A0A087X7A9_POEFO Loading...

Alkaline ceramidase

Hydrolyzes the sphingolipid ceramide into sphingosine and free fatty acid.

AlphaFold DB , UniProt , Accession A0A087X7A9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 267 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
1M46.2Very low65.8Low200 Ų200107.6 Ų107.699%0.98553%0.533SS*.  0120.20-88.3-177.6-106.500107.8
2A40.4Very low67.9Low18 Ų18101 Ų10115%0.14951%0.513CS..  trans-70.8133.5-176.800000112.9S4A2-S4 PolarHBondContact O-N 2.95Å
3P44.7Very low69.7Low82 Ų82109.1 Ų109.153%0.53253%0.533SS..  trans-82.2112.6174.828.3-29.3000113.1I5P3-I5 VanDerWaalsContact C-N 3.32Å; P3-I5 PolarHBondContact O-N 3.02Å
4S45.7Very low71.5Confident113 Ų113105.6 Ų105.679%0.7952%0.523SS*.SBendtrans21.114.9143.772.60000125.1A2 D6A2-S4 PolarHBondContact O-N 2.95Å; S4-D6 PolarHBondContact O-N 3.15Å
5I54.5Low73.1Confident165 Ų165103.7 Ų103.785%0.84652%0.519SS*.  trans-93.349.6162.6-48.6174.5000109.4P3P3-I5 VanDerWaalsContact C-N 3.32Å; P3-I5 PolarHBondContact O-N 3.02Å
6D61.2Low74.5Confident46 Ų4698.4 Ų98.425%0.24650%0.496CS..  trans-94.4130.8179.2-74.4-34.7000110.7S4 Q8 N24S4-D6 PolarHBondContact O-N 3.15Å; D6-Q8 PolarHBondContact O-N 3.37Å; D6-N24 HydrophobicContact CB-CB 3.83Å; D6-N24 VanDerWaalsContact CG-ND2 3.32Å; D6-N24 PolarHBondContact OD1-N 3.36Å; D6-N24 PolarHBondContact OD2-ND2 3.44Å
7R71.3Confident75.6Confident166 Ų16695.8 Ų95.863%0.62649%0.486SS*.  trans-62135.5176.9-68.4177.7-179.9173.40.9108.5G9 Y25R7-G9 PolarHBondContact O-N 3.4Å; R7-Y25 VanDerWaalsContact O-CD2 3.26Å; R7-Y25 WeakPolarHBondContact O-CD2 3.44Å
8Q81.2Confident76.5Confident149 Ų14991.6 Ų91.670%0.69647%0.465SS*.  trans-67.9109.6172.7-170.4172.23.300109.2D6D6-Q8 PolarHBondContact O-N 3.37Å
9G88.4Confident77.3Confident7 Ų788.6 Ų88.67%0.07245%0.45CS..  trans-95.6-172179.200000114.3R7 W11R7-G9 PolarHBondContact O-N 3.4Å; G9-W11 PolarHBondContact O-N 3.27Å
10Y95.5Very high78.2Confident132 Ų13285.4 Ų85.452%0.51843%0.432SS..THydrogen-bonded Turntrans-61-39.5-172.5-179.3-100.1000114.5G12 F29 Y30Y10-G12 VanDerWaalsContact C-N 3.28Å; Y10-G12 PolarHBondContact O-N 3.08Å; Y10-F29 VanDerWaalsContact CB-O 3.3Å; Y10-F29 WeakPolarHBondContact CB-O 3.3Å; Y10-F29 AromaticContact CD2-CE1 3.89Å; Y10-F29 HydrophobicContact CD2-CE1 3.89Å; Y10-F29 HydrophobicContact CG-CE1 4.38Å; Y10-F29 PolarHBondContact N-O 2.96Å; Y10-Y30 HydrophobicContact CD1-CD1 4.26Å; Y10-Y30 AromaticContact CD2-CD1 3.84Å; Y10-Y30 HydrophobicContact CD2-CD1 3.84Å; Y10-Y30 AromaticContact CD2-CE1 3.83Å; Y10-Y30 HydrophobicContact CD2-CE1 3.83Å; Y10-Y30 HydrophobicContact CE2-CD1 4.38Å; Y10-Y30 HydrophobicContact CE2-CE1 4.15Å; Y10-Y30 AromaticContact CG-CD1 3.77Å; Y10-Y30 HydrophobicContact CG-CD1 3.77Å; Y10-Y30 HydrophobicContact CG-CE1 4.25Å
11W94.8Very high78.9Confident106 Ų10681.5 Ų81.540%0.40241%0.413SS..THydrogen-bonded Turntrans-84.34.2-171.5-65.1104.7000114.9G9 Y30 M82 T83G9-W11 PolarHBondContact O-N 3.27Å; W11-Y30 PolarHBondContact NE1-O 3.24Å; W11-M82 HydrophobicContact CZ2-CE 3.82Å; W11-T83 HydrophobicContact CB-CG2 4.45Å; W11-T83 HydrophobicContact CD2-CG2 3.71Å; W11-T83 HydrophobicContact CE3-CG2 4.24Å; W11-T83 HydrophobicContact CG-CG2 3.78Å; W11-T83 HydrophobicContact CZ2-CG2 4.42Å
12G91.4Very high81.2Confident28 Ų2872.2 Ų72.229%0.28937%0.367SS..  trans89.6-158.9-178.600000113.1Y10Y10-G12 VanDerWaalsContact C-N 3.28Å; Y10-G12 PolarHBondContact O-N 3.08Å
13R91.6Very high83.7Confident206 Ų20673.2 Ų73.278%0.77737%0.368SS*.SBendtrans-80.1136-179.6-67.8-176.6179.8178.4-0.4109.7T15R13-T15 PolarHBondContact O-N 3.16Å
14P94.1Very high86.1Confident60 Ų6069.4 Ų69.439%0.3934%0.344SS..  trans-51.9136172.1-28.936.6000112.2L84P14-L84 WeakPolarHBondContact CA-O 3.45Å; P14-L84 HydrophobicContact CB-CB 3.88Å; P14-L84 HydrophobicContact CG-CB 4.13Å; P14-L84 HydrophobicContact CG-CD1 4.15Å
15T95.5Very high88.3Confident77 Ų7764.5 Ų64.547%0.47231%0.308SS..  trans-121.3-6.2176.561.90000112.8R13 L84 L85 Y86R13-T15 PolarHBondContact O-N 3.16Å; T15-L84 PolarHBondContact N-O 2.93Å; T15-L85 HydrophobicContact CG2-CD2 4.32Å; T15-L85 WeakPolarHBondContact OG1-CA 3.26Å; T15-Y86 PolarHBondContact OG1-N 3.32Å
16S95.8Very high90.1Very high20 Ų2060.7 Ų60.714%0.1429%0.292CS..SBendtrans-59156.1175.353.40000112.4L18 L84 Q89S16-L18 WeakPolarHBondContact CB-O 3.46Å; S16-L18 PolarHBondContact O-N 3.05Å; S16-L18 PolarHBondContact OG-O 3.23Å; S16-L84 PolarHBondContact N-O 3.45Å; S16-L84 VanDerWaalsContact N-O 3.16Å; S16-L84 PolarHBondContact OG-O 2.95Å; S16-Q89 VanDerWaalsContact CA-OE1 3.32Å
17T94Very high91.6Very high54 Ų5462.3 Ų62.333%0.33130%0.303SS..SBendtrans-77.5-12.5175.258.70000112.5Y86 Q89 K140T17-Y86 HydrophobicContact CG2-CD2 4.13Å; T17-Y86 HydrophobicContact CG2-CE2 4Å; T17-Q89 PolarHBondContact OG1-NE2 2.9Å; T17-Q89 PolarHBondContact OG1-OE1 3.32Å; T17-K140 HydrophobicContact CG2-CB 4.23Å
18L90.3Very high92.7Very high20 Ų2055.7 Ų55.711%0.10528%0.283CS..  trans-140.2149179.854.6118.2000111.9S16 W20 F80 Q89 P142S16-L18 WeakPolarHBondContact CB-O 3.46Å; S16-L18 PolarHBondContact O-N 3.05Å; S16-L18 PolarHBondContact OG-O 3.23Å; L18-W20 HydrophobicContact CD1-CD2 4.1Å; L18-W20 HydrophobicContact CD1-CH2 3.7Å; L18-W20 HydrophobicContact CD1-CZ2 3.11Å; L18-W20 HydrophobicContact CD1-CZ3 4.38Å; L18-F80 HydrophobicContact CD1-CE1 3.79Å; L18-F80 HydrophobicContact CD1-CZ 3.65Å; L18-F80 HydrophobicContact CG-CZ 4.11Å; L18-Q89 VanDerWaalsContact CD2-NE2 3.32Å; L18-P142 HydrophobicContact CD2-CB 3.73Å; L18-P142 HydrophobicContact CD2-CG 4.25Å
19D93.1Very high93.3Very high34 Ų3454 Ų5418%0.18227%0.273CS..  trans-141.6127.3-179.9-173.96.3000106.4N24D19-N24 PolarHBondContact OD1-ND2 3.39Å; D19-N24 VanDerWaalsContact OD1-ND2 3.08Å; D19-N24 PolarHBondContact OD2-ND2 3.02Å
20W93.9Very high93.7Very high25 Ų2560.3 Ų60.310%0.09530%0.296CS..  trans-89.1-176.1-166.3-54.797.9000111.6L18 E22 E33 F80 H81 W189 R200 H217L18-W20 HydrophobicContact CD1-CD2 4.1Å; L18-W20 HydrophobicContact CD1-CH2 3.7Å; L18-W20 HydrophobicContact CD1-CZ2 3.11Å; L18-W20 HydrophobicContact CD1-CZ3 4.38Å; W20-E22 VanDerWaalsContact C-N 3.29Å; W20-E22 PolarHBondContact O-N 3.17Å; W20-E33 WeakPolarHBondContact CA-OE1 3.41Å; W20-E33 VanDerWaalsContact CB-OE1 3.22Å; W20-E33 WeakPolarHBondContact CB-OE1 3.48Å; W20-E33 VanDerWaalsContact CD1-OE2 3.28Å; W20-E33 PolarHBondContact N-OE1 3.26Å; W20-F80 HydrophobicContact CZ2-CE1 4.45Å; W20-F80 AromaticContact NE1-CE1 3.28Å; W20-F80 VanDerWaalsContact NE1-CE1 3.28Å; W20-F80 AromaticContact NE1-CZ 3.85Å; W20-H81 AromaticContact CD1-CE1 3.27Å; W20-H81 AromaticContact CD1-ND1 3.51Å; W20-H81 AromaticContact CE2-CE1 3.99Å; W20-H81 AromaticContact NE1-CE1 3.11Å; W20-H81 PolarHBondContact NE1-CE1 2.86Å; W20-H81 AromaticContact NE1-ND1 3.7Å; W20-W189 HydrophobicContact CH2-CZ2 4.43Å; W20-W189 AromaticContact CH2-NE1 3.45Å; W20-W189 HydrophobicContact CZ3-CZ2 4.26Å; W20-W189 AromaticContact CZ3-NE1 3.27Å; W20-W189 VanDerWaalsContact CZ3-NE1 3.27Å; W20-R200 PolarHBondContact O-NH2 3.11Å; W20-H217 AromaticContact CD2-CE1 3.29Å; W20-H217 AromaticContact CD2-ND1 3.58Å; W20-H217 AromaticContact CD2-NE2 3.72Å; W20-H217 AromaticContact CE2-CE1 3.34Å; W20-H217 AromaticContact CE2-NE2 3.51Å; W20-H217 AromaticContact CE3-CE1 3.29Å; W20-H217 AromaticContact CE3-ND1 3.36Å; W20-H217 AromaticContact CH2-CE1 3.41Å; W20-H217 VanDerWaalsContact CH2-CE1 3.41Å; W20-H217 WeakPolarHBondContact CH2-CE1 3.45Å; W20-H217 AromaticContact CZ2-CE1 3.36Å; W20-H217 WeakPolarHBondContact CZ2-CE1 3.14Å; W20-H217 AromaticContact CZ2-NE2 3.74Å; W20-H217 AromaticContact CZ3-CE1 3.37Å; W20-H217 WeakPolarHBondContact CZ3-CE1 3.22Å; W20-H217 AromaticContact CZ3-ND1 3.73Å; W20-H217 AromaticContact NE1-NE2 3.92Å
21C94.4Very high93.8Very high4 Ų455.4 Ų55.43%0.02728%0.278CS..SBendtrans-76.1-15.2-174.6-162.10000113.9D192 C196 R200 R203C21-D192 WeakPolarHBondContact CB-OD2 3.23Å; C21-C196 WeakPolarHBondContact CA-SG 3.34Å; C21-C196 HydrophobicContact CB-CB 3.85Å; C21-C196 WeakPolarHBondContact CB-SG 3.33Å; C21-C196 WeakPolarHBondContact SG-CA 3.48Å; C21-C196 WeakPolarHBondContact SG-CB 3.29Å; C21-C196 PolarHBondContact SG-O 3.1Å; C21-C196 VanDerWaalsContact SG-O 3.42Å; C21-C196 CovalentContact SG-SG 2.04Å; C21-C196 PolarHBondContact SG-SG 2.93Å; C21-R200 PolarHBondContact O-NE 3.49Å; C21-R200 PolarHBondContact O-NH2 2.96Å; C21-R203 PolarHBondContact O-NH1 2.82Å
22E94.3Very high93.8Very high4 Ų450.4 Ų50.42%0.01926%0.26CS..SBendtrans-66.8140.1173.8-175.7168.8-176.100110W20 E33 F34 W35 N36 R200W20-E22 VanDerWaalsContact C-N 3.29Å; W20-E22 PolarHBondContact O-N 3.17Å; E22-E33 HydrophobicContact CB-CB 4.1Å; E22-E33 HydrophobicContact CB-CG 4.14Å; E22-E33 HydrophobicContact CG-CB 4.15Å; E22-F34 PolarHBondContact OE1-N 3.17Å; E22-W35 VanDerWaalsContact OE1-CD1 3.23Å; E22-W35 PolarHBondContact OE1-N 2.97Å; E22-W35 PolarHBondContact OE2-N 2.97Å; E22-W35 VanDerWaalsContact OE2-N 3.13Å; E22-N36 WeakPolarHBondContact OE2-CB 3.42Å; E22-N36 VanDerWaalsContact OE2-CG 3.24Å; E22-N36 PolarHBondContact OE2-N 2.93Å; E22-R200 PolarHBondContact O-NH2 2.96Å
23E92.3Very high94.1Very high39 Ų3949.1 Ų49.118%0.18225%0.246CC..PPolyproline II helixtrans-78.8131.9179.9-62.995.9141.700112.3V26 R200 R203E23-V26 HydrophobicContact CB-CB 4.47Å; E23-V26 HydrophobicContact CB-CG2 3.49Å; E23-V26 VanDerWaalsContact CB-CG2 3.49Å; E23-R200 HydrophobicContact CG-CG 4.46Å; E23-R203 IonicContact OE2-NH1 2.9Å; E23-R203 PolarHBondContact OE2-NH1 3.46Å
24N94.3Very high94.3Very high2 Ų241.7 Ų41.71%0.01122%0.219CC..THydrogen-bonded Turntrans-74.3132.1-169.3-68.2-36.8000113.2D6 D19 V26 A32 E33 L84D6-N24 HydrophobicContact CB-CB 3.83Å; D6-N24 VanDerWaalsContact CG-ND2 3.32Å; D6-N24 PolarHBondContact OD1-N 3.36Å; D6-N24 PolarHBondContact OD2-ND2 3.44Å; D19-N24 PolarHBondContact OD1-ND2 3.39Å; D19-N24 VanDerWaalsContact OD1-ND2 3.08Å; D19-N24 PolarHBondContact OD2-ND2 3.02Å; N24-V26 PolarHBondContact O-N 3.43Å; N24-A32 CarbonylContact C-O 3.54Å; N24-A32 WeakPolarHBondContact CA-O 3.41Å; N24-E33 VanDerWaalsContact OD1-CG 3.32Å; N24-E33 WeakPolarHBondContact OD1-CG 3.03Å; N24-L84 WeakPolarHBondContact ND2-CD1 3.41Å; N24-L84 WeakPolarHBondContact OD1-CD1 3.17Å
25Y93.5Very high94.5Very high11 Ų1142.8 Ų42.84%0.04322%0.216CC..THydrogen-bonded Turntrans56.928.4176.8-55.2-82.1000114.2R7 S28 F29 A32R7-Y25 VanDerWaalsContact O-CD2 3.26Å; R7-Y25 WeakPolarHBondContact O-CD2 3.44Å; Y25-S28 CarbonylContact C-O 3.54Å; Y25-S28 VanDerWaalsContact CA-O 3.27Å; Y25-S28 WeakPolarHBondContact CA-O 3.34Å; Y25-S28 WeakPolarHBondContact CB-O 2.94Å; Y25-S28 WeakPolarHBondContact CD1-O 3.23Å; Y25-F29 VanDerWaalsContact CD1-O 3.25Å; Y25-F29 WeakPolarHBondContact CD1-O 3.49Å; Y25-F29 WeakPolarHBondContact CE1-O 3.31Å; Y25-A32 HydrophobicContact CD1-CB 4.37Å; Y25-A32 HydrophobicContact CD2-CB 4.19Å; Y25-A32 HydrophobicContact CE1-CB 3.94Å; Y25-A32 HydrophobicContact CE2-CB 3.72Å; Y25-A32 PolarHBondContact N-O 2.88Å
26V91.4Very high94.6Very high84 Ų8439.1 Ų39.151%0.50919%0.193SC..SBendtrans-73.2-42178.6169.30000111.9E23 N24E23-V26 HydrophobicContact CB-CB 4.47Å; E23-V26 HydrophobicContact CB-CG2 3.49Å; E23-V26 VanDerWaalsContact CB-CG2 3.49Å; N24-V26 PolarHBondContact O-N 3.43Å
27V92.1Very high94.7Very high80 Ų8038.1 Ų38.149%0.48519%0.187SC..SBendtrans-89.6-35.6-177.6-1770000112F34V27-F34 HydrophobicContact CB-CB 3.64Å; V27-F34 HydrophobicContact CB-CD1 4.15Å; V27-F34 HydrophobicContact CB-CD2 4.09Å; V27-F34 HydrophobicContact CB-CG 3.7Å; V27-F34 HydrophobicContact CG1-CB 4.17Å; V27-F34 HydrophobicContact CG1-CD1 3.77Å; V27-F34 HydrophobicContact CG1-CD2 3.79Å; V27-F34 HydrophobicContact CG1-CE1 4.06Å; V27-F34 HydrophobicContact CG1-CE2 4.08Å; V27-F34 HydrophobicContact CG1-CG 3.62Å; V27-F34 HydrophobicContact CG1-CZ 4.21Å; V27-F34 HydrophobicContact CG2-CB 3.9Å; V27-F34 HydrophobicContact CG2-CD1 4.29Å; V27-F34 HydrophobicContact CG2-CG 4.17Å
28S94Very high95Very high28 Ų2837.4 Ų37.420%0.19618%0.182CC..  trans-141.9144.2-175.6178.30000111.1Y25 Y30Y25-S28 CarbonylContact C-O 3.54Å; Y25-S28 VanDerWaalsContact CA-O 3.27Å; Y25-S28 WeakPolarHBondContact CA-O 3.34Å; Y25-S28 WeakPolarHBondContact CB-O 2.94Å; Y25-S28 WeakPolarHBondContact CD1-O 3.23Å; S28-Y30 VanDerWaalsContact C-N 3.25Å; S28-Y30 PolarHBondContact O-N 3.08Å; S28-Y30 PolarHBondContact OG-N 3.41Å; S28-Y30 VanDerWaalsContact OG-N 3.14Å
29F94.6Very high95.3Very high112 Ų11237.2 Ų37.249%0.49118%0.182SC..SBendtrans-71-22171176.9-111.9000112.9Y10 Y25Y10-F29 VanDerWaalsContact CB-O 3.3Å; Y10-F29 WeakPolarHBondContact CB-O 3.3Å; Y10-F29 AromaticContact CD2-CE1 3.89Å; Y10-F29 HydrophobicContact CD2-CE1 3.89Å; Y10-F29 HydrophobicContact CG-CE1 4.38Å; Y10-F29 PolarHBondContact N-O 2.96Å; Y25-F29 VanDerWaalsContact CD1-O 3.25Å; Y25-F29 WeakPolarHBondContact CD1-O 3.49Å; Y25-F29 WeakPolarHBondContact CE1-O 3.31Å
30Y97.1Very high95.6Very high141 Ų14135.6 Ų35.655%0.55317%0.173SC*.SBendtrans-96.9-16.3-174.2-59.6-75.2000114.4Y10 W11 S28Y10-Y30 HydrophobicContact CD1-CD1 4.26Å; Y10-Y30 AromaticContact CD2-CD1 3.84Å; Y10-Y30 HydrophobicContact CD2-CD1 3.84Å; Y10-Y30 AromaticContact CD2-CE1 3.83Å; Y10-Y30 HydrophobicContact CD2-CE1 3.83Å; Y10-Y30 HydrophobicContact CE2-CD1 4.38Å; Y10-Y30 HydrophobicContact CE2-CE1 4.15Å; Y10-Y30 AromaticContact CG-CD1 3.77Å; Y10-Y30 HydrophobicContact CG-CD1 3.77Å; Y10-Y30 HydrophobicContact CG-CE1 4.25Å; W11-Y30 PolarHBondContact NE1-O 3.24Å; S28-Y30 VanDerWaalsContact C-N 3.25Å; S28-Y30 PolarHBondContact O-N 3.08Å; S28-Y30 PolarHBondContact OG-N 3.41Å; S28-Y30 VanDerWaalsContact OG-N 3.14Å
31I97.3Very high95.8Very high29 Ų2937.6 Ų37.615%0.14919%0.186CC..  trans-128117.4-175-55.2176.9000107.5F34 T37 M82I31-F34 HydrophobicContact CB-CD2 4.4Å; I31-F34 HydrophobicContact CD1-CD2 4.04Å; I31-F34 HydrophobicContact CD1-CE2 4.2Å; I31-F34 HydrophobicContact CG2-CB 4.47Å; I31-F34 HydrophobicContact CG2-CD2 4.47Å; I31-T37 HydrophobicContact CG2-CG2 3.8Å; I31-T37 VanDerWaalsContact CG2-OG1 3.23Å; I31-T37 WeakPolarHBondContact CG2-OG1 3.46Å; I31-M82 HydrophobicContact CB-CG 4.43Å; I31-M82 HydrophobicContact CG1-CG 4.17Å; I31-M82 HydrophobicContact CG2-CB 4.39Å; I31-M82 HydrophobicContact CG2-CG 4.35Å
32A95.9Very high95.9Very high1 Ų139 Ų391%0.00819%0.193CC..SBendtrans-63.6-66.3-177.500000111.3N24 Y25 M82 L84N24-A32 CarbonylContact C-O 3.54Å; N24-A32 WeakPolarHBondContact CA-O 3.41Å; Y25-A32 HydrophobicContact CD1-CB 4.37Å; Y25-A32 HydrophobicContact CD2-CB 4.19Å; Y25-A32 HydrophobicContact CE1-CB 3.94Å; Y25-A32 HydrophobicContact CE2-CB 3.72Å; Y25-A32 PolarHBondContact N-O 2.88Å; A32-M82 PolarHBondContact N-O 2.86Å; A32-M82 VanDerWaalsContact N-O 3.08Å; A32-L84 HydrophobicContact CB-CD1 3.86Å; A32-L84 HydrophobicContact CB-CG 4.01Å
33E96.3Very high96.1Very high0 Ų039.2 Ų39.20%019%0.194CC..SBendtrans-104.790.8178.9-60.1-179164.100109.2W20 E22 N24 W35 N36 T37 H81 L84W20-E33 WeakPolarHBondContact CA-OE1 3.41Å; W20-E33 VanDerWaalsContact CB-OE1 3.22Å; W20-E33 WeakPolarHBondContact CB-OE1 3.48Å; W20-E33 VanDerWaalsContact CD1-OE2 3.28Å; W20-E33 PolarHBondContact N-OE1 3.26Å; E22-E33 HydrophobicContact CB-CB 4.1Å; E22-E33 HydrophobicContact CB-CG 4.14Å; E22-E33 HydrophobicContact CG-CB 4.15Å; N24-E33 VanDerWaalsContact OD1-CG 3.32Å; N24-E33 WeakPolarHBondContact OD1-CG 3.03Å; E33-W35 PolarHBondContact O-N 2.73Å; E33-N36 HydrophobicContact CB-CB 3.84Å; E33-N36 PolarHBondContact OE2-ND2 3.03Å; E33-T37 WeakPolarHBondContact O-CB 3.28Å; E33-T37 PolarHBondContact O-N 3.04Å; E33-T37 PolarHBondContact O-OG1 3.17Å; E33-H81 HydrophobicContact CB-CB 4.32Å; E33-H81 PolarHBondContact N-O 3.46Å; E33-H81 IonicContact OE2-CE1 2.97Å; E33-H81 IonicContact OE2-CG 2.93Å; E33-H81 IonicContact OE2-ND1 3.81Å; E33-H81 PolarHBondContact OE2-ND1 3.02Å; E33-L84 HydrophobicContact CG-CD1 4.46Å
34F96.8Very high96.4Very high50 Ų5038 Ų3822%0.21919%0.189CC..Hα-helixtrans-61.2-49.1-167.5-178-90.2000113.2E22 V27 I31 T37 V38E22-F34 PolarHBondContact OE1-N 3.17Å; V27-F34 HydrophobicContact CB-CB 3.64Å; V27-F34 HydrophobicContact CB-CD1 4.15Å; V27-F34 HydrophobicContact CB-CD2 4.09Å; V27-F34 HydrophobicContact CB-CG 3.7Å; V27-F34 HydrophobicContact CG1-CB 4.17Å; V27-F34 HydrophobicContact CG1-CD1 3.77Å; V27-F34 HydrophobicContact CG1-CD2 3.79Å; V27-F34 HydrophobicContact CG1-CE1 4.06Å; V27-F34 HydrophobicContact CG1-CE2 4.08Å; V27-F34 HydrophobicContact CG1-CG 3.62Å; V27-F34 HydrophobicContact CG1-CZ 4.21Å; V27-F34 HydrophobicContact CG2-CB 3.9Å; V27-F34 HydrophobicContact CG2-CD1 4.29Å; V27-F34 HydrophobicContact CG2-CG 4.17Å; I31-F34 HydrophobicContact CB-CD2 4.4Å; I31-F34 HydrophobicContact CD1-CD2 4.04Å; I31-F34 HydrophobicContact CD1-CE2 4.2Å; I31-F34 HydrophobicContact CG2-CB 4.47Å; I31-F34 HydrophobicContact CG2-CD2 4.47Å; F34-T37 WeakPolarHBondContact O-CB 3.46Å; F34-T37 PolarHBondContact O-N 3.5Å; F34-V38 HydrophobicContact CD1-CG2 4.45Å; F34-V38 HydrophobicContact CE1-CG1 4.2Å; F34-V38 HydrophobicContact CE1-CG2 4.25Å; F34-V38 HydrophobicContact CE2-CG1 4.29Å; F34-V38 HydrophobicContact CZ-CG1 4.06Å; F34-V38 WeakPolarHBondContact O-CG1 3.22Å; F34-V38 WeakPolarHBondContact O-CG2 3.5Å; F34-V38 PolarHBondContact O-N 2.66Å
35W97.4Very high96.5Very high83 Ų8343.1 Ų43.131%0.31422%0.215SC..Hα-helixtrans-71.9-40.6-176.9-63.7108.2000111.8E22 E33 T37 V38 S39 V212 Q215 A218E22-W35 VanDerWaalsContact OE1-CD1 3.23Å; E22-W35 PolarHBondContact OE1-N 2.97Å; E22-W35 PolarHBondContact OE2-N 2.97Å; E22-W35 VanDerWaalsContact OE2-N 3.13Å; E33-W35 PolarHBondContact O-N 2.73Å; W35-T37 PolarHBondContact O-N 3.11Å; W35-V38 HydrophobicContact CE3-CG2 4.11Å; W35-S39 VanDerWaalsContact O-CB 3.24Å; W35-S39 WeakPolarHBondContact O-CB 3.32Å; W35-S39 PolarHBondContact O-N 2.67Å; W35-S39 VanDerWaalsContact O-N 3.07Å; W35-S39 PolarHBondContact O-OG 3.3Å; W35-V212 HydrophobicContact CD2-CG1 3.86Å; W35-V212 HydrophobicContact CE3-CG1 3.9Å; W35-V212 HydrophobicContact CH2-CG1 3.9Å; W35-V212 HydrophobicContact CH2-CG2 4.05Å; W35-V212 HydrophobicContact CZ2-CB 4.26Å; W35-V212 HydrophobicContact CZ2-CG1 3.87Å; W35-V212 HydrophobicContact CZ2-CG2 3.4Å; W35-V212 HydrophobicContact CZ3-CG1 3.92Å; W35-Q215 HydrophobicContact CB-CB 4.14Å; W35-Q215 HydrophobicContact CB-CG 3.94Å; W35-Q215 HydrophobicContact CG-CG 4.02Å; W35-A218 HydrophobicContact CB-CB 4.08Å; W35-A218 WeakPolarHBondContact O-CB 3.44Å
36N98.1Very high96.7Very high0 Ų043.6 Ų43.60%022%0.219CC..Hα-helixtrans-60.4-36.5171.8-70.1-12.2000111.3E22 E33 S39 N40 H81 H217 A218 H221E22-N36 WeakPolarHBondContact OE2-CB 3.42Å; E22-N36 VanDerWaalsContact OE2-CG 3.24Å; E22-N36 PolarHBondContact OE2-N 2.93Å; E33-N36 HydrophobicContact CB-CB 3.84Å; E33-N36 PolarHBondContact OE2-ND2 3.03Å; N36-S39 PolarHBondContact O-OG 2.61Å; N36-N40 PolarHBondContact O-ND2 2.92Å; N36-H81 HydrophobicContact CB-CB 4.07Å; N36-H217 WeakPolarHBondContact OD1-CB 3.46Å; N36-A218 WeakPolarHBondContact OD1-CA 3.43Å; N36-A218 WeakPolarHBondContact OD1-CB 3.22Å; N36-A218 PolarHBondContact OD1-N 2.9Å; N36-H221 PolarHBondContact O-CE1 3.15Å; N36-H221 VanDerWaalsContact O-CE1 3.26Å; N36-H221 PolarHBondContact O-ND1 2.97Å
37T98.6Very high97Very high0 Ų039.6 Ų39.60%020%0.195CC..Hα-helixtrans-69.3-55.6177.8-60.40000112I31 E33 F34 W35 S39 N40 W78 H81 M82I31-T37 HydrophobicContact CG2-CG2 3.8Å; I31-T37 VanDerWaalsContact CG2-OG1 3.23Å; I31-T37 WeakPolarHBondContact CG2-OG1 3.46Å; E33-T37 WeakPolarHBondContact O-CB 3.28Å; E33-T37 PolarHBondContact O-N 3.04Å; E33-T37 PolarHBondContact O-OG1 3.17Å; F34-T37 WeakPolarHBondContact O-CB 3.46Å; F34-T37 PolarHBondContact O-N 3.5Å; W35-T37 PolarHBondContact O-N 3.11Å; T37-S39 VanDerWaalsContact C-N 3.32Å; T37-S39 PolarHBondContact O-N 2.99Å; T37-N40 WeakPolarHBondContact O-CB 3.22Å; T37-N40 PolarHBondContact O-N 3Å; T37-N40 PolarHBondContact O-ND2 2.7Å; T37-W78 HydrophobicContact CG2-CD2 4.17Å; T37-W78 HydrophobicContact CG2-CG 3.72Å; T37-H81 VanDerWaalsContact OG1-CB 3.32Å; T37-H81 WeakPolarHBondContact OG1-CB 3.45Å; T37-H81 PolarHBondContact OG1-O 3.27Å; T37-M82 HydrophobicContact CG2-CB 4.1Å; T37-M82 PolarHBondContact OG1-N 3.28Å
38V98.4Very high97.2Very high39 Ų3939.3 Ų39.324%0.23619%0.19CC..Hα-helixtrans-73.1-24.5-172.3-59.40000113.1F34 W35 N40 L41F34-V38 HydrophobicContact CD1-CG2 4.45Å; F34-V38 HydrophobicContact CE1-CG1 4.2Å; F34-V38 HydrophobicContact CE1-CG2 4.25Å; F34-V38 HydrophobicContact CE2-CG1 4.29Å; F34-V38 HydrophobicContact CZ-CG1 4.06Å; F34-V38 WeakPolarHBondContact O-CG1 3.22Å; F34-V38 WeakPolarHBondContact O-CG2 3.5Å; F34-V38 PolarHBondContact O-N 2.66Å; W35-V38 HydrophobicContact CE3-CG2 4.11Å; V38-N40 PolarHBondContact O-N 3.15Å; V38-L41 WeakPolarHBondContact O-CB 3.45Å; V38-L41 WeakPolarHBondContact O-CG 3.45Å; V38-L41 PolarHBondContact O-N 3.46Å
39S98.4Very high97.4Very high15 Ų1541.5 Ų41.511%0.10520%0.195CC..Hα-helixtrans-62.2-23175.9620000112.6W35 N36 T37 L41 I42 A218 H221W35-S39 VanDerWaalsContact O-CB 3.24Å; W35-S39 WeakPolarHBondContact O-CB 3.32Å; W35-S39 PolarHBondContact O-N 2.67Å; W35-S39 VanDerWaalsContact O-N 3.07Å; W35-S39 PolarHBondContact O-OG 3.3Å; N36-S39 PolarHBondContact O-OG 2.61Å; T37-S39 VanDerWaalsContact C-N 3.32Å; T37-S39 PolarHBondContact O-N 2.99Å; S39-L41 PolarHBondContact O-N 3.26Å; S39-I42 WeakPolarHBondContact O-CG2 3.29Å; S39-A218 WeakPolarHBondContact CB-O 3.43Å; S39-A218 PolarHBondContact OG-O 2.87Å; S39-H221 WeakPolarHBondContact OG-CB 3.43Å; S39-H221 PolarHBondContact OG-ND1 3.23Å
40N98.7Very high97.4Very high0 Ų036.3 Ų36.30%017%0.173CC..THydrogen-bonded Turntrans-65.5-14.8176.6-70-51000114.6N36 T37 V38 I42 M43 I44 S77 W78 H221N36-N40 PolarHBondContact O-ND2 2.92Å; T37-N40 WeakPolarHBondContact O-CB 3.22Å; T37-N40 PolarHBondContact O-N 3Å; T37-N40 PolarHBondContact O-ND2 2.7Å; V38-N40 PolarHBondContact O-N 3.15Å; N40-I42 PolarHBondContact O-N 3.39Å; N40-I42 VanDerWaalsContact O-N 3.08Å; N40-M43 HydrophobicContact CB-CE 4.43Å; N40-M43 WeakPolarHBondContact O-CA 2.99Å; N40-M43 WeakPolarHBondContact O-CB 3.41Å; N40-M43 PolarHBondContact O-N 3.26Å; N40-M43 WeakPolarHBondContact OD1-CE 3.3Å; N40-I44 WeakPolarHBondContact O-CG1 3.3Å; N40-I44 PolarHBondContact O-N 3.41Å; N40-S77 PolarHBondContact ND2-OG 2.84Å; N40-S77 VanDerWaalsContact ND2-OG 3.09Å; N40-S77 WeakPolarHBondContact OD1-CB 3.4Å; N40-S77 PolarHBondContact OD1-OG 3Å; N40-W78 HydrophobicContact CB-CB 4.26Å; N40-W78 PolarHBondContact ND2-N 3.36Å; N40-H221 PolarHBondContact OD1-ND1 3.04Å
41L98.3Very high97.4Very high68 Ų6829.9 Ų29.936%0.35615%0.149SC..Hα-helixtrans-52.5-33.5176.4-82.9165.7000113.1V38 S39 M43 I44 L45 P46 W78V38-L41 WeakPolarHBondContact O-CB 3.45Å; V38-L41 WeakPolarHBondContact O-CG 3.45Å; V38-L41 PolarHBondContact O-N 3.46Å; S39-L41 PolarHBondContact O-N 3.26Å; L41-M43 VanDerWaalsContact C-N 3.29Å; L41-M43 PolarHBondContact O-N 3.04Å; L41-I44 PolarHBondContact O-N 3.24Å; L41-I44 VanDerWaalsContact O-N 3.16Å; L41-L45 HydrophobicContact CD2-CD1 3.85Å; L41-L45 HydrophobicContact CD2-CG 4.08Å; L41-L45 PolarHBondContact O-N 3.44Å; L41-P46 WeakPolarHBondContact O-CD 3.49Å; L41-W78 HydrophobicContact CD1-CH2 4.46Å; L41-W78 HydrophobicContact CD2-CH2 3.74Å; L41-W78 HydrophobicContact CD2-CZ3 3.37Å; L41-W78 HydrophobicContact CG-CE3 4.45Å; L41-W78 HydrophobicContact CG-CH2 3.96Å; L41-W78 HydrophobicContact CG-CZ3 3.56Å
