A0A096LTN2_POEFO Loading...

Alkaline ceramidase

Hydrolyzes the sphingolipid ceramide into sphingosine and free fatty acid.

AlphaFold DB , UniProt , Accession A0A096LTN2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 266 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
1M52.8Low84.7Confident231 Ų23198.8 Ų98.8100%1.13853%0.526SS*.  045.70-66.8-169.9-86.300111.3
2A54.4Low85.1Confident99 Ų9991.5 Ų91.582%0.81849%0.487SS*.  trans-102.9-0.6-17200000114.9
3N81.3Confident85.7Confident116 Ų11690.1 Ų90.162%0.6248%0.479SS*.  trans-119.98.2-171.9-86.92000115.6F5 A6 S9N3-F5 PolarHBondContact O-N 3.02Å; N3-A6 HydrophobicContact CB-CB 4.13Å; N3-A6 VanDerWaalsContact O-CB 3.3Å; N3-A6 WeakPolarHBondContact O-CB 3.4Å; N3-A6 PolarHBondContact O-N 3.31Å; N3-S9 WeakPolarHBondContact O-CB 3.39Å; N3-S9 PolarHBondContact O-OG 2.77Å
4V89.6Confident86.2Confident57 Ų5785.5 Ų85.535%0.34545%0.452SS..THydrogen-bonded Turntrans-68.2-20-175.6-60.50000114.3S9 F82 V83V4-S9 PolarHBondContact O-OG 3.34Å; V4-F82 HydrophobicContact CB-CB 4.4Å; V4-F82 HydrophobicContact CB-CD1 4.14Å; V4-F82 HydrophobicContact CG1-CD1 4.26Å; V4-F82 PolarHBondContact O-N 3.28Å; V4-V83 HydrophobicContact CB-CG2 4.07Å; V4-V83 HydrophobicContact CG2-CG2 3.9Å; V4-V83 WeakPolarHBondContact O-CG2 3.33Å; V4-V83 PolarHBondContact O-N 2.88Å; V4-V83 VanDerWaalsContact O-N 3.08Å
5F92.8Very high86.8Confident134 Ų13480 Ų8059%0.58842%0.423SS*.THydrogen-bonded Turntrans-99.1-6.5172.9-68-86.3000112.8N3 V83N3-F5 PolarHBondContact O-N 3.02Å; F5-V83 HydrophobicContact CD1-CB 3.98Å; F5-V83 HydrophobicContact CD1-CG1 4.09Å; F5-V83 HydrophobicContact CD1-CG2 3.91Å; F5-V83 HydrophobicContact CD2-CG2 4.23Å; F5-V83 HydrophobicContact CE1-CB 3.95Å; F5-V83 HydrophobicContact CE1-CG1 3.63Å; F5-V83 HydrophobicContact CE1-CG2 3.77Å; F5-V83 HydrophobicContact CE2-CG2 4.07Å; F5-V83 HydrophobicContact CG-CG2 4.15Å; F5-V83 HydrophobicContact CZ-CB 4.49Å; F5-V83 HydrophobicContact CZ-CG1 4.24Å; F5-V83 HydrophobicContact CZ-CG2 3.84Å
6A94Very high87.3Confident35 Ų3575.3 Ų75.329%0.28940%0.398SS..SBendtrans-66.6150.9179.900000109.6N3 S9 S81N3-A6 HydrophobicContact CB-CB 4.13Å; N3-A6 VanDerWaalsContact O-CB 3.3Å; N3-A6 WeakPolarHBondContact O-CB 3.4Å; N3-A6 PolarHBondContact O-N 3.31Å; A6-S9 VanDerWaalsContact O-CB 3.29Å; A6-S9 WeakPolarHBondContact O-CB 3.45Å; A6-S9 PolarHBondContact O-N 3.41Å; A6-S9 PolarHBondContact O-OG 2.84Å; A6-S81 WeakPolarHBondContact O-CB 3.36Å
7Y95.3Very high87.8Confident98 Ų9874.5 Ų74.538%0.38439%0.394SS..THydrogen-bonded Turntrans-60.2143.7173.3-82.8-128.7000109.3S9 V26 M78 T79Y7-S9 PolarHBondContact O-N 2.94Å; Y7-S9 VanDerWaalsContact O-N 3.1Å; Y7-V26 HydrophobicContact CD1-CG2 3.8Å; Y7-V26 HydrophobicContact CE1-CG2 4.32Å; Y7-M78 VanDerWaalsContact OH-CE 3.25Å; Y7-M78 WeakPolarHBondContact OH-CE 3.45Å; Y7-T79 CarbonylContact C-O 3.07Å; Y7-T79 WeakPolarHBondContact CA-O 3.02Å; Y7-T79 HydrophobicContact CD2-CG2 4.32Å; Y7-T79 HydrophobicContact CE1-CG2 4.25Å; Y7-T79 HydrophobicContact CE2-CG2 3.76Å
8E95.5Very high88.2Confident94 Ų9473 Ų7344%0.43939%0.386SS..THydrogen-bonded Turntrans56.627.9178-60.1166.289.200113.4S10 Y19 V26 T79 L80E8-S10 VanDerWaalsContact C-N 3.33Å; E8-Y19 VanDerWaalsContact OE2-CE2 3.22Å; E8-Y19 WeakPolarHBondContact OE2-CE2 3.46Å; E8-Y19 PolarHBondContact OE2-OH 2.99Å; E8-V26 HydrophobicContact CG-CG1 4.29Å; E8-V26 HydrophobicContact CG-CG2 4.31Å; E8-T79 PolarHBondContact N-O 3.46Å; E8-L80 CarbonylContact C-O 3.43Å; E8-L80 VanDerWaalsContact CA-O 3.26Å; E8-L80 WeakPolarHBondContact CA-O 3.46Å; E8-L80 HydrophobicContact CG-CB 4.33Å; E8-L80 PolarHBondContact N-O 3.27Å
9S94.6Very high88.7Confident36 Ų3673.2 Ų73.225%0.25238%0.382SS..  trans-82.3-11.7174.557.70000113.7N3 V4 A6 Y7 L80 S81 F82N3-S9 WeakPolarHBondContact O-CB 3.39Å; N3-S9 PolarHBondContact O-OG 2.77Å; V4-S9 PolarHBondContact O-OG 3.34Å; A6-S9 VanDerWaalsContact O-CB 3.29Å; A6-S9 WeakPolarHBondContact O-CB 3.45Å; A6-S9 PolarHBondContact O-N 3.41Å; A6-S9 PolarHBondContact O-OG 2.84Å; Y7-S9 PolarHBondContact O-N 2.94Å; Y7-S9 VanDerWaalsContact O-N 3.1Å; S9-L80 PolarHBondContact N-O 3.49Å; S9-L80 VanDerWaalsContact N-O 3.13Å; S9-S81 WeakPolarHBondContact OG-CA 3.49Å; S9-F82 PolarHBondContact OG-N 3.26Å
10S92.4Very high89Confident15 Ų1576.2 Ų76.211%0.10539%0.388CS..SBendtrans-70.5139.7170.9174.60000110.7E8 L12 L80 Q85E8-S10 VanDerWaalsContact C-N 3.33Å; S10-L12 PolarHBondContact O-N 2.98Å; S10-L12 WeakPolarHBondContact OG-CA 3.38Å; S10-L12 WeakPolarHBondContact OG-CB 3.38Å; S10-L12 PolarHBondContact OG-N 2.9Å; S10-L12 PolarHBondContact OG-O 3.07Å; S10-L80 WeakPolarHBondContact CB-O 3.32Å; S10-L80 PolarHBondContact N-O 2.92Å; S10-Q85 PolarHBondContact OG-OE1 2.96Å
11E89.3Confident89.2Confident172 Ų17277.5 Ų77.580%0.80439%0.389SS*.SBendtrans-75.5-12.8167.7-63.7-176.5170.300112.3
12L89.6Confident91.2Very high11 Ų1168.1 Ų68.16%0.05835%0.346CS..  trans-94.9120.1178.6-164.7156.6000109.8S10 W14 F76S10-L12 PolarHBondContact O-N 2.98Å; S10-L12 WeakPolarHBondContact OG-CA 3.38Å; S10-L12 WeakPolarHBondContact OG-CB 3.38Å; S10-L12 PolarHBondContact OG-N 2.9Å; S10-L12 PolarHBondContact OG-O 3.07Å; L12-W14 HydrophobicContact CD1-CZ2 4.39Å; L12-W14 HydrophobicContact CD2-CD2 4.05Å; L12-W14 HydrophobicContact CD2-CG 4.27Å; L12-W14 HydrophobicContact CD2-CH2 4.46Å; L12-W14 HydrophobicContact CD2-CZ2 3.62Å; L12-F76 HydrophobicContact CD2-CE1 4.24Å; L12-F76 HydrophobicContact CD2-CZ 3.99Å
13D92.3Very high93Very high73 Ų7371.3 Ų71.339%0.3934%0.344SS..  trans-128.1135.6174.1-167.70.1000108.8N18 L80 R190D13-N18 PolarHBondContact OD1-OD1 2.94Å; D13-N18 PolarHBondContact OD2-ND2 3.21Å; D13-L80 HydrophobicContact CB-CD1 4.38Å; D13-L80 WeakPolarHBondContact OD1-CD1 3.48Å; D13-R190 PolarHBondContact O-NH1 2.88Å
14W93.6Very high93.7Very high26 Ų2672 Ų7210%0.09834%0.343CS..  trans-91-177.5-180-61.592000111.4L12 E16 E27 F76 H77 W186 H205L12-W14 HydrophobicContact CD1-CZ2 4.39Å; L12-W14 HydrophobicContact CD2-CD2 4.05Å; L12-W14 HydrophobicContact CD2-CG 4.27Å; L12-W14 HydrophobicContact CD2-CH2 4.46Å; L12-W14 HydrophobicContact CD2-CZ2 3.62Å; W14-E16 VanDerWaalsContact C-N 3.3Å; W14-E16 PolarHBondContact O-N 3.12Å; W14-E27 WeakPolarHBondContact CA-OE1 3.47Å; W14-E27 WeakPolarHBondContact CB-OE1 3.37Å; W14-E27 PolarHBondContact N-OE1 2.84Å; W14-F76 AromaticContact NE1-CE1 3.66Å; W14-H77 AromaticContact CD1-CE1 3.45Å; W14-H77 VanDerWaalsContact CD1-CE1 3.45Å; W14-H77 AromaticContact CD1-ND1 3.74Å; W14-H77 AromaticContact NE1-CE1 3.29Å; W14-H77 PolarHBondContact NE1-CE1 3.17Å; W14-H77 VanDerWaalsContact NE1-CE1 3.29Å; W14-H77 AromaticContact NE1-ND1 3.97Å; W14-W186 AromaticContact CH2-CD1 3.82Å; W14-W186 AromaticContact CH2-CE2 3.63Å; W14-W186 AromaticContact CH2-CZ2 3.96Å; W14-W186 HydrophobicContact CH2-CZ2 3.96Å; W14-W186 AromaticContact CH2-NE1 3.15Å; W14-W186 AromaticContact CZ3-NE1 3.75Å; W14-H205 HydrophobicContact CB-CB 4.49Å; W14-H205 HydrophobicContact CD2-CB 4.24Å; W14-H205 AromaticContact CD2-CD2 3.75Å; W14-H205 AromaticContact CD2-CE1 3.57Å; W14-H205 AromaticContact CD2-CG 3.53Å; W14-H205 AromaticContact CD2-ND1 3.42Å; W14-H205 AromaticContact CD2-NE2 3.77Å; W14-H205 AromaticContact CE2-CD2 3.83Å; W14-H205 AromaticContact CE2-CE1 3.28Å; W14-H205 AromaticContact CE2-CG 3.99Å; W14-H205 AromaticContact CE2-ND1 3.67Å; W14-H205 AromaticContact CE2-NE2 3.38Å; W14-H205 HydrophobicContact CE3-CB 4.08Å; W14-H205 AromaticContact CE3-CE1 3.6Å; W14-H205 AromaticContact CE3-CG 3.55Å; W14-H205 AromaticContact CE3-ND1 3.11Å; W14-H205 HydrophobicContact CG-CB 4.43Å; W14-H205 AromaticContact CG-CD2 3.99Å; W14-H205 AromaticContact CG-CG 3.98Å; W14-H205 AromaticContact CH2-CE1 3.24Å; W14-H205 WeakPolarHBondContact CH2-CE1 3.36Å; W14-H205 AromaticContact CH2-ND1 3.53Å; W14-H205 AromaticContact CZ2-CE1 3.12Å; W14-H205 WeakPolarHBondContact CZ2-CE1 3.31Å; W14-H205 AromaticContact CZ2-ND1 3.74Å; W14-H205 AromaticContact CZ2-NE2 3.59Å; W14-H205 AromaticContact CZ3-CE1 3.44Å; W14-H205 VanDerWaalsContact CZ3-CE1 3.44Å; W14-H205 WeakPolarHBondContact CZ3-CE1 3.41Å; W14-H205 AromaticContact CZ3-ND1 3.16Å; W14-H205 WeakPolarHBondContact CZ3-ND1 3.31Å; W14-H205 AromaticContact NE1-NE2 3.72Å
15C94.8Very high94Very high3 Ų370.6 Ų70.62%0.0233%0.334CS..SBendtrans-75.5-17.9-174.6-162.50000114.4D189 C193 C202C15-D189 VanDerWaalsContact CB-OD2 3.31Å; C15-D189 WeakPolarHBondContact CB-OD2 3.41Å; C15-D189 PolarHBondContact N-OD2 3.43Å; C15-D189 VanDerWaalsContact N-OD2 3.09Å; C15-C193 WeakPolarHBondContact CA-SG 3.48Å; C15-C193 HydrophobicContact CB-CB 3.8Å; C15-C193 WeakPolarHBondContact CB-SG 3.39Å; C15-C193 WeakPolarHBondContact SG-CA 3.4Å; C15-C193 WeakPolarHBondContact SG-CB 3.45Å; C15-C193 PolarHBondContact SG-O 3.43Å; C15-C193 CovalentContact SG-SG 2.05Å; C15-C193 PolarHBondContact SG-SG 3.38Å; C15-C202 HydrophobicContact CB-CB 4.36Å; C15-C202 VanDerWaalsContact O-CB 3.23Å; C15-C202 WeakPolarHBondContact O-CB 3.43Å
16E95.5Very high94.2Very high4 Ų464.2 Ų64.22%0.01931%0.306CS..SBendtrans-64.2137.7-179.5-173.6178.5173.600111.2W14 N18 E27 Y28 F29 N30 C202W14-E16 VanDerWaalsContact C-N 3.3Å; W14-E16 PolarHBondContact O-N 3.12Å; E16-N18 PolarHBondContact O-N 2.81Å; E16-E27 HydrophobicContact CB-CB 4.44Å; E16-E27 HydrophobicContact CB-CG 4.42Å; E16-Y28 PolarHBondContact OE1-N 2.76Å; E16-F29 VanDerWaalsContact CD-N 3.35Å; E16-F29 WeakPolarHBondContact OE1-CD2 3.33Å; E16-F29 PolarHBondContact OE1-N 3.09Å; E16-F29 WeakPolarHBondContact OE2-CB 3.32Å; E16-F29 PolarHBondContact OE2-N 2.93Å; E16-F29 VanDerWaalsContact OE2-N 3.12Å; E16-N30 VanDerWaalsContact OE2-CG 3.3Å; E16-N30 PolarHBondContact OE2-N 3.39Å; E16-C202 WeakPolarHBondContact CA-O 3.21Å
17D94.4Very high94.4Very high62 Ų6262.5 Ų62.533%0.33229%0.293SS..PPolyproline II helixtrans-67.2123.1178.9-65.3-32.5000111.9Y19 R20D17-Y19 PolarHBondContact O-N 3.06Å; D17-R20 HydrophobicContact CB-CB 3.9Å; D17-R20 HydrophobicContact CB-CG 4.45Å; D17-R20 WeakPolarHBondContact O-CB 3.48Å; D17-R20 PolarHBondContact O-N 3.26Å; D17-R20 WeakPolarHBondContact OD2-CD 3.4Å; D17-R20 IonicContact OD2-CZ 3.51Å; D17-R20 IonicContact OD2-NE 3.63Å; D17-R20 IonicContact OD2-NH1 2.68Å; D17-R20 PolarHBondContact OD2-NH1 3.34Å
18N96.5Very high94.5Very high48 Ų4862.2 Ų62.226%0.25729%0.292SS..THydrogen-bonded Turntrans-61132.8178.6-66.4-9.3000112.4D13 E16 R20 V26D13-N18 PolarHBondContact OD1-OD1 2.94Å; D13-N18 PolarHBondContact OD2-ND2 3.21Å; E16-N18 PolarHBondContact O-N 2.81Å; N18-R20 PolarHBondContact O-N 3.43Å; N18-R20 VanDerWaalsContact O-N 3.12Å; N18-V26 CarbonylContact C-O 3.53Å; N18-V26 VanDerWaalsContact CA-O 3.31Å; N18-V26 WeakPolarHBondContact CA-O 3.45Å; N18-V26 HydrophobicContact CB-CG1 3.79Å; N18-V26 WeakPolarHBondContact OD1-CG1 3.35Å
19Y96.4Very high94.5Very high76 Ų7661.4 Ų61.430%0.29829%0.287SS..THydrogen-bonded Turntrans57.918.7178.1-51.3-79.6000115.5E8 D17 Y21 S22 V26E8-Y19 VanDerWaalsContact OE2-CE2 3.22Å; E8-Y19 WeakPolarHBondContact OE2-CE2 3.46Å; E8-Y19 PolarHBondContact OE2-OH 2.99Å; D17-Y19 PolarHBondContact O-N 3.06Å; Y19-Y21 VanDerWaalsContact C-N 3.27Å; Y19-Y21 PolarHBondContact O-N 3.29Å; Y19-S22 VanDerWaalsContact CA-O 3.28Å; Y19-S22 WeakPolarHBondContact CA-O 3.09Å; Y19-S22 WeakPolarHBondContact CB-O 3.41Å; Y19-V26 HydrophobicContact CE1-CB 4.42Å; Y19-V26 HydrophobicContact CE1-CG2 3.73Å; Y19-V26 HydrophobicContact CE2-CG1 4.41Å; Y19-V26 HydrophobicContact CE2-CG2 4.27Å; Y19-V26 PolarHBondContact N-O 2.75Å; Y19-V26 WeakPolarHBondContact OH-CG2 3.44Å
20R94.3Very high94.7Very high133 Ų13359.7 Ų59.750%0.50228%0.275SS..SBendtrans-60.2-34.2-176.8179.8171.8179.1114.86.2114.1D17 N18D17-R20 HydrophobicContact CB-CB 3.9Å; D17-R20 HydrophobicContact CB-CG 4.45Å; D17-R20 WeakPolarHBondContact O-CB 3.48Å; D17-R20 PolarHBondContact O-N 3.26Å; D17-R20 WeakPolarHBondContact OD2-CD 3.4Å; D17-R20 IonicContact OD2-CZ 3.51Å; D17-R20 IonicContact OD2-NE 3.63Å; D17-R20 IonicContact OD2-NH1 2.68Å; D17-R20 PolarHBondContact OD2-NH1 3.34Å; N18-R20 PolarHBondContact O-N 3.43Å; N18-R20 VanDerWaalsContact O-N 3.12Å
21Y94.1Very high95Very high105 Ų10559.5 Ų59.541%0.41227%0.273SS..SBendtrans-115.7-9-174.9-61.6-80.8000114Y19 Y28 F29 Y203Y19-Y21 VanDerWaalsContact C-N 3.27Å; Y19-Y21 PolarHBondContact O-N 3.29Å; Y21-Y28 HydrophobicContact CD2-CD1 4.38Å; Y21-Y28 HydrophobicContact CD2-CG 4.44Å; Y21-Y28 HydrophobicContact CG-CD1 4.33Å; Y21-Y28 HydrophobicContact CG-CG 4.39Å; Y21-F29 HydrophobicContact CD2-CD2 4.18Å; Y21-F29 AromaticContact CD2-CE2 3.92Å; Y21-F29 HydrophobicContact CD2-CE2 3.92Å; Y21-F29 HydrophobicContact CE1-CE2 4.37Å; Y21-F29 AromaticContact CE2-CD2 3.82Å; Y21-F29 HydrophobicContact CE2-CD2 3.82Å; Y21-F29 AromaticContact CE2-CE2 3.34Å; Y21-F29 HydrophobicContact CE2-CE2 3.34Å; Y21-F29 HydrophobicContact CE2-CZ 4.43Å; Y21-F29 AromaticContact CZ-CE2 3.59Å; Y21-Y203 HydrophobicContact CE2-CE1 4.5Å; Y21-Y203 PolarHBondContact OH-OH 3.46Å
22S94Very high95.4Very high34 Ų3454.1 Ų54.124%0.23825%0.251CS..  trans-159.4140-176.4177.80000110.7Y19 H24 V25Y19-S22 VanDerWaalsContact CA-O 3.28Å; Y19-S22 WeakPolarHBondContact CA-O 3.09Å; Y19-S22 WeakPolarHBondContact CB-O 3.41Å; S22-H24 PolarHBondContact O-N 3.08Å; S22-H24 PolarHBondContact OG-N 3.49Å; S22-V25 PolarHBondContact OG-N 2.87Å
23E93.6Very high95.8Very high166 Ų16654 Ų5478%0.77625%0.252SS*.SBendtrans-75.8-9.2174.9-61.8-178.4175.800113.3
24H94.6Very high96Very high131 Ų13150.5 Ų50.561%0.60623%0.233SC*.SBendtrans-117.9-8-175-60.4-39000114S22S22-H24 PolarHBondContact O-N 3.08Å; S22-H24 PolarHBondContact OG-N 3.49Å
25V96.9Very high96.2Very high26 Ų2654.6 Ų54.616%0.15825%0.252CS..  trans-123.9113-179.4-177.20000106.6S22 T31 M78S22-V25 PolarHBondContact OG-N 2.87Å; V25-T31 HydrophobicContact CG1-CG2 4.07Å; V25-T31 WeakPolarHBondContact CG1-OG1 3.33Å; V25-M78 HydrophobicContact CG1-CB 4.39Å; V25-M78 HydrophobicContact CG1-CG 4.45Å; V25-M78 HydrophobicContact CG2-CG 4.28Å
