2.88Å
294F72.4Confident70.5Confident34 Ų3463.6 Ų63.615%0.14932%0.323CS..Hα-helixtrans-62.8-38.5176.7-176.5-125000113.5C168 P169 W172 D290 E291 E292 F297 R298C168-F294 WeakPolarHBondContact O-CD2 3.37Å; C168-F294 WeakPolarHBondContact O-CG 3.46Å; P169-F294 HydrophobicContact CG-CZ 4.35Å; W172-F294 AromaticContact CE3-CD2 3.99Å; W172-F294 HydrophobicContact CE3-CD2 3.99Å; W172-F294 AromaticContact CE3-CE2 3.97Å; W172-F294 HydrophobicContact CE3-CE2 3.97Å; W172-F294 HydrophobicContact CZ3-CD2 4.31Å; W172-F294 HydrophobicContact CZ3-CE2 4.27Å; D290-F294 WeakPolarHBondContact O-CB 3.19Å; D290-F294 PolarHBondContact O-N 3.48Å; E291-F294 PolarHBondContact O-N 3.28Å; E292-F294 VanDerWaalsContact C-N 3.31Å; E292-F294 PolarHBondContact O-N 2.89Å; F294-F297 PolarHBondContact O-N 2.89Å; F294-R298 HydrophobicContact CE2-CG 4.49Å; F294-R298 HydrophobicContact CZ-CG 4.4Å; F294-R298 WeakPolarHBondContact O-CG 3.38Å; F294-R298 PolarHBondContact O-N 3.1Å
295R72.9Confident70.9Confident157 Ų15758.1 Ų58.159%0.59229%0.29SS*.Hα-helixtrans-63.5-44.5173.6-168.6-176.4-61.51673.3111.2E291 E292 N293 F297 R298 F299E291-R295 PolarHBondContact O-N 3.46Å; E292-R295 PolarHBondContact O-N 3.3Å; N293-R295 PolarHBondContact O-N 3.5Å; R295-F297 VanDerWaalsContact C-N 3.32Å; R295-F297 PolarHBondContact O-N 3.03Å; R295-R298 WeakPolarHBondContact O-CB 3.34Å; R295-R298 PolarHBondContact O-N 3.15Å; R295-F299 HydrophobicContact CG-CD2 4.25Å; R295-F299 HydrophobicContact CG-CE2 3.95Å; R295-F299 VanDerWaalsContact O-CD2 3.27Å; R295-F299 WeakPolarHBondContact O-CD2 3.36Å; R295-F299 PolarHBondContact O-N 3.33Å
296A76.2Confident71.2Confident7 Ų754 Ų546%0.05827%0.274CS..Hα-helixtrans-60.6-43.3176.900000111.6P274 A278 E292 N293 R298 F299 Y300P274-A296 HydrophobicContact CB-CB 4.24Å; A278-A296 HydrophobicContact CB-CB 4.01Å; E292-A296 PolarHBondContact O-N 3.48Å; N293-A296 WeakPolarHBondContact O-CB 3.28Å; N293-A296 PolarHBondContact O-N 3.41Å; A296-R298 PolarHBondContact O-N 3.45Å; A296-F299 PolarHBondContact O-N 2.91Å; A296-Y300 PolarHBondContact O-N 2.77Å; A296-Y300 VanDerWaalsContact O-N 3.12Å
297F75.1Confident71.5Confident1 Ų151.3 Ų51.30%0.00426%0.257CS..Hα-helixtrans-63.3-41.9175-58.7-50.7000112Y167 W172 F174 M177 L275 N293 F294 R295 F299 Y300 S301Y167-F297 AromaticContact CD1-CE2 3.69Å; Y167-F297 HydrophobicContact CD1-CE2 3.69Å; Y167-F297 HydrophobicContact CD1-CZ 4.26Å; Y167-F297 AromaticContact CD2-CE2 3.71Å; Y167-F297 HydrophobicContact CD2-CE2 3.71Å; Y167-F297 AromaticContact CD2-CZ 3.92Å; Y167-F297 HydrophobicContact CD2-CZ 3.92Å; Y167-F297 HydrophobicContact CE1-CE2 4.01Å; Y167-F297 HydrophobicContact CE1-CZ 4.14Å; Y167-F297 HydrophobicContact CE2-CE2 4.05Å; Y167-F297 AromaticContact CE2-CZ 3.81Å; Y167-F297 HydrophobicContact CE2-CZ 3.81Å; Y167-F297 AromaticContact CG-CE2 3.52Å; Y167-F297 HydrophobicContact CG-CE2 3.52Å; Y167-F297 HydrophobicContact CG-CZ 4.15Å; Y167-F297 AromaticContact CZ-CZ 3.91Å; W172-F297 HydrophobicContact CD2-CB 4.39Å; W172-F297 HydrophobicContact CE3-CB 3.47Å; W172-F297 VanDerWaalsContact CE3-CB 3.47Å; W172-F297 HydrophobicContact CE3-CD2 4.06Å; W172-F297 HydrophobicContact CE3-CG 4.06Å; W172-F297 HydrophobicContact CH2-CB 3.27Å; W172-F297 HydrophobicContact CH2-CG 4.38Å; W172-F297 WeakPolarHBondContact CH2-O 3.25Å; W172-F297 HydrophobicContact CZ2-CB 4.14Å; W172-F297 VanDerWaalsContact CZ3-C 3.48Å; W172-F297 HydrophobicContact CZ3-CB 2.91Å; W172-F297 HydrophobicContact CZ3-CD2 4.36Å; W172-F297 AromaticContact CZ3-CG 3.96Å; W172-F297 HydrophobicContact CZ3-CG 3.96Å; F174-F297 HydrophobicContact CB-CE1 