42I96.9Very high97.4Very high33 Ų3331.4 Ų31.417%0.16916%0.159CC..Hα-helixtrans-68.8-25.1177.3-165.8169.8000113.6S39 N40 P46 I222 L226 W256S39-I42 WeakPolarHBondContact O-CG2 3.29Å; N40-I42 PolarHBondContact O-N 3.39Å; N40-I42 VanDerWaalsContact O-N 3.08Å; I42-P46 VanDerWaalsContact O-CD 3.25Å; I42-P46 WeakPolarHBondContact O-CD 3.47Å; I42-P46 WeakPolarHBondContact O-CG 3.35Å; I42-I222 HydrophobicContact CD1-CG2 3.88Å; I42-I222 HydrophobicContact CG2-CG1 4.43Å; I42-L226 HydrophobicContact CD1-CB 4.3Å; I42-W256 HydrophobicContact CD1-CH2 3.91Å; I42-W256 HydrophobicContact CD1-CZ3 3.8Å; I42-W256 HydrophobicContact CG1-CH2 3.48Å; I42-W256 VanDerWaalsContact CG1-CH2 3.48Å; I42-W256 HydrophobicContact CG1-CZ3 3.67Å
43M97.6Very high97.3Very high8 Ų832 Ų324%0.03916%0.162CC..Hα-helixtrans-86.9-14.9173.2-66.6-164.8-73.600112N40 L41 P47 L70 S71 V73 H221N40-M43 HydrophobicContact CB-CE 4.43Å; N40-M43 WeakPolarHBondContact O-CA 2.99Å; N40-M43 WeakPolarHBondContact O-CB 3.41Å; N40-M43 PolarHBondContact O-N 3.26Å; N40-M43 WeakPolarHBondContact OD1-CE 3.3Å; L41-M43 VanDerWaalsContact C-N 3.29Å; L41-M43 PolarHBondContact O-N 3.04Å; M43-P47 WeakPolarHBondContact O-CD 3.23Å; M43-P47 WeakPolarHBondContact O-CG 3.33Å; M43-L70 HydrophobicContact CG-CD1 4.44Å; M43-L70 CarbonylContact O-C 3.58Å; M43-L70 HydrophobicContact SD-CD1 4.37Å; M43-S71 VanDerWaalsContact O-CA 3.25Å; M43-S71 WeakPolarHBondContact O-CA 3.4Å; M43-S71 PolarHBondContact O-N 3.3Å; M43-V73 HydrophobicContact SD-CG1 4.45Å; M43-H221 HydrophobicContact CE-CB 4.01Å
44I98.6Very high97.2Very high15 Ų1532.2 Ų32.28%0.07716%0.163CC..Hα-helixtrans-98-64.4-177.4-61.1173.2000111.1N40 L41 P47 I48 S71 V75 W78N40-I44 WeakPolarHBondContact O-CG1 3.3Å; N40-I44 PolarHBondContact O-N 3.41Å; L41-I44 PolarHBondContact O-N 3.24Å; L41-I44 VanDerWaalsContact O-N 3.16Å; I44-P47 WeakPolarHBondContact O-CD 3.31Å; I44-I48 HydrophobicContact CG2-CD1 3.77Å; I44-I48 WeakPolarHBondContact O-CD1 3.22Å; I44-I48 VanDerWaalsContact O-CG1 3.23Å; I44-I48 WeakPolarHBondContact O-CG1 3.5Å; I44-I48 PolarHBondContact O-N 2.82Å; I44-I48 VanDerWaalsContact O-N 3.13Å; I44-S71 PolarHBondContact O-OG 2.86Å; I44-V75 HydrophobicContact CD1-CG2 3.9Å; I44-V75 HydrophobicContact CG1-CG2 4.02Å; I44-V75 HydrophobicContact CG2-CG2 4.3Å; I44-W78 HydrophobicContact CD1-CD2 4.41Å; I44-W78 HydrophobicContact CD1-CE3 3.37Å; I44-W78 HydrophobicContact CD1-CZ3 3.87Å
45L97.1Very high97.1Very high108 Ų10836.9 Ų36.957%0.56518%0.184SC*.Hα-helixtrans-69.4-49.7-166.6-53.1176.4000112.8L41 I48 Y49L41-L45 HydrophobicContact CD2-CD1 3.85Å; L41-L45 HydrophobicContact CD2-CG 4.08Å; L41-L45 PolarHBondContact O-N 3.44Å; L45-I48 PolarHBondContact O-N 2.9Å; L45-Y49 PolarHBondContact O-N 3.48Å
46P96.6Very high96.9Very high21 Ų2141.8 Ų41.814%0.13620%0.202CC..Hα-helixtrans-66.7-38.2-178.5-12.825.3000114.5L41 I42 Y49 G50 Y229 W256L41-P46 WeakPolarHBondContact O-CD 3.49Å; I42-P46 VanDerWaalsContact O-CD 3.25Å; I42-P46 WeakPolarHBondContact O-CD 3.47Å; I42-P46 WeakPolarHBondContact O-CG 3.35Å; P46-Y49 PolarHBondContact O-N 2.68Å; P46-G50 PolarHBondContact O-N 2.84Å; P46-Y229 HydrophobicContact CB-CE2 4.42Å; P46-W256 HydrophobicContact CB-CD2 3.79Å; P46-W256 HydrophobicContact CB-CE3 4.43Å; P46-W256 HydrophobicContact CB-CG 4.3Å; P46-W256 HydrophobicContact CB-CH2 3.97Å; P46-W256 HydrophobicContact CB-CZ2 3.24Å; P46-W256 VanDerWaalsContact CB-NE1 3.28Å; P46-W256 HydrophobicContact CG-CD2 4.09Å; P46-W256 HydrophobicContact CG-CE3 4.25Å; P46-W256 HydrophobicContact CG-CH2 3.8Å; P46-W256 HydrophobicContact CG-CZ2 3.62Å; P46-W256 HydrophobicContact CG-CZ3 4.12Å
47P97.8Very high96.6Very high0 Ų044 Ų440%021%0.214CC..Hα-helixtrans-66.9-36.1172.7-22.635.2000113M43 I44 Y49 G50 A51 F67 L70 S71 Y229M43-P47 WeakPolarHBondContact O-CD 3.23Å; M43-P47 WeakPolarHBondContact O-CG 3.33Å; I44-P47 WeakPolarHBondContact O-CD 3.31Å; P47-Y49 VanDerWaalsContact C-N 3.32Å; P47-Y49 PolarHBondContact O-N 2.8Å; P47-G50 CarbonylContact O-C 3.56Å; P47-G50 WeakPolarHBondContact O-CA 3.44Å; P47-G50 PolarHBondContact O-N 3.46Å; P47-G50 VanDerWaalsContact O-N 3.1Å; P47-A51 PolarHBondContact O-N 3.46Å; P47-F67 HydrophobicContact CB-CB 4.46Å; P47-F67 HydrophobicContact CB-CD1 4.13Å; P47-F67 VanDerWaalsContact CB-O 3.29Å; P47-F67 WeakPolarHBondContact CB-O 3.38Å; P47-F67 WeakPolarHBondContact O-CB 3.49Å; P47-L70 HydrophobicContact CB-CB 4.16Å; P47-L70 HydrophobicContact CB-CD2 4.21Å; P47-L70 HydrophobicContact CB-CG 4.28Å; P47-L70 HydrophobicContact CG-CB 4.24Å; P47-L70 HydrophobicContact CG-CD2 3.58Å; P47-L70 HydrophobicContact CG-CG 3.8Å; P47-S71 WeakPolarHBondContact CB-OG 3.37Å; P47-Y229 HydrophobicContact CB-CD2 4.41Å; P47-Y229 HydrophobicContact CG-CD2 3.95Å
48I97.9Very high96.2Very high75 Ų7547 Ų4739%0.38525%0.246SC..Hα-helixtrans-57.2-47.3170.7-71.8168000110.6I44 L45 G50 A51 V52 S71I44-I48 HydrophobicContact CG2-CD1 3.77Å; I44-I48 WeakPolarHBondContact O-CD1 3.22Å; I44-I48 VanDerWaalsContact O-CG1 3.23Å; I44-I48 WeakPolarHBondContact O-CG1 3.5Å; I44-I48 PolarHBondContact O-N 2.82Å; I44-I48 VanDerWaalsContact O-N 3.13Å; L45-I48 PolarHBondContact O-N 2.9Å; I48-G50 VanDerWaalsContact C-N 3.32Å; I48-G50 PolarHBondContact O-N 3.47Å; I48-A51 WeakPolarHBondContact O-CB 3.43Å; I48-A51 PolarHBondContact O-N 3.35Å; I48-V52 WeakPolarHBondContact O-CG2 3.25Å; I48-V52 PolarHBondContact O-N 3.35Å; I48-S71 WeakPolarHBondContact CG1-OG 3.39Å; I48-S71 PolarHBondContact N-OG 3.33Å
49Y96.2Very high96Very high74 Ų7446.1 Ų46.129%0.2924%0.239SC..Hα-helixtrans-59.4-44.5175.5-178.8-82.5000111.3L45 P46 P47 A51 V52 Q53 L252 T258L45-Y49 PolarHBondContact O-N 3.48Å; P46-Y49 PolarHBondContact O-N 2.68Å; P47-Y49 VanDerWaalsContact C-N 3.32Å; P47-Y49 PolarHBondContact O-N 2.8Å; Y49-A51 VanDerWaalsContact C-N 3.32Å; Y49-A51 PolarHBondContact O-N 2.93Å; Y49-V52 PolarHBondContact O-N 3.43Å; Y49-Q53 HydrophobicContact CE1-CB 4.24Å; Y49-Q53 VanDerWaalsContact CE1-OE1 3.27Å; Y49-Q53 WeakPolarHBondContact O-CB 3.37Å; Y49-Q53 PolarHBondContact O-N 2.75Å; Y49-Q53 PolarHBondContact OH-OE1 3.49Å; Y49-L252 HydrophobicContact CD1-CD2 4.31Å; Y49-L252 HydrophobicContact CD2-CD2 4.05Å; Y49-L252 HydrophobicContact CE1-CD2 4.39Å; Y49-L252 HydrophobicContact CE2-CD1 4.22Å; Y49-L252 HydrophobicContact CE2-CD2 4.07Å; Y49-L252 HydrophobicContact CG-CD2 4.18Å; Y49-T258 HydrophobicContact CD1-CG2 3.91Å; Y49-T258 HydrophobicContact CE1-CG2 3.61Å
50G96.1Very high95.8Very high3 Ų347.2 Ų47.23%0.03124%0.243CC..Hα-helixtrans-58.3-40.3175.800000113.2P46 P47 I48 Q53 T54P46-G50 PolarHBondContact O-N 2.84Å; P47-G50 CarbonylContact O-C 3.56Å; P47-G50 WeakPolarHBondContact O-CA 3.44Å; P47-G50 PolarHBondContact O-N 3.46Å; P47-G50 VanDerWaalsContact O-N 3.1Å; I48-G50 VanDerWaalsContact C-N 3.32Å; I48-G50 PolarHBondContact O-N 3.47Å; G50-Q53 PolarHBondContact O-N 3.28Å; G50-T54 VanDerWaalsContact O-CB 3.31Å; G50-T54 WeakPolarHBondContact O-CB 3.48Å; G50-T54 PolarHBondContact O-N 3.16Å; G50-T54 PolarHBondContact O-OG1 3.41Å
51A97.3Very high95.7Very high5 Ų554.5 Ų54.54%0.04128%0.275CS..Hα-helixtrans-64.2-47.1175.500000111.7P47 I48 Y49 Q53 T54 F55 I64 F67 L68P47-A51 PolarHBondContact O-N 3.46Å; I48-A51 WeakPolarHBondContact O-CB 3.43Å; I48-A51 PolarHBondContact O-N 3.35Å; Y49-A51 VanDerWaalsContact C-N 3.32Å; Y49-A51 PolarHBondContact O-N 2.93Å; A51-Q53 VanDerWaalsContact C-N 3.34Å; A51-Q53 PolarHBondContact O-N 3.01Å; A51-T54 PolarHBondContact O-N 2.99Å; A51-F55 WeakPolarHBondContact O-CB 3.36Å; A51-F55 PolarHBondContact O-N 3.25Å; A51-I64 HydrophobicContact CB-CG2 4.15Å; A51-F67 HydrophobicContact CB-CB 3.78Å; A51-L68 HydrophobicContact CB-CD2 3.73Å; A51-L68 HydrophobicContact CB-CG 3.89Å
52V96Very high95.6Very high61 Ų6152.8 Ų52.837%0.3726%0.263SS..Hα-helixtrans-62.4-42.3177.3173.70000111.2I48 Y49 F55 R56I48-V52 WeakPolarHBondContact O-CG2 3.25Å; I48-V52 PolarHBondContact O-N 3.35Å; Y49-V52 PolarHBondContact O-N 3.43Å; V52-F55 PolarHBondContact O-N 3.31Å; V52-R56 HydrophobicContact CG1-CG 4.49Å; V52-R56 WeakPolarHBondContact O-CB 3.2Å; V52-R56 VanDerWaalsContact O-CG 3.3Å; V52-R56 WeakPolarHBondContact O-CG 3.36Å; V52-R56 PolarHBondContact O-N 3.46Å
53Q93.9Very high95.7Very high15 Ų1551.2 Ų51.27%0.0726%0.256CS..Hα-helixtrans-59.7-50.9175.2-17374.665.900111.1Y49 G50 A51 F55 R56 D57 H260Y49-Q53 HydrophobicContact CE1-CB 4.24Å; Y49-Q53 VanDerWaalsContact CE1-OE1 3.27Å; Y49-Q53 WeakPolarHBondContact O-CB 3.37Å; Y49-Q53 PolarHBondContact O-N 2.75Å; Y49-Q53 PolarHBondContact OH-OE1 3.49Å; G50-Q53 PolarHBondContact O-N 3.28Å; A51-Q53 VanDerWaalsContact C-N 3.34Å; A51-Q53 PolarHBondContact O-N 3.01Å; Q53-F55 VanDerWaalsContact C-N 3.29Å; Q53-F55 PolarHBondContact O-N 2.8Å; Q53-R56 PolarHBondContact O-N 3.35Å; Q53-D57 PolarHBondContact NE2-OD1 3.24Å; Q53-D57 VanDerWaalsContact NE2-OD1 3.15Å; Q53-D57 WeakPolarHBondContact O-CB 3.29Å; Q53-D57 PolarHBondContact O-N 2.51Å; Q53-H260 PolarHBondContact NE2-CE1 2.9Å; Q53-H260 PolarHBondContact NE2-ND1 3.12Å; Q53-H260 PolarHBondContact OE1-CE1 3.28Å; Q53-H260 PolarHBondContact OE1-NE2 2.94Å
54T94.5Very high95.7Very high4 Ų451.6 Ų51.63%0.02526%0.258CS..Hα-helixtrans-58.5-41.9179.6-58.10000111.3G50 A51 G58 L59 I64 F67G50-T54 VanDerWaalsContact O-CB 3.31Å; G50-T54 WeakPolarHBondContact O-CB 3.48Å; G50-T54 PolarHBondContact O-N 3.16Å; G50-T54 PolarHBondContact O-OG1 3.41Å; A51-T54 PolarHBondContact O-N 2.99Å; T54-G58 PolarHBondContact O-N 3.47Å; T54-L59 HydrophobicContact CG2-CB 3.64Å; T54-L59 HydrophobicContact CG2-CD1 4.31Å; T54-L59 PolarHBondContact O-N 3.2Å; T54-L59 VanDerWaalsContact O-N 3.08Å; T54-I64 HydrophobicContact CG2-CG1 3.65Å; T54-F67 VanDerWaalsContact OG1-CE2 3.32Å; T54-F67 WeakPolarHBondContact OG1-CE2 3.28Å
55F95.2Very high95.7Very high148 Ų14852.8 Ų52.865%0.64927%0.267SS*.Hα-helixtrans-64.4-47175.2178.8-101.9000112.4A51 V52 Q53 D57 G58 I64A51-F55 WeakPolarHBondContact O-CB 3.36Å; A51-F55 PolarHBondContact O-N 3.25Å; V52-F55 PolarHBondContact O-N 3.31Å; Q53-F55 VanDerWaalsContact C-N 3.29Å; Q53-F55 PolarHBondContact O-N 2.8Å; F55-D57 VanDerWaalsContact C-N 3.29Å; F55-D57 PolarHBondContact O-N 3.03Å; F55-G58 PolarHBondContact O-N 2.87Å; F55-G58 VanDerWaalsContact O-N 3.08Å; F55-I64 HydrophobicContact CB-CD1 3.82Å; F55-I64 HydrophobicContact CD2-CD1 3.92Å; F55-I64 HydrophobicContact CG-CD1 4.38Å
56R92.9Very high95.8Very high185 Ų18547.8 Ų47.870%0.69824%0.241SC*.Hα-helixtrans-63-35.6179.5-77.1176.3173.3174.1-1.4112.9V52 Q53 G58V52-R56 HydrophobicContact CG1-CG 4.49Å; V52-R56 WeakPolarHBondContact O-CB 3.2Å; V52-R56 VanDerWaalsContact O-CG 3.3Å; V52-R56 WeakPolarHBondContact O-CG 3.36Å; V52-R56 PolarHBondContact O-N 3.46Å; Q53-R56 PolarHBondContact O-N 3.35Å; R56-G58 PolarHBondContact O-N 3.16Å
57D90.9Very high95.8Very high46 Ų4646.9 Ų46.925%0.24624%0.235CC..THydrogen-bonded Turntrans-79.40.3178.2-7118.9000112.3Q53 F55 L59 H260 I261Q53-D57 PolarHBondContact NE2-OD1 3.24Å; Q53-D57 VanDerWaalsContact NE2-OD1 3.15Å; Q53-D57 WeakPolarHBondContact O-CB 3.29Å; Q53-D57 PolarHBondContact O-N 2.51Å; F55-D57 VanDerWaalsContact C-N 3.29Å; F55-D57 PolarHBondContact O-N 3.03Å; D57-L59 VanDerWaalsContact C-N 3.31Å; D57-L59 HydrophobicContact CB-CD1 4.19Å; D57-L59 HydrophobicContact CB-CG 4.06Å; D57-L59 PolarHBondContact O-N 2.93Å; D57-H260 WeakPolarHBondContact OD2-CA 3.44Å; D57-I261 HydrophobicContact CB-CG1 4.41Å; D57-I261 PolarHBondContact OD2-N 3.35Å
58G91.5Very high95.9Very high65 Ų6551 Ų5167%0.6726%0.256SS*.THydrogen-bonded Turntrans69.725176.900000114.2T54 F55 R56T54-G58 PolarHBondContact O-N 3.47Å; F55-G58 PolarHBondContact O-N 2.87Å; F55-G58 VanDerWaalsContact O-N 3.08Å; R56-G58 PolarHBondContact O-N 3.16Å
59L93.4Very high95.9Very high19 Ų1948 Ų4810%0.09924%0.243CC..  trans-81.1163.6-176.5-64.3177.5000112.3T54 D57 F61 L236 Y245 L259 I261T54-L59 HydrophobicContact CG2-CB 3.64Å; T54-L59 HydrophobicContact CG2-CD1 4.31Å; T54-L59 PolarHBondContact O-N 3.2Å; T54-L59 VanDerWaalsContact O-N 3.08Å; D57-L59 VanDerWaalsContact C-N 3.31Å; D57-L59 HydrophobicContact CB-CD1 4.19Å; D57-L59 HydrophobicContact CB-CG 4.06Å; D57-L59 PolarHBondContact O-N 2.93Å; L59-F61 PolarHBondContact O-N 2.94Å; L59-L236 HydrophobicContact CD1-CD1 3.9Å; L59-L236 HydrophobicContact CD1-CD2 4.03Å; L59-L236 HydrophobicContact CD1-CG 4.31Å; L59-Y245 HydrophobicContact CD2-CD2 4.07Å; L59-Y245 HydrophobicContact CD2-CE2 3.95Å; L59-L259 HydrophobicContact CD1-CD2 4.5Å; L59-I261 HydrophobicContact CD1-CD1 4.32Å; L59-I261 HydrophobicContact CD1-CG1 3.93Å; L59-I261 HydrophobicContact CD2-CD1 4.24Å; L59-I261 HydrophobicContact CD2-CG1 3.76Å; L59-I261 HydrophobicContact CG-CG1 4.17Å
60E95.1Very high96Very high38 Ų3844.7 Ų44.718%0.17823%0.231CC..  trans-58133.8-173.6-59.1175.7135.400112.5R62 Y63 R239E60-R62 HydrophobicContact CB-CG 4.14Å; E60-R62 PolarHBondContact O-N 3.4Å; E60-R62 IonicContact OE1-NH2 2.61Å; E60-R62 IonicContact OE2-CZ 3.9Å; E60-R62 IonicContact OE2-NE 3.11Å; E60-R62 PolarHBondContact OE2-NE 2.95Å; E60-R62 IonicContact OE2-NH2 3.65Å; E60-R62 PolarHBondContact OE2-NH2 3.36Å; E60-Y63 HydrophobicContact CB-CD2 4.15Å; E60-Y63 PolarHBondContact O-N 3.29Å; E60-R239 VanDerWaalsContact CD-NE 3.31Å; E60-R239 IonicContact OE1-CZ 3.54Å; E60-R239 VanDerWaalsContact OE1-CZ 3.3Å; E60-R239 IonicContact OE1-NE 3.67Å; E60-R239 PolarHBondContact OE1-NE 3.42Å; E60-R239 VanDerWaalsContact OE1-NE 3.11Å; E60-R239 IonicContact OE1-NH2 2.66Å; E60-R239 PolarHBondContact OE1-NH2 3.33Å; E60-R239 WeakPolarHBondContact OE2-CG 3.21Å; E60-R239 IonicContact OE2-CZ 2.7Å; E60-R239 IonicContact OE2-NE 3.3Å; E60-R239 PolarHBondContact OE2-NE 3.18Å; E60-R239 IonicContact OE2-NH2 3.83Å
61F96.1Very high96.2Very high154 Ų15444.9 Ų44.968%0.67523%0.232SC*.Hα-helixtrans-53.5-32-175-176.1-108000114.4L59 Y63 I64 C65L59-F61 PolarHBondContact O-N 2.94Å; F61-Y63 PolarHBondContact O-N 3.01Å; F61-I64 HydrophobicContact CD2-CB 4.47Å; F61-I64 HydrophobicContact CD2-CD1 4.09Å; F61-I64 WeakPolarHBondContact O-CA 3.33Å; F61-I64 WeakPolarHBondContact O-CB 3.23Å; F61-I64 PolarHBondContact O-N 3.4Å; F61-C65 WeakPolarHBondContact CE1-SG 3.18Å; F61-C65 PolarHBondContact O-N 2.8Å; F61-C65 PolarHBondContact O-SG 3.28Å
62R96.8Very high96.2Very high31 Ų3146.8 Ų46.812%0.11725%0.248CC..Hα-helixtrans-57.6-29.717765.7-178.1174.8173.30.5113.8E60 S66 Y105 E109 R239E60-R62 HydrophobicContact CB-CG 4.14Å; E60-R62 PolarHBondContact O-N 3.4Å; E60-R62 IonicContact OE1-NH2 2.61Å; E60-R62 IonicContact OE2-CZ 3.9Å; E60-R62 IonicContact OE2-NE 3.11Å; E60-R62 PolarHBondContact OE2-NE 2.95Å; E60-R62 IonicContact OE2-NH2 3.65Å; E60-R62 PolarHBondContact OE2-NH2 3.36Å; R62-S66 PolarHBondContact O-N 3.4Å; R62-S66 PolarHBondContact O-OG 2.85Å; R62-Y105 HydrophobicContact CB-CE1 4.47Å; R62-E109 PolarHBondContact NH1-O 2.77Å; R62-E109 PolarHBondContact NH2-O 2.91Å; R62-R239 VanDerWaalsContact NH2-CD 3.35Å
63Y97.4Very high96.4Very high1 Ų144.6 Ų44.60%0.00423%0.234CC..Hα-helixtrans-80.5-30176.1-69.9-77.3000112.5E60 F61 C65 S66 F67 C106 S235 L236 R239E60-Y63 HydrophobicContact CB-CD2 4.15Å; E60-Y63 PolarHBondContact O-N 3.29Å; F61-Y63 PolarHBondContact O-N 3.01Å; Y63-C65 VanDerWaalsContact C-N 3.35Å; Y63-S66 WeakPolarHBondContact O-CB 3.44Å; Y63-S66 PolarHBondContact O-N 3.32Å; Y63-F67 VanDerWaalsContact O-CD2 3.28Å; Y63-F67 WeakPolarHBondContact O-CD2 3.48Å; Y63-F67 PolarHBondContact O-N 2.96Å; Y63-F67 VanDerWaalsContact O-N 3.12Å; Y63-C106 HydrophobicContact CE1-CB 3.94Å; Y63-S235 WeakPolarHBondContact CE1-OG 3.46Å; Y63-S235 PolarHBondContact OH-O 3.2Å; Y63-S235 PolarHBondContact OH-OG 3.13Å; Y63-L236 HydrophobicContact CD1-CB 4Å; Y63-L236 HydrophobicContact CD1-CD1 3.82Å; Y63-L236 HydrophobicContact CD1-CG 4.5Å; Y63-L236 HydrophobicContact CD2-CD1 3.74Å; Y63-L236 HydrophobicContact CE1-CB 4.13Å; Y63-L236 HydrophobicContact CE1-CD1 4.24Å; Y63-L236 HydrophobicContact CE2-CD1 4.19Å; Y63-L236 HydrophobicContact CG-CD1 3.56Å; Y63-R239 HydrophobicContact CE2-CB 3.98Å; Y63-R239 HydrophobicContact CE2-CG 3.81Å; Y63-R239 WeakPolarHBondContact OH-CB 3.48Å
64I98.2Very high96.6Very high16 Ų1643.9 Ų43.98%0.08223%0.231CC..Hα-helixtrans-61.7-48167.8-54.7174.8000108.9A51 T54 F55 F61 S66 F67 L68A51-I64 HydrophobicContact CB-CG2 4.15Å; T54-I64 HydrophobicContact CG2-CG1 3.65Å; F55-I64 HydrophobicContact CB-CD1 3.82Å; F55-I64 HydrophobicContact CD2-CD1 3.92Å; F55-I64 HydrophobicContact CG-CD1 4.38Å; F61-I64 HydrophobicContact CD2-CB 4.47Å; F61-I64 HydrophobicContact CD2-CD1 4.09Å; F61-I64 WeakPolarHBondContact O-CA 3.33Å; F61-I64 WeakPolarHBondContact O-CB 3.23Å; F61-I64 PolarHBondContact O-N 3.4Å; I64-S66 VanDerWaalsContact C-N 3.26Å; I64-S66 PolarHBondContact O-N 3.05Å; I64-F67 PolarHBondContact O-N 3.1Å; I64-L68 HydrophobicContact CG2-CD1 4Å; I64-L68 HydrophobicContact CG2-CG 4.37Å; I64-L68 WeakPolarHBondContact O-CG 3.36Å; I64-L68 PolarHBondContact O-N 3.22Å
65C98.4Very high96.8Very high40 Ų4046.9 Ų46.927%0.2725%0.249SC..Hα-helixtrans-59-36.4175.1-650000112.7F61 Y63 G69 V102F61-C65 WeakPolarHBondContact CE1-SG 3.18Å; F61-C65 PolarHBondContact O-N 2.8Å; F61-C65 PolarHBondContact O-SG 3.28Å; Y63-C65 VanDerWaalsContact C-N 3.35Å; C65-G69 PolarHBondContact O-N 2.87Å; C65-V102 HydrophobicContact CB-CG1 4.09Å
66S98.5Very high97Very high3 Ų339.8 Ų39.82%0.02122%0.218CC..Hα-helixtrans-63-48.9177.2-61.90000111.3R62 Y63 I64 G69 L70 V102 F103 C106R62-S66 PolarHBondContact O-N 3.4Å; R62-S66 PolarHBondContact O-OG 2.85Å; Y63-S66 WeakPolarHBondContact O-CB 3.44Å; Y63-S66 PolarHBondContact O-N 3.32Å; I64-S66 VanDerWaalsContact C-N 3.26Å; I64-S66 PolarHBondContact O-N 3.05Å; S66-G69 PolarHBondContact O-N 3.38Å; S66-L70 PolarHBondContact O-N 2.89Å; S66-L70 VanDerWaalsContact O-N 3.13Å; S66-V102 WeakPolarHBondContact OG-CG1 3.43Å; S66-F103 WeakPolarHBondContact O-CE1 3.49Å; S66-C106 PolarHBondContact OG-SG 3.33Å; S66-C106 VanDerWaalsContact OG-SG 3.36Å
67F98.6Very high97.3Very high2 Ų231 Ų311%0.00919%0.185CC..Hα-helixtrans-63.8-44.4177.1-80-59.7000112.8P47 A51 T54 Y63 I64 G69 L70 S71 Y229 I232 L233 L236P47-F67 HydrophobicContact CB-CB 4.46Å; P47-F67 HydrophobicContact CB-CD1 4.13Å; P47-F67 VanDerWaalsContact CB-O 3.29Å; P47-F67 WeakPolarHBondContact CB-O 3.38Å; P47-F67 WeakPolarHBondContact O-CB 3.49Å; A51-F67 HydrophobicContact CB-CB 3.78Å; T54-F67 VanDerWaalsContact OG1-CE2 3.32Å; T54-F67 WeakPolarHBondContact OG1-CE2 3.28Å; Y63-F67 VanDerWaalsContact O-CD2 3.28Å; Y63-F67 WeakPolarHBondContact O-CD2 3.48Å; Y63-F67 PolarHBondContact O-N 2.96Å; Y63-F67 VanDerWaalsContact O-N 3.12Å; I64-F67 PolarHBondContact O-N 3.1Å; F67-G69 VanDerWaalsContact C-N 3.3Å; F67-G69 PolarHBondContact O-N 3.32Å; F67-L70 PolarHBondContact O-N 3.07Å; F67-S71 PolarHBondContact O-N 3.06Å; F67-S71 PolarHBondContact O-OG 2.83Å; F67-Y229 HydrophobicContact CD1-CD2 4.05Å; F67-Y229 AromaticContact CD1-CE2 3.85Å; F67-Y229 HydrophobicContact CD1-CE2 3.85Å; F67-Y229 AromaticContact CE1-CD2 3.63Å; F67-Y229 HydrophobicContact CE1-CD2 3.63Å; F67-Y229 AromaticContact CE1-CE2 3.29Å; F67-Y229 HydrophobicContact CE1-CE2 3.29Å; F67-Y229 AromaticContact CE1-CZ 3.95Å; F67-Y229 HydrophobicContact CZ-CE2 4.25Å; F67-I232 HydrophobicContact CD1-CD1 4.06Å; F67-I232 HydrophobicContact CD1-CG2 3.95Å; F67-I232 HydrophobicContact CD2-CG2 4.03Å; F67-I232 HydrophobicContact CE1-CB 4.04Å; F67-I232 HydrophobicContact CE1-CD1 4.35Å; F67-I232 HydrophobicContact CE1-CG2 3.59Å; F67-I232 HydrophobicContact CE2-CG2 3.7Å; F67-I232 HydrophobicContact CG-CG2 4.15Å; F67-I232 HydrophobicContact CZ-CB 4.27Å; F67-I232 HydrophobicContact CZ-CG2 3.48Å; F67-I232 VanDerWaalsContact CZ-CG2 3.48Å; F67-L233 HydrophobicContact CZ-CD2 4.01Å; F67-L236 HydrophobicContact CE2-CD2 4.38Å
68L98.7Very high97.6Very high86 Ų8632.4 Ų32.445%0.4519%0.187SC..Hα-helixtrans-66.7-32177.1-66.3179.8000112.6A51 I64 S71 A72A51-L68 HydrophobicContact CB-CD2 3.73Å; A51-L68 HydrophobicContact CB-CG 3.89Å; I64-L68 HydrophobicContact CG2-CD1 4Å; I64-L68 HydrophobicContact CG2-CG 4.37Å; I64-L68 WeakPolarHBondContact O-CG 3.36Å; I64-L68 PolarHBondContact O-N 3.22Å; L68-S71 WeakPolarHBondContact O-CB 3.47Å; L68-S71 PolarHBondContact O-N 2.95Å; L68-A72 WeakPolarHBondContact O-CB 3.23Å; L68-A72 PolarHBondContact O-N 3.42Å
69G98.6Very high98Very high11 Ų1130.9 Ų30.911%0.11317%0.166CC..Hα-helixtrans-61.6-46.5172.700000111.6C65 S66 F67 S71 A72 V73 S99C65-G69 PolarHBondContact O-N 2.87Å; S66-G69 PolarHBondContact O-N 3.38Å; F67-G69 VanDerWaalsContact C-N 3.3Å; F67-G69 PolarHBondContact O-N 3.32Å; G69-S71 VanDerWaalsContact C-N 3.32Å; G69-S71 PolarHBondContact O-N 3.29Å; G69-A72 WeakPolarHBondContact O-CB 3.41Å; G69-A72 PolarHBondContact O-N 3.43Å; G69-A72 VanDerWaalsContact O-N 3.12Å; G69-V73 WeakPolarHBondContact O-CG2 3.5Å; G69-V73 PolarHBondContact O-N 3.24Å; G69-S99 WeakPolarHBondContact CA-OG 3.45Å; G69-S99 PolarHBondContact O-OG 3.41Å
70L98.8Very high98.2Very high5 Ų530 Ų303%0.02616%0.161CC..Hα-helixtrans-61.8-39.6174.3-175.257.5000112.2M43 P47 S66 F67 A72 V73 G74 F103 I232M43-L70 HydrophobicContact CG-CD1 4.44Å; M43-L70 CarbonylContact O-C 3.58Å; M43-L70 HydrophobicContact SD-CD1 4.37Å; P47-L70 HydrophobicContact CB-CB 4.16Å; P47-L70 HydrophobicContact CB-CD2 4.21Å; P47-L70 HydrophobicContact CB-CG 4.28Å; P47-L70 HydrophobicContact CG-CB 4.24Å; P47-L70 HydrophobicContact CG-CD2 3.58Å; P47-L70 HydrophobicContact CG-CG 3.8Å; S66-L70 PolarHBondContact O-N 2.89Å; S66-L70 VanDerWaalsContact O-N 3.13Å; F67-L70 PolarHBondContact O-N 3.07Å; L70-A72 VanDerWaalsContact C-N 3.35Å; L70-A72 PolarHBondContact O-N 3.49Å; L70-V73 PolarHBondContact O-N 3.41Å; L70-G74 PolarHBondContact O-N 3.01Å; L70-F103 HydrophobicContact CB-CZ 4.37Å; L70-I232 HydrophobicContact CB-CD1 4.1Å; L70-I232 HydrophobicContact CD2-CD1 3.92Å
71S98.8Very high98.4Very high8 Ų828.2 Ų28.26%0.05615%0.152CC..Hα-helixtrans-62.1-39.7171.8-62.60000113.2M43 I44 P47 I48 F67 L68 G69 V73 G74 V75M43-S71 VanDerWaalsContact O-CA 3.25Å; M43-S71 WeakPolarHBondContact O-CA 3.4Å; M43-S71 PolarHBondContact O-N 3.3Å; I44-S71 PolarHBondContact O-OG 2.86Å; P47-S71 WeakPolarHBondContact CB-OG 3.37Å; I48-S71 WeakPolarHBondContact CG1-OG 3.39Å; I48-S71 PolarHBondContact N-OG 3.33Å; F67-S71 PolarHBondContact O-N 3.06Å; F67-S71 PolarHBondContact O-OG 2.83Å; L68-S71 WeakPolarHBondContact O-CB 3.47Å; L68-S71 PolarHBondContact O-N 2.95Å; G69-S71 VanDerWaalsContact C-N 3.32Å; G69-S71 PolarHBondContact O-N 3.29Å; S71-V73 VanDerWaalsContact C-N 3.35Å; S71-G74 PolarHBondContact O-N 3.45Å; S71-V75 WeakPolarHBondContact O-CG2 3.39Å; S71-V75 PolarHBondContact O-N 3.4Å
72A98.7Very high98.5Very high45 Ų4522.8 Ų22.837%0.37213%0.13SC..Hα-helixtrans-64-40.8177.400000111.5L68 G69 L70 V75 G76L68-A72 WeakPolarHBondContact O-CB 3.23Å; L68-A72 PolarHBondContact O-N 3.42Å; G69-A72 WeakPolarHBondContact O-CB 3.41Å; G69-A72 PolarHBondContact O-N 3.43Å; G69-A72 VanDerWaalsContact O-N 3.12Å; L70-A72 VanDerWaalsContact C-N 3.35Å; L70-A72 PolarHBondContact O-N 3.49Å; A72-V75 PolarHBondContact O-N 2.88Å; A72-G76 PolarHBondContact O-N 3.42Å