26V97.1Very high96.3Very high0 Ų058.6 Ų58.60%027%0.269CS..SBendtrans-61.9-62-175.9-175.80000109.9Y7 E8 N18 Y19 M78 L80Y7-V26 HydrophobicContact CD1-CG2 3.8Å; Y7-V26 HydrophobicContact CE1-CG2 4.32Å; E8-V26 HydrophobicContact CG-CG1 4.29Å; E8-V26 HydrophobicContact CG-CG2 4.31Å; N18-V26 CarbonylContact C-O 3.53Å; N18-V26 VanDerWaalsContact CA-O 3.31Å; N18-V26 WeakPolarHBondContact CA-O 3.45Å; N18-V26 HydrophobicContact CB-CG1 3.79Å; N18-V26 WeakPolarHBondContact OD1-CG1 3.35Å; Y19-V26 HydrophobicContact CE1-CB 4.42Å; Y19-V26 HydrophobicContact CE1-CG2 3.73Å; Y19-V26 HydrophobicContact CE2-CG1 4.41Å; Y19-V26 HydrophobicContact CE2-CG2 4.27Å; Y19-V26 PolarHBondContact N-O 2.75Å; Y19-V26 WeakPolarHBondContact OH-CG2 3.44Å; V26-M78 VanDerWaalsContact CG2-O 3.3Å; V26-M78 WeakPolarHBondContact CG2-O 3.27Å; V26-M78 PolarHBondContact N-O 3.41Å; V26-L80 HydrophobicContact CB-CG 4.24Å; V26-L80 HydrophobicContact CG1-CB 4.36Å; V26-L80 HydrophobicContact CG1-CD1 3.54Å; V26-L80 HydrophobicContact CG1-CG 3.78Å
27E97.5Very high96.5Very high0 Ų058.6 Ų58.60%027%0.269CS..SBendtrans-110.596.9178-61.1178.8166.800110.2W14 E16 N30 T31 H77 L80W14-E27 WeakPolarHBondContact CA-OE1 3.47Å; W14-E27 WeakPolarHBondContact CB-OE1 3.37Å; W14-E27 PolarHBondContact N-OE1 2.84Å; E16-E27 HydrophobicContact CB-CB 4.44Å; E16-E27 HydrophobicContact CB-CG 4.42Å; E27-N30 HydrophobicContact CB-CB 3.89Å; E27-N30 PolarHBondContact OE2-ND2 2.82Å; E27-T31 VanDerWaalsContact O-CB 3.28Å; E27-T31 WeakPolarHBondContact O-CB 3.45Å; E27-T31 PolarHBondContact O-N 3.19Å; E27-T31 PolarHBondContact O-OG1 2.95Å; E27-H77 HydrophobicContact CB-CB 4.3Å; E27-H77 PolarHBondContact N-O 3.11Å; E27-H77 IonicContact OE2-CE1 3.26Å; E27-H77 IonicContact OE2-CG 3.76Å; E27-H77 IonicContact OE2-ND1 3.57Å; E27-H77 PolarHBondContact OE2-ND1 2.93Å; E27-L80 HydrophobicContact CG-CD1 4.27Å; E27-L80 HydrophobicContact CG-CG 4.46Å
28Y97.1Very high96.6Very high92 Ų9258.9 Ų58.936%0.36127%0.267SS..Hα-helixtrans-65.7-50.5-168.8-179-92.8000113.2E16 Y21 T31 V32E16-Y28 PolarHBondContact OE1-N 2.76Å; Y21-Y28 HydrophobicContact CD2-CD1 4.38Å; Y21-Y28 HydrophobicContact CD2-CG 4.44Å; Y21-Y28 HydrophobicContact CG-CD1 4.33Å; Y21-Y28 HydrophobicContact CG-CG 4.39Å; Y28-T31 PolarHBondContact O-N 2.94Å; Y28-V32 HydrophobicContact CD1-CG2 4.21Å; Y28-V32 HydrophobicContact CE1-CG2 3.83Å; Y28-V32 HydrophobicContact CE2-CG2 4.22Å; Y28-V32 WeakPolarHBondContact O-CB 3.35Å; Y28-V32 VanDerWaalsContact O-CG2 3.3Å; Y28-V32 WeakPolarHBondContact O-CG2 3.48Å; Y28-V32 PolarHBondContact O-N 3.43Å
29F96.8Very high96.7Very high77 Ų7761.3 Ų61.334%0.33828%0.279SS..Hα-helixtrans-70.9-38.9-178.4-76.4-78.8000112.1E16 Y21 T31 V32 S33 Y203E16-F29 VanDerWaalsContact CD-N 3.35Å; E16-F29 WeakPolarHBondContact OE1-CD2 3.33Å; E16-F29 PolarHBondContact OE1-N 3.09Å; E16-F29 WeakPolarHBondContact OE2-CB 3.32Å; E16-F29 PolarHBondContact OE2-N 2.93Å; E16-F29 VanDerWaalsContact OE2-N 3.12Å; Y21-F29 HydrophobicContact CD2-CD2 4.18Å; Y21-F29 AromaticContact CD2-CE2 3.92Å; Y21-F29 HydrophobicContact CD2-CE2 3.92Å; Y21-F29 HydrophobicContact CE1-CE2 4.37Å; Y21-F29 AromaticContact CE2-CD2 3.82Å; Y21-F29 HydrophobicContact CE2-CD2 3.82Å; Y21-F29 AromaticContact CE2-CE2 3.34Å; Y21-F29 HydrophobicContact CE2-CE2 3.34Å; Y21-F29 HydrophobicContact CE2-CZ 4.43Å; Y21-F29 AromaticContact CZ-CE2 3.59Å; F29-T31 VanDerWaalsContact C-N 3.31Å; F29-T31 PolarHBondContact O-N 2.82Å; F29-V32 PolarHBondContact O-N 3.46Å; F29-S33 VanDerWaalsContact O-CB 3.24Å; F29-S33 WeakPolarHBondContact O-CB 3.46Å; F29-S33 PolarHBondContact O-N 3.15Å; F29-S33 PolarHBondContact O-OG 3.18Å; F29-Y203 HydrophobicContact CB-CD1 3.93Å; F29-Y203 AromaticContact CD2-CD1 3.38Å; F29-Y203 HydrophobicContact CD2-CD1 3.38Å; F29-Y203 AromaticContact CD2-CE1 3.14Å; F29-Y203 HydrophobicContact CD2-CE1 3.14Å; F29-Y203 HydrophobicContact CD2-CG 4.42Å; F29-Y203 AromaticContact CE2-CD1 3.92Å; F29-Y203 HydrophobicContact CE2-CD1 3.92Å; F29-Y203 AromaticContact CE2-CE1 3.33Å; F29-Y203 HydrophobicContact CE2-CE1 3.33Å; F29-Y203 AromaticContact CE2-CZ 3.74Å; F29-Y203 AromaticContact CG-CD1 3.73Å; F29-Y203 HydrophobicContact CG-CD1 3.73Å; F29-Y203 AromaticContact CG-CE1 3.98Å; F29-Y203 HydrophobicContact CG-CE1 3.98Å; F29-Y203 HydrophobicContact CZ-CE1 4.32Å
30N97.7Very high96.7Very high0 Ų057.8 Ų57.80%027%0.266CS..Hα-helixtrans-60.6-43.3172.6-66.5-16.6000110.5E16 E27 S33 S34 H77 G206 H209E16-N30 VanDerWaalsContact OE2-CG 3.3Å; E16-N30 PolarHBondContact OE2-N 3.39Å; E27-N30 HydrophobicContact CB-CB 3.89Å; E27-N30 PolarHBondContact OE2-ND2 2.82Å; N30-S33 WeakPolarHBondContact CA-OG 3.38Å; N30-S33 PolarHBondContact O-OG 2.9Å; N30-S34 PolarHBondContact O-N 3.1Å; N30-S34 PolarHBondContact O-OG 3.3Å; N30-H77 HydrophobicContact CB-CB 3.87Å; N30-H77 WeakPolarHBondContact CB-ND1 3.23Å; N30-G206 WeakPolarHBondContact OD1-CA 3.24Å; N30-G206 PolarHBondContact OD1-N 2.89Å; N30-H209 PolarHBondContact O-CE1 3.38Å; N30-H209 PolarHBondContact O-ND1 3.01Å
31T98.1Very high96.9Very high10 Ų1051.5 Ų51.56%0.06124%0.242CC..Hα-helixtrans-61.6-48.2173.5-56.50000112.5V25 E27 Y28 F29 S34 F35 A74 H77 M78V25-T31 HydrophobicContact CG1-CG2 4.07Å; V25-T31 WeakPolarHBondContact CG1-OG1 3.33Å; E27-T31 VanDerWaalsContact O-CB 3.28Å; E27-T31 WeakPolarHBondContact O-CB 3.45Å; E27-T31 PolarHBondContact O-N 3.19Å; E27-T31 PolarHBondContact O-OG1 2.95Å; Y28-T31 PolarHBondContact O-N 2.94Å; F29-T31 VanDerWaalsContact C-N 3.31Å; F29-T31 PolarHBondContact O-N 2.82Å; T31-S34 PolarHBondContact O-N 3.3Å; T31-F35 HydrophobicContact CG2-CE2 4.46Å; T31-A74 HydrophobicContact CG2-CB 4.36Å; T31-H77 WeakPolarHBondContact OG1-CB 3.44Å; T31-H77 PolarHBondContact OG1-O 2.7Å; T31-M78 HydrophobicContact CG2-CB 4.12Å; T31-M78 WeakPolarHBondContact OG1-CA 3.49Å; T31-M78 PolarHBondContact OG1-N 3.04Å; T31-M78 VanDerWaalsContact OG1-N 3.1Å
32V97.8Very high97Very high59 Ų5949.1 Ų49.136%0.35824%0.24SC..Hα-helixtrans-67.2-40.5-175.6169.10000111.6Y28 F29 S34 F35Y28-V32 HydrophobicContact CD1-CG2 4.21Å; Y28-V32 HydrophobicContact CE1-CG2 3.83Å; Y28-V32 HydrophobicContact CE2-CG2 4.22Å; Y28-V32 WeakPolarHBondContact O-CB 3.35Å; Y28-V32 VanDerWaalsContact O-CG2 3.3Å; Y28-V32 WeakPolarHBondContact O-CG2 3.48Å; Y28-V32 PolarHBondContact O-N 3.43Å; F29-V32 PolarHBondContact O-N 3.46Å; V32-S34 VanDerWaalsContact C-N 3.3Å; V32-S34 PolarHBondContact O-N 2.9Å; V32-F35 WeakPolarHBondContact O-CB 3.24Å; V32-F35 PolarHBondContact O-N 3.49Å
33S98.1Very high97.2Very high9 Ų949.3 Ų49.36%0.06324%0.238CC..Hα-helixtrans-65-31.3179.455.60000112.8F29 N30 F35 F36 G206 H209F29-S33 VanDerWaalsContact O-CB 3.24Å; F29-S33 WeakPolarHBondContact O-CB 3.46Å; F29-S33 PolarHBondContact O-N 3.15Å; F29-S33 PolarHBondContact O-OG 3.18Å; N30-S33 WeakPolarHBondContact CA-OG 3.38Å; N30-S33 PolarHBondContact O-OG 2.9Å; S33-F35 PolarHBondContact O-N 2.87Å; S33-F35 VanDerWaalsContact O-N 3.13Å; S33-F36 WeakPolarHBondContact O-CB 3.2Å; S33-F36 WeakPolarHBondContact O-CD2 3.41Å; S33-F36 PolarHBondContact O-N 2.7Å; S33-F36 VanDerWaalsContact O-N 3.08Å; S33-G206 VanDerWaalsContact CB-O 3.26Å; S33-G206 WeakPolarHBondContact CB-O 3.28Å; S33-G206 WeakPolarHBondContact OG-CA 3.43Å; S33-G206 PolarHBondContact OG-O 2.92Å; S33-H209 PolarHBondContact OG-ND1 2.81Å
34S98.1Very high97.4Very high0 Ų041.4 Ų41.40%020%0.201CC..Hα-helixtrans-59.8-21.7171.8-50.60000112.6N30 T31 V32 F36 F37 S73 H209N30-S34 PolarHBondContact O-N 3.1Å; N30-S34 PolarHBondContact O-OG 3.3Å; T31-S34 PolarHBondContact O-N 3.3Å; V32-S34 VanDerWaalsContact C-N 3.3Å; V32-S34 PolarHBondContact O-N 2.9Å; S34-F36 PolarHBondContact O-N 3.33Å; S34-F37 WeakPolarHBondContact O-CB 3.28Å; S34-F37 VanDerWaalsContact O-CD2 3.27Å; S34-F37 WeakPolarHBondContact O-CD2 3.45Å; S34-F37 PolarHBondContact O-N 2.87Å; S34-S73 PolarHBondContact OG-OG 3.37Å; S34-H209 PolarHBondContact OG-CE1 2.83Å; S34-H209 PolarHBondContact OG-ND1 2.71Å
35F97.2Very high97.5Very high111 Ų11137.4 Ų37.449%0.48718%0.183SC..THydrogen-bonded Turntrans-68.2-16.8176.4-73.1-74.9000114.1T31 V32 S33 F37 F38T31-F35 HydrophobicContact CG2-CE2 4.46Å; V32-F35 WeakPolarHBondContact O-CB 3.24Å; V32-F35 PolarHBondContact O-N 3.49Å; S33-F35 PolarHBondContact O-N 2.87Å; S33-F35 VanDerWaalsContact O-N 3.13Å; F35-F37 PolarHBondContact O-N 3.45Å; F35-F37 VanDerWaalsContact O-N 3.16Å; F35-F38 HydrophobicContact CB-CD2 4.24Å; F35-F38 AromaticContact CD1-CD2 3.52Å; F35-F38 HydrophobicContact CD1-CD2 3.52Å; F35-F38 AromaticContact CD1-CE2 3.51Å; F35-F38 HydrophobicContact CD1-CE2 3.51Å; F35-F38 HydrophobicContact CE1-CD2 4.34Å; F35-F38 AromaticContact CE1-CE2 3.95Å; F35-F38 HydrophobicContact CE1-CE2 3.95Å; F35-F38 HydrophobicContact CG-CD2 4.28Å; F35-F38 HydrophobicContact CG-CE2 4.39Å; F35-F38 PolarHBondContact O-N 2.91Å
36F97.6Very high97.4Very high87 Ų8744 Ų4438%0.38221%0.207SC..THydrogen-bonded Turntrans-59.4-26.6174.3-87-102.1000112.6S33 S34 F38 I39 V40 I210 V213S33-F36 WeakPolarHBondContact O-CB 3.2Å; S33-F36 WeakPolarHBondContact O-CD2 3.41Å; S33-F36 PolarHBondContact O-N 2.7Å; S33-F36 VanDerWaalsContact O-N 3.08Å; S34-F36 PolarHBondContact O-N 3.33Å; F36-F38 VanDerWaalsContact C-N 3.29Å; F36-F38 PolarHBondContact O-N 3.47Å; F36-I39 PolarHBondContact O-N 2.94Å; F36-V40 PolarHBondContact O-N 3.43Å; F36-I210 HydrophobicContact CB-CG1 4.46Å; F36-I210 HydrophobicContact CD1-CG1 4.35Å; F36-I210 HydrophobicContact CD1-CG2 4.12Å; F36-I210 HydrophobicContact CD2-CD1 3.99Å; F36-I210 HydrophobicContact CD2-CG1 3.8Å; F36-I210 HydrophobicContact CE1-CD1 4.5Å; F36-I210 HydrophobicContact CE1-CG2 4.25Å; F36-I210 HydrophobicContact CE2-CD1 3.72Å; F36-I210 HydrophobicContact CE2-CG1 4.06Å; F36-I210 HydrophobicContact CG-CD1 4.49Å; F36-I210 HydrophobicContact CG-CG1 3.95Å; F36-I210 HydrophobicContact CG-CG2 4.5Å; F36-I210 HydrophobicContact CZ-CD1 4Å; F36-I210 HydrophobicContact CZ-CG1 4.45Å; F36-V213 HydrophobicContact CB-CG1 4.45Å
37F98.2Very high97.4Very high5 Ų544.4 Ų44.42%0.02221%0.209CC..Hα-helixtrans-62.9-35.1175.5-72.5-109.8000112.1S34 F35 I39 A41 M66 V69 H209 I212 V213S34-F37 WeakPolarHBondContact O-CB 3.28Å; S34-F37 VanDerWaalsContact O-CD2 3.27Å; S34-F37 WeakPolarHBondContact O-CD2 3.45Å; S34-F37 PolarHBondContact O-N 2.87Å; F35-F37 PolarHBondContact O-N 3.45Å; F35-F37 VanDerWaalsContact O-N 3.16Å; F37-I39 PolarHBondContact O-N 3.36Å; F37-A41 WeakPolarHBondContact O-CB 3.5Å; F37-A41 PolarHBondContact O-N 3.13Å; F37-M66 HydrophobicContact CD1-CE 3.71Å; F37-M66 WeakPolarHBondContact CD1-O 3.25Å; F37-M66 HydrophobicContact CE1-CE 3.47Å; F37-M66 VanDerWaalsContact CE1-CE 3.47Å; F37-V69 HydrophobicContact CD1-CB 4.42Å; F37-V69 HydrophobicContact CD1-CG1 4.24Å; F37-V69 HydrophobicContact CE1-CB 4.35Å; F37-V69 HydrophobicContact CE1-CG1 3.73Å; F37-V69 HydrophobicContact CZ-CG1 4.34Å; F37-H209 HydrophobicContact CE2-CB 4.12Å; F37-I212 HydrophobicContact CZ-CG2 4.05Å; F37-V213 HydrophobicContact CD1-CB 4.18Å; F37-V213 HydrophobicContact CD1-CG2 3.83Å; F37-V213 HydrophobicContact CD2-CB 4.3Å; F37-V213 HydrophobicContact CD2-CG2 4.49Å; F37-V213 HydrophobicContact CE1-CB 3.98Å; F37-V213 HydrophobicContact CE1-CG2 4.05Å; F37-V213 HydrophobicContact CE2-CB 4.1Å; F37-V213 HydrophobicContact CE2-CG1 4.49Å; F37-V213 HydrophobicContact CG-CB 4.35Å; F37-V213 HydrophobicContact CG-CG2 4.07Å; F37-V213 HydrophobicContact CZ-CB 3.93Å; F37-V213 HydrophobicContact CZ-CG2 4.47Å
38F97.9Very high97.3Very high67 Ų6744.4 Ų44.429%0.29421%0.209SC..Hα-helixtrans-72.4-9.5175.6-57.6-83.4000113.4F35 F36 P42 I67 L71F35-F38 HydrophobicContact CB-CD2 4.24Å; F35-F38 AromaticContact CD1-CD2 3.52Å; F35-F38 HydrophobicContact CD1-CD2 3.52Å; F35-F38 AromaticContact CD1-CE2 3.51Å; F35-F38 HydrophobicContact CD1-CE2 3.51Å; F35-F38 HydrophobicContact CE1-CD2 4.34Å; F35-F38 AromaticContact CE1-CE2 3.95Å; F35-F38 HydrophobicContact CE1-CE2 3.95Å; F35-F38 HydrophobicContact CG-CD2 4.28Å; F35-F38 HydrophobicContact CG-CE2 4.39Å; F35-F38 PolarHBondContact O-N 2.91Å; F36-F38 VanDerWaalsContact C-N 3.29Å; F36-F38 PolarHBondContact O-N 3.47Å; F38-P42 VanDerWaalsContact O-CD 3.28Å; F38-P42 WeakPolarHBondContact O-CD 3.34Å; F38-P42 VanDerWaalsContact O-CG 3.25Å; F38-P42 WeakPolarHBondContact O-CG 3.49Å; F38-I67 HydrophobicContact CD1-CG2 3.64Å; F38-I67 HydrophobicContact CE1-CG2 3.6Å; F38-L71 HydrophobicContact CE1-CB 4.33Å; F38-L71 HydrophobicContact CZ-CB 3.83Å; F38-L71 HydrophobicContact CZ-CD1 4.21Å
39I96.8Very high97.3Very high99 Ų9943.1 Ų43.151%0.50821%0.206SC..Hα-helixtrans-97.1-54.7174.1-58.5172.9000109.3F36 F37 P42 I43F36-I39 PolarHBondContact O-N 2.94Å; F37-I39 PolarHBondContact O-N 3.36Å; I39-P42 WeakPolarHBondContact O-CD 3.38Å; I39-I43 HydrophobicContact CG2-CD1 3.97Å; I39-I43 WeakPolarHBondContact O-CD1 3.36Å; I39-I43 VanDerWaalsContact O-CG1 3.28Å; I39-I43 WeakPolarHBondContact O-CG1 3.37Å; I39-I43 PolarHBondContact O-N 2.86Å
40V97.4Very high97.1Very high3 Ų342.6 Ų42.62%0.01821%0.21CC..Hα-helixtrans-68.2-42.6-174178.70000111.5F36 I43 M44 W63 V213 M214 A217 F251F36-V40 PolarHBondContact O-N 3.43Å; V40-I43 PolarHBondContact O-N 3.38Å; V40-M44 HydrophobicContact CG1-CG 4.03Å; V40-M44 WeakPolarHBondContact O-CG 3.33Å; V40-M44 PolarHBondContact O-N 2.86Å; V40-W63 HydrophobicContact CG1-CH2 4.47Å; V40-W63 HydrophobicContact CG1-CZ3 4.36Å; V40-V213 HydrophobicContact CB-CG1 4.46Å; V40-V213 HydrophobicContact CB-CG2 3.79Å; V40-V213 HydrophobicContact CG1-CG2 3.85Å; V40-V213 HydrophobicContact CG2-CG1 4.09Å; V40-V213 HydrophobicContact CG2-CG2 4.33Å; V40-M214 HydrophobicContact CG2-SD 3.95Å; V40-A217 HydrophobicContact CG1-CB 3.91Å; V40-F251 HydrophobicContact CG1-CE1 3.79Å; V40-F251 HydrophobicContact CG1-CZ 4.35Å; V40-F251 HydrophobicContact CG2-CE1 4.2Å; V40-F251 HydrophobicContact CG2-CZ 3.97Å