3.92Å; F174-F297 HydrophobicContact CB-CZ 3.82Å; F174-F297 HydrophobicContact CD1-CD1 4.4Å; F174-F297 AromaticContact CD1-CE1 3.35Å; F174-F297 HydrophobicContact CD1-CE1 3.35Å; F174-F297 AromaticContact CD1-CZ 3.76Å; F174-F297 HydrophobicContact CD1-CZ 3.76Å; F174-F297 HydrophobicContact CD2-CE1 4.13Å; F174-F297 AromaticContact CE1-CE1 3.82Å; F174-F297 HydrophobicContact CE1-CE1 3.82Å; F174-F297 HydrophobicContact CG-CD1 4.3Å; F174-F297 AromaticContact CG-CE1 3.51Å; F174-F297 HydrophobicContact CG-CE1 3.51Å; F174-F297 AromaticContact CG-CZ 3.91Å; F174-F297 HydrophobicContact CG-CZ 3.91Å; F174-F297 HydrophobicContact CZ-CE1 4.39Å; M177-F297 HydrophobicContact CE-CD1 4.43Å; M177-F297 HydrophobicContact CE-CE1 3.32Å; M177-F297 HydrophobicContact CE-CZ 3.65Å; L275-F297 HydrophobicContact CD1-CD1 3.37Å; L275-F297 HydrophobicContact CD1-CE1 3.5Å; N293-F297 HydrophobicContact CB-CE2 4.03Å; N293-F297 HydrophobicContact CB-CZ 4.5Å; N293-F297 WeakPolarHBondContact O-CD2 3.26Å; N293-F297 WeakPolarHBondContact O-CG 3.39Å; N293-F297 PolarHBondContact O-N 2.88Å; F294-F297 PolarHBondContact O-N 2.89Å; R295-F297 VanDerWaalsContact C-N 3.32Å; R295-F297 PolarHBondContact O-N 3.03Å; F297-F299 VanDerWaalsContact C-N 3.3Å; F297-F299 PolarHBondContact O-N 2.97Å; F297-Y300 WeakPolarHBondContact O-CA 3.38Å; F297-Y300 WeakPolarHBondContact O-CB 3.17Å; F297-Y300 PolarHBondContact O-N 3.43Å; F297-S301 PolarHBondContact O-N 2.89Å
298R76.7Confident71.9Confident124 Ų12449.7 Ų49.747%0.46825%0.249SC..Hα-helixtrans-54.8-45.2176-78.3177.8175.7-179-3.7112F294 R295 A296 Y300 S301 L302F294-R298 HydrophobicContact CE2-CG 4.49Å; F294-R298 HydrophobicContact CZ-CG 4.4Å; F294-R298 WeakPolarHBondContact O-CG 3.38Å; F294-R298 PolarHBondContact O-N 3.1Å; R295-R298 WeakPolarHBondContact O-CB 3.34Å; R295-R298 PolarHBondContact O-N 3.15Å; A296-R298 PolarHBondContact O-N 3.45Å; R298-Y300 VanDerWaalsContact C-N 3.31Å; R298-Y300 PolarHBondContact O-N 3.29Å; R298-S301 PolarHBondContact O-N 2.87Å; R298-L302 WeakPolarHBondContact O-CG 3.32Å; R298-L302 PolarHBondContact O-N 3.32Å
299F76.5Confident72.6Confident83 Ų8347.4 Ų47.436%0.36422%0.224SC..Hα-helixtrans-61-40.8175.2-80.8-74.4000112.2C271 P274 R295 A296 F297 L302C271-F299 VanDerWaalsContact CB-O 3.27Å; C271-F299 WeakPolarHBondContact CB-O 3.46Å; C271-F299 CarbonylContact O-C 3.59Å; C271-F299 PolarHBondContact SG-O 3.3Å; P274-F299 HydrophobicContact CB-CB 4.4Å; P274-F299 HydrophobicContact CG-CB 4.09Å; P274-F299 HydrophobicContact CG-CD2 4.38Å; P274-F299 HydrophobicContact CG-CG 4.22Å; R295-F299 HydrophobicContact CG-CD2 4.25Å; R295-F299 HydrophobicContact CG-CE2 3.95Å; R295-F299 VanDerWaalsContact O-CD2 3.27Å; R295-F299 WeakPolarHBondContact O-CD2 3.36Å; R295-F299 PolarHBondContact O-N 3.33Å; A296-F299 PolarHBondContact O-N 2.91Å; F297-F299 VanDerWaalsContact C-N 3.3Å; F297-F299 PolarHBondContact O-N 2.97Å; F299-L302 HydrophobicContact CD1-CD1 4.47Å; F299-L302 WeakPolarHBondContact O-CB 3.45Å; F299-L302 PolarHBondContact O-N 3.45Å
300Y79.4Confident72.9Confident14 Ų1446.3 Ų46.36%0.05521%0.212CC..Hα-helixtrans-63.2-43.1176.7-171.8-114.1000113G106 C271 L275 A296 F297 R298 L302 N303G106-Y300 WeakPolarHBondContact CA-OH 3.1Å; G106-Y300 PolarHBondContact O-OH 3.2Å; C271-Y300 WeakPolarHBondContact O-CA 3.28Å; C271-Y300 PolarHBondContact O-N 3.02Å; L275-Y300 HydrophobicContact CB-CD2 4.36Å; L275-Y300 HydrophobicContact CD2-CD1 3.76Å; L275-Y300 HydrophobicContact CD2-CD2 3.47Å; L275-Y300 VanDerWaalsContact CD2-CD2 3.47Å; L275-Y300 HydrophobicContact CD2-CE1 3.96Å; L275-Y300 HydrophobicContact CD2-CE2 3.7Å; L275-Y300 HydrophobicContact CD2-CG 3.49Å; L275-Y300 VanDerWaalsContact CD2-CG 3.49Å; A296-Y300 PolarHBondContact O-N 2.77Å; A296-Y300 VanDerWaalsContact O-N 3.12Å; F297-Y300 WeakPolarHBondContact O-CA 3.38Å; F297-Y300 WeakPolarHBondContact O-CB 3.17Å; F297-Y300 PolarHBondContact O-N 3.43Å; R298-Y300 VanDerWaalsContact C-N 3.31Å; R298-Y300 PolarHBondContact O-N 3.29Å; Y300-L302 PolarHBondContact O-N 2.92Å; Y300-N303 WeakPolarHBondContact O-CB 3.5Å; Y300-N303 PolarHBondContact O-N 3.29Å