73V98.8Very high98.5Very high14 Ų1421.6 Ų21.69%0.08513%0.126CC..Hα-helixtrans-58.1-49.6170.8175.10000110.5M43 G69 L70 S71 V75 G76 S77 P95 M96M43-V73 HydrophobicContact SD-CG1 4.45Å; G69-V73 WeakPolarHBondContact O-CG2 3.5Å; G69-V73 PolarHBondContact O-N 3.24Å; L70-V73 PolarHBondContact O-N 3.41Å; S71-V73 VanDerWaalsContact C-N 3.35Å; V73-V75 PolarHBondContact O-N 3.28Å; V73-G76 PolarHBondContact O-N 2.71Å; V73-S77 WeakPolarHBondContact O-CB 3.4Å; V73-S77 PolarHBondContact O-N 3.46Å; V73-P95 HydrophobicContact CG2-CB 3.92Å; V73-M96 HydrophobicContact CG1-CG 3.78Å; V73-M96 HydrophobicContact CG2-CG 4.15Å
74G98.7Very high98.5Very high0 Ų021.5 Ų21.50%013%0.126CC..Hα-helixtrans-60.8-40.5179.300000113.9L70 S71 W78L70-G74 PolarHBondContact O-N 3.01Å; S71-G74 PolarHBondContact O-N 3.45Å; G74-W78 WeakPolarHBondContact O-CB 3.18Å; G74-W78 PolarHBondContact O-N 3.48Å
75V98.9Very high98.4Very high67 Ų6722.5 Ų22.541%0.40613%0.131SC..Hα-helixtrans-66.9-44.4176.1170.80000110.9I44 S71 A72 V73 W78 C79I44-V75 HydrophobicContact CD1-CG2 3.9Å; I44-V75 HydrophobicContact CG1-CG2 4.02Å; I44-V75 HydrophobicContact CG2-CG2 4.3Å; S71-V75 WeakPolarHBondContact O-CG2 3.39Å; S71-V75 PolarHBondContact O-N 3.4Å; A72-V75 PolarHBondContact O-N 2.88Å; V73-V75 PolarHBondContact O-N 3.28Å; V75-W78 PolarHBondContact O-N 2.9Å; V75-C79 PolarHBondContact O-N 3.07Å; V75-C79 PolarHBondContact O-SG 3.45Å; V75-C79 VanDerWaalsContact O-SG 3.36Å
76G98.8Very high98.4Very high0 Ų021.9 Ų21.90%012%0.123CC..Hα-helixtrans-57.5-51.6175.600000112.3A72 V73 W78 C79 F80 L91A72-G76 PolarHBondContact O-N 3.42Å; V73-G76 PolarHBondContact O-N 2.71Å; G76-W78 PolarHBondContact O-N 2.88Å; G76-C79 WeakPolarHBondContact O-CB 3.35Å; G76-C79 PolarHBondContact O-N 3.12Å; G76-C79 VanDerWaalsContact O-N 3.15Å; G76-F80 PolarHBondContact O-N 3.27Å; G76-L91 VanDerWaalsContact CA-O 3.26Å; G76-L91 WeakPolarHBondContact CA-O 3.34Å
77S98.7Very high98.4Very high1 Ų127.3 Ų27.31%0.00715%0.148CC..Hα-helixtrans-57.6-45.4175.8-171.40000111.9N40 V73 C79 F80 H81 D92N40-S77 PolarHBondContact ND2-OG 2.84Å; N40-S77 VanDerWaalsContact ND2-OG 3.09Å; N40-S77 WeakPolarHBondContact OD1-CB 3.4Å; N40-S77 PolarHBondContact OD1-OG 3Å; V73-S77 WeakPolarHBondContact O-CB 3.4Å; V73-S77 PolarHBondContact O-N 3.46Å; S77-C79 PolarHBondContact O-N 3.45Å; S77-F80 PolarHBondContact O-N 2.75Å; S77-H81 PolarHBondContact O-CD2 3.12Å; S77-H81 PolarHBondContact O-N 2.92Å; S77-H81 PolarHBondContact OG-CD2 3.13Å; S77-H81 PolarHBondContact OG-NE2 3.34Å; S77-D92 VanDerWaalsContact CA-CG 3.44Å; S77-D92 WeakPolarHBondContact CA-OD1 3.39Å; S77-D92 WeakPolarHBondContact CB-OD1 3.39Å; S77-D92 PolarHBondContact N-OD1 3Å
78W98.8Very high98.4Very high75 Ų7530.1 Ų30.128%0.28416%0.162SC..Hα-helixtrans-56.4-50.9174.4-170.8-42.2000111.2T37 N40 L41 I44 G74 V75 G76 F80 M82T37-W78 HydrophobicContact CG2-CD2 4.17Å; T37-W78 HydrophobicContact CG2-CG 3.72Å; N40-W78 HydrophobicContact CB-CB 4.26Å; N40-W78 PolarHBondContact ND2-N 3.36Å; L41-W78 HydrophobicContact CD1-CH2 4.46Å; L41-W78 HydrophobicContact CD2-CH2 3.74Å; L41-W78 HydrophobicContact CD2-CZ3 3.37Å; L41-W78 HydrophobicContact CG-CE3 4.45Å; L41-W78 HydrophobicContact CG-CH2 3.96Å; L41-W78 HydrophobicContact CG-CZ3 3.56Å; I44-W78 HydrophobicContact CD1-CD2 4.41Å; I44-W78 HydrophobicContact CD1-CE3 3.37Å; I44-W78 HydrophobicContact CD1-CZ3 3.87Å; G74-W78 WeakPolarHBondContact O-CB 3.18Å; G74-W78 PolarHBondContact O-N 3.48Å; V75-W78 PolarHBondContact O-N 2.9Å; G76-W78 PolarHBondContact O-N 2.88Å; W78-F80 VanDerWaalsContact C-N 3.28Å; W78-F80 PolarHBondContact O-N 3.03Å; W78-M82 WeakPolarHBondContact O-CB 3.35Å; W78-M82 PolarHBondContact O-N 3.48Å
79C98.7Very high98.3Very high33 Ų3326 Ų2622%0.22314%0.141CC..Hα-helixtrans-60.4-39179-71.20000112V75 G76 S77 T83 M88 L91V75-C79 PolarHBondContact O-N 3.07Å; V75-C79 PolarHBondContact O-SG 3.45Å; V75-C79 VanDerWaalsContact O-SG 3.36Å; G76-C79 WeakPolarHBondContact O-CB 3.35Å; G76-C79 PolarHBondContact O-N 3.12Å; G76-C79 VanDerWaalsContact O-N 3.15Å; S77-C79 PolarHBondContact O-N 3.45Å; C79-T83 WeakPolarHBondContact O-CB 3.46Å; C79-T83 WeakPolarHBondContact O-CG2 3.45Å; C79-T83 PolarHBondContact O-N 3.32Å; C79-T83 PolarHBondContact O-OG1 3.48Å; C79-M88 HydrophobicContact CB-CB 4.28Å; C79-M88 HydrophobicContact CB-CG 4.25Å; C79-M88 HydrophobicContact CB-SD 3.77Å; C79-L91 HydrophobicContact CB-CD2 4.39Å
80F98.6Very high98.3Very high0 Ų027 Ų270%014%0.143CC..Hα-helixtrans-65-59177.8173.7-134.7000111.7L18 W20 G76 S77 W78 M82 T83 L84 M88 Q89 D92L18-F80 HydrophobicContact CD1-CE1 3.79Å; L18-F80 HydrophobicContact CD1-CZ 3.65Å; L18-F80 HydrophobicContact CG-CZ 4.11Å; W20-F80 HydrophobicContact CZ2-CE1 4.45Å; W20-F80 AromaticContact NE1-CE1 3.28Å; W20-F80 VanDerWaalsContact NE1-CE1 3.28Å; W20-F80 AromaticContact NE1-CZ 3.85Å; G76-F80 PolarHBondContact O-N 3.27Å; S77-F80 PolarHBondContact O-N 2.75Å; W78-F80 VanDerWaalsContact C-N 3.28Å; W78-F80 PolarHBondContact O-N 3.03Å; F80-M82 PolarHBondContact O-N 3.5Å; F80-T83 PolarHBondContact O-N 3.2Å; F80-L84 HydrophobicContact CE2-CD2 3.96Å; F80-L84 HydrophobicContact CZ-CD2 4.2Å; F80-L84 WeakPolarHBondContact O-CA 3.47Å; F80-L84 PolarHBondContact O-N 3.32Å; F80-M88 HydrophobicContact CB-CB 4.33Å; F80-Q89 HydrophobicContact CD2-CB 3.69Å; F80-Q89 HydrophobicContact CD2-CG 4.25Å; F80-Q89 HydrophobicContact CE1-CG 4.35Å; F80-Q89 HydrophobicContact CE2-CB 3.7Å; F80-Q89 HydrophobicContact CE2-CG 3.93Å; F80-Q89 HydrophobicContact CG-CB 4.31Å; F80-Q89 HydrophobicContact CZ-CB 4.27Å; F80-Q89 HydrophobicContact CZ-CG 3.98Å; F80-D92 HydrophobicContact CB-CB 3.89Å; F80-D92 HydrophobicContact CD1-CB 4.24Å; F80-D92 WeakPolarHBondContact CD1-OD2 3.34Å; F80-D92 HydrophobicContact CG-CB 4.36Å
81H98.3Very high98.3Very high0 Ų030.5 Ų30.50%016%0.161CC..Hα-helixtrans-64.3-24.4-177.8-68.2-73000113.5W20 E33 N36 T37 S77 H217 H221W20-H81 AromaticContact CD1-CE1 3.27Å; W20-H81 AromaticContact CD1-ND1 3.51Å; W20-H81 AromaticContact CE2-CE1 3.99Å; W20-H81 AromaticContact NE1-CE1 3.11Å; W20-H81 PolarHBondContact NE1-CE1 2.86Å; W20-H81 AromaticContact NE1-ND1 3.7Å; E33-H81 HydrophobicContact CB-CB 4.32Å; E33-H81 PolarHBondContact N-O 3.46Å; E33-H81 IonicContact OE2-CE1 2.97Å; E33-H81 IonicContact OE2-CG 2.93Å; E33-H81 IonicContact OE2-ND1 3.81Å; E33-H81 PolarHBondContact OE2-ND1 3.02Å; N36-H81 HydrophobicContact CB-CB 4.07Å; T37-H81 VanDerWaalsContact OG1-CB 3.32Å; T37-H81 WeakPolarHBondContact OG1-CB 3.45Å; T37-H81 PolarHBondContact OG1-O 3.27Å; S77-H81 PolarHBondContact O-CD2 3.12Å; S77-H81 PolarHBondContact O-N 2.92Å; S77-H81 PolarHBondContact OG-CD2 3.13Å; S77-H81 PolarHBondContact OG-NE2 3.34Å; H81-H217 AromaticContact CE1-CD2 3.63Å; H81-H217 AromaticContact CE1-NE2 3.5Å; H81-H217 PolarHBondContact CE1-NE2 2.95Å; H81-H217 AromaticContact NE2-NE2 3.81Å; H81-H221 AromaticContact CD2-CE1 3.56Å; H81-H221 AromaticContact CE1-CE1 3.71Å; H81-H221 AromaticContact CE1-NE2 3.97Å; H81-H221 AromaticContact NE2-CE1 3.11Å; H81-H221 PolarHBondContact NE2-CE1 3.09Å; H81-H221 AromaticContact NE2-NE2 3.28Å; H81-H221 PolarHBondContact NE2-NE2 3.45Å
82M98.1Very high98.3Very high41 Ų4130.8 Ų30.820%0.20216%0.162CC..Hα-helixtrans-71-33.2173.9-178.9177.971.400112.7W11 I31 A32 T37 W78 F80W11-M82 HydrophobicContact CZ2-CE 3.82Å; I31-M82 HydrophobicContact CB-CG 4.43Å; I31-M82 HydrophobicContact CG1-CG 4.17Å; I31-M82 HydrophobicContact CG2-CB 4.39Å; I31-M82 HydrophobicContact CG2-CG 4.35Å; A32-M82 PolarHBondContact N-O 2.86Å; A32-M82 VanDerWaalsContact N-O 3.08Å; T37-M82 HydrophobicContact CG2-CB 4.1Å; T37-M82 PolarHBondContact OG1-N 3.28Å; W78-M82 WeakPolarHBondContact O-CB 3.35Å; W78-M82 PolarHBondContact O-N 3.48Å; F80-M82 PolarHBondContact O-N 3.5Å
83T97.5Very high98.3Very high5 Ų529.1 Ų29.13%0.03115%0.147CC..Hα-helixtrans-117.8-31.3-165.464.30000114.7W11 C79 F80 L85 M88W11-T83 HydrophobicContact CB-CG2 4.45Å; W11-T83 HydrophobicContact CD2-CG2 3.71Å; W11-T83 HydrophobicContact CE3-CG2 4.24Å; W11-T83 HydrophobicContact CG-CG2 3.78Å; W11-T83 HydrophobicContact CZ2-CG2 4.42Å; C79-T83 WeakPolarHBondContact O-CB 3.46Å; C79-T83 WeakPolarHBondContact O-CG2 3.45Å; C79-T83 PolarHBondContact O-N 3.32Å; C79-T83 PolarHBondContact O-OG1 3.48Å; F80-T83 PolarHBondContact O-N 3.2Å; T83-L85 PolarHBondContact O-N 3.36Å; T83-L85 PolarHBondContact OG1-N 2.96Å; T83-M88 WeakPolarHBondContact OG1-CG 3.48Å
84L97.3Very high98.2Very high0 Ų029.2 Ų29.20%015%0.147CC..  trans52.535.3-170.3-60.5175000113.7P14 T15 S16 N24 A32 E33 F80P14-L84 WeakPolarHBondContact CA-O 3.45Å; P14-L84 HydrophobicContact CB-CB 3.88Å; P14-L84 HydrophobicContact CG-CB 4.13Å; P14-L84 HydrophobicContact CG-CD1 4.15Å; T15-L84 PolarHBondContact N-O 2.93Å; S16-L84 PolarHBondContact N-O 3.45Å; S16-L84 VanDerWaalsContact N-O 3.16Å; S16-L84 PolarHBondContact OG-O 2.95Å; N24-L84 WeakPolarHBondContact ND2-CD1 3.41Å; N24-L84 WeakPolarHBondContact OD1-CD1 3.17Å; A32-L84 HydrophobicContact CB-CD1 3.86Å; A32-L84 HydrophobicContact CB-CG 4.01Å; E33-L84 HydrophobicContact CG-CD1 4.46Å; F80-L84 HydrophobicContact CE2-CD2 3.96Å; F80-L84 HydrophobicContact CZ-CD2 4.2Å; F80-L84 WeakPolarHBondContact O-CA 3.47Å; F80-L84 PolarHBondContact O-N 3.32Å
85L97.1Very high98.2Very high37 Ų3730 Ų3019%0.19415%0.152CC..  trans-95.4141.8175.5-62.2177.1000110.8T15 T83 E87 M88 Q89T15-L85 HydrophobicContact CG2-CD2 4.32Å; T15-L85 WeakPolarHBondContact OG1-CA 3.26Å; T83-L85 PolarHBondContact O-N 3.36Å; T83-L85 PolarHBondContact OG1-N 2.96Å; L85-E87 VanDerWaalsContact C-N 3.25Å; L85-E87 PolarHBondContact O-N 3.46Å; L85-M88 HydrophobicContact CB-CG 4.4Å; L85-M88 PolarHBondContact O-N 3.01Å; L85-Q89 PolarHBondContact O-N 3.34Å
86Y97.4Very high98.2Very high26 Ų2628.1 Ų28.110%0.10214%0.139CC..Hα-helixtrans-57.3-37.8-179.5-177.4-108.4000112.8T15 T17 M88 Q89 L90 K140T15-Y86 PolarHBondContact OG1-N 3.32Å; T17-Y86 HydrophobicContact CG2-CD2 4.13Å; T17-Y86 HydrophobicContact CG2-CE2 4Å; Y86-M88 VanDerWaalsContact C-N 3.28Å; Y86-M88 PolarHBondContact O-N 3.06Å; Y86-Q89 WeakPolarHBondContact O-CB 3.5Å; Y86-Q89 PolarHBondContact O-N 2.91Å; Y86-L90 HydrophobicContact CD1-CD1 4.24Å; Y86-L90 HydrophobicContact CE1-CD1 3.76Å; Y86-L90 HydrophobicContact CE1-CD2 4.46Å; Y86-L90 HydrophobicContact CE1-CG 4.16Å; Y86-L90 WeakPolarHBondContact O-CG 3.46Å; Y86-L90 PolarHBondContact O-N 3.47Å; Y86-K140 HydrophobicContact CE1-CD 4.44Å; Y86-K140 HydrophobicContact CE2-CD 4.14Å; Y86-K140 WeakPolarHBondContact OH-CD 3.42Å; Y86-K140 WeakPolarHBondContact OH-CE 3.48Å; Y86-K140 WeakPolarHBondContact OH-CG 3.46Å
87E97.9Very high98.2Very high118 Ų11828.1 Ų28.155%0.55114%0.139SC*.Hα-helixtrans-63.3-36.6177.5-63.775.3-16700111.9L85 L91L85-E87 VanDerWaalsContact C-N 3.25Å; L85-E87 PolarHBondContact O-N 3.46Å; E87-L91 PolarHBondContact O-N 2.95Å
88M98.3Very high98.2Very high61 Ų6132.2 Ų32.230%0.316%0.155SC..Hα-helixtrans-79.7-30.9177.7-60.5-58.6146.600111.5C79 F80 T83 L85 Y86 L90 L91 D92C79-M88 HydrophobicContact CB-CB 4.28Å; C79-M88 HydrophobicContact CB-CG 4.25Å; C79-M88 HydrophobicContact CB-SD 3.77Å; F80-M88 HydrophobicContact CB-CB 4.33Å; T83-M88 WeakPolarHBondContact OG1-CG 3.48Å; L85-M88 HydrophobicContact CB-CG 4.4Å; L85-M88 PolarHBondContact O-N 3.01Å; Y86-M88 VanDerWaalsContact C-N 3.28Å; Y86-M88 PolarHBondContact O-N 3.06Å; M88-L90 VanDerWaalsContact C-N 3.3Å; M88-L90 PolarHBondContact O-N 2.72Å; M88-L91 CarbonylContact O-C 3.57Å; M88-L91 WeakPolarHBondContact O-CA 3.48Å; M88-L91 WeakPolarHBondContact O-CB 3.22Å; M88-L91 PolarHBondContact O-N 2.94Å; M88-L91 HydrophobicContact SD-CD2 4.07Å; M88-D92 PolarHBondContact O-N 3.39Å
89Q98.4Very high98.2Very high0 Ų029 Ų290%014%0.144CC..Hα-helixtrans-58.3-43169.4-171.7-168-36.500111.3S16 T17 L18 F80 L85 Y86 L91 D92 E93 Y136S16-Q89 VanDerWaalsContact CA-OE1 3.32Å; T17-Q89 PolarHBondContact OG1-NE2 2.9Å; T17-Q89 PolarHBondContact OG1-OE1 3.32Å; L18-Q89 VanDerWaalsContact CD2-NE2 3.32Å; F80-Q89 HydrophobicContact CD2-CB 3.69Å; F80-Q89 HydrophobicContact CD2-CG 4.25Å; F80-Q89 HydrophobicContact CE1-CG 4.35Å; F80-Q89 HydrophobicContact CE2-CB 3.7Å; F80-Q89 HydrophobicContact CE2-CG 3.93Å; F80-Q89 HydrophobicContact CG-CB 4.31Å; F80-Q89 HydrophobicContact CZ-CB 4.27Å; F80-Q89 HydrophobicContact CZ-CG 3.98Å; L85-Q89 PolarHBondContact O-N 3.34Å; Y86-Q89 WeakPolarHBondContact O-CB 3.5Å; Y86-Q89 PolarHBondContact O-N 2.91Å; Q89-L91 VanDerWaalsContact C-N 3.28Å; Q89-L91 PolarHBondContact O-N 3.4Å; Q89-D92 WeakPolarHBondContact O-CB 3.47Å; Q89-D92 PolarHBondContact O-N 3.21Å; Q89-D92 VanDerWaalsContact O-N 3.15Å; Q89-E93 HydrophobicContact CG-CG 4.49Å; Q89-E93 WeakPolarHBondContact CG-OE2 3.25Å; Q89-E93 PolarHBondContact NE2-OE2 2.67Å; Q89-E93 PolarHBondContact O-N 2.97Å; Q89-Y136 PolarHBondContact NE2-OH 3.13Å
90L98.3Very high98.2Very high30 Ų3027.7 Ų27.716%0.15714%0.135CC..Hα-helixtrans-62.4-36.7173.5-66.3174.8000112.2Y86 M88 D92 L94 Y136 L137Y86-L90 HydrophobicContact CD1-CD1 4.24Å; Y86-L90 HydrophobicContact CE1-CD1 3.76Å; Y86-L90 HydrophobicContact CE1-CD2 4.46Å; Y86-L90 HydrophobicContact CE1-CG 4.16Å; Y86-L90 WeakPolarHBondContact O-CG 3.46Å; Y86-L90 PolarHBondContact O-N 3.47Å; M88-L90 VanDerWaalsContact C-N 3.3Å; M88-L90 PolarHBondContact O-N 2.72Å; L90-D92 VanDerWaalsContact C-N 3.25Å; L90-D92 PolarHBondContact O-N 2.91Å; L90-L94 HydrophobicContact CB-CD1 4.18Å; L90-L94 HydrophobicContact CD2-CD1 4.19Å; L90-L94 HydrophobicContact CD2-CG 4.46Å; L90-L94 VanDerWaalsContact O-CB 3.26Å; L90-L94 WeakPolarHBondContact O-CB 3.39Å; L90-L94 WeakPolarHBondContact O-CG 3.43Å; L90-L94 PolarHBondContact O-N 3.07Å; L90-L94 VanDerWaalsContact O-N 3.1Å; L90-Y136 HydrophobicContact CD2-CD1 4.13Å; L90-Y136 HydrophobicContact CD2-CE1 4.07Å; L90-L137 HydrophobicContact CD1-CD2 3.58Å; L90-L137 HydrophobicContact CD2-CD2 3.71Å; L90-L137 HydrophobicContact CG-CD2 4.31Å
91L98.2Very high98.2Very high80 Ų8028.1 Ų28.142%0.41914%0.137SC..Hα-helixtrans-69.3-22.5176.8-166.465.9000112.6G76 C79 E87 M88 Q89 P95G76-L91 VanDerWaalsContact CA-O 3.26Å; G76-L91 WeakPolarHBondContact CA-O 3.34Å; C79-L91 HydrophobicContact CB-CD2 4.39Å; E87-L91 PolarHBondContact O-N 2.95Å; M88-L91 CarbonylContact O-C 3.57Å; M88-L91 WeakPolarHBondContact O-CA 3.48Å; M88-L91 WeakPolarHBondContact O-CB 3.22Å; M88-L91 PolarHBondContact O-N 2.94Å; M88-L91 HydrophobicContact SD-CD2 4.07Å; Q89-L91 VanDerWaalsContact C-N 3.28Å; Q89-L91 PolarHBondContact O-N 3.4Å; L91-P95 WeakPolarHBondContact O-CD 3.41Å; L91-P95 WeakPolarHBondContact O-CG 3.39Å
92D98.4Very high98.2Very high13 Ų1330.2 Ų30.27%0.0715%0.15CC..Hα-helixtrans-82.6-58.6171.7-178.523.9000111.6S77 F80 M88 Q89 L90 P95 M96S77-D92 VanDerWaalsContact CA-CG 3.44Å; S77-D92 WeakPolarHBondContact CA-OD1 3.39Å; S77-D92 WeakPolarHBondContact CB-OD1 3.39Å; S77-D92 PolarHBondContact N-OD1 3Å; F80-D92 HydrophobicContact CB-CB 3.89Å; F80-D92 HydrophobicContact CD1-CB 4.24Å; F80-D92 WeakPolarHBondContact CD1-OD2 3.34Å; F80-D92 HydrophobicContact CG-CB 4.36Å; M88-D92 PolarHBondContact O-N 3.39Å; Q89-D92 WeakPolarHBondContact O-CB 3.47Å; Q89-D92 PolarHBondContact O-N 3.21Å; Q89-D92 VanDerWaalsContact O-N 3.15Å; L90-D92 VanDerWaalsContact C-N 3.25Å; L90-D92 PolarHBondContact O-N 2.91Å; D92-P95 WeakPolarHBondContact O-CD 3.18Å; D92-M96 WeakPolarHBondContact O-CG 3.37Å
93E98.3Very high98.2Very high10 Ų1028.9 Ų28.95%0.04714%0.144CC..Hα-helixtrans-73.4-39.9-167.6-72.4-179.6135.700113.2Q89 M96 Y136 H145Q89-E93 HydrophobicContact CG-CG 4.49Å; Q89-E93 WeakPolarHBondContact CG-OE2 3.25Å; Q89-E93 PolarHBondContact NE2-OE2 2.67Å; Q89-E93 PolarHBondContact O-N 2.97Å; E93-M96 WeakPolarHBondContact O-CB 3.13Å; E93-M96 PolarHBondContact O-N 3.03Å; E93-Y136 HydrophobicContact CB-CE1 4.38Å; E93-Y136 VanDerWaalsContact CD-OH 3.26Å; E93-Y136 PolarHBondContact OE1-OH 3.49Å; E93-Y136 VanDerWaalsContact OE2-CE1 3.29Å; E93-Y136 WeakPolarHBondContact OE2-CE1 3.37Å; E93-Y136 VanDerWaalsContact OE2-CZ 3.22Å; E93-Y136 PolarHBondContact OE2-OH 3.3Å; E93-H145 PolarHBondContact O-NE2 3.09Å
94L98.4Very high98.3Very high17 Ų1729.4 Ų29.49%0.08915%0.147CC..Hα-helixtrans-68.7-43.4-176.7-64.8176.6000112.8L90 M96 I97 Y98 T133 Y136L90-L94 HydrophobicContact CB-CD1 4.18Å; L90-L94 HydrophobicContact CD2-CD1 4.19Å; L90-L94 HydrophobicContact CD2-CG 4.46Å; L90-L94 VanDerWaalsContact O-CB 3.26Å; L90-L94 WeakPolarHBondContact O-CB 3.39Å; L90-L94 WeakPolarHBondContact O-CG 3.43Å; L90-L94 PolarHBondContact O-N 3.07Å; L90-L94 VanDerWaalsContact O-N 3.1Å; L94-M96 PolarHBondContact O-N 3.06Å; L94-I97 WeakPolarHBondContact O-CB 3.48Å; L94-I97 PolarHBondContact O-N 3.16Å; L94-Y98 HydrophobicContact CB-CE2 3.77Å; L94-Y98 WeakPolarHBondContact O-CD2 3.34Å; L94-Y98 PolarHBondContact O-N 3.45Å; L94-Y98 VanDerWaalsContact O-N 3.17Å; L94-T133 HydrophobicContact CD1-CG2 3.94Å; L94-T133 HydrophobicContact CD2-CG2 4.08Å; L94-Y136 HydrophobicContact CD2-CD1 4.01Å
95P98.6Very high98.4Very high17 Ų1730.9 Ų30.911%0.1115%0.152CC..Hα-helixtrans-58.4-25.3172.8-31.942.2000114.7V73 L91 D92 I97 Y98 S99V73-P95 HydrophobicContact CG2-CB 3.92Å; L91-P95 WeakPolarHBondContact O-CD 3.41Å; L91-P95 WeakPolarHBondContact O-CG 3.39Å; D92-P95 WeakPolarHBondContact O-CD 3.18Å; P95-I97 VanDerWaalsContact C-N 3.32Å; P95-I97 PolarHBondContact O-N 3.22Å; P95-Y98 PolarHBondContact O-N 2.88Å; P95-S99 WeakPolarHBondContact O-CB 3.26Å; P95-S99 PolarHBondContact O-N 3.4Å; P95-S99 PolarHBondContact O-OG 2.96Å
96M98.6Very high98.4Very high26 Ų2629.1 Ų29.113%0.12814%0.143CC..Hα-helixtrans-60.8-43.8173.2-62.617366.800110.9V73 D92 E93 L94 T100 Y149V73-M96 HydrophobicContact CG1-CG 3.78Å; V73-M96 HydrophobicContact CG2-CG 4.15Å; D92-M96 WeakPolarHBondContact O-CG 3.37Å; E93-M96 WeakPolarHBondContact O-CB 3.13Å; E93-M96 PolarHBondContact O-N 3.03Å; L94-M96 PolarHBondContact O-N 3.06Å; M96-T100 VanDerWaalsContact O-CB 3.27Å; M96-T100 WeakPolarHBondContact O-CB 3.49Å; M96-T100 PolarHBondContact O-N 3.02Å; M96-T100 VanDerWaalsContact O-N 3.12Å; M96-T100 PolarHBondContact O-OG1 3.5Å; M96-Y149 HydrophobicContact CB-CD2 3.95Å; M96-Y149 HydrophobicContact CB-CE2 3.91Å; M96-Y149 HydrophobicContact CE-CD1 3.97Å; M96-Y149 HydrophobicContact CE-CD2 4.13Å; M96-Y149 HydrophobicContact CE-CE1 3.7Å; M96-Y149 HydrophobicContact CE-CE2 3.87Å; M96-Y149 HydrophobicContact CE-CG 4.17Å
97I98.8Very high98.4Very high0 Ų027.9 Ų27.90%014%0.139CC..Hα-helixtrans-64.9-50.7176.5-59.3-63.5000110L94 P95 S99 T100 C101 F128 V132 M148 Y149 L152L94-I97 WeakPolarHBondContact O-CB 3.48Å; L94-I97 PolarHBondContact O-N 3.16Å; P95-I97 VanDerWaalsContact C-N 3.32Å; P95-I97 PolarHBondContact O-N 3.22Å; I97-S99 PolarHBondContact O-N 2.96Å; I97-T100 PolarHBondContact O-N 3.36Å; I97-C101 PolarHBondContact O-N 3.22Å; I97-C101 PolarHBondContact O-SG 2.96Å; I97-C101 VanDerWaalsContact O-SG 3.37Å; I97-F128 HydrophobicContact CG2-CD1 4.49Å; I97-F128 HydrophobicContact CG2-CE1 4.14Å; I97-V132 HydrophobicContact CD1-CG1 4.33Å; I97-V132 HydrophobicContact CG1-CG1 4.14Å; I97-V132 HydrophobicContact CG2-CG1 4.46Å; I97-M148 HydrophobicContact CD1-CB 4.38Å; I97-Y149 HydrophobicContact CD1-CD2 4.4Å; I97-L152 HydrophobicContact CD1-CD1 4.42Å; I97-L152 HydrophobicContact CG2-CD1 4.09Å
98Y98.7Very high98.4Very high88 Ų8827 Ų2735%0.34513%0.131SC..Hα-helixtrans-63.1-45.5-174.9-52-27.1000112.2L94 P95 T100 C101 V102 T133L94-Y98 HydrophobicContact CB-CE2 3.77Å; L94-Y98 WeakPolarHBondContact O-CD2 3.34Å; L94-Y98 PolarHBondContact O-N 3.45Å; L94-Y98 VanDerWaalsContact O-N 3.17Å; P95-Y98 PolarHBondContact O-N 2.88Å; Y98-T100 VanDerWaalsContact C-N 3.34Å; Y98-T100 PolarHBondContact O-N 3.08Å; Y98-C101 WeakPolarHBondContact O-CB 3.28Å; Y98-C101 PolarHBondContact O-N 3.36Å; Y98-V102 PolarHBondContact O-N 3.46Å; Y98-V102 VanDerWaalsContact O-N 3.12Å; Y98-T133 WeakPolarHBondContact CE1-OG1 3.38Å; Y98-T133 WeakPolarHBondContact OH-CG2 3.37Å; Y98-T133 PolarHBondContact OH-OG1 3.15Å
99S98.4Very high98.4Very high8 Ų824.9 Ų24.96%0.05612%0.12CC..Hα-helixtrans-65.1-40.6178.9-55.50000111.1G69 P95 I97 C101 V102 F103G69-S99 WeakPolarHBondContact CA-OG 3.45Å; G69-S99 PolarHBondContact O-OG 3.41Å; P95-S99 WeakPolarHBondContact O-CB 3.26Å; P95-S99 PolarHBondContact O-N 3.4Å; P95-S99 PolarHBondContact O-OG 2.96Å; I97-S99 PolarHBondContact O-N 2.96Å; S99-C101 VanDerWaalsContact C-N 3.33Å; S99-C101 PolarHBondContact O-N 3.34Å; S99-V102 WeakPolarHBondContact O-CA 3.46Å; S99-V102 WeakPolarHBondContact O-CB 3.18Å; S99-V102 PolarHBondContact O-N 3.44Å; S99-V102 VanDerWaalsContact O-N 3.07Å; S99-F103 VanDerWaalsContact O-CD1 3.23Å; S99-F103 WeakPolarHBondContact O-CD1 3.49Å; S99-F103 VanDerWaalsContact O-CG 3.28Å; S99-F103 WeakPolarHBondContact O-CG 3.27Å; S99-F103 PolarHBondContact O-N 3.39Å
100T98.6Very high98.3Very high4 Ų424.9 Ų24.93%0.02512%0.12CC..Hα-helixtrans-68.5-33.8177.9-51.10000111.6M96 I97 Y98 V102 F103 V104 Y149 L152 V153 L156M96-T100 VanDerWaalsContact O-CB 3.27Å; M96-T100 WeakPolarHBondContact O-CB 3.49Å; M96-T100 PolarHBondContact O-N 3.02Å; M96-T100 VanDerWaalsContact O-N 3.12Å; M96-T100 PolarHBondContact O-OG1 3.5Å; I97-T100 PolarHBondContact O-N 3.36Å; Y98-T100 VanDerWaalsContact C-N 3.34Å; Y98-T100 PolarHBondContact O-N 3.08Å; T100-V102 VanDerWaalsContact C-N 3.32Å; T100-V102 PolarHBondContact O-N 2.88Å; T100-F103 WeakPolarHBondContact O-CB 3.36Å; T100-F103 PolarHBondContact O-N 2.94Å; T100-V104 WeakPolarHBondContact O-CG2 3.42Å; T100-V104 PolarHBondContact O-N 2.87Å; T100-Y149 WeakPolarHBondContact OG1-CE2 3.26Å; T100-L152 HydrophobicContact CG2-CB 3.58Å; T100-L152 HydrophobicContact CG2-CD1 4.23Å; T100-V153 HydrophobicContact CG2-CG2 4.43Å; T100-L156 HydrophobicContact CG2-CD1 3.6Å; T100-L156 HydrophobicContact CG2-CG 4.47Å
101C98.8Very high98.2Very high9 Ų925.9 Ų25.96%0.06112%0.123CC..Hα-helixtrans-57.9-43.9168.1-73.20000111.7I97 Y98 S99 F103 V104 Y105 L125I97-C101 PolarHBondContact O-N 3.22Å; I97-C101 PolarHBondContact O-SG 2.96Å; I97-C101 VanDerWaalsContact O-SG 3.37Å; Y98-C101 WeakPolarHBondContact O-CB 3.28Å; Y98-C101 PolarHBondContact O-N 3.36Å; S99-C101 VanDerWaalsContact C-N 3.33Å; S99-C101 PolarHBondContact O-N 3.34Å; C101-F103 VanDerWaalsContact C-N 3.34Å; C101-F103 PolarHBondContact O-N 3.13Å; C101-V104 PolarHBondContact O-N 3.16Å; C101-Y105 PolarHBondContact O-N 2.97Å; C101-L125 HydrophobicContact CB-CB 4.15Å; C101-L125 HydrophobicContact CB-CD2 4.1Å; C101-L125 WeakPolarHBondContact O-CD1 3.16Å
102V98.6Very high98Very high45 Ų4526.5 Ų26.527%0.27312%0.123SC..Hα-helixtrans-62.3-41.4174.8177.70000111.3C65 S66 Y98 S99 T100 V104 Y105 C106C65-V102 HydrophobicContact CB-CG1 4.09Å; S66-V102 WeakPolarHBondContact OG-CG1 3.43Å; Y98-V102 PolarHBondContact O-N 3.46Å; Y98-V102 VanDerWaalsContact O-N 3.12Å; S99-V102 WeakPolarHBondContact O-CA 3.46Å; S99-V102 WeakPolarHBondContact O-CB 3.18Å; S99-V102 PolarHBondContact O-N 3.44Å; S99-V102 VanDerWaalsContact O-N 3.07Å; T100-V102 VanDerWaalsContact C-N 3.32Å; T100-V102 PolarHBondContact O-N 2.88Å; V102-V104 PolarHBondContact O-N 3.42Å; V102-Y105 WeakPolarHBondContact O-CB 3.46Å; V102-Y105 PolarHBondContact O-N 3.39Å; V102-C106 PolarHBondContact O-N 3.27Å; V102-C106 PolarHBondContact O-SG 2.84Å