41A97.5Very high97Very high0 Ų042.6 Ų42.60%021%0.21CC..Hα-helixtrans-65.3-44.5-174.700000113.4F37 I43 M44 L45 W63 M66 I67F37-A41 WeakPolarHBondContact O-CB 3.5Å; F37-A41 PolarHBondContact O-N 3.13Å; A41-I43 PolarHBondContact O-N 3.23Å; A41-M44 PolarHBondContact O-N 2.94Å; A41-L45 VanDerWaalsContact O-CB 3.32Å; A41-L45 WeakPolarHBondContact O-CB 3.28Å; A41-L45 PolarHBondContact O-N 2.79Å; A41-W63 HydrophobicContact CB-CE3 3.67Å; A41-W63 HydrophobicContact CB-CZ3 4.21Å; A41-M66 HydrophobicContact CB-CB 4.01Å; A41-I67 HydrophobicContact CB-CG1 3.67Å
42P97.8Very high96.9Very high56 Ų5642.1 Ų42.136%0.36421%0.207SC..Hα-helixtrans-63-38.1172.9-27.338.2000114F38 I39 L45 Y46 I67F38-P42 VanDerWaalsContact O-CD 3.28Å; F38-P42 WeakPolarHBondContact O-CD 3.34Å; F38-P42 VanDerWaalsContact O-CG 3.25Å; F38-P42 WeakPolarHBondContact O-CG 3.49Å; I39-P42 WeakPolarHBondContact O-CD 3.38Å; P42-L45 PolarHBondContact O-N 3.16Å; P42-Y46 PolarHBondContact O-N 3.34Å; P42-I67 HydrophobicContact CG-CD1 4.26Å
43I97Very high96.7Very high38 Ų3846.3 Ų46.320%0.19522%0.221CC..Hα-helixtrans-59.9-49.6175.1-69.8169.5000109.7I39 V40 A41 L45 Y46 L47 W242 F251I39-I43 HydrophobicContact CG2-CD1 3.97Å; I39-I43 WeakPolarHBondContact O-CD1 3.36Å; I39-I43 VanDerWaalsContact O-CG1 3.28Å; I39-I43 WeakPolarHBondContact O-CG1 3.37Å; I39-I43 PolarHBondContact O-N 2.86Å; V40-I43 PolarHBondContact O-N 3.38Å; A41-I43 PolarHBondContact O-N 3.23Å; I43-L45 PolarHBondContact O-N 3.19Å; I43-Y46 WeakPolarHBondContact O-CB 3.2Å; I43-Y46 PolarHBondContact O-N 3.38Å; I43-L47 HydrophobicContact CG2-CD1 3.62Å; I43-L47 HydrophobicContact CG2-CG 4.19Å; I43-L47 WeakPolarHBondContact O-CB 3.48Å; I43-L47 VanDerWaalsContact O-CG 3.28Å; I43-L47 WeakPolarHBondContact O-CG 3.38Å; I43-L47 PolarHBondContact O-N 2.8Å; I43-W242 HydrophobicContact CG2-CE3 4.45Å; I43-W242 HydrophobicContact CG2-CZ3 4.49Å; I43-F251 HydrophobicContact CD1-CE2 4.2Å; I43-F251 HydrophobicContact CG2-CB 4.48Å; I43-F251 HydrophobicContact CG2-CD2 4.11Å; I43-F251 HydrophobicContact CG2-CG 4.15Å
44M97.4Very high96.5Very high0 Ų049.5 Ų49.50%024%0.235CC..Hα-helixtrans-68.5-34-179.2-66.7-54.6-58.400112.9V40 A41 Y46 L47 L48 W63 A217 T221 F251V40-M44 HydrophobicContact CG1-CG 4.03Å; V40-M44 WeakPolarHBondContact O-CG 3.33Å; V40-M44 PolarHBondContact O-N 2.86Å; A41-M44 PolarHBondContact O-N 2.94Å; M44-Y46 VanDerWaalsContact C-N 3.32Å; M44-Y46 PolarHBondContact O-N 3.33Å; M44-L47 PolarHBondContact O-N 3.48Å; M44-L47 HydrophobicContact SD-CD1 4.19Å; M44-L48 HydrophobicContact CE-CD1 4.17Å; M44-L48 HydrophobicContact CE-CG 4.28Å; M44-L48 WeakPolarHBondContact O-CB 3.5Å; M44-L48 WeakPolarHBondContact O-CG 3.4Å; M44-L48 PolarHBondContact O-N 3.25Å; M44-W63 HydrophobicContact CB-CD2 3.57Å; M44-W63 HydrophobicContact CB-CE3 3.9Å; M44-W63 HydrophobicContact CB-CG 4.19Å; M44-W63 HydrophobicContact CB-CH2 3.68Å; M44-W63 HydrophobicContact CB-CZ2 3.32Å; M44-W63 HydrophobicContact CB-CZ3 3.95Å; M44-W63 HydrophobicContact CE-CZ2 4.04Å; M44-W63 HydrophobicContact CG-CD2 4.48Å; M44-W63 HydrophobicContact CG-CE3 4.48Å; M44-W63 HydrophobicContact CG-CH2 3.5Å; M44-W63 VanDerWaalsContact CG-CH2 3.5Å; M44-W63 HydrophobicContact CG-CZ2 3.48Å; M44-W63 VanDerWaalsContact CG-CZ2 3.48Å; M44-W63 HydrophobicContact CG-CZ3 4.03Å; M44-A217 HydrophobicContact CE-CB 4.27Å; M44-A217 HydrophobicContact CG-CB 3.82Å; M44-A217 HydrophobicContact SD-CB 3.85Å; M44-T221 VanDerWaalsContact CE-OG1 3.24Å; M44-T221 WeakPolarHBondContact CE-OG1 3.07Å; M44-F251 HydrophobicContact SD-CB 4.42Å; M44-F251 HydrophobicContact SD-CD1 3.88Å; M44-F251 HydrophobicContact SD-CG 4.49Å
45L96.9Very high96.3Very high47 Ų4752 Ų5225%0.24624%0.244CC..Hα-helixtrans-59.1-44.7171.4-175.771000111.2A41 P42 I43 H49 H60 W63A41-L45 VanDerWaalsContact O-CB 3.32Å; A41-L45 WeakPolarHBondContact O-CB 3.28Å; A41-L45 PolarHBondContact O-N 2.79Å; P42-L45 PolarHBondContact O-N 3.16Å; I43-L45 PolarHBondContact O-N 3.19Å; L45-H49 PolarHBondContact O-N 2.94Å; L45-H60 HydrophobicContact CD1-CB 3.65Å; L45-W63 HydrophobicContact CB-CB 4.14Å; L45-W63 HydrophobicContact CD1-CB 4.15Å
46Y96.8Very high96Very high165 Ų16549.2 Ų49.265%0.64724%0.238SC*.Hα-helixtrans-64.9-49.9175.4170.1-101.2000111.8P42 I43 M44 L48 H49P42-Y46 PolarHBondContact O-N 3.34Å; I43-Y46 WeakPolarHBondContact O-CB 3.2Å; I43-Y46 PolarHBondContact O-N 3.38Å; M44-Y46 VanDerWaalsContact C-N 3.32Å; M44-Y46 PolarHBondContact O-N 3.33Å; Y46-L48 PolarHBondContact O-N 3.27Å; Y46-H49 VanDerWaalsContact O-CB 3.28Å; Y46-H49 WeakPolarHBondContact O-CB 3.31Å; Y46-H49 PolarHBondContact O-N 2.8Å
47L96.2Very high95.9Very high7 Ų750 Ų504%0.03725%0.246CC..Hα-helixtrans-66.4-34-175.3-70.6177.9000113.4I43 M44 P50 W242 F251 H253I43-L47 HydrophobicContact CG2-CD1 3.62Å; I43-L47 HydrophobicContact CG2-CG 4.19Å; I43-L47 WeakPolarHBondContact O-CB 3.48Å; I43-L47 VanDerWaalsContact O-CG 3.28Å; I43-L47 WeakPolarHBondContact O-CG 3.38Å; I43-L47 PolarHBondContact O-N 2.8Å; M44-L47 PolarHBondContact O-N 3.48Å; M44-L47 HydrophobicContact SD-CD1 4.19Å; L47-P50 WeakPolarHBondContact O-CD 3.45Å; L47-W242 HydrophobicContact CD1-CB 4.04Å; L47-W242 HydrophobicContact CD1-CG 4.4Å; L47-W242 HydrophobicContact CD2-CB 3.8Å; L47-W242 HydrophobicContact CD2-CD2 4.47Å; L47-W242 HydrophobicContact CD2-CG 3.76Å; L47-F251 HydrophobicContact CD1-CB 3.75Å; L47-H253 HydrophobicContact CB-CB 3.79Å; L47-H253 HydrophobicContact CD1-CB 4.2Å; L47-H253 HydrophobicContact CD2-CB 4.22Å; L47-H253 HydrophobicContact CG-CB 4.28Å
48L95.9Very high95.6Very high1 Ų151 Ų511%0.00525%0.254CS..Hα-helixtrans-88.2-5.4178.5-66.2172.6000113.6M44 Y46 P50 Y51 A52 A224 I254M44-L48 HydrophobicContact CE-CD1 4.17Å; M44-L48 HydrophobicContact CE-CG 4.28Å; M44-L48 WeakPolarHBondContact O-CB 3.5Å; M44-L48 WeakPolarHBondContact O-CG 3.4Å; M44-L48 PolarHBondContact O-N 3.25Å; Y46-L48 PolarHBondContact O-N 3.27Å; L48-P50 VanDerWaalsContact C-CD 3.48Å; L48-Y51 PolarHBondContact O-N 3.33Å; L48-Y51 VanDerWaalsContact O-N 3.14Å; L48-A52 PolarHBondContact O-N 2.9Å; L48-A224 HydrophobicContact CD2-CB 4.17Å; L48-I254 HydrophobicContact CD2-CG2 3.89Å
49H95.8Very high95.5Very high64 Ų6447.9 Ų47.930%0.29624%0.241SC..Hα-helixtrans-54.8-43.8-178.3-176.568.5000114.2L45 Y46 Y51 A52 K53 H60L45-H49 PolarHBondContact O-N 2.94Å; Y46-H49 VanDerWaalsContact O-CB 3.28Å; Y46-H49 WeakPolarHBondContact O-CB 3.31Å; Y46-H49 PolarHBondContact O-N 2.8Å; H49-Y51 VanDerWaalsContact C-N 3.29Å; H49-Y51 PolarHBondContact O-N 2.81Å; H49-A52 PolarHBondContact O-N 2.94Å; H49-K53 WeakPolarHBondContact NE2-CD 3.23Å; H49-K53 WeakPolarHBondContact NE2-CE 3.38Å; H49-K53 PolarHBondContact NE2-NZ 3.4Å; H49-K53 PolarHBondContact O-N 3.3Å; H49-H60 AromaticContact CE1-CE1 3.75Å; H49-H60 AromaticContact CE1-NE2 3.98Å; H49-H60 AromaticContact CG-NE2 3.94Å; H49-H60 AromaticContact ND1-CE1 3.2Å; H49-H60 PolarHBondContact ND1-CE1 3.47Å; H49-H60 AromaticContact ND1-NE2 3.02Å; H49-H60 PolarHBondContact ND1-NE2 2.84Å
50P93.8Very high95.4Very high66 Ų6644.9 Ų44.943%0.42923%0.225SC..Hα-helixtrans-60.7-39.1178.3-23.735.6000112.7L47 L48 Q54L47-P50 WeakPolarHBondContact O-CD 3.45Å; L48-P50 VanDerWaalsContact C-CD 3.48Å; P50-Q54 PolarHBondContact O-N 2.95Å
51Y95.3Very high95.4Very high0 Ų049.8 Ų49.80%025%0.249CC..Hα-helixtrans-70.3-44.2175.2160.6-108.4000112.2L48 H49 K53 Q54 R55 I59 W103 A224 D227 A228 I232 I254L48-Y51 PolarHBondContact O-N 3.33Å; L48-Y51 VanDerWaalsContact O-N 3.14Å; H49-Y51 VanDerWaalsContact C-N 3.29Å; H49-Y51 PolarHBondContact O-N 2.81Å; Y51-K53 PolarHBondContact O-N 2.64Å; Y51-Q54 PolarHBondContact O-N 3.37Å; Y51-R55 HydrophobicContact CD2-CB 4.01Å; Y51-R55 HydrophobicContact CE2-CB 3.6Å; Y51-R55 HydrophobicContact CE2-CG 3.79Å; Y51-R55 WeakPolarHBondContact O-CB 3.11Å; Y51-R55 PolarHBondContact O-N 3.42Å; Y51-I59 HydrophobicContact CD1-CD1 3.74Å; Y51-I59 HydrophobicContact CE1-CD1 3.16Å; Y51-I59 HydrophobicContact CE1-CG1 4.1Å; Y51-I59 HydrophobicContact CE1-CG2 4.4Å; Y51-W103 AromaticContact CE1-NE1 3.75Å; Y51-W103 AromaticContact CZ-NE1 3.89Å; Y51-W103 PolarHBondContact OH-NE1 3.42Å; Y51-W103 VanDerWaalsContact OH-NE1 3.07Å; Y51-A224 HydrophobicContact CD1-CB 3.83Å; Y51-A224 HydrophobicContact CE1-CB 3.46Å; Y51-A224 VanDerWaalsContact CE1-CB 3.46Å; Y51-D227 VanDerWaalsContact OH-CG 3.27Å; Y51-D227 PolarHBondContact OH-OD2 3.43Å; Y51-A228 HydrophobicContact CD2-CB 4.1Å; Y51-A228 HydrophobicContact CE2-CB 3.88Å; Y51-I232 HydrophobicContact CD2-CD1 4.3Å; Y51-I232 HydrophobicContact CE2-CD1 4.43Å; Y51-I254 VanDerWaalsContact CB-CG2 3.48Å; Y51-I254 HydrophobicContact CD1-CG2 4.46Å; Y51-I254 HydrophobicContact CD2-CD1 4.08Å; Y51-I254 HydrophobicContact CG-CD1 4.35Å; Y51-I254 HydrophobicContact CG-CG2 4.01Å
52A95.3Very high95.3Very high0 Ų050 Ų500%025%0.25CS..Hα-helixtrans-57-38.8175.800000112L48 H49 Q54 S56 L57 I59L48-A52 PolarHBondContact O-N 2.9Å; H49-A52 PolarHBondContact O-N 2.94Å; A52-Q54 PolarHBondContact O-N 3.42Å; A52-S56 CarbonylContact O-C 3.5Å; A52-S56 WeakPolarHBondContact O-CA 2.68Å; A52-S56 PolarHBondContact O-N 2.84Å; A52-L57 PolarHBondContact O-N 2.87Å; A52-I59 HydrophobicContact CB-CB 4.04Å; A52-I59 HydrophobicContact CB-CD1 4.43Å; A52-I59 HydrophobicContact CB-CG2 4.24Å
53K95Very high95.3Very high147 Ų14747.4 Ų47.464%0.63923%0.233SC*.Hα-helixtrans-63-37175.1-91-175.6165.11600114H49 Y51 L57H49-K53 WeakPolarHBondContact NE2-CD 3.23Å; H49-K53 WeakPolarHBondContact NE2-CE 3.38Å; H49-K53 PolarHBondContact NE2-NZ 3.4Å; H49-K53 PolarHBondContact O-N 3.3Å; Y51-K53 PolarHBondContact O-N 2.64Å; K53-L57 HydrophobicContact CG-CD2 4.38Å
54Q93.3Very high95.3Very high77 Ų7749.3 Ų49.336%0.3624%0.243SC..Hα-helixtrans-83.6-31.1179.6-65.2-160.534.100112.8P50 Y51 A52 I232 L256P50-Q54 PolarHBondContact O-N 2.95Å; Y51-Q54 PolarHBondContact O-N 3.37Å; A52-Q54 PolarHBondContact O-N 3.42Å; Q54-I232 HydrophobicContact CB-CD1 4.06Å; Q54-L256 HydrophobicContact CB-CD1 3.92Å; Q54-L256 HydrophobicContact CG-CD1 3.82Å
55R92.6Very high95.3Very high53 Ų5351.4 Ų51.420%0.225%0.253CS..Hα-helixtrans-102.1-58.9-171.9-176.664.917985.89.1114.1Y51 I59 D227 E231 I232Y51-R55 HydrophobicContact CD2-CB 4.01Å; Y51-R55 HydrophobicContact CE2-CB 3.6Å; Y51-R55 HydrophobicContact CE2-CG 3.79Å; Y51-R55 WeakPolarHBondContact O-CB 3.11Å; Y51-R55 PolarHBondContact O-N 3.42Å; R55-I59 HydrophobicContact CB-CD1 4.12Å; R55-I59 HydrophobicContact CG-CD1 4.14Å; R55-D227 WeakPolarHBondContact CD-OD2 3.35Å; R55-D227 WeakPolarHBondContact CG-OD2 3.26Å; R55-D227 IonicContact CZ-OD1 3.83Å; R55-D227 IonicContact CZ-OD2 3.13Å; R55-D227 IonicContact NE-OD1 3.16Å; R55-D227 PolarHBondContact NE-OD1 3.18Å; R55-D227 IonicContact NE-OD2 3.13Å; R55-D227 PolarHBondContact NE-OD2 3.16Å; R55-D227 IonicContact NH2-OD1 3.74Å; R55-D227 PolarHBondContact NH2-OD1 3.32Å; R55-D227 VanDerWaalsContact NH2-OD1 3.13Å; R55-D227 IonicContact NH2-OD2 2.7Å; R55-E231 IonicContact NH2-OE2 2.65Å; R55-I232 HydrophobicContact CB-CD1 4.31Å
56S92.8Very high95.4Very high51 Ų5149.7 Ų49.736%0.35724%0.244SC..  trans-175.4131.8177.6-176.60000111.1A52 A58 I59A52-S56 CarbonylContact O-C 3.5Å; A52-S56 WeakPolarHBondContact O-CA 2.68Å; A52-S56 PolarHBondContact O-N 2.84Å; S56-A58 PolarHBondContact O-N 3.36Å; S56-A58 VanDerWaalsContact O-N 3.15Å; S56-A58 WeakPolarHBondContact OG-CB 3.07Å; S56-A58 PolarHBondContact OG-N 3.21Å; S56-I59 WeakPolarHBondContact O-CB 3.06Å; S56-I59 VanDerWaalsContact O-CD1 3.31Å; S56-I59 WeakPolarHBondContact O-CD1 3.48Å; S56-I59 WeakPolarHBondContact O-CG1 3.32Å; S56-I59 PolarHBondContact O-N 2.98Å
57L94.1Very high95.5Very high105 Ų10544.1 Ų44.155%0.5523%0.225SC..THydrogen-bonded Turntrans-66.6-13.3174.4-65.2178000113.3A52 K53 I59 H60A52-L57 PolarHBondContact O-N 2.87Å; K53-L57 HydrophobicContact CG-CD2 4.38Å; L57-I59 PolarHBondContact O-N 3.37Å; L57-I59 VanDerWaalsContact O-N 3.13Å; L57-H60 WeakPolarHBondContact O-CB 3.49Å; L57-H60 PolarHBondContact O-N 3.48Å
58A92.8Very high95.6Very high24 Ų2448.5 Ų48.520%0.19824%0.244CC..THydrogen-bonded Turntrans-59.1-22.4173.700000112.8S56 H60 M61 T102S56-A58 PolarHBondContact O-N 3.36Å; S56-A58 VanDerWaalsContact O-N 3.15Å; S56-A58 WeakPolarHBondContact OG-CB 3.07Å; S56-A58 PolarHBondContact OG-N 3.21Å; A58-H60 PolarHBondContact O-N 3.2Å; A58-M61 HydrophobicContact CB-CE 4.26Å; A58-M61 VanDerWaalsContact O-CB 3.26Å; A58-M61 WeakPolarHBondContact O-CB 3.29Å; A58-M61 PolarHBondContact O-N 3.44Å; A58-T102 HydrophobicContact CB-CG2 3.96Å
59I94.4Very high95.7Very high3 Ų348.7 Ų48.72%0.01525%0.245CC..Hα-helixtrans-59.4-32.6174.4-70.3155.5000111.8Y51 A52 R55 S56 L57 M61 V62 W103Y51-I59 HydrophobicContact CD1-CD1 3.74Å; Y51-I59 HydrophobicContact CE1-CD1 3.16Å; Y51-I59 HydrophobicContact CE1-CG1 4.1Å; Y51-I59 HydrophobicContact CE1-CG2 4.4Å; A52-I59 HydrophobicContact CB-CB 4.04Å; A52-I59 HydrophobicContact CB-CD1 4.43Å; A52-I59 HydrophobicContact CB-CG2 4.24Å; R55-I59 HydrophobicContact CB-CD1 4.12Å; R55-I59 HydrophobicContact CG-CD1 4.14Å; S56-I59 WeakPolarHBondContact O-CB 3.06Å; S56-I59 VanDerWaalsContact O-CD1 3.31Å; S56-I59 WeakPolarHBondContact O-CD1 3.48Å; S56-I59 WeakPolarHBondContact O-CG1 3.32Å; S56-I59 PolarHBondContact O-N 2.98Å; L57-I59 PolarHBondContact O-N 3.37Å; L57-I59 VanDerWaalsContact O-N 3.13Å; I59-M61 PolarHBondContact O-N 3.25Å; I59-V62 WeakPolarHBondContact O-CB 3.28Å; I59-V62 PolarHBondContact O-N 2.97Å; I59-W103 HydrophobicContact CB-CZ2 4.45Å; I59-W103 HydrophobicContact CG1-CZ2 4.11Å; I59-W103 HydrophobicContact CG2-CH2 4.36Å; I59-W103 HydrophobicContact CG2-CZ2 3.7Å