301S75.1Confident72.9Confident46 Ų4646.6 Ų46.632%0.32221%0.213SC..Hα-helixtrans-66.1-19.2175.9-82.40000114.5W172 F297 R298 N303 P304 I305W172-S301 WeakPolarHBondContact CH2-OG 3.43Å; W172-S301 WeakPolarHBondContact CZ2-OG 3.47Å; F297-S301 PolarHBondContact O-N 2.89Å; R298-S301 PolarHBondContact O-N 2.87Å; S301-N303 PolarHBondContact O-N 2.93Å; S301-P304 WeakPolarHBondContact O-CD 3.46Å; S301-I305 WeakPolarHBondContact O-CD1 3.32Å
302L75.8Confident72.7Confident39 Ų3940.3 Ų40.320%0.20418%0.184CC..THydrogen-bonded Turntrans-73-19.2173.4-68.1172.1000112.1F25 R298 F299 Y300 I305 M306F25-L302 HydrophobicContact CD1-CD2 3.77Å; F25-L302 HydrophobicContact CE1-CD2 3.67Å; F25-L302 HydrophobicContact CG-CD2 4.3Å; F25-L302 HydrophobicContact CZ-CD2 4.07Å; R298-L302 WeakPolarHBondContact O-CG 3.32Å; R298-L302 PolarHBondContact O-N 3.32Å; F299-L302 HydrophobicContact CD1-CD1 4.47Å; F299-L302 WeakPolarHBondContact O-CB 3.45Å; F299-L302 PolarHBondContact O-N 3.45Å; Y300-L302 PolarHBondContact O-N 2.92Å; L302-I305 HydrophobicContact CD2-CD1 4.24Å; L302-I305 PolarHBondContact O-N 3.3Å; L302-M306 HydrophobicContact CB-CG 4.47Å; L302-M306 WeakPolarHBondContact O-CB 3.49Å; L302-M306 VanDerWaalsContact O-CG 3.28Å; L302-M306 WeakPolarHBondContact O-CG 3.38Å; L302-M306 PolarHBondContact O-N 3.45Å
303N78Confident72.2Confident7 Ų740 Ų404%0.03718%0.184CC..Hα-helixtrans-56.3-60.8-179.3-166.576.7000112.7F268 C271 Y300 S301 I305 M306 D307F268-N303 WeakPolarHBondContact CA-OD1 3.3Å; C271-N303 HydrophobicContact CB-CB 3.82Å; Y300-N303 WeakPolarHBondContact O-CB 3.5Å; Y300-N303 PolarHBondContact O-N 3.29Å; S301-N303 PolarHBondContact O-N 2.93Å; N303-I305 PolarHBondContact O-N 2.94Å; N303-I305 VanDerWaalsContact O-N 3.1Å; N303-M306 PolarHBondContact O-N 3.48Å; N303-D307 PolarHBondContact ND2-OD2 3.49Å; N303-D307 WeakPolarHBondContact O-CB 3.34Å; N303-D307 PolarHBondContact O-N 3.41Å
304P71.8Confident71.6Confident31 Ų3144.5 Ų44.520%0.20120%0.204CC..Hα-helixtrans-66.3-15.217928.1-37.6000114N33 D65 S301 P308N33-P304 PolarHBondContact ND2-O 3.32Å; D65-P304 HydrophobicContact CB-CB 3.76Å; S301-P304 WeakPolarHBondContact O-CD 3.46Å; P304-P308 VanDerWaalsContact O-CD 3.28Å; P304-P308 WeakPolarHBondContact O-CD 3.29Å
305I75.8Confident71.2Confident16 Ų1644.4 Ų44.48%0.08220%0.203CC..Hα-helixtrans-79.1-49.5174.4-62.3168.8000109.4F25 L28 S301 L302 N303 P308F25-I305 HydrophobicContact CB-CD1 3.82Å; F25-I305 HydrophobicContact CG-CD1 4.47Å; F25-I305 WeakPolarHBondContact O-CD1 3.47Å; L28-I305 HydrophobicContact CB-CG2 4.1Å; S301-I305 WeakPolarHBondContact O-CD1 3.32Å; L302-I305 HydrophobicContact CD2-CD1 4.24Å; L302-I305 PolarHBondContact O-N 3.3Å; N303-I305 PolarHBondContact O-N 2.94Å; N303-I305 VanDerWaalsContact O-N 3.1Å; I305-P308 WeakPolarHBondContact O-CD 3.33Å; I305-P308 VanDerWaalsContact O-CG 3.31Å; I305-P308 WeakPolarHBondContact O-CG 3.48Å