103F98.6Very high97.7Very high13 Ų1333.1 Ų33.16%0.05715%0.153CC..Hα-helixtrans-62.3-43.8176.5-57.9-15.3000111.7S66 L70 S99 T100 C101 Y105 C106 L107 L156 I232S66-F103 WeakPolarHBondContact O-CE1 3.49Å; L70-F103 HydrophobicContact CB-CZ 4.37Å; S99-F103 VanDerWaalsContact O-CD1 3.23Å; S99-F103 WeakPolarHBondContact O-CD1 3.49Å; S99-F103 VanDerWaalsContact O-CG 3.28Å; S99-F103 WeakPolarHBondContact O-CG 3.27Å; S99-F103 PolarHBondContact O-N 3.39Å; T100-F103 WeakPolarHBondContact O-CB 3.36Å; T100-F103 PolarHBondContact O-N 2.94Å; C101-F103 VanDerWaalsContact C-N 3.34Å; C101-F103 PolarHBondContact O-N 3.13Å; F103-Y105 VanDerWaalsContact C-N 3.35Å; F103-C106 PolarHBondContact O-N 3.26Å; F103-L107 WeakPolarHBondContact O-CB 3.42Å; F103-L107 PolarHBondContact O-N 2.86Å; F103-L156 HydrophobicContact CB-CD1 3.77Å; F103-L156 HydrophobicContact CB-CD2 4.05Å; F103-L156 HydrophobicContact CD2-CD1 4.19Å; F103-I232 HydrophobicContact CD1-CG1 4.23Å; F103-I232 HydrophobicContact CE1-CD1 3.74Å; F103-I232 HydrophobicContact CE1-CG1 3.83Å; F103-I232 HydrophobicContact CZ-CD1 3.8Å; F103-I232 HydrophobicContact CZ-CG1 4.09Å
104V98.6Very high97.3Very high16 Ų1636.6 Ų36.610%0.09717%0.169CC..Hα-helixtrans-59.8-47.8176.4169.10000109.7T100 C101 V102 C106 L107 Y108 L125 L152 L156T100-V104 WeakPolarHBondContact O-CG2 3.42Å; T100-V104 PolarHBondContact O-N 2.87Å; C101-V104 PolarHBondContact O-N 3.16Å; V102-V104 PolarHBondContact O-N 3.42Å; V104-C106 PolarHBondContact O-N 3.16Å; V104-L107 PolarHBondContact O-N 3.41Å; V104-Y108 HydrophobicContact CG1-CD2 3.92Å; V104-Y108 HydrophobicContact CG1-CE2 4.18Å; V104-Y108 WeakPolarHBondContact O-CB 3.38Å; V104-Y108 WeakPolarHBondContact O-CD2 3.33Å; V104-Y108 PolarHBondContact O-N 2.91Å; V104-L125 HydrophobicContact CB-CD2 4.34Å; V104-L125 HydrophobicContact CG1-CD1 4.42Å; V104-L125 HydrophobicContact CG1-CD2 4.04Å; V104-L152 HydrophobicContact CG2-CD2 4.23Å; V104-L156 HydrophobicContact CB-CD2 4.3Å; V104-L156 HydrophobicContact CG2-CD1 4.42Å; V104-L156 HydrophobicContact CG2-CD2 3.71Å; V104-L156 HydrophobicContact CG2-CG 3.7Å
105Y98.4Very high96.8Very high30 Ų3042.6 Ų42.612%0.11820%0.202CC..Hα-helixtrans-56.4-51.2176178.9-102.3000111.8R62 C101 V102 F103 L107 Y108 E109 P121 I122R62-Y105 HydrophobicContact CB-CE1 4.47Å; C101-Y105 PolarHBondContact O-N 2.97Å; V102-Y105 WeakPolarHBondContact O-CB 3.46Å; V102-Y105 PolarHBondContact O-N 3.39Å; F103-Y105 VanDerWaalsContact C-N 3.35Å; Y105-L107 VanDerWaalsContact C-N 3.33Å; Y105-L107 PolarHBondContact O-N 3.26Å; Y105-Y108 PolarHBondContact O-N 3.22Å; Y105-E109 HydrophobicContact CD2-CG 3.96Å; Y105-E109 HydrophobicContact CE2-CG 3.71Å; Y105-E109 VanDerWaalsContact O-CB 3.23Å; Y105-E109 WeakPolarHBondContact O-CB 3.33Å; Y105-E109 WeakPolarHBondContact O-CG 3.39Å; Y105-E109 PolarHBondContact O-N 3.06Å; Y105-P121 HydrophobicContact CD2-CB 4.31Å; Y105-P121 HydrophobicContact CD2-CG 4.19Å; Y105-P121 HydrophobicContact CE2-CG 4.05Å; Y105-I122 HydrophobicContact CD2-CG1 3.84Å; Y105-I122 HydrophobicContact CE2-CD1 3.88Å; Y105-I122 HydrophobicContact CE2-CG1 3.38Å
106C98.2Very high96.4Very high1 Ų144 Ų441%0.00721%0.212CC..Hα-helixtrans-58.8-43.6-179.4-66.60000112.4Y63 S66 V102 F103 V104 C110Y63-C106 HydrophobicContact CE1-CB 3.94Å; S66-C106 PolarHBondContact OG-SG 3.33Å; S66-C106 VanDerWaalsContact OG-SG 3.36Å; V102-C106 PolarHBondContact O-N 3.27Å; V102-C106 PolarHBondContact O-SG 2.84Å; F103-C106 PolarHBondContact O-N 3.26Å; V104-C106 PolarHBondContact O-N 3.16Å; C106-C110 WeakPolarHBondContact O-CB 3.29Å; C106-C110 PolarHBondContact O-N 3.1Å; C106-C110 VanDerWaalsContact O-N 3.16Å
107L98.1Very high96.1Very high0 Ų048.7 Ų48.70%024%0.236CC..Hα-helixtrans-75.4-35.7-176-170.367.1000113F103 V104 Y105 C110 L156 R159 S160 I163 I238F103-L107 WeakPolarHBondContact O-CB 3.42Å; F103-L107 PolarHBondContact O-N 2.86Å; V104-L107 PolarHBondContact O-N 3.41Å; Y105-L107 VanDerWaalsContact C-N 3.33Å; Y105-L107 PolarHBondContact O-N 3.26Å; L107-C110 PolarHBondContact O-SG 3.5Å; L107-L156 HydrophobicContact CB-CD2 4.21Å; L107-L156 HydrophobicContact CD2-CD2 3.81Å; L107-R159 HydrophobicContact CD2-CB 3.78Å; L107-R159 HydrophobicContact CD2-CG 3.7Å; L107-R159 HydrophobicContact CG-CB 4.38Å; L107-R159 HydrophobicContact CG-CG 3.73Å; L107-S160 WeakPolarHBondContact CD2-OG 3.38Å; L107-I163 HydrophobicContact CD1-CD1 3.82Å; L107-I163 HydrophobicContact CG-CD1 4.25Å; L107-I238 HydrophobicContact CD1-CD1 3.96Å
108Y97.6Very high95.7Very high99 Ų9950 Ų5039%0.38825%0.245SC..Hα-helixtrans-75-30.9176.9-85-103.9000112.1V104 Y105 R159V104-Y108 HydrophobicContact CG1-CD2 3.92Å; V104-Y108 HydrophobicContact CG1-CE2 4.18Å; V104-Y108 WeakPolarHBondContact O-CB 3.38Å; V104-Y108 WeakPolarHBondContact O-CD2 3.33Å; V104-Y108 PolarHBondContact O-N 2.91Å; Y105-Y108 PolarHBondContact O-N 3.22Å; Y108-R159 HydrophobicContact CD2-CB 4.35Å; Y108-R159 HydrophobicContact CD2-CG 4Å; Y108-R159 HydrophobicContact CE2-CB 3.63Å; Y108-R159 HydrophobicContact CE2-CG 3.75Å
109E96.9Very high95.5Very high16 Ų1650.4 Ų50.48%0.07526%0.257CS..THydrogen-bonded Turntrans-96.513.8-179.2-62.8-69.7108.900113.3R62 Y105 F111 K112 S118 P121R62-E109 PolarHBondContact NH1-O 2.77Å; R62-E109 PolarHBondContact NH2-O 2.91Å; Y105-E109 HydrophobicContact CD2-CG 3.96Å; Y105-E109 HydrophobicContact CE2-CG 3.71Å; Y105-E109 VanDerWaalsContact O-CB 3.23Å; Y105-E109 WeakPolarHBondContact O-CB 3.33Å; Y105-E109 WeakPolarHBondContact O-CG 3.39Å; Y105-E109 PolarHBondContact O-N 3.06Å; E109-F111 VanDerWaalsContact C-N 3.28Å; E109-F111 PolarHBondContact O-N 3.45Å; E109-K112 HydrophobicContact CB-CG 4.41Å; E109-K112 PolarHBondContact O-N 2.99Å; E109-K112 WeakPolarHBondContact OE2-CG 3.33Å; E109-S118 WeakPolarHBondContact OE2-CB 3.33Å; E109-S118 PolarHBondContact OE2-OG 3.39Å; E109-P121 HydrophobicContact CG-CG 4.46Å
110C96.2Very high95.4Very high0 Ų057.9 Ų57.90%029%0.288CS..THydrogen-bonded Turntrans-69.1-23.2-176.666.40000113.8C106 L107 I238 R239C106-C110 WeakPolarHBondContact O-CB 3.29Å; C106-C110 PolarHBondContact O-N 3.1Å; C106-C110 VanDerWaalsContact O-N 3.16Å; L107-C110 PolarHBondContact O-SG 3.5Å; C110-I238 HydrophobicContact CB-CG2 3.95Å; C110-I238 VanDerWaalsContact SG-CG2 3.57Å; C110-R239 WeakPolarHBondContact O-CD 3.29Å; C110-R239 PolarHBondContact O-NH1 2.91Å
111F96.7Very high95.3Very high51 Ų5159 Ų5922%0.22430%0.295CS..THydrogen-bonded Turntrans-104.817-179.4-56.7-55.3000114.2E109 I163 V167 Y168 I238 Y242E109-F111 VanDerWaalsContact C-N 3.28Å; E109-F111 PolarHBondContact O-N 3.45Å; F111-I163 HydrophobicContact CE2-CD1 3.96Å; F111-I163 HydrophobicContact CE2-CG1 3.88Å; F111-I163 HydrophobicContact CZ-CD1 4.18Å; F111-I163 HydrophobicContact CZ-CG1 4.06Å; F111-I163 HydrophobicContact CZ-CG2 4.04Å; F111-V167 HydrophobicContact CE1-CG1 4.13Å; F111-V167 HydrophobicContact CZ-CB 4.38Å; F111-V167 HydrophobicContact CZ-CG1 3.83Å; F111-V167 HydrophobicContact CZ-CG2 4.48Å; F111-Y168 HydrophobicContact CE1-CD2 4.42Å; F111-Y168 AromaticContact CE1-CE2 3.57Å; F111-Y168 HydrophobicContact CE1-CE2 3.57Å; F111-Y168 AromaticContact CE1-CZ 3.91Å; F111-Y168 HydrophobicContact CZ-CE2 4.14Å; F111-I238 HydrophobicContact CE1-CG2 3.82Å; F111-I238 HydrophobicContact CZ-CG2 3.88Å; F111-Y242 HydrophobicContact CB-CD2 4.22Å; F111-Y242 HydrophobicContact CB-CE2 4.09Å; F111-Y242 AromaticContact CD1-CD2 3.64Å; F111-Y242 HydrophobicContact CD1-CD2 3.64Å; F111-Y242 HydrophobicContact CD1-CE2 4.31Å; F111-Y242 HydrophobicContact CD1-CG 4.06Å; F111-Y242 HydrophobicContact CG-CD2 4.42Å; F111-Y242 PolarHBondContact O-OH 3.5Å
112K94.9Very high95.2Very high94 Ų9461.1 Ų61.141%0.40931%0.306SS..SBendtrans-89.1162.1177.3-68.6-73.7-167.5172.90111.4E109 R239 Y242E109-K112 HydrophobicContact CB-CG 4.41Å; E109-K112 PolarHBondContact O-N 2.99Å; E109-K112 WeakPolarHBondContact OE2-CG 3.33Å; K112-R239 PolarHBondContact O-NH1 3.43Å; K112-R239 PolarHBondContact O-NH2 3.21Å; K112-Y242 WeakPolarHBondContact O-CE1 3.37Å
113Q92.1Very high95.2Very high151 Ų15162.4 Ų62.471%0.70631%0.314SS*.PPolyproline II helixtrans-58.7146.2176.5-170.9173.7-8.900110.9S116Q113-S116 PolarHBondContact N-OG 2.88Å; Q113-S116 WeakPolarHBondContact O-CB 3.5Å; Q113-S116 PolarHBondContact O-N 3.29Å; Q113-S116 PolarHBondContact O-OG 2.85Å
114E90.1Very high95.2Very high83 Ų8366.4 Ų66.439%0.38834%0.335SS..THydrogen-bonded Turntrans-54.9143.2171.5-163.2176.6-169.300110.9S116 L243 Y245E114-S116 PolarHBondContact O-N 3.4Å; E114-L243 HydrophobicContact CB-CD2 3.95Å; E114-L243 HydrophobicContact CG-CD1 4.42Å; E114-L243 HydrophobicContact CG-CD2 4.4Å; E114-Y245 PolarHBondContact OE1-OH 2.87Å
115N86.8Confident95.2Very high144 Ų14466.7 Ų66.777%0.7734%0.336SS*.THydrogen-bonded Turntrans60.110.3-177-56-48.3000115.8
116S91Very high95.2Very high47 Ų4769.6 Ų69.633%0.32935%0.352SS..  trans-86.3132170.371.30000110.9Q113 E114Q113-S116 PolarHBondContact N-OG 2.88Å; Q113-S116 WeakPolarHBondContact O-CB 3.5Å; Q113-S116 PolarHBondContact O-N 3.29Å; Q113-S116 PolarHBondContact O-OG 2.85Å; E114-S116 PolarHBondContact O-N 3.4Å
117I91.3Very high95.2Very high124 Ų12474.2 Ų74.264%0.63638%0.376SS*.  trans-114.6110.4178.5-57.5178.2000108.6V119 I122I117-V119 PolarHBondContact O-N 3.03Å; I117-I122 HydrophobicContact CG2-CD1 3.64Å
118S92Very high95.2Very high27 Ų2777.1 Ų77.119%0.18939%0.389CS..  trans-80.8106.2171.4-600000110.5E109 P121 I122E109-S118 WeakPolarHBondContact OE2-CB 3.33Å; E109-S118 PolarHBondContact OE2-OG 3.39Å; S118-P121 VanDerWaalsContact O-CD 3.29Å; S118-P121 WeakPolarHBondContact O-CD 3.23Å; S118-P121 WeakPolarHBondContact O-CG 3.2Å; S118-I122 WeakPolarHBondContact O-CG1 3.13Å
119V93.8Very high95.2Very high96 Ų9673.1 Ų73.158%0.58238%0.375SS*.Hα-helixtrans-68.5-36.7-179.4178.80000112.1I117 I122 V123I117-V119 PolarHBondContact O-N 3.03Å; V119-I122 WeakPolarHBondContact O-CB 3.35Å; V119-I122 PolarHBondContact O-N 3.45Å; V119-V123 HydrophobicContact CG1-CG2 3.88Å; V119-V123 WeakPolarHBondContact O-CG2 3.3Å; V119-V123 PolarHBondContact O-N 3.04Å
120F96.8Very high95.3Very high165 Ų16575.8 Ų75.872%0.72439%0.393SS*.Hα-helixtrans-54.1-55.8-178.7175.8-97.9000114I122 V123 L124F120-I122 VanDerWaalsContact C-N 3.28Å; F120-I122 PolarHBondContact O-N 3.15Å; F120-V123 PolarHBondContact O-N 3.18Å; F120-L124 HydrophobicContact CE1-CD2 4.46Å; F120-L124 WeakPolarHBondContact O-CB 3.49Å; F120-L124 PolarHBondContact O-N 3.1Å
121P96.4Very high95.4Very high27 Ų2778.6 Ų78.618%0.17541%0.412CS..Hα-helixtrans-64.4-31.6178.125-34.5000112.7Y105 E109 S118 L124 L125Y105-P121 HydrophobicContact CD2-CB 4.31Å; Y105-P121 HydrophobicContact CD2-CG 4.19Å; Y105-P121 HydrophobicContact CE2-CG 4.05Å; E109-P121 HydrophobicContact CG-CG 4.46Å; S118-P121 VanDerWaalsContact O-CD 3.29Å; S118-P121 WeakPolarHBondContact O-CD 3.23Å; S118-P121 WeakPolarHBondContact O-CG 3.2Å; P121-L124 PolarHBondContact O-N 3.12Å; P121-L125 WeakPolarHBondContact O-CB 3.3Å; P121-L125 WeakPolarHBondContact O-CD1 3.32Å; P121-L125 WeakPolarHBondContact O-CG 3.33Å; P121-L125 PolarHBondContact O-N 3.29Å
122I96.8Very high95.5Very high55 Ų5576.3 Ų76.328%0.28240%0.403SS..Hα-helixtrans-62.1-52.1175.5-64.8172000110.1Y105 I117 S118 V119 F120 L124 L125 I126Y105-I122 HydrophobicContact CD2-CG1 3.84Å; Y105-I122 HydrophobicContact CE2-CD1 3.88Å; Y105-I122 HydrophobicContact CE2-CG1 3.38Å; I117-I122 HydrophobicContact CG2-CD1 3.64Å; S118-I122 WeakPolarHBondContact O-CG1 3.13Å; V119-I122 WeakPolarHBondContact O-CB 3.35Å; V119-I122 PolarHBondContact O-N 3.45Å; F120-I122 VanDerWaalsContact C-N 3.28Å; F120-I122 PolarHBondContact O-N 3.15Å; I122-L124 VanDerWaalsContact C-N 3.32Å; I122-L124 PolarHBondContact O-N 3.4Å; I122-L125 PolarHBondContact O-N 3.17Å; I122-I126 HydrophobicContact CG2-CD1 3.71Å; I122-I126 HydrophobicContact CG2-CG1 4.44Å; I122-I126 VanDerWaalsContact O-CG1 3.3Å; I122-I126 WeakPolarHBondContact O-CG1 3.36Å; I122-I126 PolarHBondContact O-N 3.48Å
123V98.1Very high95.7Very high71 Ų7172.8 Ų72.843%0.4339%0.389SS..Hα-helixtrans-60.5-43.9179.7172.30000110.8V119 F120 L125 I126 I127V119-V123 HydrophobicContact CG1-CG2 3.88Å; V119-V123 WeakPolarHBondContact O-CG2 3.3Å; V119-V123 PolarHBondContact O-N 3.04Å; F120-V123 PolarHBondContact O-N 3.18Å; V123-L125 PolarHBondContact O-N 3.27Å; V123-I126 PolarHBondContact O-N 2.92Å; V123-I127 HydrophobicContact CG1-CD1 3.75Å; V123-I127 HydrophobicContact CG1-CG1 4.41Å; V123-I127 VanDerWaalsContact O-CG1 3.3Å; V123-I127 WeakPolarHBondContact O-CG1 3.3Å; V123-I127 PolarHBondContact O-N 2.64Å
124L98.3Very high96Very high97 Ų9770.7 Ų70.751%0.50838%0.382SS..Hα-helixtrans-59.3-47177.7179.963.5000112.2F120 P121 I122 I127 F128F120-L124 HydrophobicContact CE1-CD2 4.46Å; F120-L124 WeakPolarHBondContact O-CB 3.49Å; F120-L124 PolarHBondContact O-N 3.1Å; P121-L124 PolarHBondContact O-N 3.12Å; I122-L124 VanDerWaalsContact C-N 3.32Å; I122-L124 PolarHBondContact O-N 3.4Å; L124-I127 PolarHBondContact O-N 3.44Å; L124-F128 WeakPolarHBondContact O-CB 3.25Å; L124-F128 PolarHBondContact O-N 3.37Å
125L98.3Very high96.4Very high22 Ų2269.7 Ų69.712%0.11538%0.381CS..Hα-helixtrans-68.9-35.1-179.5-70.7166.6000112.2C101 V104 P121 I122 V123 F128 S129C101-L125 HydrophobicContact CB-CB 4.15Å; C101-L125 HydrophobicContact CB-CD2 4.1Å; C101-L125 WeakPolarHBondContact O-CD1 3.16Å; V104-L125 HydrophobicContact CB-CD2 4.34Å; V104-L125 HydrophobicContact CG1-CD1 4.42Å; V104-L125 HydrophobicContact CG1-CD2 4.04Å; P121-L125 WeakPolarHBondContact O-CB 3.3Å; P121-L125 WeakPolarHBondContact O-CD1 3.32Å; P121-L125 WeakPolarHBondContact O-CG 3.33Å; P121-L125 PolarHBondContact O-N 3.29Å; I122-L125 PolarHBondContact O-N 3.17Å; V123-L125 PolarHBondContact O-N 3.27Å; L125-F128 PolarHBondContact O-N 3.37Å; L125-S129 WeakPolarHBondContact O-CB 3.38Å; L125-S129 PolarHBondContact O-N 3.37Å; L125-S129 PolarHBondContact O-OG 3.29Å; L125-S129 VanDerWaalsContact O-OG 3.13Å
126I98.4Very high96.9Very high91 Ų9162.8 Ų62.847%0.46735%0.345SS..Hα-helixtrans-63.5-50.8172.5-70.4170.1000110.1I122 V123 F128 S129 V130I122-I126 HydrophobicContact CG2-CD1 3.71Å; I122-I126 HydrophobicContact CG2-CG1 4.44Å; I122-I126 VanDerWaalsContact O-CG1 3.3Å; I122-I126 WeakPolarHBondContact O-CG1 3.36Å; I122-I126 PolarHBondContact O-N 3.48Å; V123-I126 PolarHBondContact O-N 2.92Å; I126-F128 VanDerWaalsContact C-N 3.27Å; I126-F128 PolarHBondContact O-N 2.91Å; I126-S129 PolarHBondContact O-N 3.03Å; I126-S129 PolarHBondContact O-OG 2.97Å; I126-V130 HydrophobicContact CG2-CG2 4.21Å; I126-V130 WeakPolarHBondContact O-CB 2.85Å; I126-V130 WeakPolarHBondContact O-CG2 3.19Å; I126-V130 PolarHBondContact O-N 3.23Å
127I98.6Very high97.2Very high98 Ų9863.7 Ų63.750%0.50335%0.345SS..Hα-helixtrans-56.5-44.8177.9-70168.4000110.5V123 L124 S131V123-I127 HydrophobicContact CG1-CD1 3.75Å; V123-I127 HydrophobicContact CG1-CG1 4.41Å; V123-I127 VanDerWaalsContact O-CG1 3.3Å; V123-I127 WeakPolarHBondContact O-CG1 3.3Å; V123-I127 PolarHBondContact O-N 2.64Å; L124-I127 PolarHBondContact O-N 3.44Å; I127-S131 VanDerWaalsContact O-CB 3.26Å; I127-S131 WeakPolarHBondContact O-CB 3.19Å; I127-S131 PolarHBondContact O-N 3.44Å; I127-S131 PolarHBondContact O-OG 2.71Å
128F98.5Very high97.5Very high61 Ų6165.8 Ų65.827%0.26835%0.352SS..Hα-helixtrans-58.5-55.5176.3177.3-92000111.4I97 L124 L125 I126 V130 S131 V132 M148 L152I97-F128 HydrophobicContact CG2-CD1 4.49Å; I97-F128 HydrophobicContact CG2-CE1 4.14Å; L124-F128 WeakPolarHBondContact O-CB 3.25Å; L124-F128 PolarHBondContact O-N 3.37Å; L125-F128 PolarHBondContact O-N 3.37Å; I126-F128 VanDerWaalsContact C-N 3.27Å; I126-F128 PolarHBondContact O-N 2.91Å; F128-V130 PolarHBondContact O-N 2.99Å; F128-S131 PolarHBondContact O-N 3.49Å; F128-V132 HydrophobicContact CD1-CG2 4.24Å; F128-V132 HydrophobicContact CE1-CG2 3.8Å; F128-V132 HydrophobicContact CE2-CG2 4.11Å; F128-V132 HydrophobicContact CZ-CG2 3.74Å; F128-V132 WeakPolarHBondContact O-CG2 3.33Å; F128-V132 PolarHBondContact O-N 2.93Å; F128-M148 HydrophobicContact CE2-SD 4.3Å; F128-M148 HydrophobicContact CZ-CB 4.28Å; F128-M148 HydrophobicContact CZ-SD 4.33Å; F128-L152 HydrophobicContact CD1-CD1 4.29Å; F128-L152 HydrophobicContact CD1-CD2 4.25Å; F128-L152 HydrophobicContact CD1-CG 4.46Å; F128-L152 HydrophobicContact CE1-CD1 3.58Å; F128-L152 HydrophobicContact CE1-CD2 3.91Å; F128-L152 HydrophobicContact CE1-CG 3.67Å; F128-L152 HydrophobicContact CZ-CD1 4.38Å; F128-L152 HydrophobicContact CZ-CD2 4.39Å; F128-L152 HydrophobicContact CZ-CG 4.06Å
129S98.4Very high97.7Very high15 Ų1572.3 Ų72.311%0.10537%0.373CS..Hα-helixtrans-62.3-40.1-176.264.50000113.5L125 I126 T133L125-S129 WeakPolarHBondContact O-CB 3.38Å; L125-S129 PolarHBondContact O-N 3.37Å; L125-S129 PolarHBondContact O-OG 3.29Å; L125-S129 VanDerWaalsContact O-OG 3.13Å; I126-S129 PolarHBondContact O-N 3.03Å; I126-S129 PolarHBondContact O-OG 2.97Å; S129-T133 WeakPolarHBondContact O-CB 3.43Å; S129-T133 PolarHBondContact O-N 3.04Å; S129-T133 PolarHBondContact O-OG1 3.41Å
130V98.6Very high97.8Very high72 Ų7272.3 Ų72.344%0.43637%0.365SS..Hα-helixtrans-66.4-44.2175.8172.10000110.4I126 F128 V132 T133 L134I126-V130 HydrophobicContact CG2-CG2 4.21Å; I126-V130 WeakPolarHBondContact O-CB 2.85Å; I126-V130 WeakPolarHBondContact O-CG2 3.19Å; I126-V130 PolarHBondContact O-N 3.23Å; F128-V130 PolarHBondContact O-N 2.99Å; V130-V132 PolarHBondContact O-N 3.21Å; V130-T133 PolarHBondContact O-N 3.48Å; V130-L134 HydrophobicContact CG1-CD1 3.93Å; V130-L134 HydrophobicContact CG1-CG 4.28Å; V130-L134 WeakPolarHBondContact O-CG 3.37Å; V130-L134 PolarHBondContact O-N 3.07Å
131S98.5Very high97.7Very high59 Ų5967.9 Ų67.941%0.41335%0.347SS..Hα-helixtrans-60.3-47.2177.6-58.80000111.8I127 F128 T133 L134 V135I127-S131 VanDerWaalsContact O-CB 3.26Å; I127-S131 WeakPolarHBondContact O-CB 3.19Å; I127-S131 PolarHBondContact O-N 3.44Å; I127-S131 PolarHBondContact O-OG 2.71Å; F128-S131 PolarHBondContact O-N 3.49Å; S131-T133 VanDerWaalsContact C-N 3.32Å; S131-T133 PolarHBondContact O-N 3.07Å; S131-L134 PolarHBondContact O-N 3.2Å; S131-V135 WeakPolarHBondContact O-CG2 3.47Å; S131-V135 PolarHBondContact O-N 2.98Å
132V98.5Very high97.6Very high4 Ų467.8 Ų67.82%0.02435%0.346CS..Hα-helixtrans-59.1-45.2175.9172.50000110.6I97 F128 V130 V135 Y136 F144 M148I97-V132 HydrophobicContact CD1-CG1 4.33Å; I97-V132 HydrophobicContact CG1-CG1 4.14Å; I97-V132 HydrophobicContact CG2-CG1 4.46Å; F128-V132 HydrophobicContact CD1-CG2 4.24Å; F128-V132 HydrophobicContact CE1-CG2 3.8Å; F128-V132 HydrophobicContact CE2-CG2 4.11Å; F128-V132 HydrophobicContact CZ-CG2 3.74Å; F128-V132 WeakPolarHBondContact O-CG2 3.33Å; F128-V132 PolarHBondContact O-N 2.93Å; V130-V132 PolarHBondContact O-N 3.21Å; V132-V135 PolarHBondContact O-N 2.96Å; V132-Y136 WeakPolarHBondContact O-CB 3.36Å; V132-Y136 PolarHBondContact O-N 3.28Å; V132-F144 HydrophobicContact CG1-CE1 4.09Å; V132-M148 HydrophobicContact CG1-CB 4.13Å; V132-M148 HydrophobicContact CG1-CG 4.27Å; V132-M148 HydrophobicContact CG2-CB 4Å; V132-M148 HydrophobicContact CG2-CG 3.86Å; V132-M148 HydrophobicContact CG2-SD 4.17Å
133T98.5Very high97.6Very high19 Ų1968.7 Ų68.712%0.11735%0.354CS..Hα-helixtrans-60.9-48.4179.3-55.60000111.8L94 Y98 S129 V130 S131 Y136 L137L94-T133 HydrophobicContact CD1-CG2 3.94Å; L94-T133 HydrophobicContact CD2-CG2 4.08Å; Y98-T133 WeakPolarHBondContact CE1-OG1 3.38Å; Y98-T133 WeakPolarHBondContact OH-CG2 3.37Å; Y98-T133 PolarHBondContact OH-OG1 3.15Å; S129-T133 WeakPolarHBondContact O-CB 3.43Å; S129-T133 PolarHBondContact O-N 3.04Å; S129-T133 PolarHBondContact O-OG1 3.41Å; V130-T133 PolarHBondContact O-N 3.48Å; S131-T133 VanDerWaalsContact C-N 3.32Å; S131-T133 PolarHBondContact O-N 3.07Å; T133-Y136 PolarHBondContact O-N 3.2Å; T133-L137 HydrophobicContact CG2-CD1 3.93Å; T133-L137 HydrophobicContact CG2-CG 4.4Å; T133-L137 VanDerWaalsContact O-CG 3.29Å; T133-L137 WeakPolarHBondContact O-CG 3.36Å; T133-L137 PolarHBondContact O-N 3.3Å
134L98.4Very high97.6Very high108 Ų10867.1 Ų67.157%0.56534%0.341SS*.Hα-helixtrans-62.9-45.5-178.8-70.2174.9000111.7V130 S131 Y136 Q138V130-L134 HydrophobicContact CG1-CD1 3.93Å; V130-L134 HydrophobicContact CG1-CG 4.28Å; V130-L134 WeakPolarHBondContact O-CG 3.37Å; V130-L134 PolarHBondContact O-N 3.07Å; S131-L134 PolarHBondContact O-N 3.2Å; L134-Y136 VanDerWaalsContact C-N 3.34Å; L134-Q138 WeakPolarHBondContact O-CG 3.48Å; L134-Q138 PolarHBondContact O-N 3.33Å
135V98.3Very high97.6Very high61 Ų6162.7 Ų62.737%0.3732%0.318SS..Hα-helixtrans-64.1-42.7176.9174.70000110.5S131 V132 L137 Q138 W139 F144S131-V135 WeakPolarHBondContact O-CG2 3.47Å; S131-V135 PolarHBondContact O-N 2.98Å; V132-V135 PolarHBondContact O-N 2.96Å; V135-L137 PolarHBondContact O-N 3Å; V135-Q138 PolarHBondContact O-N 3.41Å; V135-W139 HydrophobicContact CG1-CE3 4.29Å; V135-W139 WeakPolarHBondContact O-CB 3.17Å; V135-W139 PolarHBondContact O-N 3.33Å; V135-F144 HydrophobicContact CB-CE1 3.82Å; V135-F144 HydrophobicContact CB-CZ 3.73Å; V135-F144 HydrophobicContact CG1-CD1 4.14Å; V135-F144 HydrophobicContact CG1-CD2 4.37Å; V135-F144 HydrophobicContact CG1-CE1 3.63Å; V135-F144 HydrophobicContact CG1-CE2 3.89Å; V135-F144 HydrophobicContact CG1-CG 4.49Å; V135-F144 HydrophobicContact CG1-CZ 3.49Å; V135-F144 VanDerWaalsContact CG1-CZ 3.49Å; V135-F144 HydrophobicContact CG2-CZ 4.47Å
136Y98Very high97.6Very high0 Ų064.9 Ų64.90%033%0.328CS..Hα-helixtrans-65.5-39.2-177.6-168.7-128.2000113Q89 L90 E93 L94 V132 T133 L134 Q138 K140 E141 F144 H145Q89-Y136 PolarHBondContact NE2-OH 3.13Å; L90-Y136 HydrophobicContact CD2-CD1 4.13Å; L90-Y136 HydrophobicContact CD2-CE1 4.07Å; E93-Y136 HydrophobicContact CB-CE1 4.38Å; E93-Y136 VanDerWaalsContact CD-OH 3.26Å; E93-Y136 PolarHBondContact OE1-OH 3.49Å; E93-Y136 VanDerWaalsContact OE2-CE1 3.29Å; E93-Y136 WeakPolarHBondContact OE2-CE1 3.37Å; E93-Y136 VanDerWaalsContact OE2-CZ 3.22Å; E93-Y136 PolarHBondContact OE2-OH 3.3Å; L94-Y136 HydrophobicContact CD2-CD1 4.01Å; V132-Y136 WeakPolarHBondContact O-CB 3.36Å; V132-Y136 PolarHBondContact O-N 3.28Å; T133-Y136 PolarHBondContact O-N 3.2Å; L134-Y136 VanDerWaalsContact C-N 3.34Å; Y136-Q138 VanDerWaalsContact C-N 3.29Å; Y136-Q138 PolarHBondContact O-N 3Å; Y136-K140 VanDerWaalsContact O-CA 3.3Å; Y136-K140 WeakPolarHBondContact O-CA 3.32Å; Y136-K140 PolarHBondContact O-N 3.17Å; Y136-E141 WeakPolarHBondContact CE2-O 3.12Å; Y136-F144 HydrophobicContact CD2-CD1 4.17Å; Y136-H145 HydrophobicContact CD2-CB 4.1Å; Y136-H145 HydrophobicContact CE1-CB 4.46Å; Y136-H145 HydrophobicContact CE2-CB 3.85Å
137L97.6Very high97.6Very high66 Ų6664.6 Ų64.635%0.34633%0.33SS..Hα-helixtrans-66.3-29.7176.6-71.1172.7000113.3L90 T133 V135L90-L137 HydrophobicContact CD1-CD2 3.58Å; L90-L137 HydrophobicContact CD2-CD2 3.71Å; L90-L137 HydrophobicContact CG-CD2 4.31Å; T133-L137 HydrophobicContact CG2-CD1 3.93Å; T133-L137 HydrophobicContact CG2-CG 4.4Å; T133-L137 VanDerWaalsContact O-CG 3.29Å; T133-L137 WeakPolarHBondContact O-CG 3.36Å; T133-L137 PolarHBondContact O-N 3.3Å; V135-L137 PolarHBondContact O-N 3Å
138Q96.8Very high97.6Very high168 Ų16862 Ų6279%0.78532%0.317SS*.Hα-helixtrans-85.6-44.3179.7-64.9-61.9-26.800112.3L134 V135 Y136L134-Q138 WeakPolarHBondContact O-CG 3.48Å; L134-Q138 PolarHBondContact O-N 3.33Å; V135-Q138 PolarHBondContact O-N 3.41Å; Y136-Q138 VanDerWaalsContact C-N 3.29Å; Y136-Q138 PolarHBondContact O-N 3Å