60H95.9Very high95.8Very high36 Ų3645.7 Ų45.717%0.16723%0.231CC..Hα-helixtrans-62.6-30174.8-65.5159.3000112.4L45 H49 L57 A58 V62 W63 I64L45-H60 HydrophobicContact CD1-CB 3.65Å; H49-H60 AromaticContact CE1-CE1 3.75Å; H49-H60 AromaticContact CE1-NE2 3.98Å; H49-H60 AromaticContact CG-NE2 3.94Å; H49-H60 AromaticContact ND1-CE1 3.2Å; H49-H60 PolarHBondContact ND1-CE1 3.47Å; H49-H60 AromaticContact ND1-NE2 3.02Å; H49-H60 PolarHBondContact ND1-NE2 2.84Å; L57-H60 WeakPolarHBondContact O-CB 3.49Å; L57-H60 PolarHBondContact O-N 3.48Å; A58-H60 PolarHBondContact O-N 3.2Å; H60-V62 PolarHBondContact O-N 2.84Å; H60-W63 PolarHBondContact O-N 2.99Å; H60-I64 HydrophobicContact CB-CD1 4.32Å; H60-I64 VanDerWaalsContact O-CG1 3.3Å; H60-I64 WeakPolarHBondContact O-CG1 3.21Å; H60-I64 PolarHBondContact O-N 3.48Å
61M96.7Very high96Very high106 Ų10646.3 Ų46.352%0.52223%0.23SC..Hα-helixtrans-61.3-36.1179.4-60.2-169.7-152.400111.4A58 I59 W63 I64 M65 V98A58-M61 HydrophobicContact CB-CE 4.26Å; A58-M61 VanDerWaalsContact O-CB 3.26Å; A58-M61 WeakPolarHBondContact O-CB 3.29Å; A58-M61 PolarHBondContact O-N 3.44Å; I59-M61 PolarHBondContact O-N 3.25Å; M61-W63 PolarHBondContact O-N 2.9Å; M61-I64 PolarHBondContact O-N 3.28Å; M61-M65 VanDerWaalsContact O-CB 3.32Å; M61-M65 WeakPolarHBondContact O-CB 3.48Å; M61-M65 WeakPolarHBondContact O-CG 3.36Å; M61-M65 PolarHBondContact O-N 2.68Å; M61-V98 HydrophobicContact CB-CG1 3.96Å
62V96.4Very high96.2Very high5 Ų548.6 Ų48.63%0.0324%0.241CC..Hα-helixtrans-56.1-51.2177.4178.10000110.5I59 H60 M65 M66 V95 V98 W103I59-V62 WeakPolarHBondContact O-CB 3.28Å; I59-V62 PolarHBondContact O-N 2.97Å; H60-V62 PolarHBondContact O-N 2.84Å; V62-M65 PolarHBondContact O-N 3.26Å; V62-M66 WeakPolarHBondContact O-CG 3.25Å; V62-M66 PolarHBondContact O-N 3.42Å; V62-V95 HydrophobicContact CG1-CG1 4.31Å; V62-V98 HydrophobicContact CG2-CG1 3.8Å; V62-W103 HydrophobicContact CB-CH2 4.36Å; V62-W103 HydrophobicContact CB-CZ3 4.4Å; V62-W103 HydrophobicContact CG1-CH2 4.22Å; V62-W103 HydrophobicContact CG1-CZ3 3.98Å; V62-W103 HydrophobicContact CG2-CH2 4.15Å; V62-W103 HydrophobicContact CG2-CZ3 3.97Å
63W97Very high96.3Very high1 Ų148.7 Ų48.70%0.00424%0.241CC..Hα-helixtrans-78.4-30.2-175.9-73.5109.3000113.8V40 A41 M44 L45 H60 M61 M65 M66 I67 V216 A217 S220V40-W63 HydrophobicContact CG1-CH2 4.47Å; V40-W63 HydrophobicContact CG1-CZ3 4.36Å; A41-W63 HydrophobicContact CB-CE3 3.67Å; A41-W63 HydrophobicContact CB-CZ3 4.21Å; M44-W63 HydrophobicContact CB-CD2 3.57Å; M44-W63 HydrophobicContact CB-CE3 3.9Å; M44-W63 HydrophobicContact CB-CG 4.19Å; M44-W63 HydrophobicContact CB-CH2 3.68Å; M44-W63 HydrophobicContact CB-CZ2 3.32Å; M44-W63 HydrophobicContact CB-CZ3 3.95Å; M44-W63 HydrophobicContact CE-CZ2 4.04Å; M44-W63 HydrophobicContact CG-CD2 4.48Å; M44-W63 HydrophobicContact CG-CE3 4.48Å; M44-W63 HydrophobicContact CG-CH2 3.5Å; M44-W63 VanDerWaalsContact CG-CH2 3.5Å; M44-W63 HydrophobicContact CG-CZ2 3.48Å; M44-W63 VanDerWaalsContact CG-CZ2 3.48Å; M44-W63 HydrophobicContact CG-CZ3 4.03Å; L45-W63 HydrophobicContact CB-CB 4.14Å; L45-W63 HydrophobicContact CD1-CB 4.15Å; H60-W63 PolarHBondContact O-N 2.99Å; M61-W63 PolarHBondContact O-N 2.9Å; W63-M65 VanDerWaalsContact C-N 3.31Å; W63-M66 HydrophobicContact CE3-CB 3.87Å; W63-M66 HydrophobicContact CE3-CG 3.86Å; W63-M66 HydrophobicContact CZ3-CB 4.31Å; W63-M66 HydrophobicContact CZ3-CE 4.48Å; W63-M66 HydrophobicContact CZ3-CG 4.12Å; W63-M66 PolarHBondContact O-N 2.9Å; W63-I67 PolarHBondContact O-N 3.25Å; W63-V216 HydrophobicContact CH2-CG1 4.05Å; W63-V216 HydrophobicContact CZ2-CG1 4.49Å; W63-A217 HydrophobicContact CH2-CB 3.93Å; W63-A217 HydrophobicContact CZ2-CB 4.45Å; W63-S220 VanDerWaalsContact CZ2-OG 3.25Å; W63-S220 WeakPolarHBondContact CZ2-OG 3.46Å
64I97.9Very high96.5Very high77 Ų7742.1 Ų42.140%0.39521%0.214SC..Hα-helixtrans-61.9-44.2168.5-68.9166000109.7H60 M61 M66 I67 F68H60-I64 HydrophobicContact CB-CD1 4.32Å; H60-I64 VanDerWaalsContact O-CG1 3.3Å; H60-I64 WeakPolarHBondContact O-CG1 3.21Å; H60-I64 PolarHBondContact O-N 3.48Å; M61-I64 PolarHBondContact O-N 3.28Å; I64-M66 VanDerWaalsContact C-N 3.33Å; I64-M66 PolarHBondContact O-N 3.46Å; I64-I67 WeakPolarHBondContact O-CB 3.33Å; I64-I67 PolarHBondContact O-N 3.23Å; I64-I67 VanDerWaalsContact O-N 3.16Å; I64-F68 HydrophobicContact CG2-CD2 4.45Å; I64-F68 HydrophobicContact CG2-CE2 4.18Å; I64-F68 WeakPolarHBondContact O-CD2 3.4Å; I64-F68 PolarHBondContact O-N 3.36Å
65M97.6Very high96.7Very high45 Ų4542.2 Ų42.222%0.22221%0.212CC..Hα-helixtrans-69.3-30.3178.2-69-171.374.500112.7M61 V62 W63 I67 F68 V69 W94 V95 V98M61-M65 VanDerWaalsContact O-CB 3.32Å; M61-M65 WeakPolarHBondContact O-CB 3.48Å; M61-M65 WeakPolarHBondContact O-CG 3.36Å; M61-M65 PolarHBondContact O-N 2.68Å; V62-M65 PolarHBondContact O-N 3.26Å; W63-M65 VanDerWaalsContact C-N 3.31Å; M65-I67 PolarHBondContact O-N 3.01Å; M65-F68 CarbonylContact O-C 3.55Å; M65-F68 WeakPolarHBondContact O-CA 3.42Å; M65-F68 WeakPolarHBondContact O-CB 3.48Å; M65-F68 PolarHBondContact O-N 3.41Å; M65-V69 PolarHBondContact O-N 3.43Å; M65-W94 HydrophobicContact CE-CB 3.38Å; M65-W94 HydrophobicContact CE-CG 4.44Å; M65-V95 HydrophobicContact CB-CG2 3.36Å; M65-V98 HydrophobicContact SD-CB 4.47Å; M65-V98 HydrophobicContact SD-CG2 3.72Å
66M97.8Very high97Very high11 Ų1139.9 Ų39.95%0.05420%0.203CC..Hα-helixtrans-61.3-30.4170.3-75.2-64.7-70.900113.2F37 A41 V62 W63 I64 F68 V69 G70 V95 V213 V216F37-M66 HydrophobicContact CD1-CE 3.71Å; F37-M66 WeakPolarHBondContact CD1-O 3.25Å; F37-M66 HydrophobicContact CE1-CE 3.47Å; F37-M66 VanDerWaalsContact CE1-CE 3.47Å; A41-M66 HydrophobicContact CB-CB 4.01Å; V62-M66 WeakPolarHBondContact O-CG 3.25Å; V62-M66 PolarHBondContact O-N 3.42Å; W63-M66 HydrophobicContact CE3-CB 3.87Å; W63-M66 HydrophobicContact CE3-CG 3.86Å; W63-M66 HydrophobicContact CZ3-CB 4.31Å; W63-M66 HydrophobicContact CZ3-CE 4.48Å; W63-M66 HydrophobicContact CZ3-CG 4.12Å; W63-M66 PolarHBondContact O-N 2.9Å; I64-M66 VanDerWaalsContact C-N 3.33Å; I64-M66 PolarHBondContact O-N 3.46Å; M66-F68 VanDerWaalsContact C-N 3.33Å; M66-V69 PolarHBondContact O-N 2.83Å; M66-V69 HydrophobicContact SD-CG2 4.41Å; M66-G70 PolarHBondContact O-N 3.45Å; M66-G70 VanDerWaalsContact O-N 3.12Å; M66-V95 HydrophobicContact CG-CG1 4.16Å; M66-V95 HydrophobicContact SD-CG1 3.79Å; M66-V95 HydrophobicContact SD-CG2 4.3Å; M66-V213 HydrophobicContact CE-CG2 3.94Å; M66-V216 HydrophobicContact CE-CB 4.37Å; M66-V216 HydrophobicContact CE-CG1 4.07Å; M66-V216 HydrophobicContact SD-CG1 4.45Å
67I98.3Very high97.2Very high47 Ų4737.5 Ų37.524%0.24119%0.186CC..Hα-helixtrans-64.6-41.5171.4-63.8169.4000110.1F38 A41 P42 W63 I64 M65 G70 L71F38-I67 HydrophobicContact CD1-CG2 3.64Å; F38-I67 HydrophobicContact CE1-CG2 3.6Å; A41-I67 HydrophobicContact CB-CG1 3.67Å; P42-I67 HydrophobicContact CG-CD1 4.26Å; W63-I67 PolarHBondContact O-N 3.25Å; I64-I67 WeakPolarHBondContact O-CB 3.33Å; I64-I67 PolarHBondContact O-N 3.23Å; I64-I67 VanDerWaalsContact O-N 3.16Å; M65-I67 PolarHBondContact O-N 3.01Å; I67-G70 PolarHBondContact O-N 2.81Å; I67-L71 PolarHBondContact O-N 3.49Å
68F98.2Very high97.4Very high99 Ų9935.7 Ų35.743%0.43418%0.176SC..Hα-helixtrans-66.9-35.6175.6-76.6-81.4000112.8I64 M65 M66 G70 L71 F72I64-F68 HydrophobicContact CG2-CD2 4.45Å; I64-F68 HydrophobicContact CG2-CE2 4.18Å; I64-F68 WeakPolarHBondContact O-CD2 3.4Å; I64-F68 PolarHBondContact O-N 3.36Å; M65-F68 CarbonylContact O-C 3.55Å; M65-F68 WeakPolarHBondContact O-CA 3.42Å; M65-F68 WeakPolarHBondContact O-CB 3.48Å; M65-F68 PolarHBondContact O-N 3.41Å; M66-F68 VanDerWaalsContact C-N 3.33Å; F68-G70 VanDerWaalsContact C-N 3.35Å; F68-L71 HydrophobicContact CD1-CD2 4.19Å; F68-L71 HydrophobicContact CE1-CD2 4.47Å; F68-L71 PolarHBondContact O-N 3.44Å; F68-F72 HydrophobicContact CB-CD2 4.25Å; F68-F72 HydrophobicContact CB-CE2 3.94Å; F68-F72 HydrophobicContact CD1-CE2 4.03Å; F68-F72 AromaticContact CD1-CZ 3.86Å; F68-F72 HydrophobicContact CD1-CZ 3.86Å; F68-F72 HydrophobicContact CG-CE2 4.43Å; F68-F72 WeakPolarHBondContact O-CB 3.31Å; F68-F72 WeakPolarHBondContact O-CD2 3.34Å; F68-F72 VanDerWaalsContact O-CG 3.31Å; F68-F72 WeakPolarHBondContact O-CG 3.41Å; F68-F72 PolarHBondContact O-N 2.74Å
69V98.4Very high97.6Very high6 Ų634.6 Ų34.64%0.03617%0.167CC..Hα-helixtrans-56.9-50.5170.8173.90000110.2F37 M65 M66 L71 F72 S73 S91 I92 V95F37-V69 HydrophobicContact CD1-CB 4.42Å; F37-V69 HydrophobicContact CD1-CG1 4.24Å; F37-V69 HydrophobicContact CE1-CB 4.35Å; F37-V69 HydrophobicContact CE1-CG1 3.73Å; F37-V69 HydrophobicContact CZ-CG1 4.34Å; M65-V69 PolarHBondContact O-N 3.43Å; M66-V69 PolarHBondContact O-N 2.83Å; M66-V69 HydrophobicContact SD-CG2 4.41Å; V69-L71 VanDerWaalsContact C-N 3.32Å; V69-L71 PolarHBondContact O-N 3.24Å; V69-F72 PolarHBondContact O-N 2.83Å; V69-S73 WeakPolarHBondContact O-CB 3.47Å; V69-S73 PolarHBondContact O-N 2.86Å; V69-S91 WeakPolarHBondContact CA-OG 3.4Å; V69-S91 WeakPolarHBondContact CG2-OG 3.32Å; V69-I92 HydrophobicContact CG1-CD1 4.45Å; V69-I92 HydrophobicContact CG1-CG1 3.76Å; V69-I92 HydrophobicContact CG2-CG1 4.19Å; V69-V95 HydrophobicContact CG2-CG2 3.66Å
70G98.3Very high97.7Very high0 Ų034.6 Ų34.60%017%0.167CC..Hα-helixtrans-58.8-41.6176.300000113.5M66 I67 F68 A74M66-G70 PolarHBondContact O-N 3.45Å; M66-G70 VanDerWaalsContact O-N 3.12Å; I67-G70 PolarHBondContact O-N 2.81Å; F68-G70 VanDerWaalsContact C-N 3.35Å; G70-A74 VanDerWaalsContact O-CB 3.29Å; G70-A74 WeakPolarHBondContact O-CB 3.28Å; G70-A74 PolarHBondContact O-N 2.75Å
71L98.6Very high97.8Very high79 Ų7932.9 Ų32.941%0.41416%0.159SC..Hα-helixtrans-63.4-47.4177.6179.866.1000112.4F38 I67 F68 V69 A74 Y75F38-L71 HydrophobicContact CE1-CB 4.33Å; F38-L71 HydrophobicContact CZ-CB 3.83Å; F38-L71 HydrophobicContact CZ-CD1 4.21Å; I67-L71 PolarHBondContact O-N 3.49Å; F68-L71 HydrophobicContact CD1-CD2 4.19Å; F68-L71 HydrophobicContact CE1-CD2 4.47Å; F68-L71 PolarHBondContact O-N 3.44Å; V69-L71 VanDerWaalsContact C-N 3.32Å; V69-L71 PolarHBondContact O-N 3.24Å; L71-A74 PolarHBondContact O-N 3.15Å; L71-Y75 WeakPolarHBondContact O-CB 3.33Å; L71-Y75 PolarHBondContact O-N 2.95Å
72F98.5Very high97.7Very high49 Ų4930.6 Ų30.622%0.21515%0.146CC..Hα-helixtrans-75.9-34.9-176.9-62.5-39.1000112.3F68 V69 Y75 F76 L87 D88F68-F72 HydrophobicContact CB-CD2 4.25Å; F68-F72 HydrophobicContact CB-CE2 3.94Å; F68-F72 HydrophobicContact CD1-CE2 4.03Å; F68-F72 AromaticContact CD1-CZ 3.86Å; F68-F72 HydrophobicContact CD1-CZ 3.86Å; F68-F72 HydrophobicContact CG-CE2 4.43Å; F68-F72 WeakPolarHBondContact O-CB 3.31Å; F68-F72 WeakPolarHBondContact O-CD2 3.34Å; F68-F72 VanDerWaalsContact O-CG 3.31Å; F68-F72 WeakPolarHBondContact O-CG 3.41Å; F68-F72 PolarHBondContact O-N 2.74Å; V69-F72 PolarHBondContact O-N 2.83Å; F72-Y75 PolarHBondContact O-N 2.8Å; F72-F76 WeakPolarHBondContact O-CB 3.45Å; F72-F76 PolarHBondContact O-N 2.6Å; F72-L87 HydrophobicContact CB-CB 3.88Å; F72-L87 HydrophobicContact CD1-CB 3.94Å; F72-L87 HydrophobicContact CD1-CD1 4.07Å; F72-L87 HydrophobicContact CD1-CG 4.43Å; F72-L87 HydrophobicContact CD2-CB 4.17Å; F72-L87 HydrophobicContact CE1-CD1 4.22Å; F72-L87 HydrophobicContact CE1-CD2 4.32Å; F72-L87 HydrophobicContact CG-CB 3.75Å; F72-L87 HydrophobicContact CZ-CD2 4.28Å; F72-D88 HydrophobicContact CB-CB 4.42Å
73S98.2Very high97.7Very high2 Ų231.7 Ų31.71%0.01415%0.153CC..Hα-helixtrans-59-49.2167.8172.70000110.7S34 V69 Y75 F76 H77 D88 H209S34-S73 PolarHBondContact OG-OG 3.37Å; V69-S73 WeakPolarHBondContact O-CB 3.47Å; V69-S73 PolarHBondContact O-N 2.86Å; S73-Y75 VanDerWaalsContact C-N 3.33Å; S73-Y75 PolarHBondContact O-N 3.39Å; S73-F76 PolarHBondContact O-N 2.81Å; S73-F76 VanDerWaalsContact O-N 3.15Å; S73-H77 PolarHBondContact O-CD2 3.16Å; S73-H77 PolarHBondContact O-N 3.49Å; S73-H77 PolarHBondContact OG-CD2 3.29Å; S73-D88 WeakPolarHBondContact CB-OD1 3.42Å; S73-H209 PolarHBondContact OG-NE2 3.46Å
74A98.4Very high97.6Very high9 Ų931.7 Ų31.77%0.07415%0.153CC..Hα-helixtrans-59.5-42.8176.200000112.2T31 G70 L71 M78T31-A74 HydrophobicContact CG2-CB 4.36Å; G70-A74 VanDerWaalsContact O-CB 3.29Å; G70-A74 WeakPolarHBondContact O-CB 3.28Å; G70-A74 PolarHBondContact O-N 2.75Å; L71-A74 PolarHBondContact O-N 3.15Å; A74-M78 WeakPolarHBondContact O-CB 3.42Å; A74-M78 PolarHBondContact O-N 3.25Å
75Y98.3Very high97.5Very high79 Ų7928.1 Ų28.131%0.3114%0.135SC..Hα-helixtrans-64.3-40.3176175.4-108.5000112.5L71 F72 S73 T79 L87L71-Y75 WeakPolarHBondContact O-CB 3.33Å; L71-Y75 PolarHBondContact O-N 2.95Å; F72-Y75 PolarHBondContact O-N 2.8Å; S73-Y75 VanDerWaalsContact C-N 3.33Å; S73-Y75 PolarHBondContact O-N 3.39Å; Y75-T79 HydrophobicContact CD2-CG2 4.15Å; Y75-T79 HydrophobicContact CE2-CG2 3.83Å; Y75-T79 WeakPolarHBondContact O-CB 3.38Å; Y75-T79 WeakPolarHBondContact O-CG2 3.28Å; Y75-T79 PolarHBondContact O-N 2.86Å; Y75-T79 PolarHBondContact O-OG1 3.07Å; Y75-L87 HydrophobicContact CD1-CD1 4.31Å; Y75-L87 HydrophobicContact CE1-CD1 4.32Å
76F98.1Very high97.5Very high4 Ų426.3 Ų26.32%0.01813%0.126CC..Hα-helixtrans-62.7-56.5176.3174-129.2000110.8L12 W14 F72 S73 M78 T79 L80 Q85 D88L12-F76 HydrophobicContact CD2-CE1 4.24Å; L12-F76 HydrophobicContact CD2-CZ 3.99Å; W14-F76 AromaticContact NE1-CE1 3.66Å; F72-F76 WeakPolarHBondContact O-CB 3.45Å; F72-F76 PolarHBondContact O-N 2.6Å; S73-F76 PolarHBondContact O-N 2.81Å; S73-F76 VanDerWaalsContact O-N 3.15Å; F76-M78 PolarHBondContact O-N 2.83Å; F76-T79 CarbonylContact O-C 3.54Å; F76-T79 PolarHBondContact O-N 3.45Å; F76-T79 PolarHBondContact O-OG1 3.13Å; F76-L80 HydrophobicContact CD2-CD2 4.36Å; F76-L80 HydrophobicContact CE1-CD2 4.26Å; F76-L80 HydrophobicContact CE2-CD2 3.74Å; F76-L80 HydrophobicContact CZ-CD2 3.67Å; F76-L80 VanDerWaalsContact O-CA 3.3Å; F76-L80 WeakPolarHBondContact O-CA 3.13Å; F76-L80 PolarHBondContact O-N 3.4Å; F76-Q85 HydrophobicContact CD2-CB 3.88Å; F76-Q85 HydrophobicContact CE2-CB 3.61Å; F76-Q85 HydrophobicContact CE2-CG 4.26Å; F76-Q85 HydrophobicContact CZ-CB 4.11Å; F76-Q85 HydrophobicContact CZ-CG 4.25Å; F76-D88 HydrophobicContact CB-CB 4.2Å