306M72Confident70.3Confident78 Ų7841.2 Ų41.238%0.38419%0.193SC..Hα-helixtrans-76.9-34.4-172.4-67.3-59.1-63.200112.9I267 L302 N303 W309 V310I267-M306 HydrophobicContact CG2-CB 3.76Å; L302-M306 HydrophobicContact CB-CG 4.47Å; L302-M306 WeakPolarHBondContact O-CB 3.49Å; L302-M306 VanDerWaalsContact O-CG 3.28Å; L302-M306 WeakPolarHBondContact O-CG 3.38Å; L302-M306 PolarHBondContact O-N 3.45Å; N303-M306 PolarHBondContact O-N 3.48Å; M306-W309 PolarHBondContact O-N 3.28Å; M306-W309 VanDerWaalsContact O-N 3.15Å; M306-V310 WeakPolarHBondContact O-CG2 3.34Å; M306-V310 PolarHBondContact O-N 2.84Å
307D70.8Confident69.3Low0 Ų042.9 Ų42.90%020%0.204CC..Hα-helixtrans-48.2-57.4-179.3-75.2-18.1000112.7N303 W309 V310 F311N303-D307 PolarHBondContact ND2-OD2 3.49Å; N303-D307 WeakPolarHBondContact O-CB 3.34Å; N303-D307 PolarHBondContact O-N 3.41Å; D307-W309 PolarHBondContact O-N 2.98Å; D307-V310 PolarHBondContact O-N 2.75Å; D307-F311 WeakPolarHBondContact O-CD2 3.38Å; D307-F311 PolarHBondContact O-N 2.79Å; D307-F311 VanDerWaalsContact O-N 3.13Å
308P69.6Low68.3Low0 Ų043.1 Ų43.10%021%0.206CC..Hα-helixtrans-62.9-36179.926.4-38.1000113.9N33 A36 P304 I305 V310 F311 I312N33-P308 WeakPolarHBondContact OD1-CG 3.4Å; A36-P308 HydrophobicContact CB-CB 3.76Å; P304-P308 VanDerWaalsContact O-CD 3.28Å; P304-P308 WeakPolarHBondContact O-CD 3.29Å; I305-P308 WeakPolarHBondContact O-CD 3.33Å; I305-P308 VanDerWaalsContact O-CG 3.31Å; I305-P308 WeakPolarHBondContact O-CG 3.48Å; P308-V310 VanDerWaalsContact C-N 3.3Å; P308-V310 PolarHBondContact O-N 3.46Å; P308-F311 WeakPolarHBondContact O-CB 3.4Å; P308-F311 PolarHBondContact O-N 3.22Å; P308-I312 WeakPolarHBondContact O-CB 3.27Å; P308-I312 WeakPolarHBondContact O-CD1 3.48Å; P308-I312 WeakPolarHBondContact O-CG1 3.31Å; P308-I312 PolarHBondContact O-N 3.15Å
309W69.2Low67.3Low62 Ų6243.5 Ų43.524%0.23521%0.211CC..Hα-helixtrans-66.3-36.1178.9-68.8109.9000111.7L28 V31 M306 D307 I312 I313L28-W309 HydrophobicContact CD2-CZ2 4.01Å; L28-W309 PolarHBondContact O-NE1 3.18Å; V31-W309 HydrophobicContact CG1-CH2 4.45Å; M306-W309 PolarHBondContact O-N 3.28Å; M306-W309 VanDerWaalsContact O-N 3.15Å; D307-W309 PolarHBondContact O-N 2.98Å; W309-I312 PolarHBondContact O-N 2.75Å; W309-I313 HydrophobicContact CB-CD1 4.27Å; W309-I313 VanDerWaalsContact O-CB 3.27Å; W309-I313 WeakPolarHBondContact O-CB 3.39Å; W309-I313 WeakPolarHBondContact O-CG1 3.44Å; W309-I313 PolarHBondContact O-N 3.48Å
310V68.6Low66.4Low4 Ų447.9 Ų47.92%0.02423%0.225CC..Hα-helixtrans-67.6-42.6176.1179.40000110.2L263 I264 I267 M306 D307 P308 I312 F314L263-V310 HydrophobicContact CB-CG1 3.76Å; I264-V310 HydrophobicContact CG1-CB 4.3Å; I264-V310 HydrophobicContact CG1-CG1 3.78Å; I267-V310 HydrophobicContact CD1-CB 4.32Å; I267-V310 HydrophobicContact CD1-CG1 4.36Å; I267-V310 HydrophobicContact CD1-CG2 3.11Å; M306-V310 WeakPolarHBondContact O-CG2 3.34Å; M306-V310 PolarHBondContact O-N 2.84Å; D307-V310 PolarHBondContact O-N 2.75Å; P308-V310 VanDerWaalsContact C-N 3.3Å; P308-V310 PolarHBondContact O-N 3.46Å; V310-I312 VanDerWaalsContact C-N 3.31Å; V310-I312 PolarHBondContact O-N 3.31Å; V310-F314 HydrophobicContact CG1-CD2 3.95Å; V310-F314 HydrophobicContact CG1-CE2 4.5Å; V310-F314 WeakPolarHBondContact O-CB 3.43Å; V310-F314 PolarHBondContact O-N 2.97Å