139W96.1Very high97.6Very high163 Ų16360.6 Ų60.662%0.61731%0.309SS*.Hα-helixtrans-88-31.5-174.5-165.74.1000112.8V135 E141 F144V135-W139 HydrophobicContact CG1-CE3 4.29Å; V135-W139 WeakPolarHBondContact O-CB 3.17Å; V135-W139 PolarHBondContact O-N 3.33Å; W139-E141 HydrophobicContact CD2-CB 3.94Å; W139-E141 HydrophobicContact CG-CB 3.96Å; W139-E141 HydrophobicContact CZ2-CG 4.46Å; W139-E141 PolarHBondContact O-N 3.08Å; W139-E141 VanDerWaalsContact O-N 3.13Å; W139-F144 HydrophobicContact CE3-CB 4.32Å; W139-F144 HydrophobicContact CE3-CD2 4.43Å; W139-F144 HydrophobicContact CE3-CG 4.38Å; W139-F144 HydrophobicContact CZ3-CB 4.36Å; W139-F144 HydrophobicContact CZ3-CD2 4.24Å
140K95.3Very high97.6Very high97 Ų9761.5 Ų61.542%0.42232%0.322SS..  trans54.826.3179.9-48.5-168.4174.1-174.70114.6T17 Y86 Y136 P142T17-K140 HydrophobicContact CG2-CB 4.23Å; Y86-K140 HydrophobicContact CE1-CD 4.44Å; Y86-K140 HydrophobicContact CE2-CD 4.14Å; Y86-K140 WeakPolarHBondContact OH-CD 3.42Å; Y86-K140 WeakPolarHBondContact OH-CE 3.48Å; Y86-K140 WeakPolarHBondContact OH-CG 3.46Å; Y136-K140 VanDerWaalsContact O-CA 3.3Å; Y136-K140 WeakPolarHBondContact O-CA 3.32Å; Y136-K140 PolarHBondContact O-N 3.17Å; K140-P142 WeakPolarHBondContact O-CD 3.46Å
141E95.7Very high97.6Very high72 Ų7260.3 Ų60.334%0.33632%0.319SS..  trans-93.1107.9-179.8-179.452.4-119.700110.1Y136 W139 V143 F144Y136-E141 WeakPolarHBondContact CE2-O 3.12Å; W139-E141 HydrophobicContact CD2-CB 3.94Å; W139-E141 HydrophobicContact CG-CB 3.96Å; W139-E141 HydrophobicContact CZ2-CG 4.46Å; W139-E141 PolarHBondContact O-N 3.08Å; W139-E141 VanDerWaalsContact O-N 3.13Å; E141-V143 HydrophobicContact CG-CB 4.35Å; E141-V143 PolarHBondContact O-N 3.17Å; E141-V143 WeakPolarHBondContact OE1-CG2 3.49Å; E141-V143 PolarHBondContact OE1-N 2.91Å; E141-F144 HydrophobicContact CB-CB 4.42Å; E141-F144 WeakPolarHBondContact O-CB 3.45Å; E141-F144 PolarHBondContact O-N 3Å
142P94.3Very high97.6Very high24 Ų2458.1 Ų58.116%0.15630%0.303CS..Hα-helixtrans-62.8-28.5-174.824.5-34.6000113.1L18 K140 F144 H145 Q146L18-P142 HydrophobicContact CD2-CB 3.73Å; L18-P142 HydrophobicContact CD2-CG 4.25Å; K140-P142 WeakPolarHBondContact O-CD 3.46Å; P142-F144 VanDerWaalsContact C-N 3.26Å; P142-F144 PolarHBondContact O-N 3.24Å; P142-H145 WeakPolarHBondContact O-CB 3.34Å; P142-H145 PolarHBondContact O-N 3.37Å; P142-Q146 VanDerWaalsContact O-CG 3.32Å; P142-Q146 WeakPolarHBondContact O-CG 3.5Å; P142-Q146 PolarHBondContact O-N 3.35Å
143V96.9Very high97.6Very high75 Ų7559.3 Ų59.346%0.45531%0.31SS..Hα-helixtrans-62.8-35.1176179.30000111.4E141 H145 Q146 V147E141-V143 HydrophobicContact CG-CB 4.35Å; E141-V143 PolarHBondContact O-N 3.17Å; E141-V143 WeakPolarHBondContact OE1-CG2 3.49Å; E141-V143 PolarHBondContact OE1-N 2.91Å; V143-H145 PolarHBondContact O-N 3.35Å; V143-Q146 PolarHBondContact O-N 3.17Å; V143-V147 HydrophobicContact CG1-CG2 4.34Å; V143-V147 VanDerWaalsContact O-CG2 3.31Å; V143-V147 WeakPolarHBondContact O-CG2 3.39Å; V143-V147 PolarHBondContact O-N 3.37Å
144F98.1Very high97.5Very high37 Ų3760.6 Ų60.616%0.16232%0.322CS..Hα-helixtrans-60.7-46.4175.3168.1-98.9000111.2V132 V135 Y136 W139 E141 P142 V147 M148V132-F144 HydrophobicContact CG1-CE1 4.09Å; V135-F144 HydrophobicContact CB-CE1 3.82Å; V135-F144 HydrophobicContact CB-CZ 3.73Å; V135-F144 HydrophobicContact CG1-CD1 4.14Å; V135-F144 HydrophobicContact CG1-CD2 4.37Å; V135-F144 HydrophobicContact CG1-CE1 3.63Å; V135-F144 HydrophobicContact CG1-CE2 3.89Å; V135-F144 HydrophobicContact CG1-CG 4.49Å; V135-F144 HydrophobicContact CG1-CZ 3.49Å; V135-F144 VanDerWaalsContact CG1-CZ 3.49Å; V135-F144 HydrophobicContact CG2-CZ 4.47Å; Y136-F144 HydrophobicContact CD2-CD1 4.17Å; W139-F144 HydrophobicContact CE3-CB 4.32Å; W139-F144 HydrophobicContact CE3-CD2 4.43Å; W139-F144 HydrophobicContact CE3-CG 4.38Å; W139-F144 HydrophobicContact CZ3-CB 4.36Å; W139-F144 HydrophobicContact CZ3-CD2 4.24Å; E141-F144 HydrophobicContact CB-CB 4.42Å; E141-F144 WeakPolarHBondContact O-CB 3.45Å; E141-F144 PolarHBondContact O-N 3Å; P142-F144 VanDerWaalsContact C-N 3.26Å; P142-F144 PolarHBondContact O-N 3.24Å; F144-V147 PolarHBondContact O-N 3.07Å; F144-M148 HydrophobicContact CD2-CG 4.27Å; F144-M148 HydrophobicContact CE1-CG 4.14Å; F144-M148 HydrophobicContact CE2-CE 4.5Å; F144-M148 HydrophobicContact CE2-CG 3.8Å; F144-M148 HydrophobicContact CE2-SD 4.15Å; F144-M148 HydrophobicContact CZ-CG 3.73Å; F144-M148 HydrophobicContact CZ-SD 4.32Å; F144-M148 WeakPolarHBondContact O-CG 3.46Å; F144-M148 PolarHBondContact O-N 3.46Å; F144-M148 VanDerWaalsContact O-N 3.1Å
145H97.6Very high97.5Very high5 Ų557.6 Ų57.62%0.02331%0.31CS..Hα-helixtrans-58.6-48.9175.6167.7-82.6000111.3E93 Y136 P142 V143 V147 M148 Y149E93-H145 PolarHBondContact O-NE2 3.09Å; Y136-H145 HydrophobicContact CD2-CB 4.1Å; Y136-H145 HydrophobicContact CE1-CB 4.46Å; Y136-H145 HydrophobicContact CE2-CB 3.85Å; P142-H145 WeakPolarHBondContact O-CB 3.34Å; P142-H145 PolarHBondContact O-N 3.37Å; V143-H145 PolarHBondContact O-N 3.35Å; H145-V147 VanDerWaalsContact C-N 3.3Å; H145-V147 PolarHBondContact O-N 3.43Å; H145-M148 PolarHBondContact O-N 3.02Å; H145-M148 VanDerWaalsContact O-N 3.14Å; H145-Y149 WeakPolarHBondContact O-CB 3.34Å; H145-Y149 PolarHBondContact O-N 2.72Å
146Q97.7Very high97.5Very high68 Ų6855.2 Ų55.232%0.31830%0.295SS..Hα-helixtrans-57.5-42.2-179-68.5164.913.100112.1P142 V143 G150P142-Q146 VanDerWaalsContact O-CG 3.32Å; P142-Q146 WeakPolarHBondContact O-CG 3.5Å; P142-Q146 PolarHBondContact O-N 3.35Å; V143-Q146 PolarHBondContact O-N 3.17Å; Q146-G150 PolarHBondContact O-N 2.72Å
147V98.4Very high97.5Very high84 Ų8457.4 Ų57.451%0.50931%0.308SS..Hα-helixtrans-66.9-43.7177.81750000111.3V143 F144 H145 G150 A151V143-V147 HydrophobicContact CG1-CG2 4.34Å; V143-V147 VanDerWaalsContact O-CG2 3.31Å; V143-V147 WeakPolarHBondContact O-CG2 3.39Å; V143-V147 PolarHBondContact O-N 3.37Å; F144-V147 PolarHBondContact O-N 3.07Å; H145-V147 VanDerWaalsContact C-N 3.3Å; H145-V147 PolarHBondContact O-N 3.43Å; V147-G150 PolarHBondContact O-N 2.79Å; V147-A151 PolarHBondContact O-N 3.18Å
148M98.6Very high97.6Very high45 Ų4560 Ų6022%0.22232%0.32CS..Hα-helixtrans-66.5-41.6178.7-66.4-61.699.400112.1I97 F128 V132 F144 H145 A151 L152I97-M148 HydrophobicContact CD1-CB 4.38Å; F128-M148 HydrophobicContact CE2-SD 4.3Å; F128-M148 HydrophobicContact CZ-CB 4.28Å; F128-M148 HydrophobicContact CZ-SD 4.33Å; V132-M148 HydrophobicContact CG1-CB 4.13Å; V132-M148 HydrophobicContact CG1-CG 4.27Å; V132-M148 HydrophobicContact CG2-CB 4Å; V132-M148 HydrophobicContact CG2-CG 3.86Å; V132-M148 HydrophobicContact CG2-SD 4.17Å; F144-M148 HydrophobicContact CD2-CG 4.27Å; F144-M148 HydrophobicContact CE1-CG 4.14Å; F144-M148 HydrophobicContact CE2-CE 4.5Å; F144-M148 HydrophobicContact CE2-CG 3.8Å; F144-M148 HydrophobicContact CE2-SD 4.15Å; F144-M148 HydrophobicContact CZ-CG 3.73Å; F144-M148 HydrophobicContact CZ-SD 4.32Å; F144-M148 WeakPolarHBondContact O-CG 3.46Å; F144-M148 PolarHBondContact O-N 3.46Å; F144-M148 VanDerWaalsContact O-N 3.1Å; H145-M148 PolarHBondContact O-N 3.02Å; H145-M148 VanDerWaalsContact O-N 3.14Å; M148-A151 PolarHBondContact O-N 2.87Å; M148-L152 PolarHBondContact O-N 2.91Å
149Y98.6Very high97.7Very high30 Ų3054.3 Ų54.312%0.11829%0.292CS..Hα-helixtrans-62.2-47.5172.8176.7-107.7000111.3M96 I97 T100 H145 A151 L152 V153 F182M96-Y149 HydrophobicContact CB-CD2 3.95Å; M96-Y149 HydrophobicContact CB-CE2 3.91Å; M96-Y149 HydrophobicContact CE-CD1 3.97Å; M96-Y149 HydrophobicContact CE-CD2 4.13Å; M96-Y149 HydrophobicContact CE-CE1 3.7Å; M96-Y149 HydrophobicContact CE-CE2 3.87Å; M96-Y149 HydrophobicContact CE-CG 4.17Å; I97-Y149 HydrophobicContact CD1-CD2 4.4Å; T100-Y149 WeakPolarHBondContact OG1-CE2 3.26Å; H145-Y149 WeakPolarHBondContact O-CB 3.34Å; H145-Y149 PolarHBondContact O-N 2.72Å; Y149-A151 VanDerWaalsContact C-N 3.28Å; Y149-A151 PolarHBondContact O-N 2.82Å; Y149-L152 PolarHBondContact O-N 3.45Å; Y149-L152 VanDerWaalsContact O-N 3.11Å; Y149-V153 HydrophobicContact CD1-CG2 4.2Å; Y149-V153 HydrophobicContact CD2-CG2 4.39Å; Y149-V153 HydrophobicContact CE1-CG2 3.73Å; Y149-V153 HydrophobicContact CE2-CG2 3.95Å; Y149-V153 WeakPolarHBondContact O-CG2 3.38Å; Y149-V153 PolarHBondContact O-N 3.43Å; Y149-F182 HydrophobicContact CE1-CZ 4.31Å
150G98.4Very high97.8Very high35 Ų3546.8 Ų46.836%0.36126%0.264SS..Hα-helixtrans-58-37.6177.100000113Q146 V147 V153 A154Q146-G150 PolarHBondContact O-N 2.72Å; V147-G150 PolarHBondContact O-N 2.79Å; G150-V153 PolarHBondContact O-N 2.88Å; G150-A154 WeakPolarHBondContact O-CB 3.28Å; G150-A154 PolarHBondContact O-N 3.4Å
151A98.4Very high97.9Very high47 Ų4744.2 Ų44.239%0.38826%0.256SS..Hα-helixtrans-63.9-43.7174.600000112.5V147 M148 Y149 A154 C155V147-A151 PolarHBondContact O-N 3.18Å; M148-A151 PolarHBondContact O-N 2.87Å; Y149-A151 VanDerWaalsContact C-N 3.28Å; Y149-A151 PolarHBondContact O-N 2.82Å; A151-A154 PolarHBondContact O-N 3.34Å; A151-C155 PolarHBondContact O-N 3.43Å; A151-C155 PolarHBondContact O-SG 2.95Å; A151-C155 VanDerWaalsContact O-SG 3.4Å
152L98.6Very high98.1Very high12 Ų1245.3 Ų45.36%0.06326%0.26CS..Hα-helixtrans-63.2-43.3174.7-75.7176.4000111.9I97 T100 V104 F128 M148 Y149 A154 C155 L156I97-L152 HydrophobicContact CD1-CD1 4.42Å; I97-L152 HydrophobicContact CG2-CD1 4.09Å; T100-L152 HydrophobicContact CG2-CB 3.58Å; T100-L152 HydrophobicContact CG2-CD1 4.23Å; V104-L152 HydrophobicContact CG2-CD2 4.23Å; F128-L152 HydrophobicContact CD1-CD1 4.29Å; F128-L152 HydrophobicContact CD1-CD2 4.25Å; F128-L152 HydrophobicContact CD1-CG 4.46Å; F128-L152 HydrophobicContact CE1-CD1 3.58Å; F128-L152 HydrophobicContact CE1-CD2 3.91Å; F128-L152 HydrophobicContact CE1-CG 3.67Å; F128-L152 HydrophobicContact CZ-CD1 4.38Å; F128-L152 HydrophobicContact CZ-CD2 4.39Å; F128-L152 HydrophobicContact CZ-CG 4.06Å; M148-L152 PolarHBondContact O-N 2.91Å; Y149-L152 PolarHBondContact O-N 3.45Å; Y149-L152 VanDerWaalsContact O-N 3.11Å; L152-A154 VanDerWaalsContact C-N 3.34Å; L152-A154 PolarHBondContact O-N 3.05Å; L152-C155 WeakPolarHBondContact O-CB 3.46Å; L152-C155 PolarHBondContact O-N 3.45Å; L152-L156 PolarHBondContact O-N 3.32Å
153V98.5Very high98.3Very high29 Ų2944.1 Ų44.118%0.17625%0.252CS..Hα-helixtrans-62.7-41.7176.3173.90000110.8T100 Y149 G150 C155 L156 V157 F182T100-V153 HydrophobicContact CG2-CG2 4.43Å; Y149-V153 HydrophobicContact CD1-CG2 4.2Å; Y149-V153 HydrophobicContact CD2-CG2 4.39Å; Y149-V153 HydrophobicContact CE1-CG2 3.73Å; Y149-V153 HydrophobicContact CE2-CG2 3.95Å; Y149-V153 WeakPolarHBondContact O-CG2 3.38Å; Y149-V153 PolarHBondContact O-N 3.43Å; G150-V153 PolarHBondContact O-N 2.88Å; V153-C155 VanDerWaalsContact C-N 3.34Å; V153-C155 PolarHBondContact O-N 2.96Å; V153-L156 WeakPolarHBondContact O-CB 3.29Å; V153-L156 PolarHBondContact O-N 2.91Å; V153-L156 VanDerWaalsContact O-N 3.14Å; V153-V157 HydrophobicContact CG1-CG2 4.21Å; V153-V157 WeakPolarHBondContact O-CG2 3.46Å; V153-V157 PolarHBondContact O-N 3.33Å; V153-F182 HydrophobicContact CG1-CE1 4.3Å
154A98.3Very high98.3Very high46 Ų4640.6 Ų40.638%0.3823%0.231SC..Hα-helixtrans-59.6-43.5175.500000111.7G150 A151 L152 L156 V157 M158G150-A154 WeakPolarHBondContact O-CB 3.28Å; G150-A154 PolarHBondContact O-N 3.4Å; A151-A154 PolarHBondContact O-N 3.34Å; L152-A154 VanDerWaalsContact C-N 3.34Å; L152-A154 PolarHBondContact O-N 3.05Å; A154-L156 VanDerWaalsContact C-N 3.33Å; A154-L156 PolarHBondContact O-N 3.32Å; A154-V157 PolarHBondContact O-N 2.75Å; A154-M158 WeakPolarHBondContact O-CB 3.37Å; A154-M158 WeakPolarHBondContact O-CE 3.39Å; A154-M158 VanDerWaalsContact O-CG 3.31Å; A154-M158 WeakPolarHBondContact O-CG 3.45Å; A154-M158 PolarHBondContact O-N 2.72Å
155C98.1Very high98.4Very high45 Ų4541 Ų4130%0.30424%0.236SC..Hα-helixtrans-57.6-44.3173.4-71.60000112.3A151 L152 V153 R159A151-C155 PolarHBondContact O-N 3.43Å; A151-C155 PolarHBondContact O-SG 2.95Å; A151-C155 VanDerWaalsContact O-SG 3.4Å; L152-C155 WeakPolarHBondContact O-CB 3.46Å; L152-C155 PolarHBondContact O-N 3.45Å; V153-C155 VanDerWaalsContact C-N 3.34Å; V153-C155 PolarHBondContact O-N 2.96Å; C155-R159 WeakPolarHBondContact O-CB 3.4Å; C155-R159 PolarHBondContact O-N 3.06Å; C155-R159 VanDerWaalsContact O-N 3.1Å
156L98.3Very high98.4Very high11 Ų1149.9 Ų49.96%0.05827%0.27CS..Hα-helixtrans-61.4-48.6174.9-76.4178.6000112.3T100 F103 V104 L107 L152 V153 A154 R159 S160T100-L156 HydrophobicContact CG2-CD1 3.6Å; T100-L156 HydrophobicContact CG2-CG 4.47Å; F103-L156 HydrophobicContact CB-CD1 3.77Å; F103-L156 HydrophobicContact CB-CD2 4.05Å; F103-L156 HydrophobicContact CD2-CD1 4.19Å; V104-L156 HydrophobicContact CB-CD2 4.3Å; V104-L156 HydrophobicContact CG2-CD1 4.42Å; V104-L156 HydrophobicContact CG2-CD2 3.71Å; V104-L156 HydrophobicContact CG2-CG 3.7Å; L107-L156 HydrophobicContact CB-CD2 4.21Å; L107-L156 HydrophobicContact CD2-CD2 3.81Å; L152-L156 PolarHBondContact O-N 3.32Å; V153-L156 WeakPolarHBondContact O-CB 3.29Å; V153-L156 PolarHBondContact O-N 2.91Å; V153-L156 VanDerWaalsContact O-N 3.14Å; A154-L156 VanDerWaalsContact C-N 3.33Å; A154-L156 PolarHBondContact O-N 3.32Å; L156-R159 PolarHBondContact O-N 3.23Å; L156-S160 WeakPolarHBondContact O-CB 3.28Å; L156-S160 PolarHBondContact O-N 3.46Å; L156-S160 PolarHBondContact O-OG 3.28Å; L156-S160 VanDerWaalsContact O-OG 3.1Å
157V98.4Very high98.4Very high46 Ų4649.2 Ų49.228%0.27927%0.27SS..Hα-helixtrans-62.6-48.3-177.91720000110.6V153 A154 R159 S160 V161 L179V153-V157 HydrophobicContact CG1-CG2 4.21Å; V153-V157 WeakPolarHBondContact O-CG2 3.46Å; V153-V157 PolarHBondContact O-N 3.33Å; A154-V157 PolarHBondContact O-N 2.75Å; V157-R159 VanDerWaalsContact C-N 3.31Å; V157-R159 PolarHBondContact O-N 2.99Å; V157-S160 PolarHBondContact O-N 3.3Å; V157-V161 HydrophobicContact CG1-CG2 4.22Å; V157-V161 WeakPolarHBondContact O-CB 3.48Å; V157-V161 VanDerWaalsContact O-CG2 3.28Å; V157-V161 WeakPolarHBondContact O-CG2 3.34Å; V157-V161 PolarHBondContact O-N 3.26Å; V157-L179 HydrophobicContact CG1-CD1 4.17Å; V157-L179 HydrophobicContact CG1-CD2 4.22Å; V157-L179 HydrophobicContact CG2-CD1 3.88Å
158M98.4Very high98.3Very high120 Ų12046.6 Ų46.659%0.59125%0.251SS*.Hα-helixtrans-57-45.9177.7-73.1-173.9-69.400111.3A154 F162A154-M158 WeakPolarHBondContact O-CB 3.37Å; A154-M158 WeakPolarHBondContact O-CE 3.39Å; A154-M158 VanDerWaalsContact O-CG 3.31Å; A154-M158 WeakPolarHBondContact O-CG 3.45Å; A154-M158 PolarHBondContact O-N 2.72Å; M158-F162 WeakPolarHBondContact O-CB 3.35Å; M158-F162 PolarHBondContact O-N 3.45Å
159R98.4Very high98.2Very high50 Ų5047.1 Ų47.119%0.18926%0.258CS..Hα-helixtrans-67.7-43179.3-177.360.2177.7174-2.1112.3L107 Y108 C155 L156 V157 F162 I163L107-R159 HydrophobicContact CD2-CB 3.78Å; L107-R159 HydrophobicContact CD2-CG 3.7Å; L107-R159 HydrophobicContact CG-CB 4.38Å; L107-R159 HydrophobicContact CG-CG 3.73Å; Y108-R159 HydrophobicContact CD2-CB 4.35Å; Y108-R159 HydrophobicContact CD2-CG 4Å; Y108-R159 HydrophobicContact CE2-CB 3.63Å; Y108-R159 HydrophobicContact CE2-CG 3.75Å; C155-R159 WeakPolarHBondContact O-CB 3.4Å; C155-R159 PolarHBondContact O-N 3.06Å; C155-R159 VanDerWaalsContact O-N 3.1Å; L156-R159 PolarHBondContact O-N 3.23Å; V157-R159 VanDerWaalsContact C-N 3.31Å; V157-R159 PolarHBondContact O-N 2.99Å; R159-F162 PolarHBondContact O-N 3.44Å; R159-I163 HydrophobicContact CG-CD1 4.11Å; R159-I163 WeakPolarHBondContact O-CG1 3.42Å; R159-I163 PolarHBondContact O-N 3.19Å
160S98.4Very high98.1Very high4 Ų453.2 Ų53.23%0.02828%0.281CS..Hα-helixtrans-60.9-48.1177-710000111.2L107 L156 V157 F162 I163 V164 H231L107-S160 WeakPolarHBondContact CD2-OG 3.38Å; L156-S160 WeakPolarHBondContact O-CB 3.28Å; L156-S160 PolarHBondContact O-N 3.46Å; L156-S160 PolarHBondContact O-OG 3.28Å; L156-S160 VanDerWaalsContact O-OG 3.1Å; V157-S160 PolarHBondContact O-N 3.3Å; S160-F162 VanDerWaalsContact C-N 3.34Å; S160-F162 PolarHBondContact O-N 2.9Å; S160-I163 PolarHBondContact O-N 2.96Å; S160-V164 WeakPolarHBondContact O-CG2 3.2Å; S160-V164 PolarHBondContact O-N 2.91Å; S160-H231 PolarHBondContact OG-NE2 3.23Å
161V98.5Very high98Very high44 Ų4452 Ų5227%0.26727%0.266SS..Hα-helixtrans-60.5-43.5177.6171.20000110.8V157 I163 V164 T165 Y176V157-V161 HydrophobicContact CG1-CG2 4.22Å; V157-V161 WeakPolarHBondContact O-CB 3.48Å; V157-V161 VanDerWaalsContact O-CG2 3.28Å; V157-V161 WeakPolarHBondContact O-CG2 3.34Å; V157-V161 PolarHBondContact O-N 3.26Å; V161-I163 PolarHBondContact O-N 2.91Å; V161-V164 PolarHBondContact O-N 2.92Å; V161-T165 WeakPolarHBondContact O-CB 3.41Å; V161-T165 PolarHBondContact O-N 2.86Å; V161-T165 PolarHBondContact O-OG1 2.83Å; V161-Y176 HydrophobicContact CG2-CE1 4.48Å
162F98.6Very high97.9Very high94 Ų9455 Ų5541%0.41227%0.267SS..Hα-helixtrans-56.4-49.7174.6173.5-91.6000111.6M158 R159 S160 V164 T165 W166 V167M158-F162 WeakPolarHBondContact O-CB 3.35Å; M158-F162 PolarHBondContact O-N 3.45Å; R159-F162 PolarHBondContact O-N 3.44Å; S160-F162 VanDerWaalsContact C-N 3.34Å; S160-F162 PolarHBondContact O-N 2.9Å; F162-V164 PolarHBondContact O-N 2.77Å; F162-T165 PolarHBondContact O-N 3.28Å; F162-W166 AromaticContact CD2-CD1 3.62Å; F162-W166 HydrophobicContact CD2-CG 4.5Å; F162-W166 AromaticContact CE2-CD1 3.86Å; F162-W166 HydrophobicContact CE2-CG 4.37Å; F162-W166 PolarHBondContact O-N 3.03Å; F162-V167 HydrophobicContact CE1-CG2 4.19Å
163I98.6Very high97.8Very high0 Ų056.6 Ų56.60%029%0.287CS..Hα-helixtrans-61.7-47.8-178.1-68.2168.7000111.1L107 F111 R159 S160 V161 T165 V167 Y168 I238L107-I163 HydrophobicContact CD1-CD1 3.82Å; L107-I163 HydrophobicContact CG-CD1 4.25Å; F111-I163 HydrophobicContact CE2-CD1 3.96Å; F111-I163 HydrophobicContact CE2-CG1 3.88Å; F111-I163 HydrophobicContact CZ-CD1 4.18Å; F111-I163 HydrophobicContact CZ-CG1 4.06Å; F111-I163 HydrophobicContact CZ-CG2 4.04Å; R159-I163 HydrophobicContact CG-CD1 4.11Å; R159-I163 WeakPolarHBondContact O-CG1 3.42Å; R159-I163 PolarHBondContact O-N 3.19Å; S160-I163 PolarHBondContact O-N 2.96Å; V161-I163 PolarHBondContact O-N 2.91Å; I163-T165 VanDerWaalsContact C-N 3.29Å; I163-T165 PolarHBondContact O-N 3.04Å; I163-V167 HydrophobicContact CG2-CB 4.31Å; I163-V167 CarbonylContact O-C 3.5Å; I163-V167 WeakPolarHBondContact O-CA 3.5Å; I163-V167 WeakPolarHBondContact O-CB 3.36Å; I163-V167 PolarHBondContact O-N 3.27Å; I163-Y168 HydrophobicContact CG2-CD2 4.16Å; I163-Y168 PolarHBondContact O-N 2.48Å; I163-I238 HydrophobicContact CB-CD1 4.46Å; I163-I238 HydrophobicContact CD1-CD1 4.17Å; I163-I238 HydrophobicContact CG2-CD1 3.76Å; I163-I238 HydrophobicContact CG2-CG1 4.02Å; I163-I238 HydrophobicContact CG2-CG2 4.24Å
164V98.3Very high97.7Very high0 Ų057.7 Ų57.70%029%0.292CS..Hα-helixtrans-78.4-12.9-178.3-54.80000113.6S160 V161 F162 P169 L171 R172 C175 Y176 L234S160-V164 WeakPolarHBondContact O-CG2 3.2Å; S160-V164 PolarHBondContact O-N 2.91Å; V161-V164 PolarHBondContact O-N 2.92Å; F162-V164 PolarHBondContact O-N 2.77Å; V164-P169 VanDerWaalsContact O-CA 3.28Å; V164-P169 WeakPolarHBondContact O-CA 3.49Å; V164-L171 HydrophobicContact CG1-CB 3.95Å; V164-R172 HydrophobicContact CB-CG 3.92Å; V164-R172 HydrophobicContact CG2-CG 4.07Å; V164-R172 VanDerWaalsContact O-CG 3.32Å; V164-R172 WeakPolarHBondContact O-CG 3.3Å; V164-R172 PolarHBondContact O-NE 2.9Å; V164-C175 HydrophobicContact CB-CB 4.36Å; V164-C175 HydrophobicContact CG1-CB 3.68Å; V164-C175 HydrophobicContact CG2-CB 4.04Å; V164-Y176 HydrophobicContact CG2-CE2 4.48Å; V164-L234 HydrophobicContact CG1-CD1 4.29Å
165T98.3Very high97.7Very high45 Ų4555.8 Ų55.828%0.27628%0.276SS..Hα-helixtrans-84-46.8173.5-580000110.6V161 F162 I163 R172V161-T165 WeakPolarHBondContact O-CB 3.41Å; V161-T165 PolarHBondContact O-N 2.86Å; V161-T165 PolarHBondContact O-OG1 2.83Å; F162-T165 PolarHBondContact O-N 3.28Å; I163-T165 VanDerWaalsContact C-N 3.29Å; I163-T165 PolarHBondContact O-N 3.04Å; T165-R172 PolarHBondContact O-NH2 2.86Å
166W98.1Very high97.7Very high193 Ų19358.7 Ų58.773%0.73128%0.281SS*.Hα-helixtrans-112.2-23.3-164.9-59.6106.5000115.3F162F162-W166 AromaticContact CD2-CD1 3.62Å; F162-W166 HydrophobicContact CD2-CG 4.5Å; F162-W166 AromaticContact CE2-CD1 3.86Å; F162-W166 HydrophobicContact CE2-CG 4.37Å; F162-W166 PolarHBondContact O-N 3.03Å
167V97.8Very high97.7Very high53 Ų5361.6 Ų61.632%0.32130%0.299SS..THydrogen-bonded Turntrans-110.5-57.7-172.8-169.90000111.3F111 F162 I163 P169F111-V167 HydrophobicContact CE1-CG1 4.13Å; F111-V167 HydrophobicContact CZ-CB 4.38Å; F111-V167 HydrophobicContact CZ-CG1 3.83Å; F111-V167 HydrophobicContact CZ-CG2 4.48Å; F162-V167 HydrophobicContact CE1-CG2 4.19Å; I163-V167 HydrophobicContact CG2-CB 4.31Å; I163-V167 CarbonylContact O-C 3.5Å; I163-V167 WeakPolarHBondContact O-CA 3.5Å; I163-V167 WeakPolarHBondContact O-CB 3.36Å; I163-V167 PolarHBondContact O-N 3.27Å; V167-P169 WeakPolarHBondContact O-CD 3.41Å
168Y96.9Very high97.7Very high30 Ų3059.9 Ų59.912%0.11829%0.289CS..  trans-12674.3-176.8-59.6-35000112.6F111 I163 W170 L171 I238 T241F111-Y168 HydrophobicContact CE1-CD2 4.42Å; F111-Y168 AromaticContact CE1-CE2 3.57Å; F111-Y168 HydrophobicContact CE1-CE2 3.57Å; F111-Y168 AromaticContact CE1-CZ 3.91Å; F111-Y168 HydrophobicContact CZ-CE2 4.14Å; I163-Y168 HydrophobicContact CG2-CD2 4.16Å; I163-Y168 PolarHBondContact O-N 2.48Å; Y168-W170 AromaticContact CD1-CH2 3.17Å; Y168-W170 HydrophobicContact CD1-CH2 3.17Å; Y168-W170 AromaticContact CD1-CZ2 3.3Å; Y168-W170 HydrophobicContact CD1-CZ2 3.3Å; Y168-W170 HydrophobicContact CD1-CZ3 4.04Å; Y168-W170 AromaticContact CE1-CH2 3.86Å; Y168-W170 HydrophobicContact CE1-CH2 3.86Å; Y168-W170 HydrophobicContact CE1-CZ2 4.01Å; Y168-W170 AromaticContact CG-CH2 3.96Å; Y168-W170 HydrophobicContact CG-CH2 3.96Å; Y168-W170 AromaticContact CG-CZ2 3.69Å; Y168-W170 HydrophobicContact CG-CZ2 3.69Å; Y168-W170 PolarHBondContact O-N 3.33Å; Y168-W170 VanDerWaalsContact O-N 3.16Å; Y168-L171 HydrophobicContact CD2-CD1 4.16Å; Y168-L171 HydrophobicContact CG-CD1 4.43Å; Y168-L171 PolarHBondContact O-N 3.14Å; Y168-I238 HydrophobicContact CD2-CB 4.44Å; Y168-I238 HydrophobicContact CD2-CG1 4.25Å; Y168-I238 HydrophobicContact CD2-CG2 4.08Å; Y168-I238 HydrophobicContact CE2-CG2 3.9Å; Y168-T241 HydrophobicContact CE1-CG2 4.23Å; Y168-T241 HydrophobicContact CE2-CG2 4.35Å
169P96.9Very high97.7Very high55 Ų5556.2 Ų56.236%0.35727%0.272SS..G310 helixtrans-59.9-25.5-176.6-2636.1000116.1V164 V167 L171 R172V164-P169 VanDerWaalsContact O-CA 3.28Å; V164-P169 WeakPolarHBondContact O-CA 3.49Å; V167-P169 WeakPolarHBondContact O-CD 3.41Å; P169-L171 PolarHBondContact O-N 3.43Å; P169-R172 WeakPolarHBondContact O-CB 3.47Å; P169-R172 WeakPolarHBondContact O-CD 3.43Å; P169-R172 WeakPolarHBondContact O-CG 3.19Å; P169-R172 PolarHBondContact O-N 3.42Å
170W95.4Very high97.7Very high158 Ų15855.8 Ų55.860%0.59828%0.283SS*.G310 helixtrans-68.8-15.8177.260.488.6000113.1Y168 R172 T241Y168-W170 AromaticContact CD1-CH2 3.17Å; Y168-W170 HydrophobicContact CD1-CH2 3.17Å; Y168-W170 AromaticContact CD1-CZ2 3.3Å; Y168-W170 HydrophobicContact CD1-CZ2 3.3Å; Y168-W170 HydrophobicContact CD1-CZ3 4.04Å; Y168-W170 AromaticContact CE1-CH2 3.86Å; Y168-W170 HydrophobicContact CE1-CH2 3.86Å; Y168-W170 HydrophobicContact CE1-CZ2 4.01Å; Y168-W170 AromaticContact CG-CH2 3.96Å; Y168-W170 HydrophobicContact CG-CH2 3.96Å; Y168-W170 AromaticContact CG-CZ2 3.69Å; Y168-W170 HydrophobicContact CG-CZ2 3.69Å; Y168-W170 PolarHBondContact O-N 3.33Å; Y168-W170 VanDerWaalsContact O-N 3.16Å; W170-R172 VanDerWaalsContact C-N 3.32Å; W170-T241 HydrophobicContact CZ2-CG2 3.92Å