77H98.1Very high97.4Very high0 Ų028.8 Ų28.80%014%0.139CC..Hα-helixtrans-66.1-26.9-178-67.4-67.6000113.6W14 E27 N30 T31 S73 T79 H205 H209W14-H77 AromaticContact CD1-CE1 3.45Å; W14-H77 VanDerWaalsContact CD1-CE1 3.45Å; W14-H77 AromaticContact CD1-ND1 3.74Å; W14-H77 AromaticContact NE1-CE1 3.29Å; W14-H77 PolarHBondContact NE1-CE1 3.17Å; W14-H77 VanDerWaalsContact NE1-CE1 3.29Å; W14-H77 AromaticContact NE1-ND1 3.97Å; E27-H77 HydrophobicContact CB-CB 4.3Å; E27-H77 PolarHBondContact N-O 3.11Å; E27-H77 IonicContact OE2-CE1 3.26Å; E27-H77 IonicContact OE2-CG 3.76Å; E27-H77 IonicContact OE2-ND1 3.57Å; E27-H77 PolarHBondContact OE2-ND1 2.93Å; N30-H77 HydrophobicContact CB-CB 3.87Å; N30-H77 WeakPolarHBondContact CB-ND1 3.23Å; T31-H77 WeakPolarHBondContact OG1-CB 3.44Å; T31-H77 PolarHBondContact OG1-O 2.7Å; S73-H77 PolarHBondContact O-CD2 3.16Å; S73-H77 PolarHBondContact O-N 3.49Å; S73-H77 PolarHBondContact OG-CD2 3.29Å; H77-T79 VanDerWaalsContact C-N 3.31Å; H77-H205 AromaticContact CE1-CD2 3.37Å; H77-H205 PolarHBondContact CE1-CD2 3.03Å; H77-H205 AromaticContact CE1-NE2 3.36Å; H77-H205 PolarHBondContact CE1-NE2 2.71Å; H77-H205 AromaticContact NE2-CD2 3.75Å; H77-H205 AromaticContact NE2-NE2 3.51Å; H77-H209 AromaticContact CD2-CE1 3.46Å; H77-H209 PolarHBondContact CD2-CE1 3.24Å; H77-H209 VanDerWaalsContact CD2-CE1 3.46Å; H77-H209 AromaticContact CD2-NE2 3.86Å; H77-H209 AromaticContact CE1-CE1 3.99Å; H77-H209 AromaticContact NE2-CE1 3.18Å; H77-H209 PolarHBondContact NE2-CE1 2.79Å; H77-H209 AromaticContact NE2-NE2 3.25Å; H77-H209 PolarHBondContact NE2-NE2 2.66Å
78M97.8Very high97.4Very high67 Ų6727.1 Ų27.133%0.3313%0.13SC..Hα-helixtrans-67.6-33.6172.8174.4179.2153.600112.3Y7 V25 V26 T31 A74 F76Y7-M78 VanDerWaalsContact OH-CE 3.25Å; Y7-M78 WeakPolarHBondContact OH-CE 3.45Å; V25-M78 HydrophobicContact CG1-CB 4.39Å; V25-M78 HydrophobicContact CG1-CG 4.45Å; V25-M78 HydrophobicContact CG2-CG 4.28Å; V26-M78 VanDerWaalsContact CG2-O 3.3Å; V26-M78 WeakPolarHBondContact CG2-O 3.27Å; V26-M78 PolarHBondContact N-O 3.41Å; T31-M78 HydrophobicContact CG2-CB 4.12Å; T31-M78 WeakPolarHBondContact OG1-CA 3.49Å; T31-M78 PolarHBondContact OG1-N 3.04Å; T31-M78 VanDerWaalsContact OG1-N 3.1Å; A74-M78 WeakPolarHBondContact O-CB 3.42Å; A74-M78 PolarHBondContact O-N 3.25Å; F76-M78 PolarHBondContact O-N 2.83Å
79T97.4Very high97.2Very high2 Ų223.2 Ų23.21%0.01211%0.113CC..Hα-helixtrans-114.3-23.6-169.162.30000114.6Y7 E8 Y75 F76 H77 S81Y7-T79 CarbonylContact C-O 3.07Å; Y7-T79 WeakPolarHBondContact CA-O 3.02Å; Y7-T79 HydrophobicContact CD2-CG2 4.32Å; Y7-T79 HydrophobicContact CE1-CG2 4.25Å; Y7-T79 HydrophobicContact CE2-CG2 3.76Å; E8-T79 PolarHBondContact N-O 3.46Å; Y75-T79 HydrophobicContact CD2-CG2 4.15Å; Y75-T79 HydrophobicContact CE2-CG2 3.83Å; Y75-T79 WeakPolarHBondContact O-CB 3.38Å; Y75-T79 WeakPolarHBondContact O-CG2 3.28Å; Y75-T79 PolarHBondContact O-N 2.86Å; Y75-T79 PolarHBondContact O-OG1 3.07Å; F76-T79 CarbonylContact O-C 3.54Å; F76-T79 PolarHBondContact O-N 3.45Å; F76-T79 PolarHBondContact O-OG1 3.13Å; H77-T79 VanDerWaalsContact C-N 3.31Å; T79-S81 PolarHBondContact O-N 3.4Å; T79-S81 VanDerWaalsContact O-N 3.11Å; T79-S81 WeakPolarHBondContact OG1-CB 3.45Å; T79-S81 PolarHBondContact OG1-N 3.35Å; T79-S81 PolarHBondContact OG1-OG 2.88Å
80L96.9Very high97.1Very high3 Ų324 Ų242%0.01612%0.118CC..  trans39.639.6-159.4-70-173.8000113E8 S9 S10 D13 V26 E27 F76E8-L80 CarbonylContact C-O 3.43Å; E8-L80 VanDerWaalsContact CA-O 3.26Å; E8-L80 WeakPolarHBondContact CA-O 3.46Å; E8-L80 HydrophobicContact CG-CB 4.33Å; E8-L80 PolarHBondContact N-O 3.27Å; S9-L80 PolarHBondContact N-O 3.49Å; S9-L80 VanDerWaalsContact N-O 3.13Å; S10-L80 WeakPolarHBondContact CB-O 3.32Å; S10-L80 PolarHBondContact N-O 2.92Å; D13-L80 HydrophobicContact CB-CD1 4.38Å; D13-L80 WeakPolarHBondContact OD1-CD1 3.48Å; V26-L80 HydrophobicContact CB-CG 4.24Å; V26-L80 HydrophobicContact CG1-CB 4.36Å; V26-L80 HydrophobicContact CG1-CD1 3.54Å; V26-L80 HydrophobicContact CG1-CG 3.78Å; E27-L80 HydrophobicContact CG-CD1 4.27Å; E27-L80 HydrophobicContact CG-CG 4.46Å; F76-L80 HydrophobicContact CD2-CD2 4.36Å; F76-L80 HydrophobicContact CE1-CD2 4.26Å; F76-L80 HydrophobicContact CE2-CD2 3.74Å; F76-L80 HydrophobicContact CZ-CD2 3.67Å; F76-L80 VanDerWaalsContact O-CA 3.3Å; F76-L80 WeakPolarHBondContact O-CA 3.13Å; F76-L80 PolarHBondContact O-N 3.4Å
81S96.9Very high97Very high0 Ų024.6 Ų24.60%012%0.121CC..  trans-83.6148.8178.265.40000111.7A6 S9 T79 V83 G84 Q85A6-S81 WeakPolarHBondContact O-CB 3.36Å; S9-S81 WeakPolarHBondContact OG-CA 3.49Å; T79-S81 PolarHBondContact O-N 3.4Å; T79-S81 VanDerWaalsContact O-N 3.11Å; T79-S81 WeakPolarHBondContact OG1-CB 3.45Å; T79-S81 PolarHBondContact OG1-N 3.35Å; T79-S81 PolarHBondContact OG1-OG 2.88Å; S81-V83 VanDerWaalsContact C-N 3.3Å; S81-V83 PolarHBondContact O-N 3.24Å; S81-G84 WeakPolarHBondContact O-CA 3.34Å; S81-G84 PolarHBondContact O-N 3.14Å; S81-G84 VanDerWaalsContact O-N 3.09Å; S81-G84 PolarHBondContact OG-N 3.42Å; S81-G84 VanDerWaalsContact OG-N 3.08Å; S81-Q85 PolarHBondContact O-N 3.2Å
82F94.9Very high96.9Very high57 Ų5722.7 Ų22.725%0.2511%0.111CC..Hα-helixtrans-57.7-43.1175.2177.1-91.1000112V4 S9 G84 Q85 M86 P138V4-F82 HydrophobicContact CB-CB 4.4Å; V4-F82 HydrophobicContact CB-CD1 4.14Å; V4-F82 HydrophobicContact CG1-CD1 4.26Å; V4-F82 PolarHBondContact O-N 3.28Å; S9-F82 PolarHBondContact OG-N 3.26Å; F82-G84 VanDerWaalsContact C-N 3.31Å; F82-G84 PolarHBondContact O-N 3.05Å; F82-Q85 WeakPolarHBondContact O-CB 3.45Å; F82-Q85 PolarHBondContact O-N 3.31Å; F82-M86 HydrophobicContact CD1-CG 4.19Å; F82-M86 HydrophobicContact CE1-CG 3.71Å; F82-M86 HydrophobicContact CZ-CG 3.91Å; F82-M86 HydrophobicContact CZ-SD 4.19Å; F82-M86 WeakPolarHBondContact O-CG 3.39Å; F82-M86 PolarHBondContact O-N 2.88Å; F82-P138 HydrophobicContact CE2-CB 4.49Å; F82-P138 HydrophobicContact CE2-CG 3.8Å; F82-P138 HydrophobicContact CZ-CG 4.06Å
83V95.5Very high96.8Very high29 Ų2921.7 Ų21.718%0.17611%0.108CC..Hα-helixtrans-64.1-39.6176.1172.80000111V4 F5 S81 M86 L87V4-V83 HydrophobicContact CB-CG2 4.07Å; V4-V83 HydrophobicContact CG2-CG2 3.9Å; V4-V83 WeakPolarHBondContact O-CG2 3.33Å; V4-V83 PolarHBondContact O-N 2.88Å; V4-V83 VanDerWaalsContact O-N 3.08Å; F5-V83 HydrophobicContact CD1-CB 3.98Å; F5-V83 HydrophobicContact CD1-CG1 4.09Å; F5-V83 HydrophobicContact CD1-CG2 3.91Å; F5-V83 HydrophobicContact CD2-CG2 4.23Å; F5-V83 HydrophobicContact CE1-CB 3.95Å; F5-V83 HydrophobicContact CE1-CG1 3.63Å; F5-V83 HydrophobicContact CE1-CG2 3.77Å; F5-V83 HydrophobicContact CE2-CG2 4.07Å; F5-V83 HydrophobicContact CG-CG2 4.15Å; F5-V83 HydrophobicContact CZ-CB 4.49Å; F5-V83 HydrophobicContact CZ-CG1 4.24Å; F5-V83 HydrophobicContact CZ-CG2 3.84Å; S81-V83 VanDerWaalsContact C-N 3.3Å; S81-V83 PolarHBondContact O-N 3.24Å; V83-M86 PolarHBondContact O-N 3.47Å; V83-L87 HydrophobicContact CG1-CD1 3.87Å; V83-L87 HydrophobicContact CG1-CG 4.22Å; V83-L87 WeakPolarHBondContact O-CB 3.38Å; V83-L87 VanDerWaalsContact O-CG 3.3Å; V83-L87 WeakPolarHBondContact O-CG 3.42Å; V83-L87 PolarHBondContact O-N 3.09Å
84G96.6Very high96.8Very high0 Ų025.7 Ų25.70%012%0.123CC..Hα-helixtrans-57-49.3173.100000112S81 F82 M86 L87 D88S81-G84 WeakPolarHBondContact O-CA 3.34Å; S81-G84 PolarHBondContact O-N 3.14Å; S81-G84 VanDerWaalsContact O-N 3.09Å; S81-G84 PolarHBondContact OG-N 3.42Å; S81-G84 VanDerWaalsContact OG-N 3.08Å; F82-G84 VanDerWaalsContact C-N 3.31Å; F82-G84 PolarHBondContact O-N 3.05Å; G84-M86 VanDerWaalsContact C-N 3.33Å; G84-M86 PolarHBondContact O-N 3.21Å; G84-L87 PolarHBondContact O-N 2.99Å; G84-D88 PolarHBondContact O-N 3.02Å
85Q95.8Very high96.7Very high3 Ų325.9 Ų25.91%0.01412%0.123CC..Hα-helixtrans-55.2-49.5177.1-174.6-168.6-14.700111.1S10 F76 S81 F82 L87 D88 E89S10-Q85 PolarHBondContact OG-OE1 2.96Å; F76-Q85 HydrophobicContact CD2-CB 3.88Å; F76-Q85 HydrophobicContact CE2-CB 3.61Å; F76-Q85 HydrophobicContact CE2-CG 4.26Å; F76-Q85 HydrophobicContact CZ-CB 4.11Å; F76-Q85 HydrophobicContact CZ-CG 4.25Å; S81-Q85 PolarHBondContact O-N 3.2Å; F82-Q85 WeakPolarHBondContact O-CB 3.45Å; F82-Q85 PolarHBondContact O-N 3.31Å; Q85-L87 PolarHBondContact O-N 2.97Å; Q85-D88 PolarHBondContact O-N 3.39Å; Q85-E89 HydrophobicContact CG-CG 4.41Å; Q85-E89 PolarHBondContact NE2-OE1 3.03Å; Q85-E89 WeakPolarHBondContact O-CG 3.5Å; Q85-E89 PolarHBondContact O-N 3Å
86M95.9Very high96.6Very high7 Ų724.1 Ų24.13%0.03412%0.119CC..Hα-helixtrans-64.2-40.7-178.9-69.3-54.8-44.700112.1F82 V83 G84 L90 F135 P138F82-M86 HydrophobicContact CD1-CG 4.19Å; F82-M86 HydrophobicContact CE1-CG 3.71Å; F82-M86 HydrophobicContact CZ-CG 3.91Å; F82-M86 HydrophobicContact CZ-SD 4.19Å; F82-M86 WeakPolarHBondContact O-CG 3.39Å; F82-M86 PolarHBondContact O-N 2.88Å; V83-M86 PolarHBondContact O-N 3.47Å; G84-M86 VanDerWaalsContact C-N 3.33Å; G84-M86 PolarHBondContact O-N 3.21Å; M86-L90 HydrophobicContact CB-CD1 4.48Å; M86-L90 HydrophobicContact CE-CD1 3.7Å; M86-L90 HydrophobicContact CE-CD2 4.21Å; M86-L90 HydrophobicContact CE-CG 3.84Å; M86-L90 WeakPolarHBondContact O-CB 3.48Å; M86-L90 WeakPolarHBondContact O-CD1 3.48Å; M86-L90 WeakPolarHBondContact O-CG 3.49Å; M86-L90 PolarHBondContact O-N 3.33Å; M86-F135 HydrophobicContact CB-CE1 4.33Å; M86-F135 HydrophobicContact CE-CD1 3.99Å; M86-F135 HydrophobicContact CE-CD2 4.33Å; M86-F135 HydrophobicContact CE-CE1 3.81Å; M86-F135 HydrophobicContact CE-CE2 4.16Å; M86-F135 HydrophobicContact CE-CG 4.25Å; M86-F135 HydrophobicContact CE-CZ 3.9Å; M86-F135 HydrophobicContact CG-CD1 4.31Å; M86-F135 HydrophobicContact CG-CE1 3.89Å; M86-F135 HydrophobicContact SD-CD1 4.27Å; M86-F135 HydrophobicContact SD-CE1 4.29Å; M86-P138 HydrophobicContact SD-CB 3.9Å; M86-P138 HydrophobicContact SD-CG 3.96Å
87L96.8Very high96.5Very high62 Ų6224.5 Ų24.533%0.32512%0.123SC..Hα-helixtrans-64-43.3177.6-73.6171.6000111.6F72 Y75 V83 G84 Q85 S91F72-L87 HydrophobicContact CB-CB 3.88Å; F72-L87 HydrophobicContact CD1-CB 3.94Å; F72-L87 HydrophobicContact CD1-CD1 4.07Å; F72-L87 HydrophobicContact CD1-CG 4.43Å; F72-L87 HydrophobicContact CD2-CB 4.17Å; F72-L87 HydrophobicContact CE1-CD1 4.22Å; F72-L87 HydrophobicContact CE1-CD2 4.32Å; F72-L87 HydrophobicContact CG-CB 3.75Å; F72-L87 HydrophobicContact CZ-CD2 4.28Å; Y75-L87 HydrophobicContact CD1-CD1 4.31Å; Y75-L87 HydrophobicContact CE1-CD1 4.32Å; V83-L87 HydrophobicContact CG1-CD1 3.87Å; V83-L87 HydrophobicContact CG1-CG 4.22Å; V83-L87 WeakPolarHBondContact O-CB 3.38Å; V83-L87 VanDerWaalsContact O-CG 3.3Å; V83-L87 WeakPolarHBondContact O-CG 3.42Å; V83-L87 PolarHBondContact O-N 3.09Å; G84-L87 PolarHBondContact O-N 2.99Å; Q85-L87 PolarHBondContact O-N 2.97Å; L87-S91 WeakPolarHBondContact O-CB 3.43Å; L87-S91 PolarHBondContact O-N 3.34Å; L87-S91 PolarHBondContact O-OG 3.07Å
88D97.3Very high96.4Very high12 Ų1225.9 Ų25.96%0.06413%0.131CC..Hα-helixtrans-63-60.4178.4-176.329.3000111.1F72 S73 F76 G84 Q85 L90 S91 I92F72-D88 HydrophobicContact CB-CB 4.42Å; S73-D88 WeakPolarHBondContact CB-OD1 3.42Å; F76-D88 HydrophobicContact CB-CB 4.2Å; G84-D88 PolarHBondContact O-N 3.02Å; Q85-D88 PolarHBondContact O-N 3.39Å; D88-L90 VanDerWaalsContact C-N 3.35Å; D88-L90 PolarHBondContact O-N 3.12Å; D88-S91 PolarHBondContact O-N 3.19Å; D88-S91 VanDerWaalsContact O-N 3.13Å; D88-S91 PolarHBondContact O-OG 3.36Å; D88-I92 PolarHBondContact O-N 2.77Å
89E95.3Very high96.3Very high17 Ų1723.3 Ų23.38%0.07912%0.122CC..Hα-helixtrans-59.9-41.6-177.4-68.4179.2174.500112.8Q85 I92 L93 N141Q85-E89 HydrophobicContact CG-CG 4.41Å; Q85-E89 PolarHBondContact NE2-OE1 3.03Å; Q85-E89 WeakPolarHBondContact O-CG 3.5Å; Q85-E89 PolarHBondContact O-N 3Å; E89-I92 PolarHBondContact O-N 2.94Å; E89-L93 PolarHBondContact O-N 3.24Å; E89-N141 WeakPolarHBondContact OE2-CB 3.24Å; E89-N141 PolarHBondContact OE2-ND2 3.37Å
90L95.8Very high96.1Very high24 Ų2425.1 Ų25.113%0.12613%0.129CC..Hα-helixtrans-70.1-37.3178.7-67175000111.5M86 D88 I92 L93 W94 T131 F135M86-L90 HydrophobicContact CB-CD1 4.48Å; M86-L90 HydrophobicContact CE-CD1 3.7Å; M86-L90 HydrophobicContact CE-CD2 4.21Å; M86-L90 HydrophobicContact CE-CG 3.84Å; M86-L90 WeakPolarHBondContact O-CB 3.48Å; M86-L90 WeakPolarHBondContact O-CD1 3.48Å; M86-L90 WeakPolarHBondContact O-CG 3.49Å; M86-L90 PolarHBondContact O-N 3.33Å; D88-L90 VanDerWaalsContact C-N 3.35Å; D88-L90 PolarHBondContact O-N 3.12Å; L90-I92 PolarHBondContact O-N 2.7Å; L90-L93 HydrophobicContact CD2-CD2 4.16Å; L90-L93 WeakPolarHBondContact O-CB 3.14Å; L90-L93 PolarHBondContact O-N 2.9Å; L90-L93 VanDerWaalsContact O-N 3.14Å; L90-W94 PolarHBondContact O-N 2.88Å; L90-T131 HydrophobicContact CD1-CG2 3.96Å; L90-T131 HydrophobicContact CD2-CG2 3.86Å; L90-F135 HydrophobicContact CD1-CE2 4.14Å; L90-F135 HydrophobicContact CD1-CZ 4.01Å
91S97.1Very high96.1Very high11 Ų1125.7 Ų25.78%0.07713%0.133CC..Hα-helixtrans-61.3-37.2177.970.90000112.3V69 L87 D88 W94 V95V69-S91 WeakPolarHBondContact CA-OG 3.4Å; V69-S91 WeakPolarHBondContact CG2-OG 3.32Å; L87-S91 WeakPolarHBondContact O-CB 3.43Å; L87-S91 PolarHBondContact O-N 3.34Å; L87-S91 PolarHBondContact O-OG 3.07Å; D88-S91 PolarHBondContact O-N 3.19Å; D88-S91 VanDerWaalsContact O-N 3.13Å; D88-S91 PolarHBondContact O-OG 3.36Å; S91-W94 PolarHBondContact O-N 3.31Å; S91-V95 WeakPolarHBondContact O-CG2 3.4Å; S91-V95 PolarHBondContact O-N 2.91Å
92I96.6Very high95.9Very high39 Ų3926.9 Ų26.920%0.214%0.141CC..Hα-helixtrans-62.9-48.3172.9-61169.1000110.5V69 D88 E89 L90 W94 V95 L96 L145V69-I92 HydrophobicContact CG1-CD1 4.45Å; V69-I92 HydrophobicContact CG1-CG1 3.76Å; V69-I92 HydrophobicContact CG2-CG1 4.19Å; D88-I92 PolarHBondContact O-N 2.77Å; E89-I92 PolarHBondContact O-N 2.94Å; L90-I92 PolarHBondContact O-N 2.7Å; I92-W94 VanDerWaalsContact C-N 3.27Å; I92-W94 PolarHBondContact O-N 3.48Å; I92-V95 PolarHBondContact O-N 3.27Å; I92-L96 HydrophobicContact CG2-CD1 3.99Å; I92-L96 HydrophobicContact CG2-CG 4.43Å; I92-L96 VanDerWaalsContact O-CG 3.3Å; I92-L96 WeakPolarHBondContact O-CG 3.26Å; I92-L96 PolarHBondContact O-N 2.95Å; I92-L145 HydrophobicContact CB-CD1 4.41Å; I92-L145 HydrophobicContact CG2-CD1 4.26Å; I92-L145 HydrophobicContact CG2-CD2 4.16Å