311F65.9Low65.3Low14 Ų1449.1 Ų49.16%0.06123%0.232CC..Hα-helixtrans-59.3-39.6172.6-78-74.2000112.6V58 L61 M260 I264 D307 P308 R315V58-F311 HydrophobicContact CB-CE1 4.17Å; V58-F311 HydrophobicContact CB-CZ 4.41Å; V58-F311 HydrophobicContact CG1-CD1 3.85Å; V58-F311 HydrophobicContact CG1-CE1 3.48Å; V58-F311 VanDerWaalsContact CG1-CE1 3.48Å; V58-F311 HydrophobicContact CG1-CE2 4.46Å; V58-F311 HydrophobicContact CG1-CG 4.48Å; V58-F311 HydrophobicContact CG1-CZ 3.83Å; V58-F311 HydrophobicContact CG2-CE1 3.53Å; V58-F311 HydrophobicContact CG2-CZ 3.9Å; L61-F311 HydrophobicContact CD2-CE2 3.75Å; L61-F311 HydrophobicContact CD2-CZ 4Å; M260-F311 HydrophobicContact CE-CD1 3.42Å; M260-F311 VanDerWaalsContact CE-CD1 3.42Å; M260-F311 HydrophobicContact CE-CE1 3.49Å; M260-F311 VanDerWaalsContact CE-CE1 3.49Å; M260-F311 HydrophobicContact CG-CD1 4.19Å; M260-F311 HydrophobicContact SD-CB 4.47Å; M260-F311 HydrophobicContact SD-CD1 3.47Å; M260-F311 WeakPolarHBondContact SD-CD1 3.42Å; M260-F311 HydrophobicContact SD-CE1 4.14Å; M260-F311 HydrophobicContact SD-CG 4.34Å; I264-F311 HydrophobicContact CD1-CD1 3.78Å; I264-F311 HydrophobicContact CD1-CD2 4.07Å; I264-F311 HydrophobicContact CD1-CE1 3.27Å; I264-F311 HydrophobicContact CD1-CE2 3.57Å; I264-F311 HydrophobicContact CD1-CG 4.14Å; I264-F311 HydrophobicContact CD1-CZ 3.15Å; I264-F311 HydrophobicContact CG1-CE2 4.18Å; I264-F311 HydrophobicContact CG1-CZ 4.2Å; D307-F311 WeakPolarHBondContact O-CD2 3.38Å; D307-F311 PolarHBondContact O-N 2.79Å; D307-F311 VanDerWaalsContact O-N 3.13Å; P308-F311 WeakPolarHBondContact O-CB 3.4Å; P308-F311 PolarHBondContact O-N 3.22Å; F311-R315 WeakPolarHBondContact O-CB 3.49Å
312I62.2Low64.5Low15 Ų1549.7 Ų49.78%0.07723%0.231CC..Hα-helixtrans-76.5-49.3-177.4-67.4162.1000111.7L35 A36 I39 P308 W309 V310 V318L35-I312 HydrophobicContact CB-CD1 4.05Å; L35-I312 HydrophobicContact CD2-CD1 3.98Å; L35-I312 HydrophobicContact CG-CD1 3.93Å; A36-I312 HydrophobicContact CB-CD1 3.93Å; A36-I312 HydrophobicContact CB-CG1 4.11Å; I39-I312 HydrophobicContact CD1-CG1 4.12Å; I39-I312 HydrophobicContact CD1-CG2 4.26Å; P308-I312 WeakPolarHBondContact O-CB 3.27Å; P308-I312 WeakPolarHBondContact O-CD1 3.48Å; P308-I312 WeakPolarHBondContact O-CG1 3.31Å; P308-I312 PolarHBondContact O-N 3.15Å; W309-I312 PolarHBondContact O-N 2.75Å; V310-I312 VanDerWaalsContact C-N 3.31Å; V310-I312 PolarHBondContact O-N 3.31Å; I312-V318 HydrophobicContact CG2-CG1 4.16Å
313I61Low63.7Low103 Ų10350.2 Ų50.253%0.52824%0.237SC..Hα-helixtrans-71.5-42.9-171.1-67.4167.7000111W309W309-I313 HydrophobicContact CB-CD1 4.27Å; W309-I313 VanDerWaalsContact O-CB 3.27Å; W309-I313 WeakPolarHBondContact O-CB 3.39Å; W309-I313 WeakPolarHBondContact O-CG1 3.44Å; W309-I313 PolarHBondContact O-N 3.48Å
314F58.5Low62.7Low100 Ų10052.7 Ų52.744%0.43926%0.255SS..Hα-helixtrans-90.5-7.8-171.6-69.1-79.4000114.1L263 V310 K316L263-F314 HydrophobicContact CD1-CB 4.05Å; L263-F314 HydrophobicContact CD1-CD1 3.49Å; L263-F314 VanDerWaalsContact CD1-CD1 3.49Å; L263-F314 HydrophobicContact CD1-CD2 3.71Å; L263-F314 HydrophobicContact CD1-CE1 3.77Å; L263-F314 HydrophobicContact CD1-CE2 3.98Å; L263-F314 HydrophobicContact CD1-CG 3.45Å; L263-F314 VanDerWaalsContact CD1-CG 3.45Å; L263-F314 HydrophobicContact CD1-CZ 4Å; V310-F314 HydrophobicContact CG1-CD2 3.95Å; V310-F314 HydrophobicContact CG1-CE2 4.5Å; V310-F314 WeakPolarHBondContact O-CB 3.43Å; V310-F314 PolarHBondContact O-N 2.97Å; F314-K316 PolarHBondContact O-N 3.16Å
315R63.9Low62.1Low31 Ų3154.6 Ų54.612%0.11726%0.263CS..  trans-86.1101.2175.7-167.9169.3174.1-170.92.7110M260 F311 S317 V318 F319M260-R315 HydrophobicContact SD-CB 4.24Å; F311-R315 WeakPolarHBondContact O-CB 3.49Å; R315-S317 WeakPolarHBondContact CG-OG 3.08Å; R315-S317 PolarHBondContact NE-OG 3.43Å; R315-S317 VanDerWaalsContact NE-OG 3.12Å; R315-S317 PolarHBondContact O-N 3.3Å; R315-S317 VanDerWaalsContact O-N 3.1Å; R315-V318 HydrophobicContact CB-CB 4.1Å; R315-V318 HydrophobicContact CB-CG2 3.85Å; R315-V318 HydrophobicContact CG-CB 4.37Å; R315-V318 HydrophobicContact CG-CG2 3.75Å; R315-V318 WeakPolarHBondContact O-CA 3.49Å; R315-V318 WeakPolarHBondContact O-CB 3.34Å; R315-V318 PolarHBondContact O-N 3.44Å; R315-F319 PolarHBondContact O-N 2.86Å