171L96.2Very high97.7Very high10 Ų1057.3 Ų57.35%0.05229%0.29CS..G310 helixtrans-86.91.9176.2-59.7-178.5000113.6V164 Y168 P169 G173 L174 C175 L234 Q237 I238V164-L171 HydrophobicContact CG1-CB 3.95Å; Y168-L171 HydrophobicContact CD2-CD1 4.16Å; Y168-L171 HydrophobicContact CG-CD1 4.43Å; Y168-L171 PolarHBondContact O-N 3.14Å; P169-L171 PolarHBondContact O-N 3.43Å; L171-G173 VanDerWaalsContact C-N 3.3Å; L171-G173 PolarHBondContact O-N 3.05Å; L171-L174 PolarHBondContact O-N 3.36Å; L171-C175 PolarHBondContact O-N 3.1Å; L171-L234 HydrophobicContact CB-CD1 3.89Å; L171-L234 HydrophobicContact CD1-CD1 4.25Å; L171-Q237 HydrophobicContact CD1-CG 4.14Å; L171-Q237 HydrophobicContact CD2-CG 3.55Å; L171-I238 HydrophobicContact CD1-CG1 3.58Å
172R97Very high97.7Very high109 Ų10956.4 Ų56.441%0.41128%0.283SS..Hα-helixtrans-55.3-42.5179.1-77.1173.9-171.5-176.33.3112.8V164 T165 P169 W170 C175 Y176V164-R172 HydrophobicContact CB-CG 3.92Å; V164-R172 HydrophobicContact CG2-CG 4.07Å; V164-R172 VanDerWaalsContact O-CG 3.32Å; V164-R172 WeakPolarHBondContact O-CG 3.3Å; V164-R172 PolarHBondContact O-NE 2.9Å; T165-R172 PolarHBondContact O-NH2 2.86Å; P169-R172 WeakPolarHBondContact O-CB 3.47Å; P169-R172 WeakPolarHBondContact O-CD 3.43Å; P169-R172 WeakPolarHBondContact O-CG 3.19Å; P169-R172 PolarHBondContact O-N 3.42Å; W170-R172 VanDerWaalsContact C-N 3.32Å; R172-C175 PolarHBondContact O-N 2.98Å; R172-Y176 HydrophobicContact CB-CD2 4.02Å; R172-Y176 HydrophobicContact CB-CE2 4.06Å; R172-Y176 HydrophobicContact CG-CD2 4.5Å; R172-Y176 HydrophobicContact CG-CE2 4.04Å; R172-Y176 WeakPolarHBondContact O-CB 3.31Å; R172-Y176 WeakPolarHBondContact O-CD2 3.43Å; R172-Y176 PolarHBondContact O-N 3.3Å
173G96.9Very high97.7Very high47 Ų4756.7 Ų56.749%0.48529%0.286SS..Hα-helixtrans-55.3-56.2178.600000111.6L171 C175 Y176 T177L171-G173 VanDerWaalsContact C-N 3.3Å; L171-G173 PolarHBondContact O-N 3.05Å; G173-C175 PolarHBondContact O-N 2.68Å; G173-Y176 PolarHBondContact O-N 2.96Å; G173-T177 VanDerWaalsContact O-CB 3.3Å; G173-T177 WeakPolarHBondContact O-CB 3.4Å; G173-T177 PolarHBondContact O-N 3.28Å; G173-T177 PolarHBondContact O-OG1 3.11Å
174L96.4Very high97.7Very high52 Ų5260.3 Ų60.327%0.27231%0.305SS..Hα-helixtrans-60.4-43.2179-179.559.3000112.5L171 S178 L230 L234L171-L174 PolarHBondContact O-N 3.36Å; L174-S178 WeakPolarHBondContact O-CB 3.25Å; L174-S178 PolarHBondContact O-N 2.84Å; L174-L230 HydrophobicContact CD1-CB 4.18Å; L174-L230 HydrophobicContact CD1-CD2 3.96Å; L174-L234 HydrophobicContact CD2-CB 3.97Å; L174-L234 HydrophobicContact CD2-CD1 4.25Å; L174-L234 HydrophobicContact CG-CB 4.16Å; L174-L234 HydrophobicContact CG-CD1 4.39Å
175C98.1Very high97.7Very high6 Ų660.3 Ų60.34%0.04131%0.305CS..Hα-helixtrans-63.8-48.9180-178.60000112.8V164 L171 R172 G173 S178 L179 L234V164-C175 HydrophobicContact CB-CB 4.36Å; V164-C175 HydrophobicContact CG1-CB 3.68Å; V164-C175 HydrophobicContact CG2-CB 4.04Å; L171-C175 PolarHBondContact O-N 3.1Å; R172-C175 PolarHBondContact O-N 2.98Å; G173-C175 PolarHBondContact O-N 2.68Å; C175-S178 PolarHBondContact O-N 3.42Å; C175-L179 WeakPolarHBondContact O-CB 3.33Å; C175-L179 PolarHBondContact O-N 2.99Å; C175-L234 HydrophobicContact CB-CD1 4.18Å; C175-L234 HydrophobicContact CB-CD2 3.73Å
176Y98.2Very high97.7Very high106 Ų10662.2 Ų62.242%0.41631%0.31SS..Hα-helixtrans-75.8-27-178.6-69.1-60.6000112.6V161 V164 R172 G173 L179 G180V161-Y176 HydrophobicContact CG2-CE1 4.48Å; V164-Y176 HydrophobicContact CG2-CE2 4.48Å; R172-Y176 HydrophobicContact CB-CD2 4.02Å; R172-Y176 HydrophobicContact CB-CE2 4.06Å; R172-Y176 HydrophobicContact CG-CD2 4.5Å; R172-Y176 HydrophobicContact CG-CE2 4.04Å; R172-Y176 WeakPolarHBondContact O-CB 3.31Å; R172-Y176 WeakPolarHBondContact O-CD2 3.43Å; R172-Y176 PolarHBondContact O-N 3.3Å; G173-Y176 PolarHBondContact O-N 2.96Å; Y176-L179 HydrophobicContact CD1-CD2 4.37Å; Y176-G180 PolarHBondContact O-N 3.5Å
177T98.2Very high97.7Very high72 Ų7257.6 Ų57.644%0.44230%0.299SS..Hα-helixtrans-65.4-48.3168.1-62.50000111G173 L179 G180 I181 L230G173-T177 VanDerWaalsContact O-CB 3.3Å; G173-T177 WeakPolarHBondContact O-CB 3.4Å; G173-T177 PolarHBondContact O-N 3.28Å; G173-T177 PolarHBondContact O-OG1 3.11Å; T177-L179 PolarHBondContact O-N 3.26Å; T177-G180 PolarHBondContact O-N 3.36Å; T177-I181 HydrophobicContact CG2-CD1 3.64Å; T177-I181 HydrophobicContact CG2-CG1 4.34Å; T177-I181 WeakPolarHBondContact O-CB 3.43Å; T177-I181 VanDerWaalsContact O-CG1 3.24Å; T177-I181 WeakPolarHBondContact O-CG1 3.49Å; T177-I181 PolarHBondContact O-N 3.4Å; T177-L230 HydrophobicContact CG2-CD1 4.05Å
178S98.3Very high97.7Very high9 Ų956.1 Ų56.16%0.06329%0.289CS..Hα-helixtrans-55.5-50.6174.9168.50000111.4L174 C175 F182 G227 H231L174-S178 WeakPolarHBondContact O-CB 3.25Å; L174-S178 PolarHBondContact O-N 2.84Å; C175-S178 PolarHBondContact O-N 3.42Å; S178-F182 WeakPolarHBondContact O-CB 3.44Å; S178-F182 PolarHBondContact O-N 3.39Å; S178-G227 PolarHBondContact OG-O 3.23Å; S178-H231 PolarHBondContact OG-N 3.26Å
179L98.4Very high97.8Very high44 Ų4456.2 Ų56.223%0.2329%0.29CS..Hα-helixtrans-63.3-46.9178.9178.860.2000112.5V157 C175 Y176 T177 I181 F182 M183V157-L179 HydrophobicContact CG1-CD1 4.17Å; V157-L179 HydrophobicContact CG1-CD2 4.22Å; V157-L179 HydrophobicContact CG2-CD1 3.88Å; C175-L179 WeakPolarHBondContact O-CB 3.33Å; C175-L179 PolarHBondContact O-N 2.99Å; Y176-L179 HydrophobicContact CD1-CD2 4.37Å; T177-L179 PolarHBondContact O-N 3.26Å; L179-I181 PolarHBondContact O-N 3.27Å; L179-F182 PolarHBondContact O-N 3.36Å; L179-M183 HydrophobicContact CD1-CG 3.95Å; L179-M183 HydrophobicContact CG-CG 4.36Å; L179-M183 WeakPolarHBondContact O-CB 3.5Å; L179-M183 VanDerWaalsContact O-CG 3.29Å; L179-M183 WeakPolarHBondContact O-CG 3.47Å; L179-M183 PolarHBondContact O-N 3.47Å
180G98.6Very high97.8Very high40 Ų4056 Ų5641%0.41229%0.285SS..Hα-helixtrans-63-43.2-177.800000112.5Y176 T177 M183 L184Y176-G180 PolarHBondContact O-N 3.5Å; T177-G180 PolarHBondContact O-N 3.36Å; G180-M183 PolarHBondContact O-N 2.84Å; G180-L184 WeakPolarHBondContact O-CB 3.37Å; G180-L184 PolarHBondContact O-N 2.85Å
181I98.3Very high97.9Very high37 Ų3750.8 Ų50.819%0.1927%0.269CS..Hα-helixtrans-64.9-45.5175.9-65.3172.7000110T177 L179 M183 L184 G185 F223 L226 L230T177-I181 HydrophobicContact CG2-CD1 3.64Å; T177-I181 HydrophobicContact CG2-CG1 4.34Å; T177-I181 WeakPolarHBondContact O-CB 3.43Å; T177-I181 VanDerWaalsContact O-CG1 3.24Å; T177-I181 WeakPolarHBondContact O-CG1 3.49Å; T177-I181 PolarHBondContact O-N 3.4Å; L179-I181 PolarHBondContact O-N 3.27Å; I181-M183 VanDerWaalsContact C-N 3.34Å; I181-M183 PolarHBondContact O-N 3.4Å; I181-L184 WeakPolarHBondContact O-CB 3.27Å; I181-L184 PolarHBondContact O-N 3.06Å; I181-G185 PolarHBondContact O-N 2.89Å; I181-F223 HydrophobicContact CG2-CB 3.88Å; I181-F223 HydrophobicContact CG2-CD1 3.74Å; I181-F223 HydrophobicContact CG2-CG 4.22Å; I181-F223 VanDerWaalsContact CG2-O 3.28Å; I181-F223 WeakPolarHBondContact CG2-O 3.49Å; I181-F223 WeakPolarHBondContact O-CB 3.5Å; I181-L226 HydrophobicContact CD1-CD2 3.95Å; I181-L226 HydrophobicContact CD1-CG 4.35Å; I181-L226 HydrophobicContact CG2-CB 4.42Å; I181-L226 HydrophobicContact CG2-CD2 4.32Å; I181-L226 HydrophobicContact CG2-CG 4.46Å; I181-L230 HydrophobicContact CD1-CD1 3.93Å
182F98.4Very high97.9Very high25 Ų2550.3 Ų50.311%0.1127%0.266CS..Hα-helixtrans-59.2-44.7177.5-167.7-80.6000112Y149 V153 S178 L179 G185 F186 W220 T224Y149-F182 HydrophobicContact CE1-CZ 4.31Å; V153-F182 HydrophobicContact CG1-CE1 4.3Å; S178-F182 WeakPolarHBondContact O-CB 3.44Å; S178-F182 PolarHBondContact O-N 3.39Å; L179-F182 PolarHBondContact O-N 3.36Å; F182-G185 PolarHBondContact O-N 3.14Å; F182-F186 PolarHBondContact O-N 3.24Å; F182-W220 HydrophobicContact CZ-CH2 4.39Å; F182-T224 HydrophobicContact CD2-CG2 3.95Å; F182-T224 HydrophobicContact CE1-CG2 4.46Å; F182-T224 HydrophobicContact CE2-CG2 3.86Å; F182-T224 HydrophobicContact CG-CG2 4.3Å; F182-T224 HydrophobicContact CZ-CG2 4.12Å
183M98.5Very high97.7Very high99 Ų9948.3 Ų48.349%0.48826%0.264SS..Hα-helixtrans-66.9-34.4177.7-70.4-57-60.300113L179 G180 I181 G185 F186 L187L179-M183 HydrophobicContact CD1-CG 3.95Å; L179-M183 HydrophobicContact CG-CG 4.36Å; L179-M183 WeakPolarHBondContact O-CB 3.5Å; L179-M183 VanDerWaalsContact O-CG 3.29Å; L179-M183 WeakPolarHBondContact O-CG 3.47Å; L179-M183 PolarHBondContact O-N 3.47Å; G180-M183 PolarHBondContact O-N 2.84Å; I181-M183 VanDerWaalsContact C-N 3.34Å; I181-M183 PolarHBondContact O-N 3.4Å; M183-G185 VanDerWaalsContact C-N 3.35Å; M183-F186 HydrophobicContact CE-CD1 4.27Å; M183-F186 PolarHBondContact O-N 3.48Å; M183-L187 PolarHBondContact O-N 3.31Å
184L98.5Very high97.7Very high76 Ų7651.7 Ų51.740%0.39827%0.269SS..Hα-helixtrans-63.1-43.9171.9176.461.9000110.9G180 I181 F186 L187 L188 F223G180-L184 WeakPolarHBondContact O-CB 3.37Å; G180-L184 PolarHBondContact O-N 2.85Å; I181-L184 WeakPolarHBondContact O-CB 3.27Å; I181-L184 PolarHBondContact O-N 3.06Å; L184-F186 VanDerWaalsContact C-N 3.33Å; L184-F186 PolarHBondContact O-N 2.88Å; L184-L187 WeakPolarHBondContact O-CB 3.43Å; L184-L187 PolarHBondContact O-N 3.48Å; L184-L188 WeakPolarHBondContact O-CG 3.48Å; L184-L188 PolarHBondContact O-N 2.95Å; L184-F223 HydrophobicContact CD2-CD2 4.29Å; L184-F223 HydrophobicContact CD2-CE1 4.19Å; L184-F223 HydrophobicContact CD2-CE2 3.96Å; L184-F223 HydrophobicContact CD2-CZ 3.9Å; L184-F223 HydrophobicContact CG-CD2 4.19Å; L184-F223 HydrophobicContact CG-CE2 4.17Å
185G98.4Very high97.7Very high0 Ų054.5 Ų54.50%028%0.28CS..Hα-helixtrans-52.9-54169.900000110.5I181 F182 M183 L187 L188 W189I181-G185 PolarHBondContact O-N 2.89Å; F182-G185 PolarHBondContact O-N 3.14Å; M183-G185 VanDerWaalsContact C-N 3.35Å; G185-L187 VanDerWaalsContact C-N 3.26Å; G185-L187 PolarHBondContact O-N 2.99Å; G185-L188 WeakPolarHBondContact O-CB 3.48Å; G185-L188 PolarHBondContact O-N 2.63Å; G185-W189 PolarHBondContact O-N 2.76Å
186F97.9Very high97.5Very high85 Ų8554.8 Ų54.837%0.37328%0.282SS..Hα-helixtrans-58.8-37.3-177.4-172.9-117.7000113.3F182 M183 L184 W189 N190 W220F182-F186 PolarHBondContact O-N 3.24Å; M183-F186 HydrophobicContact CE-CD1 4.27Å; M183-F186 PolarHBondContact O-N 3.48Å; L184-F186 VanDerWaalsContact C-N 3.33Å; L184-F186 PolarHBondContact O-N 2.88Å; F186-W189 HydrophobicContact CD2-CE3 4.11Å; F186-W189 AromaticContact CE2-CE3 3.79Å; F186-W189 HydrophobicContact CE2-CE3 3.79Å; F186-W189 AromaticContact CE2-CZ3 3.9Å; F186-W189 HydrophobicContact CE2-CZ3 3.9Å; F186-W189 HydrophobicContact CZ-CZ3 4.47Å; F186-W189 PolarHBondContact O-N 2.98Å; F186-N190 WeakPolarHBondContact CE1-ND2 3.24Å; F186-N190 WeakPolarHBondContact CZ-ND2 3.38Å; F186-N190 PolarHBondContact O-N 3.13Å; F186-N190 VanDerWaalsContact O-N 3.13Å; F186-N190 PolarHBondContact O-ND2 2.82Å; F186-W220 HydrophobicContact CB-CE3 4.38Å; F186-W220 HydrophobicContact CB-CZ3 3.71Å; F186-W220 HydrophobicContact CD2-CH2 4.16Å; F186-W220 AromaticContact CD2-CZ3 3.75Å; F186-W220 HydrophobicContact CD2-CZ3 3.75Å; F186-W220 HydrophobicContact CG-CZ3 4.23Å
187L98.4Very high97.2Very high96 Ų9654.9 Ų54.950%0.50329%0.289SS..Hα-helixtrans-60.8-49.4172.5175.363.4000111.2M183 L184 G185 W189 N190 I191M183-L187 PolarHBondContact O-N 3.31Å; L184-L187 WeakPolarHBondContact O-CB 3.43Å; L184-L187 PolarHBondContact O-N 3.48Å; G185-L187 VanDerWaalsContact C-N 3.26Å; G185-L187 PolarHBondContact O-N 2.99Å; L187-W189 VanDerWaalsContact C-N 3.33Å; L187-W189 PolarHBondContact O-N 3.45Å; L187-N190 PolarHBondContact O-N 3.4Å; L187-I191 HydrophobicContact CD1-CD1 4.15Å; L187-I191 HydrophobicContact CD1-CG1 4.45Å; L187-I191 HydrophobicContact CG-CD1 3.99Å; L187-I191 WeakPolarHBondContact O-CG1 3.24Å; L187-I191 PolarHBondContact O-N 2.8Å
188L98.1Very high97Very high23 Ų2354.8 Ų54.812%0.1229%0.292CS..Hα-helixtrans-63.4-38.8179.6-68.1-178.4000112.2L184 G185 N190 I191 D192 F216 W219 F223L184-L188 WeakPolarHBondContact O-CG 3.48Å; L184-L188 PolarHBondContact O-N 2.95Å; G185-L188 WeakPolarHBondContact O-CB 3.48Å; G185-L188 PolarHBondContact O-N 2.63Å; L188-N190 VanDerWaalsContact C-N 3.34Å; L188-N190 PolarHBondContact O-N 2.87Å; L188-I191 HydrophobicContact CD2-CD1 4.28Å; L188-I191 PolarHBondContact O-N 3.03Å; L188-D192 PolarHBondContact O-N 2.88Å; L188-F216 HydrophobicContact CB-CB 4.1Å; L188-F216 HydrophobicContact CD2-CD1 3.9Å; L188-F216 HydrophobicContact CD2-CE1 4.21Å; L188-F216 HydrophobicContact CD2-CG 4.16Å; L188-F216 WeakPolarHBondContact O-CB 3.49Å; L188-W219 HydrophobicContact CD1-CB 3.56Å; L188-W219 HydrophobicContact CD1-CG 4.23Å; L188-F223 HydrophobicContact CD1-CD2 3.78Å; L188-F223 HydrophobicContact CD1-CE2 3.5Å
189W97.7Very high96.7Very high32 Ų3255.2 Ų55.212%0.12129%0.293CS..Hα-helixtrans-57.3-45.1172.7177.387000112W20 G185 F186 L187 D192 N193 H217 W220W20-W189 HydrophobicContact CH2-CZ2 4.43Å; W20-W189 AromaticContact CH2-NE1 3.45Å; W20-W189 HydrophobicContact CZ3-CZ2 4.26Å; W20-W189 AromaticContact CZ3-NE1 3.27Å; W20-W189 VanDerWaalsContact CZ3-NE1 3.27Å; G185-W189 PolarHBondContact O-N 2.76Å; F186-W189 HydrophobicContact CD2-CE3 4.11Å; F186-W189 AromaticContact CE2-CE3 3.79Å; F186-W189 HydrophobicContact CE2-CE3 3.79Å; F186-W189 AromaticContact CE2-CZ3 3.9Å; F186-W189 HydrophobicContact CE2-CZ3 3.9Å; F186-W189 HydrophobicContact CZ-CZ3 4.47Å; F186-W189 PolarHBondContact O-N 2.98Å; L187-W189 VanDerWaalsContact C-N 3.33Å; L187-W189 PolarHBondContact O-N 3.45Å; W189-D192 PolarHBondContact O-N 3.37Å; W189-N193 VanDerWaalsContact CE2-ND2 3.34Å; W189-N193 PolarHBondContact NE1-ND2 3.05Å; W189-N193 PolarHBondContact O-N 3.5Å; W189-N193 VanDerWaalsContact O-N 3.15Å; W189-N193 PolarHBondContact O-ND2 2.93Å; W189-H217 AromaticContact CD1-CE1 3.37Å; W189-H217 AromaticContact CD1-ND1 3.38Å; W189-H217 AromaticContact NE1-CE1 3.53Å; W189-H217 AromaticContact NE1-ND1 3.8Å; W189-W220 HydrophobicContact CB-CB 4.01Å; W189-W220 HydrophobicContact CB-CD2 3.82Å; W189-W220 HydrophobicContact CB-CE3 3.63Å; W189-W220 HydrophobicContact CB-CG 3.99Å; W189-W220 HydrophobicContact CB-CZ3 4.36Å; W189-W220 HydrophobicContact CG-CD2 4.16Å; W189-W220 HydrophobicContact CG-CE3 4.24Å; W189-W220 HydrophobicContact CG-CG 4.38Å
190N97.9Very high96.4Very high50 Ų5054.4 Ų54.427%0.26729%0.287SS..Hα-helixtrans-66-39.9176.6-80.2-84.4000112F186 L187 L188 D192 N193 I194F186-N190 WeakPolarHBondContact CE1-ND2 3.24Å; F186-N190 WeakPolarHBondContact CZ-ND2 3.38Å; F186-N190 PolarHBondContact O-N 3.13Å; F186-N190 VanDerWaalsContact O-N 3.13Å; F186-N190 PolarHBondContact O-ND2 2.82Å; L187-N190 PolarHBondContact O-N 3.4Å; L188-N190 VanDerWaalsContact C-N 3.34Å; L188-N190 PolarHBondContact O-N 2.87Å; N190-D192 VanDerWaalsContact C-N 3.34Å; N190-D192 PolarHBondContact O-N 3.26Å; N190-N193 PolarHBondContact O-N 3.31Å; N190-I194 HydrophobicContact CB-CD1 4.35Å; N190-I194 WeakPolarHBondContact O-CB 3.47Å; N190-I194 VanDerWaalsContact O-CG1 3.27Å; N190-I194 WeakPolarHBondContact O-CG1 3.28Å; N190-I194 PolarHBondContact O-N 2.99Å
191I97.6Very high95.9Very high48 Ų4856.4 Ų56.425%0.24629%0.291CS..Hα-helixtrans-62.2-44177.4-66.1167.7000110.4L187 L188 N193 I194 F195 F216L187-I191 HydrophobicContact CD1-CD1 4.15Å; L187-I191 HydrophobicContact CD1-CG1 4.45Å; L187-I191 HydrophobicContact CG-CD1 3.99Å; L187-I191 WeakPolarHBondContact O-CG1 3.24Å; L187-I191 PolarHBondContact O-N 2.8Å; L188-I191 HydrophobicContact CD2-CD1 4.28Å; L188-I191 PolarHBondContact O-N 3.03Å; I191-N193 VanDerWaalsContact C-N 3.32Å; I191-N193 PolarHBondContact O-N 2.92Å; I191-I194 PolarHBondContact O-N 2.8Å; I191-F195 HydrophobicContact CG2-CD2 4.12Å; I191-F195 WeakPolarHBondContact O-CB 3.5Å; I191-F195 PolarHBondContact O-N 3.29Å; I191-F216 HydrophobicContact CB-CD2 4.2Å; I191-F216 HydrophobicContact CG2-CD2 3.57Å; I191-F216 HydrophobicContact CG2-CE2 3.64Å
192D95.8Very high95.5Very high0 Ų057 Ų570%030%0.299CS..Hα-helixtrans-58.4-43.5177.5-157.582.5000111.8C21 L188 W189 N190 C196 R203 F216 H217C21-D192 WeakPolarHBondContact CB-OD2 3.23Å; L188-D192 PolarHBondContact O-N 2.88Å; W189-D192 PolarHBondContact O-N 3.37Å; N190-D192 VanDerWaalsContact C-N 3.34Å; N190-D192 PolarHBondContact O-N 3.26Å; D192-C196 WeakPolarHBondContact O-CA 3.26Å; D192-C196 VanDerWaalsContact O-CB 3.28Å; D192-C196 WeakPolarHBondContact O-CB 3.32Å; D192-C196 PolarHBondContact O-N 3.3Å; D192-R203 IonicContact OD1-NH2 3.78Å; D192-F216 HydrophobicContact CB-CB 3.83Å; D192-F216 PolarHBondContact OD1-N 3.38Å; D192-F216 VanDerWaalsContact OD1-N 3.15Å; D192-H217 HydrophobicContact CB-CB 4.42Å; D192-H217 PolarHBondContact OD1-N 3.1Å
193N94Very high95.1Very high68 Ų6857.1 Ų57.136%0.36430%0.298SS..Hα-helixtrans-71.9-44.9-179.8-80-82.7000113.3W189 N190 I191W189-N193 VanDerWaalsContact CE2-ND2 3.34Å; W189-N193 PolarHBondContact NE1-ND2 3.05Å; W189-N193 PolarHBondContact O-N 3.5Å; W189-N193 VanDerWaalsContact O-N 3.15Å; W189-N193 PolarHBondContact O-ND2 2.93Å; N190-N193 PolarHBondContact O-N 3.31Å; I191-N193 VanDerWaalsContact C-N 3.32Å; I191-N193 PolarHBondContact O-N 2.92Å
194I96.4Very high94.5Very high117 Ų11759.7 Ų59.760%0.631%0.31SS*.Hα-helixtrans-78.9-40.6-172.9-65.2167.1000111.4N190 I191N190-I194 HydrophobicContact CB-CD1 4.35Å; N190-I194 WeakPolarHBondContact O-CB 3.47Å; N190-I194 VanDerWaalsContact O-CG1 3.27Å; N190-I194 WeakPolarHBondContact O-CG1 3.28Å; N190-I194 PolarHBondContact O-N 2.99Å; I191-I194 PolarHBondContact O-N 2.8Å
195F95.8Very high93.9Very high112 Ų11261.9 Ų61.949%0.49133%0.325SS..SBendtrans-103.822.6-173.8-63.8-81.5000113I191 D197 S198 L199I191-F195 HydrophobicContact CG2-CD2 4.12Å; I191-F195 WeakPolarHBondContact O-CB 3.5Å; I191-F195 PolarHBondContact O-N 3.29Å; F195-D197 PolarHBondContact O-N 2.66Å; F195-S198 PolarHBondContact O-N 3.31Å; F195-S198 VanDerWaalsContact O-N 3.13Å; F195-L199 WeakPolarHBondContact O-CG 3.48Å; F195-L199 PolarHBondContact O-N 3.49Å
196C94.5Very high93.3Very high12 Ų1265.8 Ų65.88%0.08135%0.346CS..Hα-helixtrans-55.8-46.9-171.2-177.50000113.7C21 D192 S198 L199 R200C21-C196 WeakPolarHBondContact CA-SG 3.34Å; C21-C196 HydrophobicContact CB-CB 3.85Å; C21-C196 WeakPolarHBondContact CB-SG 3.33Å; C21-C196 WeakPolarHBondContact SG-CA 3.48Å; C21-C196 WeakPolarHBondContact SG-CB 3.29Å; C21-C196 PolarHBondContact SG-O 3.1Å; C21-C196 VanDerWaalsContact SG-O 3.42Å; C21-C196 CovalentContact SG-SG 2.04Å; C21-C196 PolarHBondContact SG-SG 2.93Å; D192-C196 WeakPolarHBondContact O-CA 3.26Å; D192-C196 VanDerWaalsContact O-CB 3.28Å; D192-C196 WeakPolarHBondContact O-CB 3.32Å; D192-C196 PolarHBondContact O-N 3.3Å; C196-S198 VanDerWaalsContact C-N 3.3Å; C196-S198 PolarHBondContact O-N 3.28Å; C196-L199 PolarHBondContact O-N 3.11Å; C196-L199 VanDerWaalsContact O-N 3.14Å; C196-R200 PolarHBondContact O-N 2.94Å
197D92Very high92.8Very high108 Ų10865.6 Ų65.658%0.57835%0.353SS*.Hα-helixtrans-61.9-40.3-179.1-64.5-31.4000111.8F195 T201F195-D197 PolarHBondContact O-N 2.66Å; D197-T201 WeakPolarHBondContact O-CB 3.46Å; D197-T201 PolarHBondContact O-N 2.82Å; D197-T201 PolarHBondContact O-OG1 3.23Å
198S93.4Very high91.9Very high70 Ų7066.5 Ų66.549%0.4937%0.365SS..Hα-helixtrans-67.3-38.8175.8-56.90000112F195 C196 S202F195-S198 PolarHBondContact O-N 3.31Å; F195-S198 VanDerWaalsContact O-N 3.13Å; C196-S198 VanDerWaalsContact C-N 3.3Å; C196-S198 PolarHBondContact O-N 3.28Å; S198-S202 WeakPolarHBondContact O-CB 3.48Å; S198-S202 PolarHBondContact O-N 3.3Å; S198-S202 PolarHBondContact O-OG 3.41Å
199L92.7Very high91.1Very high17 Ų1767.9 Ų67.99%0.08938%0.384CS..Hα-helixtrans-64.2-53.1176.1-69.1168.3000110.4F195 C196 T201 S202 R203 T214 F216F195-L199 WeakPolarHBondContact O-CG 3.48Å; F195-L199 PolarHBondContact O-N 3.49Å; C196-L199 PolarHBondContact O-N 3.11Å; C196-L199 VanDerWaalsContact O-N 3.14Å; L199-T201 PolarHBondContact O-N 2.83Å; L199-S202 WeakPolarHBondContact O-CA 3.47Å; L199-S202 WeakPolarHBondContact O-CB 3.49Å; L199-S202 PolarHBondContact O-N 3.26Å; L199-R203 VanDerWaalsContact O-CG 3.31Å; L199-R203 WeakPolarHBondContact O-CG 3.37Å; L199-R203 PolarHBondContact O-N 2.99Å; L199-T214 HydrophobicContact CD2-CG2 4.48Å; L199-F216 HydrophobicContact CD1-CD2 3.87Å; L199-F216 HydrophobicContact CD1-CE2 4.29Å; L199-F216 HydrophobicContact CD2-CD2 4.02Å; L199-F216 HydrophobicContact CD2-CE2 3.62Å; L199-F216 HydrophobicContact CD2-CZ 4.49Å
200R90.8Very high90.4Very high27 Ų2768.9 Ų68.910%0.10239%0.394CS..Hα-helixtrans-57.2-45.8177.5-72.4-174.9169.7-158.1-2.8112.3W20 C21 E22 E23 C196 S202 R203 Q204W20-R200 PolarHBondContact O-NH2 3.11Å; C21-R200 PolarHBondContact O-NE 3.49Å; C21-R200 PolarHBondContact O-NH2 2.96Å; E22-R200 PolarHBondContact O-NH2 2.96Å; E23-R200 HydrophobicContact CG-CG 4.46Å; C196-R200 PolarHBondContact O-N 2.94Å; R200-S202 VanDerWaalsContact C-N 3.28Å; R200-S202 PolarHBondContact O-N 3.25Å; R200-R203 WeakPolarHBondContact O-CB 3.37Å; R200-R203 PolarHBondContact O-N 3.49Å; R200-R203 VanDerWaalsContact O-N 3.15Å; R200-Q204 WeakPolarHBondContact O-CG 3.36Å; R200-Q204 PolarHBondContact O-N 3.46Å
201T90.1Very high89.8Confident82 Ų8267.1 Ų67.150%0.50339%0.387SS..Hα-helixtrans-58.3-43.1175.5-54.90000111D197 L199 R203 Q204D197-T201 WeakPolarHBondContact O-CB 3.46Å; D197-T201 PolarHBondContact O-N 2.82Å; D197-T201 PolarHBondContact O-OG1 3.23Å; L199-T201 PolarHBondContact O-N 2.83Å; T201-R203 VanDerWaalsContact C-N 3.35Å; T201-R203 PolarHBondContact O-N 3.4Å; T201-Q204 PolarHBondContact O-N 3.17Å
202S88.9Confident89.3Confident51 Ų5167.3 Ų67.336%0.35739%0.391SS..Hα-helixtrans-64.3-38.9177.9-58.10000112.1S198 L199 R200 Q204 V205 L206S198-S202 WeakPolarHBondContact O-CB 3.48Å; S198-S202 PolarHBondContact O-N 3.3Å; S198-S202 PolarHBondContact O-OG 3.41Å; L199-S202 WeakPolarHBondContact O-CA 3.47Å; L199-S202 WeakPolarHBondContact O-CB 3.49Å; L199-S202 PolarHBondContact O-N 3.26Å; R200-S202 VanDerWaalsContact C-N 3.28Å; R200-S202 PolarHBondContact O-N 3.25Å; S202-Q204 PolarHBondContact O-N 3.04Å; S202-V205 PolarHBondContact O-N 2.99Å; S202-L206 VanDerWaalsContact O-CB 3.28Å; S202-L206 WeakPolarHBondContact O-CB 3.41Å; S202-L206 VanDerWaalsContact O-CG 3.29Å; S202-L206 WeakPolarHBondContact O-CG 3.42Å; S202-L206 PolarHBondContact O-N 3.23Å
203R89.9Confident89.1Confident26 Ų2671.2 Ų71.210%0.09841%0.414CS..Hα-helixtrans-63.7-27.6177.7-65.2176.4-168.4153.54.1113.1C21 E23 D192 L199 R200 T201 T214 Q215C21-R203 PolarHBondContact O-NH1 2.82Å; E23-R203 IonicContact OE2-NH1 2.9Å; E23-R203 PolarHBondContact OE2-NH1 3.46Å; D192-R203 IonicContact OD1-NH2 3.78Å; L199-R203 VanDerWaalsContact O-CG 3.31Å; L199-R203 WeakPolarHBondContact O-CG 3.37Å; L199-R203 PolarHBondContact O-N 2.99Å; R200-R203 WeakPolarHBondContact O-CB 3.37Å; R200-R203 PolarHBondContact O-N 3.49Å; R200-R203 VanDerWaalsContact O-N 3.15Å; T201-R203 VanDerWaalsContact C-N 3.35Å; T201-R203 PolarHBondContact O-N 3.4Å; R203-T214 WeakPolarHBondContact CG-OG1 3.35Å; R203-T214 PolarHBondContact NE-OG1 3.49Å; R203-T214 VanDerWaalsContact NE-OG1 3.17Å; R203-T214 PolarHBondContact NH2-O 3.31Å; R203-Q215 VanDerWaalsContact NH2-OE1 3.13Å