93L96.1Very high95.9Very high28 Ų2825.3 Ų25.315%0.14713%0.133CC..Hα-helixtrans-53.7-45.6176.5174.365.7000111.5E89 L90 L96 A97 T127 T130 L145E89-L93 PolarHBondContact O-N 3.24Å; L90-L93 HydrophobicContact CD2-CD2 4.16Å; L90-L93 WeakPolarHBondContact O-CB 3.14Å; L90-L93 PolarHBondContact O-N 2.9Å; L90-L93 VanDerWaalsContact O-N 3.14Å; L93-L96 PolarHBondContact O-N 3.36Å; L93-A97 WeakPolarHBondContact O-CB 3.44Å; L93-A97 PolarHBondContact O-N 3.3Å; L93-T127 HydrophobicContact CD2-CG2 4.39Å; L93-T127 HydrophobicContact CG-CG2 4.18Å; L93-T130 HydrophobicContact CD1-CG2 4.19Å; L93-T130 HydrophobicContact CD2-CG2 3.82Å; L93-L145 HydrophobicContact CB-CD2 4.13Å; L93-L145 HydrophobicContact CD1-CD2 4.39Å
94W96.9Very high95.9Very high86 Ų8624.7 Ų24.733%0.32613%0.128SC..Hα-helixtrans-72.9-36.3-178-78.474.5000112.9M65 L90 S91 I92 L96 A97 V98 L124 T127 V128 T131M65-W94 HydrophobicContact CE-CB 3.38Å; M65-W94 HydrophobicContact CE-CG 4.44Å; L90-W94 PolarHBondContact O-N 2.88Å; S91-W94 PolarHBondContact O-N 3.31Å; I92-W94 VanDerWaalsContact C-N 3.27Å; I92-W94 PolarHBondContact O-N 3.48Å; W94-L96 VanDerWaalsContact C-N 3.32Å; W94-L96 PolarHBondContact O-N 3.23Å; W94-A97 WeakPolarHBondContact O-CB 3.33Å; W94-A97 PolarHBondContact O-N 3Å; W94-V98 WeakPolarHBondContact O-CG2 3.42Å; W94-V98 PolarHBondContact O-N 2.93Å; W94-L124 HydrophobicContact CH2-CD1 4.17Å; W94-L124 HydrophobicContact CZ3-CD1 4.04Å; W94-T127 HydrophobicContact CD2-CG2 3.94Å; W94-T127 HydrophobicContact CE3-CG2 4.41Å; W94-T127 HydrophobicContact CG-CG2 4.15Å; W94-T127 HydrophobicContact CZ2-CG2 4.37Å; W94-V128 HydrophobicContact CH2-CG2 4.2Å; W94-V128 HydrophobicContact CZ2-CG2 4.36Å; W94-T131 PolarHBondContact NE1-OG1 2.88Å
95V96.8Very high95.7Very high13 Ų1325.8 Ų25.88%0.07914%0.136CC..Hα-helixtrans-58.3-47.6170.1167.50000110.4V62 M65 M66 V69 S91 I92 A97 V98 G99V62-V95 HydrophobicContact CG1-CG1 4.31Å; M65-V95 HydrophobicContact CB-CG2 3.36Å; M66-V95 HydrophobicContact CG-CG1 4.16Å; M66-V95 HydrophobicContact SD-CG1 3.79Å; M66-V95 HydrophobicContact SD-CG2 4.3Å; V69-V95 HydrophobicContact CG2-CG2 3.66Å; S91-V95 WeakPolarHBondContact O-CG2 3.4Å; S91-V95 PolarHBondContact O-N 2.91Å; I92-V95 PolarHBondContact O-N 3.27Å; V95-A97 VanDerWaalsContact C-N 3.31Å; V95-A97 PolarHBondContact O-N 3.25Å; V95-V98 PolarHBondContact O-N 2.92Å; V95-G99 PolarHBondContact O-N 2.91Å
96L95.5Very high95.4Very high43 Ų4330.9 Ų30.923%0.22515%0.154CC..Hα-helixtrans-60.6-42.2178.2-70.9170.9000111I92 L93 W94 G99 Y100 L145 F148 L152I92-L96 HydrophobicContact CG2-CD1 3.99Å; I92-L96 HydrophobicContact CG2-CG 4.43Å; I92-L96 VanDerWaalsContact O-CG 3.3Å; I92-L96 WeakPolarHBondContact O-CG 3.26Å; I92-L96 PolarHBondContact O-N 2.95Å; L93-L96 PolarHBondContact O-N 3.36Å; W94-L96 VanDerWaalsContact C-N 3.32Å; W94-L96 PolarHBondContact O-N 3.23Å; L96-G99 PolarHBondContact O-N 3.34Å; L96-Y100 WeakPolarHBondContact O-CB 3.29Å; L96-Y100 PolarHBondContact O-N 2.94Å; L96-L145 HydrophobicContact CD1-CD2 3.72Å; L96-F148 HydrophobicContact CB-CD1 4.12Å; L96-F148 HydrophobicContact CB-CE1 3.81Å; L96-F148 HydrophobicContact CD1-CD1 3.84Å; L96-F148 HydrophobicContact CD1-CE1 4.38Å; L96-F148 HydrophobicContact CD2-CD1 4.03Å; L96-F148 HydrophobicContact CD2-CE1 4.05Å; L96-F148 HydrophobicContact CG-CD1 4.23Å; L96-F148 HydrophobicContact CG-CE1 4.3Å; L96-L152 HydrophobicContact CD2-CD1 3.91Å
97A96.1Very high95.1Very high12 Ų1236.6 Ų36.610%0.09918%0.179CC..Hα-helixtrans-61-45.3176.100000112.5L93 W94 V95 Y100 A101 V123 T127L93-A97 WeakPolarHBondContact O-CB 3.44Å; L93-A97 PolarHBondContact O-N 3.3Å; W94-A97 WeakPolarHBondContact O-CB 3.33Å; W94-A97 PolarHBondContact O-N 3Å; V95-A97 VanDerWaalsContact C-N 3.31Å; V95-A97 PolarHBondContact O-N 3.25Å; A97-Y100 PolarHBondContact O-N 3.49Å; A97-A101 VanDerWaalsContact O-CB 3.25Å; A97-A101 WeakPolarHBondContact O-CB 3.42Å; A97-A101 PolarHBondContact O-N 2.92Å; A97-V123 HydrophobicContact CB-CG1 4.01Å; A97-V123 WeakPolarHBondContact O-CG1 3.43Å; A97-T127 HydrophobicContact CB-CG2 3.76Å; A97-T127 WeakPolarHBondContact CB-OG1 3.2Å
98V96Very high94.9Very high29 Ų2936.6 Ų36.618%0.17618%0.179CC..Hα-helixtrans-65.4-44.8176.9173.90000111M61 V62 M65 W94 V95 Y100 A101 T102M61-V98 HydrophobicContact CB-CG1 3.96Å; V62-V98 HydrophobicContact CG2-CG1 3.8Å; M65-V98 HydrophobicContact SD-CB 4.47Å; M65-V98 HydrophobicContact SD-CG2 3.72Å; W94-V98 WeakPolarHBondContact O-CG2 3.42Å; W94-V98 PolarHBondContact O-N 2.93Å; V95-V98 PolarHBondContact O-N 2.92Å; V98-Y100 VanDerWaalsContact C-N 3.33Å; V98-Y100 PolarHBondContact O-N 3.33Å; V98-A101 PolarHBondContact O-N 3.02Å; V98-T102 HydrophobicContact CG1-CG2 4.41Å; V98-T102 WeakPolarHBondContact O-CB 3.35Å; V98-T102 VanDerWaalsContact O-CG2 3.28Å; V98-T102 WeakPolarHBondContact O-CG2 3.28Å; V98-T102 PolarHBondContact O-N 3.23Å; V98-T102 PolarHBondContact O-OG1 3.01Å
99G95.6Very high94.7Very high13 Ų1337.1 Ų37.113%0.13418%0.181CC..Hα-helixtrans-59.1-43.9174.900000112V95 L96 T102 W103V95-G99 PolarHBondContact O-N 2.91Å; L96-G99 PolarHBondContact O-N 3.34Å; G99-T102 WeakPolarHBondContact CA-OG1 3.4Å; G99-T102 PolarHBondContact O-N 2.92Å; G99-T102 PolarHBondContact O-OG1 3.46Å; G99-W103 WeakPolarHBondContact O-CB 3.01Å; G99-W103 PolarHBondContact O-N 3.31Å
100Y94.8Very high94.5Very high40 Ų4038.7 Ų38.716%0.15719%0.193CC..Hα-helixtrans-66.5-47.8178.5-158.2-108.7000111.4L96 A97 V98 T102 F104 F119 V123 F148 H151 L152L96-Y100 WeakPolarHBondContact O-CB 3.29Å; L96-Y100 PolarHBondContact O-N 2.94Å; A97-Y100 PolarHBondContact O-N 3.49Å; V98-Y100 VanDerWaalsContact C-N 3.33Å; V98-Y100 PolarHBondContact O-N 3.33Å; Y100-T102 VanDerWaalsContact C-N 3.27Å; Y100-T102 PolarHBondContact O-N 3.07Å; Y100-F104 HydrophobicContact CD1-CB 4.35Å; Y100-F104 HydrophobicContact CD1-CG 4.46Å; Y100-F104 HydrophobicContact CD2-CB 4.17Å; Y100-F104 AromaticContact CD2-CD2 3.8Å; Y100-F104 HydrophobicContact CD2-CD2 3.8Å; Y100-F104 HydrophobicContact CD2-CG 4.23Å; Y100-F104 HydrophobicContact CE1-CB 4.46Å; Y100-F104 HydrophobicContact CE1-CD1 4.39Å; Y100-F104 HydrophobicContact CE1-CD2 4.18Å; Y100-F104 HydrophobicContact CE1-CG 4.1Å; Y100-F104 HydrophobicContact CE2-CB 4.29Å; Y100-F104 AromaticContact CE2-CD2 3.15Å; Y100-F104 HydrophobicContact CE2-CD2 3.15Å; Y100-F104 AromaticContact CE2-CE2 3.54Å; Y100-F104 HydrophobicContact CE2-CE2 3.54Å; Y100-F104 AromaticContact CE2-CG 3.83Å; Y100-F104 HydrophobicContact CE2-CG 3.83Å; Y100-F104 HydrophobicContact CE2-CZ 4.45Å; Y100-F104 HydrophobicContact CG-CB 4.21Å; Y100-F104 AromaticContact CZ-CD2 3.37Å; Y100-F104 AromaticContact CZ-CE2 3.5Å; Y100-F104 AromaticContact CZ-CG 3.75Å; Y100-F104 AromaticContact CZ-CZ 3.99Å; Y100-F104 WeakPolarHBondContact O-CB 3.46Å; Y100-F104 PolarHBondContact O-N 3.21Å; Y100-F104 WeakPolarHBondContact OH-CE2 3.41Å; Y100-F104 VanDerWaalsContact OH-CZ 3.32Å; Y100-F104 WeakPolarHBondContact OH-CZ 3.48Å; Y100-F119 AromaticContact CD1-CE1 3.85Å; Y100-F119 HydrophobicContact CD1-CE1 3.85Å; Y100-F119 AromaticContact CD1-CZ 3.58Å; Y100-F119 HydrophobicContact CD1-CZ 3.58Å; Y100-F119 HydrophobicContact CE1-CE1 4.11Å; Y100-F119 HydrophobicContact CE1-CE2 4.24Å; Y100-F119 AromaticContact CE1-CZ 3.36Å; Y100-F119 HydrophobicContact CE1-CZ 3.36Å; Y100-F119 WeakPolarHBondContact O-CE1 3.27Å; Y100-V123 HydrophobicContact CD1-CG2 3.78Å; Y100-V123 HydrophobicContact CE1-CG2 4.37Å; Y100-F148 HydrophobicContact CD2-CE1 4.35Å; Y100-F148 HydrophobicContact CD2-CE2 4.31Å; Y100-F148 AromaticContact CD2-CZ 3.55Å; Y100-F148 HydrophobicContact CD2-CZ 3.55Å; Y100-F148 HydrophobicContact CE2-CE2 4.37Å; Y100-F148 AromaticContact CE2-CZ 3.99Å; Y100-F148 HydrophobicContact CE2-CZ 3.99Å; Y100-F148 AromaticContact CG-CZ 3.85Å; Y100-F148 HydrophobicContact CG-CZ 3.85Å; Y100-H151 AromaticContact CE2-NE2 3.82Å; Y100-H151 AromaticContact CZ-NE2 3.8Å; Y100-H151 PolarHBondContact OH-NE2 3.43Å; Y100-L152 HydrophobicContact CD2-CD2 3.91Å; Y100-L152 HydrophobicContact CE2-CD2 4.16Å
101A95.4Very high94.3Very high14 Ų1443.5 Ų43.512%0.11623%0.228CC..Hα-helixtrans-56.2-43.1176.700000111.6A97 V98 R116 V123A97-A101 VanDerWaalsContact O-CB 3.25Å; A97-A101 WeakPolarHBondContact O-CB 3.42Å; A97-A101 PolarHBondContact O-N 2.92Å; V98-A101 PolarHBondContact O-N 3.02Å; A101-R116 WeakPolarHBondContact O-CD 3.41Å; A101-R116 PolarHBondContact O-NH1 2.97Å; A101-V123 HydrophobicContact CB-CG1 4.34Å
102T93.9Very high94.1Very high25 Ų2550.3 Ų50.315%0.15326%0.257CS..Hα-helixtrans-77.6-48.2-176.752.90000113.5A58 V98 G99 Y100A58-T102 HydrophobicContact CB-CG2 3.96Å; V98-T102 HydrophobicContact CG1-CG2 4.41Å; V98-T102 WeakPolarHBondContact O-CB 3.35Å; V98-T102 VanDerWaalsContact O-CG2 3.28Å; V98-T102 WeakPolarHBondContact O-CG2 3.28Å; V98-T102 PolarHBondContact O-N 3.23Å; V98-T102 PolarHBondContact O-OG1 3.01Å; G99-T102 WeakPolarHBondContact CA-OG1 3.4Å; G99-T102 PolarHBondContact O-N 2.92Å; G99-T102 PolarHBondContact O-OG1 3.46Å; Y100-T102 VanDerWaalsContact C-N 3.27Å; Y100-T102 PolarHBondContact O-N 3.07Å
103W94.8Very high93.9Very high25 Ų2548.9 Ų48.910%0.09525%0.249CC..Hα-helixtrans-108.1-10.1-167.2-71.9-46.9000116Y51 I59 V62 G99 V223Y51-W103 AromaticContact CE1-NE1 3.75Å; Y51-W103 AromaticContact CZ-NE1 3.89Å; Y51-W103 PolarHBondContact OH-NE1 3.42Å; Y51-W103 VanDerWaalsContact OH-NE1 3.07Å; I59-W103 HydrophobicContact CB-CZ2 4.45Å; I59-W103 HydrophobicContact CG1-CZ2 4.11Å; I59-W103 HydrophobicContact CG2-CH2 4.36Å; I59-W103 HydrophobicContact CG2-CZ2 3.7Å; V62-W103 HydrophobicContact CB-CH2 4.36Å; V62-W103 HydrophobicContact CB-CZ3 4.4Å; V62-W103 HydrophobicContact CG1-CH2 4.22Å; V62-W103 HydrophobicContact CG1-CZ3 3.98Å; V62-W103 HydrophobicContact CG2-CH2 4.15Å; V62-W103 HydrophobicContact CG2-CZ3 3.97Å; G99-W103 WeakPolarHBondContact O-CB 3.01Å; G99-W103 PolarHBondContact O-N 3.31Å; W103-V223 HydrophobicContact CB-CG1 3.4Å; W103-V223 VanDerWaalsContact CB-CG1 3.4Å; W103-V223 HydrophobicContact CD2-CG1 3.85Å; W103-V223 HydrophobicContact CE3-CG1 4.2Å; W103-V223 HydrophobicContact CG-CG1 3.53Å
104F94.7Very high93.7Very high15 Ų1556.7 Ų56.77%0.06628%0.282CS..SBendtrans-58129.4-177.4-173.4-111.1000110.8Y100 R106 L108 F109 R116 F119 T155Y100-F104 HydrophobicContact CD1-CB 4.35Å; Y100-F104 HydrophobicContact CD1-CG 4.46Å; Y100-F104 HydrophobicContact CD2-CB 4.17Å; Y100-F104 AromaticContact CD2-CD2 3.8Å; Y100-F104 HydrophobicContact CD2-CD2 3.8Å; Y100-F104 HydrophobicContact CD2-CG 4.23Å; Y100-F104 HydrophobicContact CE1-CB 4.46Å; Y100-F104 HydrophobicContact CE1-CD1 4.39Å; Y100-F104 HydrophobicContact CE1-CD2 4.18Å; Y100-F104 HydrophobicContact CE1-CG 4.1Å; Y100-F104 HydrophobicContact CE2-CB 4.29Å; Y100-F104 AromaticContact CE2-CD2 3.15Å; Y100-F104 HydrophobicContact CE2-CD2 3.15Å; Y100-F104 AromaticContact CE2-CE2 3.54Å; Y100-F104 HydrophobicContact CE2-CE2 3.54Å; Y100-F104 AromaticContact CE2-CG 3.83Å; Y100-F104 HydrophobicContact CE2-CG 3.83Å; Y100-F104 HydrophobicContact CE2-CZ 4.45Å; Y100-F104 HydrophobicContact CG-CB 4.21Å; Y100-F104 AromaticContact CZ-CD2 3.37Å; Y100-F104 AromaticContact CZ-CE2 3.5Å; Y100-F104 AromaticContact CZ-CG 3.75Å; Y100-F104 AromaticContact CZ-CZ 3.99Å; Y100-F104 WeakPolarHBondContact O-CB 3.46Å; Y100-F104 PolarHBondContact O-N 3.21Å; Y100-F104 WeakPolarHBondContact OH-CE2 3.41Å; Y100-F104 VanDerWaalsContact OH-CZ 3.32Å; Y100-F104 WeakPolarHBondContact OH-CZ 3.48Å; F104-R106 PolarHBondContact O-N 3.08Å; F104-L108 HydrophobicContact CE1-CB 3.9Å; F104-L108 WeakPolarHBondContact CE1-O 3.49Å; F104-L108 HydrophobicContact CE2-CB 4.49Å; F104-L108 HydrophobicContact CZ-CB 3.69Å; F104-F109 AromaticContact CD1-CD1 3.65Å; F104-F109 HydrophobicContact CD1-CD1 3.65Å; F104-F109 AromaticContact CD1-CE1 3.7Å; F104-F109 HydrophobicContact CD1-CE1 3.7Å; F104-F109 HydrophobicContact CE1-CD1 4Å; F104-F109 HydrophobicContact CE1-CE1 4.5Å; F104-R116 PolarHBondContact O-NH1 2.73Å; F104-R116 PolarHBondContact O-NH2 2.8Å; F104-F119 HydrophobicContact CB-CE1 3.72Å; F104-F119 HydrophobicContact CB-CZ 3.77Å; F104-F119 AromaticContact CD1-CE1 3.98Å; F104-F119 HydrophobicContact CD1-CE1 3.98Å; F104-F119 AromaticContact CD1-CE2 3.72Å; F104-F119 HydrophobicContact CD1-CE2 3.72Å; F104-F119 AromaticContact CD1-CZ 3.24Å; F104-F119 HydrophobicContact CD1-CZ 3.24Å; F104-F119 HydrophobicContact CE1-CE2 4.14Å; F104-F119 HydrophobicContact CE1-CZ 4.02Å; F104-F119 HydrophobicContact CG-CE1 4.19Å; F104-F119 AromaticContact CG-CZ 3.71Å; F104-F119 HydrophobicContact CG-CZ 3.71Å; F104-T155 HydrophobicContact CD2-CG2 4.21Å; F104-T155 HydrophobicContact CE2-CG2 3.84Å
105P92.1Very high93.5Very high24 Ų2455.7 Ų55.716%0.15628%0.283CS..  trans-62.5129.8-171.9-24.434000112.6K107 L108 F109 T155 E159P105-K107 HydrophobicContact CB-CG 4.26Å; P105-K107 PolarHBondContact O-N 3.2Å; P105-L108 HydrophobicContact CB-CD1 4.2Å; P105-L108 HydrophobicContact CB-CG 4.25Å; P105-L108 HydrophobicContact CG-CD1 4.13Å; P105-L108 PolarHBondContact O-N 2.97Å; P105-F109 WeakPolarHBondContact O-CD1 3.13Å; P105-T155 HydrophobicContact CG-CG2 4.15Å; P105-E159 WeakPolarHBondContact CB-OE1 3.32Å; P105-E159 HydrophobicContact CG-CG 3.75Å; P105-E159 WeakPolarHBondContact CG-OE1 3.26Å