316K55.2Low61.4Low90 Ų9058.2 Ų58.239%0.39128%0.282SS..Hα-helixtrans-52.7-33.6178.4-73.5-175.1-168.9139.60113.9D256 F314 V318 R320D256-K316 IonicContact OD1-NZ 3.1Å; D256-K316 PolarHBondContact OD1-NZ 3.36Å; D256-K316 VanDerWaalsContact OD1-NZ 3.1Å; D256-K316 WeakPolarHBondContact OD2-CD 3.26Å; D256-K316 IonicContact OD2-NZ 3.86Å; F314-K316 PolarHBondContact O-N 3.16Å; K316-V318 VanDerWaalsContact C-N 3.28Å; K316-V318 PolarHBondContact O-N 2.88Å; K316-R320 WeakPolarHBondContact O-CB 3.07Å; K316-R320 PolarHBondContact O-N 2.77Å
317S54.7Low60.7Low42 Ų4258.3 Ų58.329%0.29429%0.29SS..Hα-helixtrans-66-32.8176.971.40000112.1R315 H321R315-S317 WeakPolarHBondContact CG-OG 3.08Å; R315-S317 PolarHBondContact NE-OG 3.43Å; R315-S317 VanDerWaalsContact NE-OG 3.12Å; R315-S317 PolarHBondContact O-N 3.3Å; R315-S317 VanDerWaalsContact O-N 3.1Å; S317-H321 WeakPolarHBondContact O-CB 3.07Å; S317-H321 PolarHBondContact O-N 3.27Å; S317-H321 VanDerWaalsContact O-N 3.17Å
318V54.5Low59.7Low6 Ų662.3 Ų62.34%0.03632%0.317CS..Hα-helixtrans-76.9-45.6177.61730000110.5I39 I312 R315 K316 R320 H321 L322I39-V318 HydrophobicContact CD1-CG1 3.66Å; I39-V318 HydrophobicContact CG1-CG1 4.3Å; I39-V318 HydrophobicContact CG2-CB 4.05Å; I39-V318 HydrophobicContact CG2-CG1 3.58Å; I39-V318 HydrophobicContact CG2-CG2 3.39Å; I312-V318 HydrophobicContact CG2-CG1 4.16Å; R315-V318 HydrophobicContact CB-CB 4.1Å; R315-V318 HydrophobicContact CB-CG2 3.85Å; R315-V318 HydrophobicContact CG-CB 4.37Å; R315-V318 HydrophobicContact CG-CG2 3.75Å; R315-V318 WeakPolarHBondContact O-CA 3.49Å; R315-V318 WeakPolarHBondContact O-CB 3.34Å; R315-V318 PolarHBondContact O-N 3.44Å; K316-V318 VanDerWaalsContact C-N 3.28Å; K316-V318 PolarHBondContact O-N 2.88Å; V318-R320 VanDerWaalsContact C-N 3.32Å; V318-R320 PolarHBondContact O-N 3.48Å; V318-H321 CarbonylContact O-C 3.6Å; V318-H321 PolarHBondContact O-N 3.03Å; V318-H321 VanDerWaalsContact O-N 3.11Å; V318-L322 WeakPolarHBondContact O-CB 3.29Å; V318-L322 PolarHBondContact O-N 3.28Å
319F55.2Low58.7Low132 Ų13272.7 Ų72.758%0.57936%0.356SS*.Hα-helixtrans-57.3-45.4175-174.3-99.2000111.7R315 H321 L322 C323R315-F319 PolarHBondContact O-N 2.86Å; F319-H321 VanDerWaalsContact C-N 3.34Å; F319-H321 PolarHBondContact O-N 3.34Å; F319-L322 PolarHBondContact O-N 2.94Å; F319-C323 WeakPolarHBondContact O-CB 3.34Å; F319-C323 PolarHBondContact O-N 2.77Å; F319-C323 PolarHBondContact O-SG 2.93Å
320R56.8Low57.4Low176 Ų17678.3 Ų78.366%0.66438%0.383SS*.Hα-helixtrans-60.9-40.2174.6-108.9-177.5-68.6-136.41.9113K316 V318 S324K316-R320 WeakPolarHBondContact O-CB 3.07Å; K316-R320 PolarHBondContact O-N 2.77Å; V318-R320 VanDerWaalsContact C-N 3.32Å; V318-R320 PolarHBondContact O-N 3.48Å; R320-S324 VanDerWaalsContact O-CB 3.26Å; R320-S324 WeakPolarHBondContact O-CB 3.45Å; R320-S324 PolarHBondContact O-N 3.16Å
321H57.5Low56.2Low40 Ų4080.7 Ų80.719%0.18541%0.408CS..Hα-helixtrans-73.8-37.6179.8-162.265.4000112.1V42 E46 S317 V318 F319 S324 L325V42-H321 VanDerWaalsContact CG1-NE2 3.34Å; V42-H321 WeakPolarHBondContact CG1-NE2 3.47Å; E46-H321 IonicContact OE2-CE1 2.73Å; E46-H321 PolarHBondContact OE2-CE1 3.04Å; E46-H321 IonicContact OE2-ND1 2.77Å; E46-H321 IonicContact OE2-NE2 3.19Å; S317-H321 WeakPolarHBondContact O-CB 3.07Å; S317-H321 PolarHBondContact O-N 3.27Å; S317-H321 VanDerWaalsContact O-N 3.17Å; V318-H321 CarbonylContact O-C 3.6Å; V318-H321 PolarHBondContact O-N 3.03Å; V318-H321 VanDerWaalsContact O-N 3.11Å; F319-H321 VanDerWaalsContact C-N 3.34Å; F319-H321 PolarHBondContact O-N 3.34Å; H321-S324 PolarHBondContact O-N 3.34Å; H321-L325 WeakPolarHBondContact O-CB 3.07Å; H321-L325 VanDerWaalsContact O-CG 3.28Å; H321-L325 WeakPolarHBondContact O-CG 3.3Å; H321-L325 PolarHBondContact O-N 3.02Å