204Q85.6Confident89Confident154 Ų15468.8 Ų68.872%0.7240%0.402SS*.Hα-helixtrans-74.5-26.7177.7-68.2175.22.100113.3R200 T201 S202R200-Q204 WeakPolarHBondContact O-CG 3.36Å; R200-Q204 PolarHBondContact O-N 3.46Å; T201-Q204 PolarHBondContact O-N 3.17Å; S202-Q204 PolarHBondContact O-N 3.04Å
205V86.9Confident88.9Confident121 Ų12163.7 Ų63.773%0.73338%0.376SS*.Hα-helixtrans-105.4-29-173-174.70000112.2S202S202-V205 PolarHBondContact O-N 2.99Å
206L85.6Confident89Confident82 Ų8260.4 Ų60.443%0.42936%0.361SS..SBendtrans-89.4160.9-175.7-64.3176.1000112.7S202 V210S202-L206 VanDerWaalsContact O-CB 3.28Å; S202-L206 WeakPolarHBondContact O-CB 3.41Å; S202-L206 VanDerWaalsContact O-CG 3.29Å; S202-L206 WeakPolarHBondContact O-CG 3.42Å; S202-L206 PolarHBondContact O-N 3.23Å; L206-V210 HydrophobicContact CB-CB 4.03Å; L206-V210 HydrophobicContact CB-CG1 4.11Å; L206-V210 HydrophobicContact CB-CG2 4.41Å; L206-V210 HydrophobicContact CD1-CG1 3.76Å
207P86.6Confident89.2Confident81 Ų8159.9 Ų59.953%0.52636%0.358SS..  trans-56.9150.6179.4-25.434.4000112.9G209 V210 G211P207-G209 PolarHBondContact O-N 3.5Å; P207-V210 WeakPolarHBondContact O-CB 3.37Å; P207-V210 PolarHBondContact O-N 3.16Å; P207-G211 PolarHBondContact O-N 2.99Å
208P80.2Confident89.5Confident116 Ų11655.1 Ų55.175%0.75333%0.334SS*.Hα-helixtrans-53.6-33.1-175.7-28.634.7000114.9V210 G211 V212P208-V210 VanDerWaalsContact C-N 3.31Å; P208-V210 PolarHBondContact O-N 2.89Å; P208-G211 WeakPolarHBondContact O-CA 3.39Å; P208-G211 PolarHBondContact O-N 3.33Å; P208-V212 PolarHBondContact O-N 3.19Å
209G82.1Confident89.7Confident51 Ų5156 Ų5653%0.52633%0.326SS..Hα-helixtrans-63.1-34.4176.400000113.6P207 G211 V212 V213P207-G209 PolarHBondContact O-N 3.5Å; G209-G211 VanDerWaalsContact C-N 3.29Å; G209-V212 PolarHBondContact O-N 3.41Å; G209-V213 WeakPolarHBondContact O-CG2 3.29Å; G209-V213 PolarHBondContact O-N 3.11Å
210V82.4Confident90Very high54 Ų5456.5 Ų56.533%0.32733%0.327SS..Hα-helixtrans-70.4-32.7173-175.50000110.4L206 P207 P208 V212 V213 T214L206-V210 HydrophobicContact CB-CB 4.03Å; L206-V210 HydrophobicContact CB-CG1 4.11Å; L206-V210 HydrophobicContact CB-CG2 4.41Å; L206-V210 HydrophobicContact CD1-CG1 3.76Å; P207-V210 WeakPolarHBondContact O-CB 3.37Å; P207-V210 PolarHBondContact O-N 3.16Å; P208-V210 VanDerWaalsContact C-N 3.31Å; P208-V210 PolarHBondContact O-N 2.89Å; V210-V212 VanDerWaalsContact C-N 3.3Å; V210-V212 PolarHBondContact O-N 3.33Å; V210-V213 PolarHBondContact O-N 2.95Å; V210-T214 HydrophobicContact CG1-CG2 3.98Å; V210-T214 WeakPolarHBondContact O-CB 3.45Å; V210-T214 VanDerWaalsContact O-CG2 3.3Å; V210-T214 WeakPolarHBondContact O-CG2 3.33Å; V210-T214 PolarHBondContact O-N 2.71Å; V210-T214 PolarHBondContact O-OG1 3.47Å
211G84.3Confident90.3Very high12 Ų1255.5 Ų55.512%0.12432%0.323CS..Hα-helixtrans-52.7-46.6171.100000112.8P207 P208 G209 T214 Q215P207-G211 PolarHBondContact O-N 2.99Å; P208-G211 WeakPolarHBondContact O-CA 3.39Å; P208-G211 PolarHBondContact O-N 3.33Å; G209-G211 VanDerWaalsContact C-N 3.29Å; G211-T214 PolarHBondContact O-OG1 2.91Å; G211-T214 VanDerWaalsContact O-OG1 3.13Å; G211-Q215 WeakPolarHBondContact O-CG 3.32Å
212V87.5Confident90.7Very high53 Ų5353.9 Ų53.932%0.32131%0.311SS..Hα-helixtrans-68.3-45.7177.8-175.90000112W35 P208 G209 V210 T214 Q215W35-V212 HydrophobicContact CD2-CG1 3.86Å; W35-V212 HydrophobicContact CE3-CG1 3.9Å; W35-V212 HydrophobicContact CH2-CG1 3.9Å; W35-V212 HydrophobicContact CH2-CG2 4.05Å; W35-V212 HydrophobicContact CZ2-CB 4.26Å; W35-V212 HydrophobicContact CZ2-CG1 3.87Å; W35-V212 HydrophobicContact CZ2-CG2 3.4Å; W35-V212 HydrophobicContact CZ3-CG1 3.92Å; P208-V212 PolarHBondContact O-N 3.19Å; G209-V212 PolarHBondContact O-N 3.41Å; V210-V212 VanDerWaalsContact C-N 3.3Å; V210-V212 PolarHBondContact O-N 3.33Å; V212-T214 PolarHBondContact O-N 3.03Å; V212-Q215 WeakPolarHBondContact O-CB 3.31Å; V212-Q215 WeakPolarHBondContact O-CG 3.36Å; V212-Q215 PolarHBondContact O-N 3.14Å
213V90.6Very high91.2Very high81 Ų8153.5 Ų53.549%0.49130%0.303SS..Hα-helixtrans-66.3-29.1-176.2174.70000112.2G209 V210 Q215 W219G209-V213 WeakPolarHBondContact O-CG2 3.29Å; G209-V213 PolarHBondContact O-N 3.11Å; V210-V213 PolarHBondContact O-N 2.95Å; V213-Q215 VanDerWaalsContact C-N 3.28Å; V213-Q215 PolarHBondContact O-N 3.2Å; V213-W219 PolarHBondContact O-NE1 3.21Å
214T92.9Very high91.6Very high18 Ų1852.6 Ų52.611%0.1130%0.301CS..THydrogen-bonded Turntrans-83.73.7179.655.70000114L199 R203 V210 G211 V212 F216L199-T214 HydrophobicContact CD2-CG2 4.48Å; R203-T214 WeakPolarHBondContact CG-OG1 3.35Å; R203-T214 PolarHBondContact NE-OG1 3.49Å; R203-T214 VanDerWaalsContact NE-OG1 3.17Å; R203-T214 PolarHBondContact NH2-O 3.31Å; V210-T214 HydrophobicContact CG1-CG2 3.98Å; V210-T214 WeakPolarHBondContact O-CB 3.45Å; V210-T214 VanDerWaalsContact O-CG2 3.3Å; V210-T214 WeakPolarHBondContact O-CG2 3.33Å; V210-T214 PolarHBondContact O-N 2.71Å; V210-T214 PolarHBondContact O-OG1 3.47Å; G211-T214 PolarHBondContact O-OG1 2.91Å; G211-T214 VanDerWaalsContact O-OG1 3.13Å; V212-T214 PolarHBondContact O-N 3.03Å; T214-F216 PolarHBondContact O-N 2.85Å
215Q95.2Very high92.2Very high10 Ų1045.3 Ų45.35%0.04727%0.266CS..  trans-76.574.3170.1-57.8-62.1-3.700109.8W35 R203 G211 V212 V213 H217 A218 W219W35-Q215 HydrophobicContact CB-CB 4.14Å; W35-Q215 HydrophobicContact CB-CG 3.94Å; W35-Q215 HydrophobicContact CG-CG 4.02Å; R203-Q215 VanDerWaalsContact NH2-OE1 3.13Å; G211-Q215 WeakPolarHBondContact O-CG 3.32Å; V212-Q215 WeakPolarHBondContact O-CB 3.31Å; V212-Q215 WeakPolarHBondContact O-CG 3.36Å; V212-Q215 PolarHBondContact O-N 3.14Å; V213-Q215 VanDerWaalsContact C-N 3.28Å; V213-Q215 PolarHBondContact O-N 3.2Å; Q215-H217 VanDerWaalsContact C-N 3.28Å; Q215-H217 PolarHBondContact O-N 3.02Å; Q215-A218 HydrophobicContact CB-CB 3.98Å; Q215-A218 WeakPolarHBondContact O-CB 3.5Å; Q215-A218 PolarHBondContact O-N 3.35Å; Q215-A218 VanDerWaalsContact O-N 3.09Å; Q215-W219 PolarHBondContact O-N 3.06Å
216F97.4Very high92.7Very high42 Ų4241.4 Ų41.418%0.18424%0.241CC..Hα-helixtrans-70.5-25-170.7-69.7-32.7000113.1L188 I191 D192 L199 T214 W219 W220L188-F216 HydrophobicContact CB-CB 4.1Å; L188-F216 HydrophobicContact CD2-CD1 3.9Å; L188-F216 HydrophobicContact CD2-CE1 4.21Å; L188-F216 HydrophobicContact CD2-CG 4.16Å; L188-F216 WeakPolarHBondContact O-CB 3.49Å; I191-F216 HydrophobicContact CB-CD2 4.2Å; I191-F216 HydrophobicContact CG2-CD2 3.57Å; I191-F216 HydrophobicContact CG2-CE2 3.64Å; D192-F216 HydrophobicContact CB-CB 3.83Å; D192-F216 PolarHBondContact OD1-N 3.38Å; D192-F216 VanDerWaalsContact OD1-N 3.15Å; L199-F216 HydrophobicContact CD1-CD2 3.87Å; L199-F216 HydrophobicContact CD1-CE2 4.29Å; L199-F216 HydrophobicContact CD2-CD2 4.02Å; L199-F216 HydrophobicContact CD2-CE2 3.62Å; L199-F216 HydrophobicContact CD2-CZ 4.49Å; T214-F216 PolarHBondContact O-N 2.85Å; F216-W219 AromaticContact CD1-CD1 3.98Å; F216-W219 PolarHBondContact O-N 3.21Å; F216-W220 PolarHBondContact O-N 2.88Å
217H97.9Very high93.3Very high2 Ų237.5 Ų37.51%0.00922%0.221CC..Hα-helixtrans-65.2-37.8168.7-159.190.3000112.6W20 N36 H81 W189 D192 Q215 W219 W220 H221W20-H217 AromaticContact CD2-CE1 3.29Å; W20-H217 AromaticContact CD2-ND1 3.58Å; W20-H217 AromaticContact CD2-NE2 3.72Å; W20-H217 AromaticContact CE2-CE1 3.34Å; W20-H217 AromaticContact CE2-NE2 3.51Å; W20-H217 AromaticContact CE3-CE1 3.29Å; W20-H217 AromaticContact CE3-ND1 3.36Å; W20-H217 AromaticContact CH2-CE1 3.41Å; W20-H217 VanDerWaalsContact CH2-CE1 3.41Å; W20-H217 WeakPolarHBondContact CH2-CE1 3.45Å; W20-H217 AromaticContact CZ2-CE1 3.36Å; W20-H217 WeakPolarHBondContact CZ2-CE1 3.14Å; W20-H217 AromaticContact CZ2-NE2 3.74Å; W20-H217 AromaticContact CZ3-CE1 3.37Å; W20-H217 WeakPolarHBondContact CZ3-CE1 3.22Å; W20-H217 AromaticContact CZ3-ND1 3.73Å; W20-H217 AromaticContact NE1-NE2 3.92Å; N36-H217 WeakPolarHBondContact OD1-CB 3.46Å; H81-H217 AromaticContact CE1-CD2 3.63Å; H81-H217 AromaticContact CE1-NE2 3.5Å; H81-H217 PolarHBondContact CE1-NE2 2.95Å; H81-H217 AromaticContact NE2-NE2 3.81Å; W189-H217 AromaticContact CD1-CE1 3.37Å; W189-H217 AromaticContact CD1-ND1 3.38Å; W189-H217 AromaticContact NE1-CE1 3.53Å; W189-H217 AromaticContact NE1-ND1 3.8Å; D192-H217 HydrophobicContact CB-CB 4.42Å; D192-H217 PolarHBondContact OD1-N 3.1Å; Q215-H217 VanDerWaalsContact C-N 3.28Å; Q215-H217 PolarHBondContact O-N 3.02Å; H217-W219 VanDerWaalsContact C-N 3.33Å; H217-W219 PolarHBondContact O-N 3.3Å; H217-W220 WeakPolarHBondContact O-CA 3.47Å; H217-W220 VanDerWaalsContact O-CB 3.23Å; H217-W220 WeakPolarHBondContact O-CB 3.46Å; H217-W220 PolarHBondContact O-N 3.23Å; H217-W220 VanDerWaalsContact O-N 3.11Å; H217-H221 AromaticContact CD2-CE1 3.49Å; H217-H221 PolarHBondContact CD2-CE1 3.36Å; H217-H221 VanDerWaalsContact CD2-CE1 3.49Å; H217-H221 AromaticContact CD2-NE2 3.31Å; H217-H221 PolarHBondContact CD2-NE2 3.04Å; H217-H221 VanDerWaalsContact CD2-NE2 3.31Å; H217-H221 AromaticContact NE2-CE1 3.83Å; H217-H221 AromaticContact NE2-NE2 3.23Å; H217-H221 PolarHBondContact NE2-NE2 2.85Å; H217-H221 PolarHBondContact O-N 3.34Å
218A98.1Very high93.9Very high8 Ų834.3 Ų34.37%0.06620%0.201CC..Hα-helixtrans-64.9-38.1173.800000111.9W35 N36 S39 Q215 W220 H221 I222W35-A218 HydrophobicContact CB-CB 4.08Å; W35-A218 WeakPolarHBondContact O-CB 3.44Å; N36-A218 WeakPolarHBondContact OD1-CA 3.43Å; N36-A218 WeakPolarHBondContact OD1-CB 3.22Å; N36-A218 PolarHBondContact OD1-N 2.9Å; S39-A218 WeakPolarHBondContact CB-O 3.43Å; S39-A218 PolarHBondContact OG-O 2.87Å; Q215-A218 HydrophobicContact CB-CB 3.98Å; Q215-A218 WeakPolarHBondContact O-CB 3.5Å; Q215-A218 PolarHBondContact O-N 3.35Å; Q215-A218 VanDerWaalsContact O-N 3.09Å; A218-W220 VanDerWaalsContact C-N 3.31Å; A218-W220 PolarHBondContact O-N 3.4Å; A218-H221 WeakPolarHBondContact O-CB 3.49Å; A218-H221 PolarHBondContact O-N 3.13Å; A218-I222 PolarHBondContact O-N 3.08Å
219W98.3Very high94.8Very high87 Ų8728.9 Ų28.933%0.3317%0.165SC..Hα-helixtrans-66-32.7172.3-70.9106.9000112.8L188 V213 Q215 F216 H217 H221 I222 F223L188-W219 HydrophobicContact CD1-CB 3.56Å; L188-W219 HydrophobicContact CD1-CG 4.23Å; V213-W219 PolarHBondContact O-NE1 3.21Å; Q215-W219 PolarHBondContact O-N 3.06Å; F216-W219 AromaticContact CD1-CD1 3.98Å; F216-W219 PolarHBondContact O-N 3.21Å; H217-W219 VanDerWaalsContact C-N 3.33Å; H217-W219 PolarHBondContact O-N 3.3Å; W219-H221 VanDerWaalsContact C-N 3.35Å; W219-H221 PolarHBondContact O-N 3.43Å; W219-I222 HydrophobicContact CE3-CD1 3.96Å; W219-I222 HydrophobicContact CZ3-CD1 4.14Å; W219-I222 PolarHBondContact O-N 3.37Å; W219-F223 HydrophobicContact CB-CD2 4.16Å; W219-F223 HydrophobicContact CB-CE2 4.02Å; W219-F223 HydrophobicContact CD2-CE2 4.42Å; W219-F223 AromaticContact CE3-CE2 3.91Å; W219-F223 HydrophobicContact CE3-CE2 3.91Å; W219-F223 AromaticContact CE3-CZ 3.94Å; W219-F223 HydrophobicContact CE3-CZ 3.94Å; W219-F223 HydrophobicContact CZ3-CZ 4.43Å; W219-F223 WeakPolarHBondContact O-CB 3.48Å; W219-F223 WeakPolarHBondContact O-CD2 3.46Å; W219-F223 WeakPolarHBondContact O-CG 3.35Å; W219-F223 PolarHBondContact O-N 3.42Å
220W98.3Very high95.5Very high29 Ų2927.1 Ų27.111%0.1114%0.144CC..Hα-helixtrans-56-48.1171153.2-95.5000110.9F182 F186 W189 F216 H217 A218 I222 F223 T224F182-W220 HydrophobicContact CZ-CH2 4.39Å; F186-W220 HydrophobicContact CB-CE3 4.38Å; F186-W220 HydrophobicContact CB-CZ3 3.71Å; F186-W220 HydrophobicContact CD2-CH2 4.16Å; F186-W220 AromaticContact CD2-CZ3 3.75Å; F186-W220 HydrophobicContact CD2-CZ3 3.75Å; F186-W220 HydrophobicContact CG-CZ3 4.23Å; W189-W220 HydrophobicContact CB-CB 4.01Å; W189-W220 HydrophobicContact CB-CD2 3.82Å; W189-W220 HydrophobicContact CB-CE3 3.63Å; W189-W220 HydrophobicContact CB-CG 3.99Å; W189-W220 HydrophobicContact CB-CZ3 4.36Å; W189-W220 HydrophobicContact CG-CD2 4.16Å; W189-W220 HydrophobicContact CG-CE3 4.24Å; W189-W220 HydrophobicContact CG-CG 4.38Å; F216-W220 PolarHBondContact O-N 2.88Å; H217-W220 WeakPolarHBondContact O-CA 3.47Å; H217-W220 VanDerWaalsContact O-CB 3.23Å; H217-W220 WeakPolarHBondContact O-CB 3.46Å; H217-W220 PolarHBondContact O-N 3.23Å; H217-W220 VanDerWaalsContact O-N 3.11Å; A218-W220 VanDerWaalsContact C-N 3.31Å; A218-W220 PolarHBondContact O-N 3.4Å; W220-I222 VanDerWaalsContact C-N 3.33Å; W220-I222 PolarHBondContact O-N 2.96Å; W220-F223 PolarHBondContact O-N 2.95Å; W220-T224 HydrophobicContact CD2-CG2 3.59Å; W220-T224 HydrophobicContact CE3-CG2 3.27Å; W220-T224 HydrophobicContact CG-CG2 4.46Å; W220-T224 HydrophobicContact CH2-CG2 3.55Å; W220-T224 HydrophobicContact CZ2-CG2 3.85Å; W220-T224 HydrophobicContact CZ3-CG2 3.23Å; W220-T224 WeakPolarHBondContact O-CB 3.3Å; W220-T224 WeakPolarHBondContact O-CG2 3.42Å; W220-T224 PolarHBondContact O-N 3.24Å; W220-T224 PolarHBondContact O-OG1 3.28Å
221H98.5Very high96.3Very high5 Ų525.5 Ų25.52%0.02313%0.132CC..Hα-helixtrans-57.7-43.7176-58.8155.8000112.7N36 S39 N40 M43 H81 H217 A218 W219 G225N36-H221 PolarHBondContact O-CE1 3.15Å; N36-H221 VanDerWaalsContact O-CE1 3.26Å; N36-H221 PolarHBondContact O-ND1 2.97Å; S39-H221 WeakPolarHBondContact OG-CB 3.43Å; S39-H221 PolarHBondContact OG-ND1 3.23Å; N40-H221 PolarHBondContact OD1-ND1 3.04Å; M43-H221 HydrophobicContact CE-CB 4.01Å; H81-H221 AromaticContact CD2-CE1 3.56Å; H81-H221 AromaticContact CE1-CE1 3.71Å; H81-H221 AromaticContact CE1-NE2 3.97Å; H81-H221 AromaticContact NE2-CE1 3.11Å; H81-H221 PolarHBondContact NE2-CE1 3.09Å; H81-H221 AromaticContact NE2-NE2 3.28Å; H81-H221 PolarHBondContact NE2-NE2 3.45Å; H217-H221 AromaticContact CD2-CE1 3.49Å; H217-H221 PolarHBondContact CD2-CE1 3.36Å; H217-H221 VanDerWaalsContact CD2-CE1 3.49Å; H217-H221 AromaticContact CD2-NE2 3.31Å; H217-H221 PolarHBondContact CD2-NE2 3.04Å; H217-H221 VanDerWaalsContact CD2-NE2 3.31Å; H217-H221 AromaticContact NE2-CE1 3.83Å; H217-H221 AromaticContact NE2-NE2 3.23Å; H217-H221 PolarHBondContact NE2-NE2 2.85Å; H217-H221 PolarHBondContact O-N 3.34Å; A218-H221 WeakPolarHBondContact O-CB 3.49Å; A218-H221 PolarHBondContact O-N 3.13Å; W219-H221 VanDerWaalsContact C-N 3.35Å; W219-H221 PolarHBondContact O-N 3.43Å; H221-G225 WeakPolarHBondContact O-CA 3.33Å; H221-G225 PolarHBondContact O-N 3.33Å
222I98.3Very high97Very high49 Ų4925 Ų2525%0.25113%0.127SC..Hα-helixtrans-62.5-50.1179.6-64.6174.2000110.6I42 A218 W219 W220 L226I42-I222 HydrophobicContact CD1-CG2 3.88Å; I42-I222 HydrophobicContact CG2-CG1 4.43Å; A218-I222 PolarHBondContact O-N 3.08Å; W219-I222 HydrophobicContact CE3-CD1 3.96Å; W219-I222 HydrophobicContact CZ3-CD1 4.14Å; W219-I222 PolarHBondContact O-N 3.37Å; W220-I222 VanDerWaalsContact C-N 3.33Å; W220-I222 PolarHBondContact O-N 2.96Å; I222-L226 VanDerWaalsContact O-CB 3.3Å; I222-L226 WeakPolarHBondContact O-CB 3.5Å; I222-L226 PolarHBondContact O-N 2.96Å
223F98.5Very high97.5Very high42 Ų4223 Ų2318%0.18412%0.115CC..Hα-helixtrans-75.5-42.3-174.4-69-46000112.9I181 L184 L188 W219 W220 G227I181-F223 HydrophobicContact CG2-CB 3.88Å; I181-F223 HydrophobicContact CG2-CD1 3.74Å; I181-F223 HydrophobicContact CG2-CG 4.22Å; I181-F223 VanDerWaalsContact CG2-O 3.28Å; I181-F223 WeakPolarHBondContact CG2-O 3.49Å; I181-F223 WeakPolarHBondContact O-CB 3.5Å; L184-F223 HydrophobicContact CD2-CD2 4.29Å; L184-F223 HydrophobicContact CD2-CE1 4.19Å; L184-F223 HydrophobicContact CD2-CE2 3.96Å; L184-F223 HydrophobicContact CD2-CZ 3.9Å; L184-F223 HydrophobicContact CG-CD2 4.19Å; L184-F223 HydrophobicContact CG-CE2 4.17Å; L188-F223 HydrophobicContact CD1-CD2 3.78Å; L188-F223 HydrophobicContact CD1-CE2 3.5Å; W219-F223 HydrophobicContact CB-CD2 4.16Å; W219-F223 HydrophobicContact CB-CE2 4.02Å; W219-F223 HydrophobicContact CD2-CE2 4.42Å; W219-F223 AromaticContact CE3-CE2 3.91Å; W219-F223 HydrophobicContact CE3-CE2 3.91Å; W219-F223 AromaticContact CE3-CZ 3.94Å; W219-F223 HydrophobicContact CE3-CZ 3.94Å; W219-F223 HydrophobicContact CZ3-CZ 4.43Å; W219-F223 WeakPolarHBondContact O-CB 3.48Å; W219-F223 WeakPolarHBondContact O-CD2 3.46Å; W219-F223 WeakPolarHBondContact O-CG 3.35Å; W219-F223 PolarHBondContact O-N 3.42Å; W220-F223 PolarHBondContact O-N 2.95Å; F223-G227 PolarHBondContact O-N 3.47Å
224T98.3Very high97.8Very high8 Ų819.2 Ų19.25%0.0499%0.091CC..Hα-helixtrans-72.4-33.3176.359.70000112.4F182 W220 G227 S228F182-T224 HydrophobicContact CD2-CG2 3.95Å; F182-T224 HydrophobicContact CE1-CG2 4.46Å; F182-T224 HydrophobicContact CE2-CG2 3.86Å; F182-T224 HydrophobicContact CG-CG2 4.3Å; F182-T224 HydrophobicContact CZ-CG2 4.12Å; W220-T224 HydrophobicContact CD2-CG2 3.59Å; W220-T224 HydrophobicContact CE3-CG2 3.27Å; W220-T224 HydrophobicContact CG-CG2 4.46Å; W220-T224 HydrophobicContact CH2-CG2 3.55Å; W220-T224 HydrophobicContact CZ2-CG2 3.85Å; W220-T224 HydrophobicContact CZ3-CG2 3.23Å; W220-T224 WeakPolarHBondContact O-CB 3.3Å; W220-T224 WeakPolarHBondContact O-CG2 3.42Å; W220-T224 PolarHBondContact O-N 3.24Å; W220-T224 PolarHBondContact O-OG1 3.28Å; T224-G227 PolarHBondContact O-N 3.01Å; T224-S228 WeakPolarHBondContact O-CB 3.43Å; T224-S228 PolarHBondContact O-N 3.06Å; T224-S228 PolarHBondContact O-OG 2.89Å
225G98.3Very high98Very high0 Ų018.5 Ų18.50%09%0.087CC..Hα-helixtrans-60.3-51.2171.600000112.2H221 Y229H221-G225 WeakPolarHBondContact O-CA 3.33Å; H221-G225 PolarHBondContact O-N 3.33Å; G225-Y229 WeakPolarHBondContact O-CB 3.17Å; G225-Y229 PolarHBondContact O-N 3.46Å
226L98.2Very high98.1Very high39 Ų3918.2 Ų18.220%0.2049%0.086CC..Hα-helixtrans-63.9-45.3175179.359000111.8I42 I181 I222 S228 Y229 L230 W256I42-L226 HydrophobicContact CD1-CB 4.3Å; I181-L226 HydrophobicContact CD1-CD2 3.95Å; I181-L226 HydrophobicContact CD1-CG 4.35Å; I181-L226 HydrophobicContact CG2-CB 4.42Å; I181-L226 HydrophobicContact CG2-CD2 4.32Å; I181-L226 HydrophobicContact CG2-CG 4.46Å; I222-L226 VanDerWaalsContact O-CB 3.3Å; I222-L226 WeakPolarHBondContact O-CB 3.5Å; I222-L226 PolarHBondContact O-N 2.96Å; L226-S228 VanDerWaalsContact C-N 3.35Å; L226-S228 PolarHBondContact O-N 2.94Å; L226-Y229 PolarHBondContact O-N 2.79Å; L226-L230 HydrophobicContact CD1-CD1 4.21Å; L226-L230 HydrophobicContact CD1-CD2 4.47Å; L226-L230 HydrophobicContact CD1-CG 4.06Å; L226-L230 HydrophobicContact CG-CD1 4.12Å; L226-L230 HydrophobicContact CG-CG 4.39Å; L226-L230 WeakPolarHBondContact O-CB 3.38Å; L226-L230 VanDerWaalsContact O-CG 3.25Å; L226-L230 WeakPolarHBondContact O-CG 2.99Å; L226-L230 PolarHBondContact O-N 2.91Å; L226-W256 HydrophobicContact CD1-CH2 3.71Å; L226-W256 HydrophobicContact CD1-CZ2 4.24Å; L226-W256 HydrophobicContact CD1-CZ3 4.02Å
227G98.4Very high98.1Very high1 Ų117.7 Ų17.71%0.018%0.084CC..Hα-helixtrans-58.2-45.2178.400000112.4S178 F223 T224 L230 H231S178-G227 PolarHBondContact OG-O 3.23Å; F223-G227 PolarHBondContact O-N 3.47Å; T224-G227 PolarHBondContact O-N 3.01Å; G227-L230 PolarHBondContact O-N 2.84Å; G227-H231 PolarHBondContact O-N 3.47Å
228S98.6Very high98Very high14 Ų1417.6 Ų17.610%0.0988%0.084CC..Hα-helixtrans-66.6-43176.6-58.30000111.6T224 L226 L230 H231 I232T224-S228 WeakPolarHBondContact O-CB 3.43Å; T224-S228 PolarHBondContact O-N 3.06Å; T224-S228 PolarHBondContact O-OG 2.89Å; L226-S228 VanDerWaalsContact C-N 3.35Å; L226-S228 PolarHBondContact O-N 2.94Å; S228-L230 PolarHBondContact O-N 3.13Å; S228-H231 WeakPolarHBondContact O-CB 2.96Å; S228-H231 PolarHBondContact O-N 3.44Å; S228-H231 VanDerWaalsContact O-N 3.13Å; S228-I232 WeakPolarHBondContact O-CG1 2.99Å; S228-I232 PolarHBondContact O-N 3.02Å
229Y98.5Very high97.9Very high1 Ų117.5 Ų17.50%0.0048%0.082CC..Hα-helixtrans-59.5-45.9174.9-177.5-92.4000112.1P46 P47 F67 G225 L226 H231 I232 L233 W256 P257P46-Y229 HydrophobicContact CB-CE2 4.42Å; P47-Y229 HydrophobicContact CB-CD2 4.41Å; P47-Y229 HydrophobicContact CG-CD2 3.95Å; F67-Y229 HydrophobicContact CD1-CD2 4.05Å; F67-Y229 AromaticContact CD1-CE2 3.85Å; F67-Y229 HydrophobicContact CD1-CE2 3.85Å; F67-Y229 AromaticContact CE1-CD2 3.63Å; F67-Y229 HydrophobicContact CE1-CD2 3.63Å; F67-Y229 AromaticContact CE1-CE2 3.29Å; F67-Y229 HydrophobicContact CE1-CE2 3.29Å; F67-Y229 AromaticContact CE1-CZ 3.95Å; F67-Y229 HydrophobicContact CZ-CE2 4.25Å; G225-Y229 WeakPolarHBondContact O-CB 3.17Å; G225-Y229 PolarHBondContact O-N 3.46Å; L226-Y229 PolarHBondContact O-N 2.79Å; Y229-H231 VanDerWaalsContact C-N 3.27Å; Y229-H231 PolarHBondContact O-N 3.5Å; Y229-I232 PolarHBondContact O-N 3.39Å; Y229-L233 HydrophobicContact CD1-CD1 4.02Å; Y229-L233 HydrophobicContact CD1-CG 4.26Å; Y229-L233 HydrophobicContact CE1-CD1 3.49Å; Y229-L233 VanDerWaalsContact CE1-CD1 3.49Å; Y229-L233 HydrophobicContact CE1-CD2 4.36Å; Y229-L233 HydrophobicContact CE1-CG 3.86Å; Y229-L233 PolarHBondContact O-N 3.05Å; Y229-W256 AromaticContact CD1-CE2 3.81Å; Y229-W256 AromaticContact CD1-CZ2 3.56Å; Y229-W256 HydrophobicContact CD1-CZ2 3.56Å; Y229-W256 AromaticContact CD1-NE1 3.66Å; Y229-W256 HydrophobicContact CD2-CZ2 4.05Å; Y229-W256 AromaticContact CE1-CD1 3.95Å; Y229-W256 AromaticContact CE1-CE2 3.66Å; Y229-W256 AromaticContact CE1-CZ2 3.92Å; Y229-W256 HydrophobicContact CE1-CZ2 3.92Å; Y229-W256 AromaticContact CE1-NE1 3.02Å; Y229-W256 HydrophobicContact CE2-CZ2 4.34Å; Y229-W256 AromaticContact CE2-NE1 3.64Å; Y229-W256 AromaticContact CG-CZ2 3.64Å; Y229-W256 HydrophobicContact CG-CZ2 3.64Å; Y229-W256 AromaticContact CZ-CD1 3.93Å; Y229-W256 AromaticContact CZ-CE2 3.95Å; Y229-W256 AromaticContact CZ-NE1 3.03Å; Y229-W256 PolarHBondContact OH-NE1 3.45Å; Y229-P257 HydrophobicContact CE1-CG 4.4Å; Y229-P257 VanDerWaalsContact CE1-O 3.22Å; Y229-P257 WeakPolarHBondContact CE1-O 3.37Å; Y229-P257 PolarHBondContact OH-O 3.39Å; Y229-P257 VanDerWaalsContact OH-O 3.07Å
230L98.1Very high97.8Very high14 Ų1413.4 Ų13.47%0.0737%0.066CC..Hα-helixtrans-63.7-32.5175.6-67.5176.4000112.2L174 T177 I181 L226 G227 S228 L233 L234 P257L174-L230 HydrophobicContact CD1-CB 4.18Å; L174-L230 HydrophobicContact CD1-CD2 3.96Å; T177-L230 HydrophobicContact CG2-CD1 4.05Å; I181-L230 HydrophobicContact CD1-CD1 3.93Å; L226-L230 HydrophobicContact CD1-CD1 4.21Å; L226-L230 HydrophobicContact CD1-CD2 4.47Å; L226-L230 HydrophobicContact CD1-CG 4.06Å; L226-L230 HydrophobicContact CG-CD1 4.12Å; L226-L230 HydrophobicContact CG-CG 4.39Å; L226-L230 WeakPolarHBondContact O-CB 3.38Å; L226-L230 VanDerWaalsContact O-CG 3.25Å; L226-L230 WeakPolarHBondContact O-CG 2.99Å; L226-L230 PolarHBondContact O-N 2.91Å; G227-L230 PolarHBondContact O-N 2.84Å; S228-L230 PolarHBondContact O-N 3.13Å; L230-L233 HydrophobicContact CD2-CD1 4.39Å; L230-L233 PolarHBondContact O-N 2.87Å; L230-L234 WeakPolarHBondContact O-CB 3.37Å; L230-L234 PolarHBondContact O-N 3.23Å; L230-P257 HydrophobicContact CD2-CG 3.87Å
231H98.5Very high97.6Very high20 Ų2013.8 Ų13.89%0.0937%0.072CC..Hα-helixtrans-67.6-41.9173.7179.4-84.4000112S160 S178 G227 S228 Y229 L233 L234 S235S160-H231 PolarHBondContact OG-NE2 3.23Å; S178-H231 PolarHBondContact OG-N 3.26Å; G227-H231 PolarHBondContact O-N 3.47Å; S228-H231 WeakPolarHBondContact O-CB 2.96Å; S228-H231 PolarHBondContact O-N 3.44Å; S228-H231 VanDerWaalsContact O-N 3.13Å; Y229-H231 VanDerWaalsContact C-N 3.27Å; Y229-H231 PolarHBondContact O-N 3.5Å; H231-L233 VanDerWaalsContact C-N 3.3Å; H231-L233 PolarHBondContact O-N 3.01Å; H231-L234 WeakPolarHBondContact O-CB 3.28Å; H231-L234 PolarHBondContact O-N 2.97Å; H231-L234 VanDerWaalsContact O-N 3.16Å; H231-S235 PolarHBondContact O-N 3.44Å