106R90.9Very high93.3Very high109 Ų10957 Ų5741%0.41129%0.287SS..G310 helixtrans-60.2-32.9-178.5-64.8-169-157.7-1634.7113.3F104 L108 F109 R116 E231F104-R106 PolarHBondContact O-N 3.08Å; R106-L108 PolarHBondContact O-N 3.28Å; R106-F109 HydrophobicContact CG-CE1 4.44Å; R106-F109 HydrophobicContact CG-CE2 4.25Å; R106-F109 HydrophobicContact CG-CZ 4.09Å; R106-F109 VanDerWaalsContact O-CB 3.29Å; R106-F109 WeakPolarHBondContact O-CB 3.32Å; R106-F109 WeakPolarHBondContact O-CG 3.31Å; R106-F109 PolarHBondContact O-N 3.44Å; R106-F109 VanDerWaalsContact O-N 3.08Å; R106-R116 VanDerWaalsContact CG-NH2 3.27Å; R106-E231 VanDerWaalsContact CD-OE1 3.28Å; R106-E231 WeakPolarHBondContact CD-OE1 3.46Å; R106-E231 WeakPolarHBondContact CG-OE1 3.2Å; R106-E231 IonicContact CZ-OE1 3.9Å; R106-E231 IonicContact CZ-OE2 2.76Å; R106-E231 IonicContact NE-OE1 3.75Å; R106-E231 PolarHBondContact NE-OE1 2.95Å; R106-E231 IonicContact NE-OE2 3.54Å; R106-E231 PolarHBondContact NE-OE2 3.37Å; R106-E231 VanDerWaalsContact NE-OE2 3.16Å; R106-E231 IonicContact NH2-OE1 3.45Å; R106-E231 IonicContact NH2-OE2 4Å; R106-E231 PolarHBondContact NH2-OE2 3.43Å
107K89.2Confident93.2Very high127 Ų12758.3 Ų58.355%0.55230%0.299SS*.G310 helixtrans-65.5-16.417867.1-177.7174.8-171.80113.6P105 E159P105-K107 HydrophobicContact CB-CG 4.26Å; P105-K107 PolarHBondContact O-N 3.2Å; K107-E159 WeakPolarHBondContact CE-OE1 3.3Å; K107-E159 WeakPolarHBondContact CE-OE2 3.27Å; K107-E159 VanDerWaalsContact NZ-CD 3.3Å; K107-E159 IonicContact NZ-OE1 3.79Å; K107-E159 PolarHBondContact NZ-OE1 3.12Å; K107-E159 IonicContact NZ-OE2 2.83Å; K107-E159 PolarHBondContact NZ-OE2 3.31Å
108L91.7Very high93.2Very high62 Ų6259.9 Ų59.933%0.32531%0.308SS..G310 helixtrans-103.17.3177.1-58.5179.5000112.4F104 P105 R106 T155 V158F104-L108 HydrophobicContact CE1-CB 3.9Å; F104-L108 WeakPolarHBondContact CE1-O 3.49Å; F104-L108 HydrophobicContact CE2-CB 4.49Å; F104-L108 HydrophobicContact CZ-CB 3.69Å; P105-L108 HydrophobicContact CB-CD1 4.2Å; P105-L108 HydrophobicContact CB-CG 4.25Å; P105-L108 HydrophobicContact CG-CD1 4.13Å; P105-L108 PolarHBondContact O-N 2.97Å; R106-L108 PolarHBondContact O-N 3.28Å; L108-T155 HydrophobicContact CD1-CG2 3.76Å; L108-V158 HydrophobicContact CD2-CG1 4.36Å
109F93.3Very high93.2Very high24 Ų2458.8 Ų58.811%0.10530%0.301CS..SBendtrans-61.7145.8175.2-78.511.5000110.8F104 P105 R106 S111 I113 R116 F119F104-F109 AromaticContact CD1-CD1 3.65Å; F104-F109 HydrophobicContact CD1-CD1 3.65Å; F104-F109 AromaticContact CD1-CE1 3.7Å; F104-F109 HydrophobicContact CD1-CE1 3.7Å; F104-F109 HydrophobicContact CE1-CD1 4Å; F104-F109 HydrophobicContact CE1-CE1 4.5Å; P105-F109 WeakPolarHBondContact O-CD1 3.13Å; R106-F109 HydrophobicContact CG-CE1 4.44Å; R106-F109 HydrophobicContact CG-CE2 4.25Å; R106-F109 HydrophobicContact CG-CZ 4.09Å; R106-F109 VanDerWaalsContact O-CB 3.29Å; R106-F109 WeakPolarHBondContact O-CB 3.32Å; R106-F109 WeakPolarHBondContact O-CG 3.31Å; R106-F109 PolarHBondContact O-N 3.44Å; R106-F109 VanDerWaalsContact O-N 3.08Å; F109-S111 PolarHBondContact O-N 3.44Å; F109-I113 HydrophobicContact CD2-CB 4.44Å; F109-I113 HydrophobicContact CD2-CG2 3.94Å; F109-I113 HydrophobicContact CE2-CG2 4.33Å; F109-R116 VanDerWaalsContact CZ-CZ 3.45Å; F109-F119 HydrophobicContact CD1-CD2 4Å; F109-F119 HydrophobicContact CD1-CE2 4.09Å; F109-F119 HydrophobicContact CD1-CG 4.38Å; F109-F119 HydrophobicContact CD2-CB 4.41Å; F109-F119 HydrophobicContact CD2-CD2 4.47Å; F109-F119 HydrophobicContact CE1-CB 4.4Å; F109-F119 AromaticContact CE1-CD1 3.97Å; F109-F119 HydrophobicContact CE1-CD1 3.97Å; F109-F119 AromaticContact CE1-CD2 3.89Å; F109-F119 HydrophobicContact CE1-CD2 3.89Å; F109-F119 HydrophobicContact CE1-CE1 4.14Å; F109-F119 HydrophobicContact CE1-CE2 4.07Å; F109-F119 AromaticContact CE1-CG 3.81Å; F109-F119 HydrophobicContact CE1-CG 3.81Å; F109-F119 HydrophobicContact CE1-CZ 4.18Å; F109-F119 HydrophobicContact CE2-CB 3.73Å; F109-F119 HydrophobicContact CE2-CD2 4.36Å; F109-F119 HydrophobicContact CE2-CG 4.04Å; F109-F119 HydrophobicContact CG-CD2 4.29Å; F109-F119 HydrophobicContact CZ-CB 3.7Å; F109-F119 AromaticContact CZ-CD1 3.87Å; F109-F119 HydrophobicContact CZ-CD1 3.87Å; F109-F119 HydrophobicContact CZ-CD2 4.05Å; F109-F119 HydrophobicContact CZ-CE1 4.48Å; F109-F119 AromaticContact CZ-CG 3.6Å; F109-F119 HydrophobicContact CZ-CG 3.6Å
110P90.9Very high93.3Very high50 Ų5060 Ų6033%0.32531%0.307SS..  trans-53.7141.9166.8-22.232.1000110.6F112 I113P110-F112 HydrophobicContact CB-CD1 3.71Å; P110-F112 HydrophobicContact CB-CE1 3.26Å; P110-F112 HydrophobicContact CB-CE2 4.42Å; P110-F112 HydrophobicContact CB-CG 4.45Å; P110-F112 HydrophobicContact CB-CZ 3.67Å; P110-F112 HydrophobicContact CG-CE1 4.19Å; P110-F112 HydrophobicContact CG-CZ 4.17Å; P110-F112 PolarHBondContact O-N 2.81Å; P110-I113 HydrophobicContact CB-CD1 4.33Å; P110-I113 HydrophobicContact CB-CG1 4.33Å; P110-I113 HydrophobicContact CG-CD1 3.98Å; P110-I113 HydrophobicContact CG-CG1 4.49Å; P110-I113 PolarHBondContact O-N 3.35Å
111S91.3Very high93.3Very high125 Ų12565.4 Ų65.487%0.87433%0.328SS*.THydrogen-bonded Turntrans-56.5-24.2-172.855.40000114.9F109F109-S111 PolarHBondContact O-N 3.44Å
112F92.7Very high93.4Very high153 Ų15367.4 Ų67.467%0.67134%0.336SS*.THydrogen-bonded Turntrans-82.8-9.7177.862.4-92.4000114P110 L122P110-F112 HydrophobicContact CB-CD1 3.71Å; P110-F112 HydrophobicContact CB-CE1 3.26Å; P110-F112 HydrophobicContact CB-CE2 4.42Å; P110-F112 HydrophobicContact CB-CG 4.45Å; P110-F112 HydrophobicContact CB-CZ 3.67Å; P110-F112 HydrophobicContact CG-CE1 4.19Å; P110-F112 HydrophobicContact CG-CZ 4.17Å; P110-F112 PolarHBondContact O-N 2.81Å; F112-L122 HydrophobicContact CE2-CD2 4.39Å; F112-L122 HydrophobicContact CZ-CD2 4.4Å
113I94Very high93.5Very high9 Ų966.9 Ų66.95%0.04633%0.333CS..  trans-107.3118.3-178.6-53.2-176.8000109.5F109 P110 T118 F119 L122F109-I113 HydrophobicContact CD2-CB 4.44Å; F109-I113 HydrophobicContact CD2-CG2 3.94Å; F109-I113 HydrophobicContact CE2-CG2 4.33Å; P110-I113 HydrophobicContact CB-CD1 4.33Å; P110-I113 HydrophobicContact CB-CG1 4.33Å; P110-I113 HydrophobicContact CG-CD1 3.98Å; P110-I113 HydrophobicContact CG-CG1 4.49Å; P110-I113 PolarHBondContact O-N 3.35Å; I113-T118 HydrophobicContact CG2-CG2 4.32Å; I113-F119 HydrophobicContact CD1-CD2 4.05Å; I113-F119 HydrophobicContact CG2-CB 3.83Å; I113-F119 HydrophobicContact CG2-CD2 4.46Å; I113-L122 HydrophobicContact CD1-CD2 3.53Å
114K90.6Very high93.6Very high193 Ų19370 Ų7084%0.83935%0.351SS*.  trans-103-24.7-176.8-62-173.1179.9-178.10113.9
115D93.3Very high93.7Very high64 Ų6474.2 Ų74.234%0.34237%0.373SS..SBendtrans-130.3155-172.175.697.8000112.4S117 T118 F119D115-S117 VanDerWaalsContact C-N 3.31Å; D115-S117 PolarHBondContact O-N 3.26Å; D115-S117 WeakPolarHBondContact OD1-CA 3.39Å; D115-S117 WeakPolarHBondContact OD1-CB 3.28Å; D115-S117 PolarHBondContact OD1-N 3.06Å; D115-T118 PolarHBondContact O-N 3.33Å; D115-T118 PolarHBondContact OD1-N 3.37Å; D115-T118 PolarHBondContact OD1-OG1 3.25Å; D115-T118 WeakPolarHBondContact OD2-CB 3.41Å; D115-T118 PolarHBondContact OD2-OG1 3.16Å; D115-F119 PolarHBondContact O-N 3.28Å; D115-F119 VanDerWaalsContact O-N 3.15Å
116R92.7Very high93.9Very high40 Ų4077.3 Ų77.315%0.15139%0.388CS..Hα-helixtrans-62.9-34.2-178.5-177.464.858.7179.92.8112.6A101 F104 R106 F109 F119 S120A101-R116 WeakPolarHBondContact O-CD 3.41Å; A101-R116 PolarHBondContact O-NH1 2.97Å; F104-R116 PolarHBondContact O-NH1 2.73Å; F104-R116 PolarHBondContact O-NH2 2.8Å; R106-R116 VanDerWaalsContact CG-NH2 3.27Å; F109-R116 VanDerWaalsContact CZ-CZ 3.45Å; R116-F119 PolarHBondContact O-N 2.95Å; R116-S120 WeakPolarHBondContact O-CB 3.48Å; R116-S120 PolarHBondContact O-N 3.4Å; R116-S120 PolarHBondContact O-OG 2.98Å
117S94.3Very high94.1Very high71 Ų7172.5 Ų72.550%0.49737%0.37SS..Hα-helixtrans-69.5-44-177.7-179.10000111.3D115 S120 R121D115-S117 VanDerWaalsContact C-N 3.31Å; D115-S117 PolarHBondContact O-N 3.26Å; D115-S117 WeakPolarHBondContact OD1-CA 3.39Å; D115-S117 WeakPolarHBondContact OD1-CB 3.28Å; D115-S117 PolarHBondContact OD1-N 3.06Å; S117-S120 PolarHBondContact O-N 3.03Å; S117-R121 WeakPolarHBondContact O-CG 3.25Å; S117-R121 PolarHBondContact O-N 3.48Å
118T95.8Very high94.4Very high46 Ų4669.5 Ų69.528%0.28236%0.363SS..Hα-helixtrans-62.8-41.7173.6-56.80000111.8I113 D115 R121 L122I113-T118 HydrophobicContact CG2-CG2 4.32Å; D115-T118 PolarHBondContact O-N 3.33Å; D115-T118 PolarHBondContact OD1-N 3.37Å; D115-T118 PolarHBondContact OD1-OG1 3.25Å; D115-T118 WeakPolarHBondContact OD2-CB 3.41Å; D115-T118 PolarHBondContact OD2-OG1 3.16Å; T118-R121 PolarHBondContact O-N 3.13Å; T118-R121 PolarHBondContact OG1-NH2 2.77Å; T118-L122 PolarHBondContact O-N 3.08Å; T118-L122 VanDerWaalsContact O-N 3.08Å
119F96.1Very high94.6Very high6 Ų671.1 Ų71.13%0.02637%0.371CS..Hα-helixtrans-58.7-50.7173.1-174.3-102.4000112.1Y100 F104 F109 I113 D115 R116 R121 L122 V123Y100-F119 AromaticContact CD1-CE1 3.85Å; Y100-F119 HydrophobicContact CD1-CE1 3.85Å; Y100-F119 AromaticContact CD1-CZ 3.58Å; Y100-F119 HydrophobicContact CD1-CZ 3.58Å; Y100-F119 HydrophobicContact CE1-CE1 4.11Å; Y100-F119 HydrophobicContact CE1-CE2 4.24Å; Y100-F119 AromaticContact CE1-CZ 3.36Å; Y100-F119 HydrophobicContact CE1-CZ 3.36Å; Y100-F119 WeakPolarHBondContact O-CE1 3.27Å; F104-F119 HydrophobicContact CB-CE1 3.72Å; F104-F119 HydrophobicContact CB-CZ 3.77Å; F104-F119 AromaticContact CD1-CE1 3.98Å; F104-F119 HydrophobicContact CD1-CE1 3.98Å; F104-F119 AromaticContact CD1-CE2 3.72Å; F104-F119 HydrophobicContact CD1-CE2 3.72Å; F104-F119 AromaticContact CD1-CZ 3.24Å; F104-F119 HydrophobicContact CD1-CZ 3.24Å; F104-F119 HydrophobicContact CE1-CE2 4.14Å; F104-F119 HydrophobicContact CE1-CZ 4.02Å; F104-F119 HydrophobicContact CG-CE1 4.19Å; F104-F119 AromaticContact CG-CZ 3.71Å; F104-F119 HydrophobicContact CG-CZ 3.71Å; F109-F119 HydrophobicContact CD1-CD2 4Å; F109-F119 HydrophobicContact CD1-CE2 4.09Å; F109-F119 HydrophobicContact CD1-CG 4.38Å; F109-F119 HydrophobicContact CD2-CB 4.41Å; F109-F119 HydrophobicContact CD2-CD2 4.47Å; F109-F119 HydrophobicContact CE1-CB 4.4Å; F109-F119 AromaticContact CE1-CD1 3.97Å; F109-F119 HydrophobicContact CE1-CD1 3.97Å; F109-F119 AromaticContact CE1-CD2 3.89Å; F109-F119 HydrophobicContact CE1-CD2 3.89Å; F109-F119 HydrophobicContact CE1-CE1 4.14Å; F109-F119 HydrophobicContact CE1-CE2 4.07Å; F109-F119 AromaticContact CE1-CG 3.81Å; F109-F119 HydrophobicContact CE1-CG 3.81Å; F109-F119 HydrophobicContact CE1-CZ 4.18Å; F109-F119 HydrophobicContact CE2-CB 3.73Å; F109-F119 HydrophobicContact CE2-CD2 4.36Å; F109-F119 HydrophobicContact CE2-CG 4.04Å; F109-F119 HydrophobicContact CG-CD2 4.29Å; F109-F119 HydrophobicContact CZ-CB 3.7Å; F109-F119 AromaticContact CZ-CD1 3.87Å; F109-F119 HydrophobicContact CZ-CD1 3.87Å; F109-F119 HydrophobicContact CZ-CD2 4.05Å; F109-F119 HydrophobicContact CZ-CE1 4.48Å; F109-F119 AromaticContact CZ-CG 3.6Å; F109-F119 HydrophobicContact CZ-CG 3.6Å; I113-F119 HydrophobicContact CD1-CD2 4.05Å; I113-F119 HydrophobicContact CG2-CB 3.83Å; I113-F119 HydrophobicContact CG2-CD2 4.46Å; D115-F119 PolarHBondContact O-N 3.28Å; D115-F119 VanDerWaalsContact O-N 3.15Å; R116-F119 PolarHBondContact O-N 2.95Å; F119-R121 VanDerWaalsContact C-N 3.3Å; F119-R121 PolarHBondContact O-N 3.06Å; F119-L122 WeakPolarHBondContact O-CB 3.35Å; F119-L122 PolarHBondContact O-N 3.26Å; F119-L122 VanDerWaalsContact O-N 3.1Å; F119-V123 HydrophobicContact CD1-CG2 3.99Å; F119-V123 HydrophobicContact CE1-CG2 3.65Å; F119-V123 HydrophobicContact CE2-CG2 4.45Å; F119-V123 HydrophobicContact CZ-CG2 3.92Å; F119-V123 WeakPolarHBondContact O-CG2 3.5Å; F119-V123 PolarHBondContact O-N 3.29Å
120S95.9Very high94.6Very high38 Ų3872.4 Ų72.427%0.26638%0.38SS..Hα-helixtrans-60.9-36.8179.4-620000112.8R116 S117 V123 L124R116-S120 WeakPolarHBondContact O-CB 3.48Å; R116-S120 PolarHBondContact O-N 3.4Å; R116-S120 PolarHBondContact O-OG 2.98Å; S117-S120 PolarHBondContact O-N 3.03Å; S120-V123 PolarHBondContact O-N 3.04Å; S120-L124 WeakPolarHBondContact O-CB 3.48Å; S120-L124 PolarHBondContact O-N 3.25Å
121R96.4Very high94.8Very high154 Ų15471 Ų7158%0.58137%0.371SS*.Hα-helixtrans-64.5-40.3174-74.7-177.7-67.7174.21.8112.2S117 T118 F119 L124 L125S117-R121 WeakPolarHBondContact O-CG 3.25Å; S117-R121 PolarHBondContact O-N 3.48Å; T118-R121 PolarHBondContact O-N 3.13Å; T118-R121 PolarHBondContact OG1-NH2 2.77Å; F119-R121 VanDerWaalsContact C-N 3.3Å; F119-R121 PolarHBondContact O-N 3.06Å; R121-L124 PolarHBondContact O-N 3.29Å; R121-L125 WeakPolarHBondContact O-CB 3.35Å; R121-L125 PolarHBondContact O-N 3.13Å
122L96.3Very high94.9Very high55 Ų5570 Ų7029%0.28836%0.359SS..Hα-helixtrans-64.8-46.4175178.163.4000111.3F112 I113 T118 F119 L124 L125 I126F112-L122 HydrophobicContact CE2-CD2 4.39Å; F112-L122 HydrophobicContact CZ-CD2 4.4Å; I113-L122 HydrophobicContact CD1-CD2 3.53Å; T118-L122 PolarHBondContact O-N 3.08Å; T118-L122 VanDerWaalsContact O-N 3.08Å; F119-L122 WeakPolarHBondContact O-CB 3.35Å; F119-L122 PolarHBondContact O-N 3.26Å; F119-L122 VanDerWaalsContact O-N 3.1Å; L122-L124 VanDerWaalsContact C-N 3.31Å; L122-L124 PolarHBondContact O-N 3.24Å; L122-L125 PolarHBondContact O-N 3.15Å; L122-I126 HydrophobicContact CD1-CD1 3.95Å; L122-I126 HydrophobicContact CD1-CG1 4.24Å; L122-I126 HydrophobicContact CG-CD1 3.88Å; L122-I126 WeakPolarHBondContact O-CG1 3.43Å; L122-I126 PolarHBondContact O-N 3.26Å
123V96.3Very high94.8Very high14 Ų1465.9 Ų65.99%0.08535%0.35CS..Hα-helixtrans-58.8-44.7176.7174.40000110.6A97 Y100 A101 F119 S120 I126 T127A97-V123 HydrophobicContact CB-CG1 4.01Å; A97-V123 WeakPolarHBondContact O-CG1 3.43Å; Y100-V123 HydrophobicContact CD1-CG2 3.78Å; Y100-V123 HydrophobicContact CE1-CG2 4.37Å; A101-V123 HydrophobicContact CB-CG1 4.34Å; F119-V123 HydrophobicContact CD1-CG2 3.99Å; F119-V123 HydrophobicContact CE1-CG2 3.65Å; F119-V123 HydrophobicContact CE2-CG2 4.45Å; F119-V123 HydrophobicContact CZ-CG2 3.92Å; F119-V123 WeakPolarHBondContact O-CG2 3.5Å; F119-V123 PolarHBondContact O-N 3.29Å; S120-V123 PolarHBondContact O-N 3.04Å; V123-I126 PolarHBondContact O-N 2.93Å; V123-T127 VanDerWaalsContact O-CB 3.32Å; V123-T127 WeakPolarHBondContact O-CB 3.29Å; V123-T127 PolarHBondContact O-N 3.04Å; V123-T127 PolarHBondContact O-OG1 2.84Å