322L58.4Low54.9Low58 Ų5889.5 Ų89.530%0.30445%0.447SS..Hα-helixtrans-63.1-46.4173.2-145.391.4000110.4I39 V318 F319 L325 L326I39-L322 HydrophobicContact CD1-CD1 4Å; V318-L322 WeakPolarHBondContact O-CB 3.29Å; V318-L322 PolarHBondContact O-N 3.28Å; F319-L322 PolarHBondContact O-N 2.94Å; L322-L325 PolarHBondContact O-N 3.05Å; L322-L326 HydrophobicContact CD2-CD1 4.36Å; L322-L326 HydrophobicContact CG-CD1 4.45Å; L322-L326 VanDerWaalsContact O-CB 3.32Å; L322-L326 WeakPolarHBondContact O-CB 3.48Å; L322-L326 WeakPolarHBondContact O-CD1 3.46Å; L322-L326 WeakPolarHBondContact O-CG 3.38Å; L322-L326 PolarHBondContact O-N 3.33Å
323C59.1Low53.7Low49 Ų4992.5 Ų92.533%0.33148%0.481SS..Hα-helixtrans-60.9-44172.6-71.20000111.5F319 L325 L326 S327F319-C323 WeakPolarHBondContact O-CB 3.34Å; F319-C323 PolarHBondContact O-N 2.77Å; F319-C323 PolarHBondContact O-SG 2.93Å; C323-L325 PolarHBondContact O-N 3.34Å; C323-L326 PolarHBondContact O-N 3.29Å; C323-S327 VanDerWaalsContact O-CB 3.28Å; C323-S327 WeakPolarHBondContact O-CB 3.22Å; C323-S327 PolarHBondContact O-N 2.98Å; C323-S327 PolarHBondContact O-OG 3.21Å
324S56.6Low52.7Low59 Ų5991.7 Ų91.741%0.41349%0.49SS..Hα-helixtrans-62.9-41.5176.71750000112.5R320 H321 S327 C328R320-S324 VanDerWaalsContact O-CB 3.26Å; R320-S324 WeakPolarHBondContact O-CB 3.45Å; R320-S324 PolarHBondContact O-N 3.16Å; H321-S324 PolarHBondContact O-N 3.34Å; S324-S327 PolarHBondContact O-N 2.81Å; S324-C328 WeakPolarHBondContact O-CB 3.21Å; S324-C328 PolarHBondContact O-N 3.16Å; S324-C328 PolarHBondContact O-SG 3.41Å
325L59.5Low51.7Low71 Ų7195.6 Ų95.637%0.37251%0.512SS..Hα-helixtrans-67.4-38.8175.8-73.4171000112H321 L322 C323 C328 R329H321-L325 WeakPolarHBondContact O-CB 3.07Å; H321-L325 VanDerWaalsContact O-CG 3.28Å; H321-L325 WeakPolarHBondContact O-CG 3.3Å; H321-L325 PolarHBondContact O-N 3.02Å; L322-L325 PolarHBondContact O-N 3.05Å; C323-L325 PolarHBondContact O-N 3.34Å; L325-C328 PolarHBondContact O-N 3.19Å; L325-R329 WeakPolarHBondContact O-CB 3.49Å; L325-R329 WeakPolarHBondContact O-CG 3.26Å; L325-R329 PolarHBondContact O-N 3.38Å
326L61.1Low50.4Low93 Ų93104.4 Ų104.449%0.48755%0.551SS.*Hα-helixtrans-66.4-41.3173.2-72.2163.6000111L322 C323 R329 F330L322-L326 HydrophobicContact CD2-CD1 4.36Å; L322-L326 HydrophobicContact CG-CD1 4.45Å; L322-L326 VanDerWaalsContact O-CB 3.32Å; L322-L326 WeakPolarHBondContact O-CB 3.48Å; L322-L326 WeakPolarHBondContact O-CD1 3.46Å; L322-L326 WeakPolarHBondContact O-CG 3.38Å; L322-L326 PolarHBondContact O-N 3.33Å; C323-L326 PolarHBondContact O-N 3.29Å; L326-R329 PolarHBondContact O-N 3.36Å; L326-F330 WeakPolarHBondContact O-CB 3.35Å; L326-F330 PolarHBondContact O-N 3.42Å
327S56.4Low49.2Very low80 Ų80104.6 Ų104.656%0.55956%0.563SS**Hα-helixtrans-67.2-36.5174.8-62.20000112.6C323 S324 G331C323-S327 VanDerWaalsContact O-CB 3.28Å; C323-S327 WeakPolarHBondContact O-CB 3.22Å; C323-S327 PolarHBondContact O-N 2.98Å; C323-S327 PolarHBondContact O-OG 3.21Å; S324-S327 PolarHBondContact O-N 2.81Å; S327-G331 WeakPolarHBondContact O-CA 3.14Å; S327-G331 PolarHBondContact O-N 3.33Å
328C49.6Very low48.2Very low83 Ų83107.5 Ų107.556%0.56158%0.579SS**Hα-helixtrans-74.3-25.2174.5-73.20000113S324 L325S324-C328 WeakPolarHBondContact O-CB 3.21Å; S324-C328 PolarHBondContact O-N 3.16Å; S324-C328 PolarHBondContact O-SG 3.41Å; L325-C328 PolarHBondContact O-N 3.19Å