232I98.4Very high97.4Very high2 Ų217.8 Ų17.81%0.019%0.087CC..Hα-helixtrans-60.1-44.2173.7-61.4165.7000109.8F67 L70 F103 S228 Y229 L234 S235 L236F67-I232 HydrophobicContact CD1-CD1 4.06Å; F67-I232 HydrophobicContact CD1-CG2 3.95Å; F67-I232 HydrophobicContact CD2-CG2 4.03Å; F67-I232 HydrophobicContact CE1-CB 4.04Å; F67-I232 HydrophobicContact CE1-CD1 4.35Å; F67-I232 HydrophobicContact CE1-CG2 3.59Å; F67-I232 HydrophobicContact CE2-CG2 3.7Å; F67-I232 HydrophobicContact CG-CG2 4.15Å; F67-I232 HydrophobicContact CZ-CB 4.27Å; F67-I232 HydrophobicContact CZ-CG2 3.48Å; F67-I232 VanDerWaalsContact CZ-CG2 3.48Å; L70-I232 HydrophobicContact CB-CD1 4.1Å; L70-I232 HydrophobicContact CD2-CD1 3.92Å; F103-I232 HydrophobicContact CD1-CG1 4.23Å; F103-I232 HydrophobicContact CE1-CD1 3.74Å; F103-I232 HydrophobicContact CE1-CG1 3.83Å; F103-I232 HydrophobicContact CZ-CD1 3.8Å; F103-I232 HydrophobicContact CZ-CG1 4.09Å; S228-I232 WeakPolarHBondContact O-CG1 2.99Å; S228-I232 PolarHBondContact O-N 3.02Å; Y229-I232 PolarHBondContact O-N 3.39Å; I232-L234 PolarHBondContact O-N 3.38Å; I232-S235 PolarHBondContact O-N 3.23Å; I232-L236 WeakPolarHBondContact O-CB 3.27Å; I232-L236 PolarHBondContact O-N 3.13Å
233L97.4Very high97.3Very high11 Ų1116.9 Ų16.96%0.0588%0.083CC..Hα-helixtrans-61-41.8174.2-70.1-175.5000112.6F67 Y229 L230 H231 L236 Q237 P257 L259F67-L233 HydrophobicContact CZ-CD2 4.01Å; Y229-L233 HydrophobicContact CD1-CD1 4.02Å; Y229-L233 HydrophobicContact CD1-CG 4.26Å; Y229-L233 HydrophobicContact CE1-CD1 3.49Å; Y229-L233 VanDerWaalsContact CE1-CD1 3.49Å; Y229-L233 HydrophobicContact CE1-CD2 4.36Å; Y229-L233 HydrophobicContact CE1-CG 3.86Å; Y229-L233 PolarHBondContact O-N 3.05Å; L230-L233 HydrophobicContact CD2-CD1 4.39Å; L230-L233 PolarHBondContact O-N 2.87Å; H231-L233 VanDerWaalsContact C-N 3.3Å; H231-L233 PolarHBondContact O-N 3.01Å; L233-L236 PolarHBondContact O-N 3.29Å; L233-Q237 WeakPolarHBondContact O-CB 3.45Å; L233-Q237 PolarHBondContact O-N 3.41Å; L233-P257 HydrophobicContact CD1-CB 4.12Å; L233-P257 HydrophobicContact CD1-CG 4.1Å; L233-L259 HydrophobicContact CD2-CB 3.94Å
234L97.8Very high97Very high1 Ų123.3 Ų23.31%0.00511%0.111CC..Hα-helixtrans-58.3-49.9174.517469.8000110.6V164 L171 L174 C175 L230 H231 I232 L236 Q237 I238V164-L234 HydrophobicContact CG1-CD1 4.29Å; L171-L234 HydrophobicContact CB-CD1 3.89Å; L171-L234 HydrophobicContact CD1-CD1 4.25Å; L174-L234 HydrophobicContact CD2-CB 3.97Å; L174-L234 HydrophobicContact CD2-CD1 4.25Å; L174-L234 HydrophobicContact CG-CB 4.16Å; L174-L234 HydrophobicContact CG-CD1 4.39Å; C175-L234 HydrophobicContact CB-CD1 4.18Å; C175-L234 HydrophobicContact CB-CD2 3.73Å; L230-L234 WeakPolarHBondContact O-CB 3.37Å; L230-L234 PolarHBondContact O-N 3.23Å; H231-L234 WeakPolarHBondContact O-CB 3.28Å; H231-L234 PolarHBondContact O-N 2.97Å; H231-L234 VanDerWaalsContact O-N 3.16Å; I232-L234 PolarHBondContact O-N 3.38Å; L234-L236 VanDerWaalsContact C-N 3.34Å; L234-L236 PolarHBondContact O-N 2.95Å; L234-Q237 PolarHBondContact O-N 2.78Å; L234-I238 HydrophobicContact CD1-CD1 4.04Å; L234-I238 HydrophobicContact CD1-CG1 4.39Å; L234-I238 HydrophobicContact CG-CD1 3.82Å; L234-I238 WeakPolarHBondContact O-CD1 3.37Å; L234-I238 WeakPolarHBondContact O-CG1 3.44Å; L234-I238 PolarHBondContact O-N 3.22Å
235S98.2Very high96.6Very high4 Ų425.9 Ų25.93%0.02812%0.12CC..Hα-helixtrans-61.8-42.8180-171.50000111.7Y63 H231 I232 I238 R239Y63-S235 WeakPolarHBondContact CE1-OG 3.46Å; Y63-S235 PolarHBondContact OH-O 3.2Å; Y63-S235 PolarHBondContact OH-OG 3.13Å; H231-S235 PolarHBondContact O-N 3.44Å; I232-S235 PolarHBondContact O-N 3.23Å; S235-I238 PolarHBondContact O-N 3.24Å; S235-R239 PolarHBondContact O-N 2.77Å
236L96.9Very high96Very high4 Ų434.8 Ų34.82%0.02115%0.154CC..Hα-helixtrans-65.7-39.8176.6-173.459.8000112.2L59 Y63 F67 I232 L233 L234 R239 S240 L259L59-L236 HydrophobicContact CD1-CD1 3.9Å; L59-L236 HydrophobicContact CD1-CD2 4.03Å; L59-L236 HydrophobicContact CD1-CG 4.31Å; Y63-L236 HydrophobicContact CD1-CB 4Å; Y63-L236 HydrophobicContact CD1-CD1 3.82Å; Y63-L236 HydrophobicContact CD1-CG 4.5Å; Y63-L236 HydrophobicContact CD2-CD1 3.74Å; Y63-L236 HydrophobicContact CE1-CB 4.13Å; Y63-L236 HydrophobicContact CE1-CD1 4.24Å; Y63-L236 HydrophobicContact CE2-CD1 4.19Å; Y63-L236 HydrophobicContact CG-CD1 3.56Å; F67-L236 HydrophobicContact CE2-CD2 4.38Å; I232-L236 WeakPolarHBondContact O-CB 3.27Å; I232-L236 PolarHBondContact O-N 3.13Å; L233-L236 PolarHBondContact O-N 3.29Å; L234-L236 VanDerWaalsContact C-N 3.34Å; L234-L236 PolarHBondContact O-N 2.95Å; L236-R239 PolarHBondContact O-N 3.17Å; L236-S240 VanDerWaalsContact O-CB 3.28Å; L236-S240 WeakPolarHBondContact O-CB 3.49Å; L236-S240 PolarHBondContact O-N 3.43Å; L236-S240 PolarHBondContact O-OG 3.42Å; L236-L259 HydrophobicContact CB-CD1 4.5Å; L236-L259 HydrophobicContact CD2-CB 4.36Å; L236-L259 HydrophobicContact CD2-CD1 4.45Å; L236-L259 HydrophobicContact CD2-CD2 3.95Å; L236-L259 HydrophobicContact CG-CD1 4.29Å; L236-L259 HydrophobicContact CG-CD2 4.11Å
237Q95.9Very high95.5Very high31 Ų3134.1 Ų34.115%0.14515%0.152CC..Hα-helixtrans-65.1-43.5176-17873.211.400111.5L171 L233 L234 R239 S240 T241 P247 L259L171-Q237 HydrophobicContact CD1-CG 4.14Å; L171-Q237 HydrophobicContact CD2-CG 3.55Å; L233-Q237 WeakPolarHBondContact O-CB 3.45Å; L233-Q237 PolarHBondContact O-N 3.41Å; L234-Q237 PolarHBondContact O-N 2.78Å; Q237-R239 VanDerWaalsContact C-N 3.34Å; Q237-S240 PolarHBondContact O-N 2.79Å; Q237-T241 WeakPolarHBondContact O-CB 3.42Å; Q237-T241 PolarHBondContact O-N 3.49Å; Q237-T241 PolarHBondContact O-OG1 3.34Å; Q237-P247 VanDerWaalsContact CD-CG 3.45Å; Q237-P247 VanDerWaalsContact NE2-CG 3.27Å; Q237-L259 HydrophobicContact CB-CD1 3.89Å
238I96.7Very high94.9Very high0 Ų039.1 Ų39.10%017%0.173CC..Hα-helixtrans-57.6-50174.7-69.9161.2000109.4L107 C110 F111 I163 Y168 L171 L234 S235 T241 Y242L107-I238 HydrophobicContact CD1-CD1 3.96Å; C110-I238 HydrophobicContact CB-CG2 3.95Å; C110-I238 VanDerWaalsContact SG-CG2 3.57Å; F111-I238 HydrophobicContact CE1-CG2 3.82Å; F111-I238 HydrophobicContact CZ-CG2 3.88Å; I163-I238 HydrophobicContact CB-CD1 4.46Å; I163-I238 HydrophobicContact CD1-CD1 4.17Å; I163-I238 HydrophobicContact CG2-CD1 3.76Å; I163-I238 HydrophobicContact CG2-CG1 4.02Å; I163-I238 HydrophobicContact CG2-CG2 4.24Å; Y168-I238 HydrophobicContact CD2-CB 4.44Å; Y168-I238 HydrophobicContact CD2-CG1 4.25Å; Y168-I238 HydrophobicContact CD2-CG2 4.08Å; Y168-I238 HydrophobicContact CE2-CG2 3.9Å; L171-I238 HydrophobicContact CD1-CG1 3.58Å; L234-I238 HydrophobicContact CD1-CD1 4.04Å; L234-I238 HydrophobicContact CD1-CG1 4.39Å; L234-I238 HydrophobicContact CG-CD1 3.82Å; L234-I238 WeakPolarHBondContact O-CD1 3.37Å; L234-I238 WeakPolarHBondContact O-CG1 3.44Å; L234-I238 PolarHBondContact O-N 3.22Å; S235-I238 PolarHBondContact O-N 3.24Å; I238-T241 PolarHBondContact O-N 2.91Å; I238-Y242 PolarHBondContact O-N 3.15Å
239R96.6Very high94.2Very high5 Ų542.6 Ų42.62%0.01919%0.194CC..Hα-helixtrans-62.9-47.2179.4177.258.7171.4173.5-1.4112.9E60 R62 Y63 C110 K112 S235 L236 Q237 T241 Y242 L243E60-R239 VanDerWaalsContact CD-NE 3.31Å; E60-R239 IonicContact OE1-CZ 3.54Å; E60-R239 VanDerWaalsContact OE1-CZ 3.3Å; E60-R239 IonicContact OE1-NE 3.67Å; E60-R239 PolarHBondContact OE1-NE 3.42Å; E60-R239 VanDerWaalsContact OE1-NE 3.11Å; E60-R239 IonicContact OE1-NH2 2.66Å; E60-R239 PolarHBondContact OE1-NH2 3.33Å; E60-R239 WeakPolarHBondContact OE2-CG 3.21Å; E60-R239 IonicContact OE2-CZ 2.7Å; E60-R239 IonicContact OE2-NE 3.3Å; E60-R239 PolarHBondContact OE2-NE 3.18Å; E60-R239 IonicContact OE2-NH2 3.83Å; R62-R239 VanDerWaalsContact NH2-CD 3.35Å; Y63-R239 HydrophobicContact CE2-CB 3.98Å; Y63-R239 HydrophobicContact CE2-CG 3.81Å; Y63-R239 WeakPolarHBondContact OH-CB 3.48Å; C110-R239 WeakPolarHBondContact O-CD 3.29Å; C110-R239 PolarHBondContact O-NH1 2.91Å; K112-R239 PolarHBondContact O-NH1 3.43Å; K112-R239 PolarHBondContact O-NH2 3.21Å; S235-R239 PolarHBondContact O-N 2.77Å; L236-R239 PolarHBondContact O-N 3.17Å; Q237-R239 VanDerWaalsContact C-N 3.34Å; R239-T241 PolarHBondContact O-N 3.42Å; R239-Y242 WeakPolarHBondContact O-CB 3.28Å; R239-Y242 PolarHBondContact O-N 3.42Å; R239-Y242 VanDerWaalsContact O-N 3.16Å; R239-L243 HydrophobicContact CG-CD1 4.24Å; R239-L243 PolarHBondContact O-N 2.04Å
240S94.9Very high93.7Very high1 Ų147.9 Ų47.91%0.00722%0.217CC..Hα-helixtrans-59.4-40178.9-60.70000111L236 Q237 L243 K244 Y245L236-S240 VanDerWaalsContact O-CB 3.28Å; L236-S240 WeakPolarHBondContact O-CB 3.49Å; L236-S240 PolarHBondContact O-N 3.43Å; L236-S240 PolarHBondContact O-OG 3.42Å; Q237-S240 PolarHBondContact O-N 2.79Å; S240-L243 PolarHBondContact O-N 3.45Å; S240-K244 PolarHBondContact O-N 3.41Å; S240-Y245 PolarHBondContact O-N 3.19Å
241T94Very high93.2Very high37 Ų3753 Ų5323%0.22724%0.239CC..Hα-helixtrans-65.8-43.5176.3-53.70000111.5Y168 W170 Q237 I238 R239 L243 K244Y168-T241 HydrophobicContact CE1-CG2 4.23Å; Y168-T241 HydrophobicContact CE2-CG2 4.35Å; W170-T241 HydrophobicContact CZ2-CG2 3.92Å; Q237-T241 WeakPolarHBondContact O-CB 3.42Å; Q237-T241 PolarHBondContact O-N 3.49Å; Q237-T241 PolarHBondContact O-OG1 3.34Å; I238-T241 PolarHBondContact O-N 2.91Å; R239-T241 PolarHBondContact O-N 3.42Å; T241-L243 VanDerWaalsContact C-N 3.34Å; T241-L243 PolarHBondContact O-N 3.34Å; T241-K244 PolarHBondContact O-N 2.94Å
242Y95.7Very high92.4Very high89 Ų8955.2 Ų55.235%0.34925%0.251SS..Hα-helixtrans-61-41.9176.3175.6-95.2000112.4F111 K112 I238 R239 K244F111-Y242 HydrophobicContact CB-CD2 4.22Å; F111-Y242 HydrophobicContact CB-CE2 4.09Å; F111-Y242 AromaticContact CD1-CD2 3.64Å; F111-Y242 HydrophobicContact CD1-CD2 3.64Å; F111-Y242 HydrophobicContact CD1-CE2 4.31Å; F111-Y242 HydrophobicContact CD1-CG 4.06Å; F111-Y242 HydrophobicContact CG-CD2 4.42Å; F111-Y242 PolarHBondContact O-OH 3.5Å; K112-Y242 WeakPolarHBondContact O-CE1 3.37Å; I238-Y242 PolarHBondContact O-N 3.15Å; R239-Y242 WeakPolarHBondContact O-CB 3.28Å; R239-Y242 PolarHBondContact O-N 3.42Å; R239-Y242 VanDerWaalsContact O-N 3.16Å; Y242-K244 PolarHBondContact O-N 3Å
243L94.8Very high91.7Very high30 Ų3061.1 Ų61.116%0.15729%0.291CS..THydrogen-bonded Turntrans-76.53.5175.3-64.9-177.9000113.8E114 R239 S240 T241 Y245E114-L243 HydrophobicContact CB-CD2 3.95Å; E114-L243 HydrophobicContact CG-CD1 4.42Å; E114-L243 HydrophobicContact CG-CD2 4.4Å; R239-L243 HydrophobicContact CG-CD1 4.24Å; R239-L243 PolarHBondContact O-N 2.04Å; S240-L243 PolarHBondContact O-N 3.45Å; T241-L243 VanDerWaalsContact C-N 3.34Å; T241-L243 PolarHBondContact O-N 3.34Å; L243-Y245 HydrophobicContact CB-CD1 4.49Å; L243-Y245 HydrophobicContact CB-CD2 4.28Å; L243-Y245 HydrophobicContact CB-CE1 4.45Å; L243-Y245 HydrophobicContact CB-CE2 4.25Å; L243-Y245 HydrophobicContact CB-CG 4.4Å; L243-Y245 HydrophobicContact CD1-CE2 3.99Å; L243-Y245 PolarHBondContact O-N 3.36Å
244K92.8Very high90.9Very high177 Ų17763.5 Ų63.577%0.7732%0.318SS*.THydrogen-bonded Turntrans59.825-179.1-51.2178.4-178.5176.30113.9S240 T241 Y242S240-K244 PolarHBondContact O-N 3.41Å; T241-K244 PolarHBondContact O-N 2.94Å; Y242-K244 PolarHBondContact O-N 3Å
245Y90.2Very high90.1Very high62 Ų6268.9 Ų68.924%0.24335%0.35CS..  trans-70.6159.5165.2-62.2-20.4000110.2L59 E114 S240 L243 P247 I261L59-Y245 HydrophobicContact CD2-CD2 4.07Å; L59-Y245 HydrophobicContact CD2-CE2 3.95Å; E114-Y245 PolarHBondContact OE1-OH 2.87Å; S240-Y245 PolarHBondContact O-N 3.19Å; L243-Y245 HydrophobicContact CB-CD1 4.49Å; L243-Y245 HydrophobicContact CB-CD2 4.28Å; L243-Y245 HydrophobicContact CB-CE1 4.45Å; L243-Y245 HydrophobicContact CB-CE2 4.25Å; L243-Y245 HydrophobicContact CB-CG 4.4Å; L243-Y245 HydrophobicContact CD1-CE2 3.99Å; L243-Y245 PolarHBondContact O-N 3.36Å; Y245-P247 WeakPolarHBondContact O-CD 3.49Å; Y245-I261 HydrophobicContact CD2-CD1 4.43Å; Y245-I261 HydrophobicContact CG-CG2 4.34Å
246R86.3Confident89.6Confident187 Ų18770.6 Ų70.671%0.70636%0.356SS*.  trans-106.683.5176.6-67.7-173.1-177.9-1791.5109.6E262R246-E262 HydrophobicContact CB-CB 4.33Å; R246-E262 PolarHBondContact O-N 3.35Å; R246-E262 VanDerWaalsContact O-N 3.1Å
247P86.3Confident89.2Confident25 Ų2571.3 Ų71.316%0.16236%0.361CS..EExtended strand (participates in β ladder)trans-72.7135.5176.931.5-36.9000110.6Q237 Y245 L259 H260 I261Q237-P247 VanDerWaalsContact CD-CG 3.45Å; Q237-P247 VanDerWaalsContact NE2-CG 3.27Å; Y245-P247 WeakPolarHBondContact O-CD 3.49Å; P247-L259 HydrophobicContact CB-CD1 3.99Å; P247-L259 HydrophobicContact CB-CD2 3.87Å; P247-L259 HydrophobicContact CB-CG 3.88Å; P247-H260 CarbonylContact C-O 3.56Å; P247-H260 WeakPolarHBondContact CA-O 3.34Å; P247-I261 HydrophobicContact CB-CD1 4.07Å
248K85.6Confident88.8Confident107 Ų10770 Ų7047%0.46536%0.356SS..EExtended strand (participates in β ladder)trans-118.4131.6168.5-78.7-170.3172.6173.20109.7H260 E262K248-H260 PolarHBondContact N-O 2.86Å; K248-H260 PolarHBondContact O-N 2.95Å; K248-E262 HydrophobicContact CD-CG 3.89Å; K248-E262 VanDerWaalsContact CD-OE1 3.23Å; K248-E262 WeakPolarHBondContact CD-OE1 3.37Å; K248-E262 WeakPolarHBondContact CE-OE1 3.44Å; K248-E262 HydrophobicContact CG-CG 4.1Å; K248-E262 IonicContact NZ-OE1 2.73Å; K248-E262 PolarHBondContact NZ-OE1 3.23Å; K248-E262 IonicContact NZ-OE2 3.21Å
249V85.3Confident88.4Confident87 Ų8770.5 Ų70.553%0.52736%0.358SS..EExtended strand (participates in β ladder)trans-75.9124.8169.9-177.20000108.1F251 P257 T258V249-F251 HydrophobicContact CG1-CE2 4.07Å; V249-F251 HydrophobicContact CG1-CZ 4.33Å; V249-P257 HydrophobicContact CG1-CB 4.17Å; V249-T258 CarbonylContact C-O 3.57Å; V249-T258 WeakPolarHBondContact CA-O 3.48Å
250K87.1Confident87.9Confident112 Ų11271.8 Ų71.849%0.48736%0.364SS..EExtended strand (participates in β ladder)trans-113.5158.1167.4-61.6-168.7-174.4170.70108.8P257 T258 H260K250-P257 CarbonylContact O-C 3.54Å; K250-P257 WeakPolarHBondContact O-CA 3.31Å; K250-T258 PolarHBondContact N-O 3.05Å; K250-T258 PolarHBondContact O-N 3.35Å; K250-T258 PolarHBondContact O-OG1 2.7Å; K250-H260 HydrophobicContact CD-CB 4.39Å
251F87.1Confident87.4Confident121 Ų12173.5 Ų73.553%0.53137%0.373SS..EExtended strand (participates in β ladder)trans-112.6112.6176.5-72.8-92.3000109.6V249 C253 G254 W256 P257V249-F251 HydrophobicContact CG1-CE2 4.07Å; V249-F251 HydrophobicContact CG1-CZ 4.33Å; F251-C253 PolarHBondContact O-N 3.15Å; F251-G254 PolarHBondContact O-N 3.33Å; F251-W256 CarbonylContact C-O 3.54Å; F251-W256 VanDerWaalsContact CA-O 3.31Å; F251-W256 WeakPolarHBondContact CA-O 3.37Å; F251-P257 HydrophobicContact CD1-CB 4.39Å; F251-P257 HydrophobicContact CE1-CB 4.03Å
252L83.2Confident86.7Confident67 Ų6775 Ų7535%0.35138%0.377SS..EExtended strand (participates in β ladder)trans-66.5126.1171.3-177.169000108.6Y49 G254 V255 W256 T258Y49-L252 HydrophobicContact CD1-CD2 4.31Å; Y49-L252 HydrophobicContact CD2-CD2 4.05Å; Y49-L252 HydrophobicContact CE1-CD2 4.39Å; Y49-L252 HydrophobicContact CE2-CD1 4.22Å; Y49-L252 HydrophobicContact CE2-CD2 4.07Å; Y49-L252 HydrophobicContact CG-CD2 4.18Å; L252-G254 PolarHBondContact O-N 3.46Å; L252-V255 PolarHBondContact O-N 2.92Å; L252-W256 HydrophobicContact CB-CB 4.29Å; L252-W256 PolarHBondContact N-O 3.21Å; L252-W256 PolarHBondContact O-N 3.28Å; L252-T258 HydrophobicContact CB-CG2 4.31Å
253C83.2Confident85.4Confident125 Ų12576.5 Ų76.585%0.84540%0.398SS*.THydrogen-bonded Turntrans52.523.8-174.1-59.70000114F251 V255F251-C253 PolarHBondContact O-N 3.15Å; C253-V255 PolarHBondContact O-N 2.96Å
254G80.8Confident83.7Confident61 Ų6182.2 Ų82.263%0.62942%0.424SS*.THydrogen-bonded Turntrans74.41.9-178.200000115.5F251 L252F251-G254 PolarHBondContact O-N 3.33Å; L252-G254 PolarHBondContact O-N 3.46Å
255V81.4Confident81.8Confident114 Ų11483.4 Ų83.469%0.69143%0.429SS*.THydrogen-bonded Turntrans-122.8-44.6-172.4-177.50000112.4L252 C253L252-V255 PolarHBondContact O-N 2.92Å; C253-V255 PolarHBondContact O-N 2.96Å
256W86.9Confident79.7Confident40 Ų4087.2 Ų87.215%0.15246%0.459CS..EExtended strand (participates in β ladder)trans-97.8120.4-170.1-165-88000112.3I42 P46 L226 Y229 F251 L252I42-W256 HydrophobicContact CD1-CH2 3.91Å; I42-W256 HydrophobicContact CD1-CZ3 3.8Å; I42-W256 HydrophobicContact CG1-CH2 3.48Å; I42-W256 VanDerWaalsContact CG1-CH2 3.48Å; I42-W256 HydrophobicContact CG1-CZ3 3.67Å; P46-W256 HydrophobicContact CB-CD2 3.79Å; P46-W256 HydrophobicContact CB-CE3 4.43Å; P46-W256 HydrophobicContact CB-CG 4.3Å; P46-W256 HydrophobicContact CB-CH2 3.97Å; P46-W256 HydrophobicContact CB-CZ2 3.24Å; P46-W256 VanDerWaalsContact CB-NE1 3.28Å; P46-W256 HydrophobicContact CG-CD2 4.09Å; P46-W256 HydrophobicContact CG-CE3 4.25Å; P46-W256 HydrophobicContact CG-CH2 3.8Å; P46-W256 HydrophobicContact CG-CZ2 3.62Å; P46-W256 HydrophobicContact CG-CZ3 4.12Å; L226-W256 HydrophobicContact CD1-CH2 3.71Å; L226-W256 HydrophobicContact CD1-CZ2 4.24Å; L226-W256 HydrophobicContact CD1-CZ3 4.02Å; Y229-W256 AromaticContact CD1-CE2 3.81Å; Y229-W256 AromaticContact CD1-CZ2 3.56Å; Y229-W256 HydrophobicContact CD1-CZ2 3.56Å; Y229-W256 AromaticContact CD1-NE1 3.66Å; Y229-W256 HydrophobicContact CD2-CZ2 4.05Å; Y229-W256 AromaticContact CE1-CD1 3.95Å; Y229-W256 AromaticContact CE1-CE2 3.66Å; Y229-W256 AromaticContact CE1-CZ2 3.92Å; Y229-W256 HydrophobicContact CE1-CZ2 3.92Å; Y229-W256 AromaticContact CE1-NE1 3.02Å; Y229-W256 HydrophobicContact CE2-CZ2 4.34Å; Y229-W256 AromaticContact CE2-NE1 3.64Å; Y229-W256 AromaticContact CG-CZ2 3.64Å; Y229-W256 HydrophobicContact CG-CZ2 3.64Å; Y229-W256 AromaticContact CZ-CD1 3.93Å; Y229-W256 AromaticContact CZ-CE2 3.95Å; Y229-W256 AromaticContact CZ-NE1 3.03Å; Y229-W256 PolarHBondContact OH-NE1 3.45Å; F251-W256 CarbonylContact C-O 3.54Å; F251-W256 VanDerWaalsContact CA-O 3.31Å; F251-W256 WeakPolarHBondContact CA-O 3.37Å; L252-W256 HydrophobicContact CB-CB 4.29Å; L252-W256 PolarHBondContact N-O 3.21Å; L252-W256 PolarHBondContact O-N 3.28Å
257P89.1Confident77.4Confident20 Ų2087.2 Ų87.213%0.1349%0.488CS..EExtended strand (participates in β ladder)trans-72.5136.2-176.429.5-33.3000111.1Y229 L230 L233 V249 K250 F251Y229-P257 HydrophobicContact CE1-CG 4.4Å; Y229-P257 VanDerWaalsContact CE1-O 3.22Å; Y229-P257 WeakPolarHBondContact CE1-O 3.37Å; Y229-P257 PolarHBondContact OH-O 3.39Å; Y229-P257 VanDerWaalsContact OH-O 3.07Å; L230-P257 HydrophobicContact CD2-CG 3.87Å; L233-P257 HydrophobicContact CD1-CB 4.12Å; L233-P257 HydrophobicContact CD1-CG 4.1Å; V249-P257 HydrophobicContact CG1-CB 4.17Å; K250-P257 CarbonylContact O-C 3.54Å; K250-P257 WeakPolarHBondContact O-CA 3.31Å; F251-P257 HydrophobicContact CD1-CB 4.39Å; F251-P257 HydrophobicContact CE1-CB 4.03Å
258T88.1Confident77Confident4 Ų490.3 Ų90.33%0.02550%0.504CS..EExtended strand (participates in β ladder)trans-134.8147.5174.365.20000109.1Y49 V249 K250 L252 H260Y49-T258 HydrophobicContact CD1-CG2 3.91Å; Y49-T258 HydrophobicContact CE1-CG2 3.61Å; V249-T258 CarbonylContact C-O 3.57Å; V249-T258 WeakPolarHBondContact CA-O 3.48Å; K250-T258 PolarHBondContact N-O 3.05Å; K250-T258 PolarHBondContact O-N 3.35Å; K250-T258 PolarHBondContact O-OG1 2.7Å; L252-T258 HydrophobicContact CB-CG2 4.31Å; T258-H260 PolarHBondContact OG1-CD2 3.14Å; T258-H260 PolarHBondContact OG1-NE2 2.92Å
259L86.9Confident76.5Confident10 Ų1089.4 Ų89.45%0.05251%0.506CS..EExtended strand (participates in β ladder)trans-98.9126177.3-171.7149.1000108.9L59 L233 L236 Q237 P247 I261L59-L259 HydrophobicContact CD1-CD2 4.5Å; L233-L259 HydrophobicContact CD2-CB 3.94Å; L236-L259 HydrophobicContact CB-CD1 4.5Å; L236-L259 HydrophobicContact CD2-CB 4.36Å; L236-L259 HydrophobicContact CD2-CD1 4.45Å; L236-L259 HydrophobicContact CD2-CD2 3.95Å; L236-L259 HydrophobicContact CG-CD1 4.29Å; L236-L259 HydrophobicContact CG-CD2 4.11Å; Q237-L259 HydrophobicContact CB-CD1 3.89Å; P247-L259 HydrophobicContact CB-CD1 3.99Å; P247-L259 HydrophobicContact CB-CD2 3.87Å; P247-L259 HydrophobicContact CB-CG 3.88Å; L259-I261 HydrophobicContact CD2-CD1 3.64Å; L259-I261 HydrophobicContact CD2-CG1 4.45Å
260H86.1Confident76.1Confident32 Ų3289.6 Ų89.615%0.14851%0.505CS..EExtended strand (participates in β ladder)trans-118.8137.3174.7-74.8-99.4000110.1Q53 D57 P247 K248 K250 T258Q53-H260 PolarHBondContact NE2-CE1 2.9Å; Q53-H260 PolarHBondContact NE2-ND1 3.12Å; Q53-H260 PolarHBondContact OE1-CE1 3.28Å; Q53-H260 PolarHBondContact OE1-NE2 2.94Å; D57-H260 WeakPolarHBondContact OD2-CA 3.44Å; P247-H260 CarbonylContact C-O 3.56Å; P247-H260 WeakPolarHBondContact CA-O 3.34Å; K248-H260 PolarHBondContact N-O 2.86Å; K248-H260 PolarHBondContact O-N 2.95Å; K250-H260 HydrophobicContact CD-CB 4.39Å; T258-H260 PolarHBondContact OG1-CD2 3.14Å; T258-H260 PolarHBondContact OG1-NE2 2.92Å
261I84.8Confident75.4Confident36 Ų3688.2 Ų88.219%0.18551%0.506CS..EExtended strand (participates in β ladder)trans-87.4127.6171.3-53.7-56.7000109.7D57 L59 Y245 P247 L259D57-I261 HydrophobicContact CB-CG1 4.41Å; D57-I261 PolarHBondContact OD2-N 3.35Å; L59-I261 HydrophobicContact CD1-CD1 4.32Å; L59-I261 HydrophobicContact CD1-CG1 3.93Å; L59-I261 HydrophobicContact CD2-CD1 4.24Å; L59-I261 HydrophobicContact CD2-CG1 3.76Å; L59-I261 HydrophobicContact CG-CG1 4.17Å; Y245-I261 HydrophobicContact CD2-CD1 4.43Å; Y245-I261 HydrophobicContact CG-CG2 4.34Å; P247-I261 HydrophobicContact CB-CD1 4.07Å; L259-I261 HydrophobicContact CD2-CD1 3.64Å; L259-I261 HydrophobicContact CD2-CG1 4.45Å
262E79.1Confident74.7Confident69 Ų6986.2 Ų86.232%0.32250%0.504SS..PPolyproline II helixtrans-68.7137.1169.9-66.5-163.3127.200110.7R246 K248 Q264R246-E262 HydrophobicContact CB-CB 4.33Å; R246-E262 PolarHBondContact O-N 3.35Å; R246-E262 VanDerWaalsContact O-N 3.1Å; K248-E262 HydrophobicContact CD-CG 3.89Å; K248-E262 VanDerWaalsContact CD-OE1 3.23Å; K248-E262 WeakPolarHBondContact CD-OE1 3.37Å; K248-E262 WeakPolarHBondContact CE-OE1 3.44Å; K248-E262 HydrophobicContact CG-CG 4.1Å; K248-E262 IonicContact NZ-OE1 2.73Å; K248-E262 PolarHBondContact NZ-OE1 3.23Å; K248-E262 IonicContact NZ-OE2 3.21Å; E262-Q264 PolarHBondContact O-N 3.13Å
263P68.8Low74.1Confident121 Ų12187.5 Ų87.579%0.78651%0.514SS*.PPolyproline II helixtrans-56.8130.8171.6-38.2000109.2K265P263-K265 PolarHBondContact O-N 3.29Å; P263-K265 VanDerWaalsContact O-N 3.15Å
264Q59.7Low73.5Confident149 Ų14984.8 Ų84.870%0.69649%0.491SS*.PPolyproline II helixtrans-60.8121.3168.9-76.9-176.4-10.900107.5E262 T266E262-Q264 PolarHBondContact O-N 3.13Å; Q264-T266 PolarHBondContact O-N 2.73Å
265K51.8Low72.9Confident202 Ų20286.6 Ų86.688%0.87848%0.48SS*.  trans-59.5108.8168.1-74.6-173.1-179.8-174.70106.4P263 S267P263-K265 PolarHBondContact O-N 3.29Å; P263-K265 VanDerWaalsContact O-N 3.15Å; K265-S267 PolarHBondContact O-N 3Å
266T46.5Very low72.2Confident142 Ų14284.3 Ų84.387%0.87146%0.463SS*.  trans-60.9105165.445.50000106.7Q264Q264-T266 PolarHBondContact O-N 2.73Å
267S38.6Very low70.9Confident187 Ų18788.4 Ų88.4100%1.30849%0.491SS*.  trans-80.50167.8620000109.9K265K265-S267 PolarHBondContact O-N 3Å

Retrieved 267 of 267 residues in 127.6 ms (Link to these results)

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