329R49Very low47Very low218 Ų218115.3 Ų115.382%0.82362%0.621SS**Hα-helixtrans-81.2-32171.8-77.7-173174.6-154.4-0.2112.9L325 L326L325-R329 WeakPolarHBondContact O-CB 3.49Å; L325-R329 WeakPolarHBondContact O-CG 3.26Å; L325-R329 PolarHBondContact O-N 3.38Å; L326-R329 PolarHBondContact O-N 3.36Å
330F42.2Very low46.1Very low180 Ų180117.3 Ų117.379%0.78963%0.632SS**Hα-helixtrans-82.1-20.3171.7-92-90.2000113.7L326 K332L326-F330 WeakPolarHBondContact O-CB 3.35Å; L326-F330 PolarHBondContact O-N 3.42Å; F330-K332 PolarHBondContact O-N 3.23Å
331G43.2Very low44.8Very low55 Ų55115 Ų11557%0.56764%0.641SS**THydrogen-bonded Turntrans-82.4-0.2-178.300000116.3S327S327-G331 WeakPolarHBondContact O-CA 3.14Å; S327-G331 PolarHBondContact O-N 3.33Å
332K38.3Very low43.6Very low199 Ų199117.1 Ų117.187%0.86567%0.666SS**THydrogen-bonded Turntrans-92.14.6177.6-82.6-172.3174.2-177.70114.8F330F330-K332 PolarHBondContact O-N 3.23Å
333G37.3Very low42.4Very low77 Ų77122.1 Ų122.179%0.79469%0.692SS**SBendtrans-105.8-7.6179.400000116.4
334A40.8Very low41Very low86 Ų86125 Ų12571%0.71171%0.712SS**SBendtrans-149.570.3-171.400000113.1
335M37.5Very low39.8Very low183 Ų183131.4 Ų131.490%0.90173%0.733SS**  trans-168.492.9143-118.4174.4150.600109.5
336K34.9Very low38.7Very low216 Ų216133.8 Ų133.894%0.93975%0.753SS**  trans-13180.7159.7-141.9-174.9-169.4-175.50107.4
337S31Very low37.4Very low93 Ų93137.7 Ų137.765%0.6577%0.773SS**  trans-173.4102.1135.2-147.90000107.3
338T33.8Very low36.2Very low103 Ų103140.9 Ų140.963%0.63278%0.784SS**  66.699.8102.2-270000112
339D29.5Very low35.5Very low171 Ų171145.4 Ų145.491%0.91480%0.797SS**  trans-142.5117141.9-92.2-32.3000109
340H36Very low34.8Very low174 Ų174139.7 Ų139.781%0.80679%0.79SS**  trans-63.6129.2169-81.4-87.4000109.2
341C29Very low34.7Very low127 Ų127138.4 Ų138.486%0.85879%0.79SS**  trans-134.796.5154-148.60000108.6
342A32.3Very low35Very low85 Ų85141.7 Ų141.770%0.70280%0.801SS**  trans-66.5132.2169.400000109.3S344A342-S344 PolarHBondContact O-N 3.4Å
343L32.4Very low35.2Very low162 Ų162143.1 Ų143.185%0.84880%0.801SS**  trans-64.9123.6164.6-106.684.3000109.4
344S30.8Very low35.1Very low110 Ų110146.5 Ų146.577%0.76980%0.801SS**  trans-140.6107.2156.719.40000109.4A342A342-S344 PolarHBondContact O-N 3.4Å
345F30.5Very low35.8Very low194 Ų194151.9 Ų151.985%0.85183%0.829SS**  trans-86.5134.5161.4-95.9-90.8000108.4
346P36.4Very low35.7Very low121 Ų121150.3 Ų150.379%0.78683%0.825SS**  trans-91.4125156.720.9-6.2000109.8
347L34.1Very low35.8Very low175 Ų175146.8 Ų146.892%0.91682%0.819SS**  trans-97.4113.8167.8-127.1155.5000105.6
348D32.2Very low36Very low147 Ų147149.8 Ų149.879%0.78683%0.828SS**  trans-129.9103.9174.5-142.8-7.8000108.6
349H35Very low36.1Very low177 Ų177152.6 Ų152.682%0.81984%0.84SS**  trans-143.8101.7159.5-125.8-52.5000107.9
350S34.7Very low36.6Very low99 Ų99151.4 Ų151.469%0.69284%0.835SS**  trans-72.9126.7172.441.60000110.7
351I39.8Very low36.6Very low153 Ų153149.9 Ų149.979%0.78584%0.837SS**  trans-133.7118.6156.4-60179.8000106.4
352P49.3Very low37.1Very low123 Ų123151.6 Ų151.680%0.79984%0.836SS**  trans-80.1137.3173.529.9-28.6000111
353R41.8Very low37.5Very low229 Ų229156.7 Ų156.786%0.86485%0.846SS**  trans-81.6144.2162.1-77.2-176.1-178.2170.40.7110.2
354N36.3Very low37.9Very low149 Ų149156.3 Ų156.380%0.79785%0.846SS**  158.6164.7119.4-84.8-17.3000110.3
355P54.6Low38.6Very low198 Ų198160.5 Ų160.5100%1.28685%0.853SS**  cis-107.50-21.214.37.1000113.4

Retrieved 355 of 355 residues in 246.7 ms (Link to these results)

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