124L97Very high94.7Very high92 Ų9265.7 Ų65.748%0.48235%0.349SS..Hα-helixtrans-59.4-48.1175.9178.362.7000111.7W94 S120 R121 L122 I126 T127 V128W94-L124 HydrophobicContact CH2-CD1 4.17Å; W94-L124 HydrophobicContact CZ3-CD1 4.04Å; S120-L124 WeakPolarHBondContact O-CB 3.48Å; S120-L124 PolarHBondContact O-N 3.25Å; R121-L124 PolarHBondContact O-N 3.29Å; L122-L124 VanDerWaalsContact C-N 3.31Å; L122-L124 PolarHBondContact O-N 3.24Å; L124-I126 PolarHBondContact O-N 3.48Å; L124-T127 PolarHBondContact O-N 3.23Å; L124-V128 HydrophobicContact CD1-CG2 4.25Å; L124-V128 WeakPolarHBondContact O-CG2 3.26Å; L124-V128 PolarHBondContact O-N 3.44Å
125L97.1Very high94.7Very high103 Ų10361.8 Ų61.854%0.53933%0.333SS..Hα-helixtrans-58.3-48.6178.3178.664.7000111.6R121 L122 T127 V128 I129R121-L125 WeakPolarHBondContact O-CB 3.35Å; R121-L125 PolarHBondContact O-N 3.13Å; L122-L125 PolarHBondContact O-N 3.15Å; L125-T127 VanDerWaalsContact C-N 3.3Å; L125-T127 PolarHBondContact O-N 3.21Å; L125-V128 PolarHBondContact O-N 3.21Å; L125-I129 HydrophobicContact CD1-CD1 4.07Å; L125-I129 HydrophobicContact CG-CD1 3.98Å; L125-I129 VanDerWaalsContact O-CG1 3.31Å; L125-I129 WeakPolarHBondContact O-CG1 3.34Å; L125-I129 PolarHBondContact O-N 2.95Å
126I95.1Very high94.5Very high88 Ų8864.8 Ų64.845%0.45135%0.353SS..Hα-helixtrans-61.3-41.5177.7-67.4169.5000110.6L122 V123 L124 I129 T130L122-I126 HydrophobicContact CD1-CD1 3.95Å; L122-I126 HydrophobicContact CD1-CG1 4.24Å; L122-I126 HydrophobicContact CG-CD1 3.88Å; L122-I126 WeakPolarHBondContact O-CG1 3.43Å; L122-I126 PolarHBondContact O-N 3.26Å; V123-I126 PolarHBondContact O-N 2.93Å; L124-I126 PolarHBondContact O-N 3.48Å; I126-I129 PolarHBondContact O-N 3.35Å; I126-T130 VanDerWaalsContact O-CB 3.31Å; I126-T130 WeakPolarHBondContact O-CB 3.33Å; I126-T130 PolarHBondContact O-N 3.14Å; I126-T130 PolarHBondContact O-OG1 3.23Å
127T95.9Very high94.2Very high8 Ų869.2 Ų69.25%0.04937%0.373CS..Hα-helixtrans-64.6-41.9-179.8-570000111.6L93 W94 A97 V123 L124 L125 T130 T131L93-T127 HydrophobicContact CD2-CG2 4.39Å; L93-T127 HydrophobicContact CG-CG2 4.18Å; W94-T127 HydrophobicContact CD2-CG2 3.94Å; W94-T127 HydrophobicContact CE3-CG2 4.41Å; W94-T127 HydrophobicContact CG-CG2 4.15Å; W94-T127 HydrophobicContact CZ2-CG2 4.37Å; A97-T127 HydrophobicContact CB-CG2 3.76Å; A97-T127 WeakPolarHBondContact CB-OG1 3.2Å; V123-T127 VanDerWaalsContact O-CB 3.32Å; V123-T127 WeakPolarHBondContact O-CB 3.29Å; V123-T127 PolarHBondContact O-N 3.04Å; V123-T127 PolarHBondContact O-OG1 2.84Å; L124-T127 PolarHBondContact O-N 3.23Å; L125-T127 VanDerWaalsContact C-N 3.3Å; L125-T127 PolarHBondContact O-N 3.21Å; T127-T130 PolarHBondContact O-N 3.37Å; T127-T131 WeakPolarHBondContact O-CB 3.47Å; T127-T131 PolarHBondContact O-N 2.99Å; T127-T131 PolarHBondContact O-OG1 2.83Å
128V96.5Very high93.8Very high65 Ų6566.8 Ų66.839%0.39436%0.356SS..Hα-helixtrans-64.6-46.6175.8170.70000110.9W94 L124 L125 T130 T131 V132W94-V128 HydrophobicContact CH2-CG2 4.2Å; W94-V128 HydrophobicContact CZ2-CG2 4.36Å; L124-V128 HydrophobicContact CD1-CG2 4.25Å; L124-V128 WeakPolarHBondContact O-CG2 3.26Å; L124-V128 PolarHBondContact O-N 3.44Å; L125-V128 PolarHBondContact O-N 3.21Å; V128-T130 VanDerWaalsContact C-N 3.32Å; V128-T130 PolarHBondContact O-N 2.92Å; V128-T131 WeakPolarHBondContact O-CB 3.5Å; V128-T131 PolarHBondContact O-N 3.21Å; V128-V132 WeakPolarHBondContact O-CG2 3.47Å; V128-V132 PolarHBondContact O-N 3.04Å
129I95Very high93.1Very high95 Ų9566.7 Ų66.749%0.48736%0.355SS..Hα-helixtrans-60.3-44.5176.9-67.6167.1000110.6L125 I126 V132 S133L125-I129 HydrophobicContact CD1-CD1 4.07Å; L125-I129 HydrophobicContact CG-CD1 3.98Å; L125-I129 VanDerWaalsContact O-CG1 3.31Å; L125-I129 WeakPolarHBondContact O-CG1 3.34Å; L125-I129 PolarHBondContact O-N 2.95Å; I126-I129 PolarHBondContact O-N 3.35Å; I129-V132 PolarHBondContact O-N 3.48Å; I129-S133 WeakPolarHBondContact O-CB 3.48Å; I129-S133 PolarHBondContact O-N 3.43Å; I129-S133 PolarHBondContact O-OG 2.98Å
130T93.3Very high92.5Very high51 Ų5168.2 Ų68.231%0.31337%0.369SS..Hα-helixtrans-63.2-44.5178.4-54.70000110.5L93 I126 T127 V128 V132 S133 S134L93-T130 HydrophobicContact CD1-CG2 4.19Å; L93-T130 HydrophobicContact CD2-CG2 3.82Å; I126-T130 VanDerWaalsContact O-CB 3.31Å; I126-T130 WeakPolarHBondContact O-CB 3.33Å; I126-T130 PolarHBondContact O-N 3.14Å; I126-T130 PolarHBondContact O-OG1 3.23Å; T127-T130 PolarHBondContact O-N 3.37Å; V128-T130 VanDerWaalsContact C-N 3.32Å; V128-T130 PolarHBondContact O-N 2.92Å; T130-V132 VanDerWaalsContact C-N 3.35Å; T130-V132 PolarHBondContact O-N 2.84Å; T130-S133 CarbonylContact O-C 3.49Å; T130-S133 PolarHBondContact O-N 3.32Å; T130-S133 VanDerWaalsContact O-N 3.09Å; T130-S134 WeakPolarHBondContact O-CB 3.23Å; T130-S134 PolarHBondContact O-N 3.28Å; T130-S134 PolarHBondContact O-OG 3.4Å; T130-S134 VanDerWaalsContact O-OG 3.06Å
131T94.3Very high92.1Very high22 Ų2267.2 Ų67.214%0.13536%0.36CS..Hα-helixtrans-56.3-46.4176.6-63.10000111.9L90 W94 T127 V128 S134 F135L90-T131 HydrophobicContact CD1-CG2 3.96Å; L90-T131 HydrophobicContact CD2-CG2 3.86Å; W94-T131 PolarHBondContact NE1-OG1 2.88Å; T127-T131 WeakPolarHBondContact O-CB 3.47Å; T127-T131 PolarHBondContact O-N 2.99Å; T127-T131 PolarHBondContact O-OG1 2.83Å; V128-T131 WeakPolarHBondContact O-CB 3.5Å; V128-T131 PolarHBondContact O-N 3.21Å; T131-S134 WeakPolarHBondContact O-CB 3.49Å; T131-S134 PolarHBondContact O-N 3.02Å; T131-F135 HydrophobicContact CG2-CE2 4.5Å; T131-F135 WeakPolarHBondContact O-CD2 3.45Å; T131-F135 WeakPolarHBondContact O-CE2 3.16Å
132V93.5Very high91.5Very high102 Ų10260.6 Ų60.662%0.61834%0.339SS*.Hα-helixtrans-66.4-40.5177.3175.70000110.9V128 I129 T130 S134 F135V128-V132 WeakPolarHBondContact O-CG2 3.47Å; V128-V132 PolarHBondContact O-N 3.04Å; I129-V132 PolarHBondContact O-N 3.48Å; T130-V132 VanDerWaalsContact C-N 3.35Å; T130-V132 PolarHBondContact O-N 2.84Å; V132-S134 VanDerWaalsContact C-N 3.28Å; V132-S134 PolarHBondContact O-N 3.47Å; V132-F135 PolarHBondContact O-N 3.17Å
133S91.3Very high91.1Very high67 Ų6764 Ų6447%0.46935%0.349SS..Hα-helixtrans-67.5-28.9179.4-54.90000112.8I129 T130 F135 V136I129-S133 WeakPolarHBondContact O-CB 3.48Å; I129-S133 PolarHBondContact O-N 3.43Å; I129-S133 PolarHBondContact O-OG 2.98Å; T130-S133 CarbonylContact O-C 3.49Å; T130-S133 PolarHBondContact O-N 3.32Å; T130-S133 VanDerWaalsContact O-N 3.09Å; S133-F135 PolarHBondContact O-N 3.08Å; S133-F135 VanDerWaalsContact O-N 3.16Å; S133-V136 WeakPolarHBondContact O-CB 3.25Å; S133-V136 WeakPolarHBondContact O-CG2 3.38Å; S133-V136 PolarHBondContact O-N 3.13Å
134S91.8Very high90.6Very high6 Ų666.2 Ų66.24%0.04237%0.368CS..THydrogen-bonded Turntrans-61.5-20.8179.4-76.50000114.1T130 T131 V132 V136 P138 N141T130-S134 WeakPolarHBondContact O-CB 3.23Å; T130-S134 PolarHBondContact O-N 3.28Å; T130-S134 PolarHBondContact O-OG 3.4Å; T130-S134 VanDerWaalsContact O-OG 3.06Å; T131-S134 WeakPolarHBondContact O-CB 3.49Å; T131-S134 PolarHBondContact O-N 3.02Å; V132-S134 VanDerWaalsContact C-N 3.28Å; V132-S134 PolarHBondContact O-N 3.47Å; S134-V136 VanDerWaalsContact C-N 3.31Å; S134-P138 WeakPolarHBondContact O-CA 3.46Å; S134-N141 VanDerWaalsContact CA-OD1 3.25Å; S134-N141 WeakPolarHBondContact CA-OD1 3.22Å; S134-N141 WeakPolarHBondContact CB-ND2 3.47Å; S134-N141 WeakPolarHBondContact CB-OD1 3.49Å; S134-N141 PolarHBondContact O-ND2 3.05Å; S134-N141 PolarHBondContact OG-OD1 3.36Å
135F90.3Very high90.1Very high111 Ų11163.2 Ų63.249%0.48735%0.353SS..THydrogen-bonded Turntrans-78-12.4174.4-68.3-85.5000113.6M86 L90 T131 V132 S133M86-F135 HydrophobicContact CB-CE1 4.33Å; M86-F135 HydrophobicContact CE-CD1 3.99Å; M86-F135 HydrophobicContact CE-CD2 4.33Å; M86-F135 HydrophobicContact CE-CE1 3.81Å; M86-F135 HydrophobicContact CE-CE2 4.16Å; M86-F135 HydrophobicContact CE-CG 4.25Å; M86-F135 HydrophobicContact CE-CZ 3.9Å; M86-F135 HydrophobicContact CG-CD1 4.31Å; M86-F135 HydrophobicContact CG-CE1 3.89Å; M86-F135 HydrophobicContact SD-CD1 4.27Å; M86-F135 HydrophobicContact SD-CE1 4.29Å; L90-F135 HydrophobicContact CD1-CE2 4.14Å; L90-F135 HydrophobicContact CD1-CZ 4.01Å; T131-F135 HydrophobicContact CG2-CE2 4.5Å; T131-F135 WeakPolarHBondContact O-CD2 3.45Å; T131-F135 WeakPolarHBondContact O-CE2 3.16Å; V132-F135 PolarHBondContact O-N 3.17Å; S133-F135 PolarHBondContact O-N 3.08Å; S133-F135 VanDerWaalsContact O-N 3.16Å
136V88.9Confident89.7Confident126 Ų12660 Ų6076%0.76434%0.336SS*.THydrogen-bonded Turntrans-76.7-44.5180179.70000111.3S133 S134S133-V136 WeakPolarHBondContact O-CB 3.25Å; S133-V136 WeakPolarHBondContact O-CG2 3.38Å; S133-V136 PolarHBondContact O-N 3.13Å; S134-V136 VanDerWaalsContact C-N 3.31Å
137K86.6Confident89.4Confident133 Ų13359.8 Ų59.858%0.57834%0.341SS*.  trans-143.181.8176.7-169.3171.8-177.9174.70110.2T139 A140K137-T139 VanDerWaalsContact C-N 3.27Å; K137-T139 PolarHBondContact O-N 3.14Å; K137-A140 HydrophobicContact CB-CB 4.22Å; K137-A140 HydrophobicContact CD-CB 4.15Å; K137-A140 HydrophobicContact CG-CB 3.99Å; K137-A140 VanDerWaalsContact O-CB 3.32Å; K137-A140 WeakPolarHBondContact O-CB 3.44Å; K137-A140 PolarHBondContact O-N 2.97Å
138P85.8Confident89.1Confident20 Ų2062.2 Ų62.213%0.1335%0.351CS..Hα-helixtrans-55.1-40.8-174.8-30.738.7000113.6F82 M86 S134 A140 N141F82-P138 HydrophobicContact CE2-CB 4.49Å; F82-P138 HydrophobicContact CE2-CG 3.8Å; F82-P138 HydrophobicContact CZ-CG 4.06Å; M86-P138 HydrophobicContact SD-CB 3.9Å; M86-P138 HydrophobicContact SD-CG 3.96Å; S134-P138 WeakPolarHBondContact O-CA 3.46Å; P138-A140 PolarHBondContact O-N 3.5Å; P138-N141 WeakPolarHBondContact CA-ND2 3.3Å; P138-N141 WeakPolarHBondContact O-CB 3.46Å; P138-N141 VanDerWaalsContact O-CG 3.23Å; P138-N141 PolarHBondContact O-N 2.76Å; P138-N141 PolarHBondContact O-ND2 3.1Å
139T80.9Confident88.6Confident44 Ų4459.8 Ų59.827%0.2734%0.339SS..Hα-helixtrans-59.8-20.2177.154.60000114.4K137 Y143K137-T139 VanDerWaalsContact C-N 3.27Å; K137-T139 PolarHBondContact O-N 3.14Å; T139-Y143 WeakPolarHBondContact O-CD2 3.3Å; T139-Y143 WeakPolarHBondContact O-CE2 3.46Å
140A84.4Confident88.4Confident39 Ų3960.2 Ų60.232%0.32234%0.342SS..Hα-helixtrans-80.2-20.4175.400000113.2K137 P138 A142 Y143 A144K137-A140 HydrophobicContact CB-CB 4.22Å; K137-A140 HydrophobicContact CD-CB 4.15Å; K137-A140 HydrophobicContact CG-CB 3.99Å; K137-A140 VanDerWaalsContact O-CB 3.32Å; K137-A140 WeakPolarHBondContact O-CB 3.44Å; K137-A140 PolarHBondContact O-N 2.97Å; P138-A140 PolarHBondContact O-N 3.5Å; A140-A142 PolarHBondContact O-N 3.17Å; A140-Y143 PolarHBondContact O-N 2.85Å; A140-A144 PolarHBondContact O-N 2.84Å; A140-A144 VanDerWaalsContact O-N 3.09Å
141N87.7Confident88.4Confident16 Ų1661 Ų619%0.08634%0.342CS..Hα-helixtrans-60.3-44.8-175.8-65.3-25.9000111.8E89 S134 P138 Y143 A144 L145E89-N141 WeakPolarHBondContact OE2-CB 3.24Å; E89-N141 PolarHBondContact OE2-ND2 3.37Å; S134-N141 VanDerWaalsContact CA-OD1 3.25Å; S134-N141 WeakPolarHBondContact CA-OD1 3.22Å; S134-N141 WeakPolarHBondContact CB-ND2 3.47Å; S134-N141 WeakPolarHBondContact CB-OD1 3.49Å; S134-N141 PolarHBondContact O-ND2 3.05Å; S134-N141 PolarHBondContact OG-OD1 3.36Å; P138-N141 WeakPolarHBondContact CA-ND2 3.3Å; P138-N141 WeakPolarHBondContact O-CB 3.46Å; P138-N141 VanDerWaalsContact O-CG 3.23Å; P138-N141 PolarHBondContact O-N 2.76Å; P138-N141 PolarHBondContact O-ND2 3.1Å; N141-Y143 VanDerWaalsContact C-N 3.25Å; N141-Y143 PolarHBondContact O-N 2.87Å; N141-A144 WeakPolarHBondContact O-CB 3.37Å; N141-A144 PolarHBondContact O-N 3.32Å; N141-A144 VanDerWaalsContact O-N 3.1Å; N141-L145 WeakPolarHBondContact O-CG 3.17Å; N141-L145 PolarHBondContact O-N 3.48Å
142A84.4Confident88.2Confident15 Ų1563 Ų6312%0.12435%0.351CS..Hα-helixtrans-57.4-38.8178.900000112.2A140 N146 W186A140-A142 PolarHBondContact O-N 3.17Å; A142-N146 PolarHBondContact O-N 2.87Å; A142-N146 VanDerWaalsContact O-N 3.08Å; A142-N146 PolarHBondContact O-ND2 2.77Å; A142-W186 HydrophobicContact CB-CH2 4.39Å; A142-W186 HydrophobicContact CB-CZ2 3.88Å
143Y86Confident88.1Confident127 Ų12760.1 Ų60.150%0.49833%0.332SS..Hα-helixtrans-71.3-39.8176.4-59.8-78.9000112.1T139 A140 N141 L145 N146 C147 W186T139-Y143 WeakPolarHBondContact O-CD2 3.3Å; T139-Y143 WeakPolarHBondContact O-CE2 3.46Å; A140-Y143 PolarHBondContact O-N 2.85Å; N141-Y143 VanDerWaalsContact C-N 3.25Å; N141-Y143 PolarHBondContact O-N 2.87Å; Y143-L145 VanDerWaalsContact C-N 3.33Å; Y143-L145 PolarHBondContact O-N 2.86Å; Y143-N146 PolarHBondContact O-N 2.74Å; Y143-C147 PolarHBondContact O-N 3.18Å; Y143-C147 PolarHBondContact O-SG 3.37Å; Y143-C147 VanDerWaalsContact O-SG 3.38Å; Y143-W186 HydrophobicContact CE1-CH2 4.37Å
144A86.8Confident88.1Confident60 Ų6064 Ų6450%0.49634%0.338SS..Hα-helixtrans-61.7-41.3174.700000111.9A140 N141 C147 F148A140-A144 PolarHBondContact O-N 2.84Å; A140-A144 VanDerWaalsContact O-N 3.09Å; N141-A144 WeakPolarHBondContact O-CB 3.37Å; N141-A144 PolarHBondContact O-N 3.32Å; N141-A144 VanDerWaalsContact O-N 3.1Å; A144-C147 WeakPolarHBondContact O-CB 3.47Å; A144-C147 PolarHBondContact O-N 3.46Å; A144-F148 PolarHBondContact O-N 2.88Å; A144-F148 VanDerWaalsContact O-N 3.1Å
145L87Confident88.1Confident30 Ų3064.2 Ų64.216%0.15734%0.339CS..Hα-helixtrans-62.1-42.2174.7-72.7170.4000111.9I92 L93 L96 N141 Y143 C147 F148 G149I92-L145 HydrophobicContact CB-CD1 4.41Å; I92-L145 HydrophobicContact CG2-CD1 4.26Å; I92-L145 HydrophobicContact CG2-CD2 4.16Å; L93-L145 HydrophobicContact CB-CD2 4.13Å; L93-L145 HydrophobicContact CD1-CD2 4.39Å; L96-L145 HydrophobicContact CD1-CD2 3.72Å; N141-L145 WeakPolarHBondContact O-CG 3.17Å; N141-L145 PolarHBondContact O-N 3.48Å; Y143-L145 VanDerWaalsContact C-N 3.33Å; Y143-L145 PolarHBondContact O-N 2.86Å; L145-C147 PolarHBondContact O-N 3.41Å; L145-F148 WeakPolarHBondContact O-CB 3.27Å; L145-F148 PolarHBondContact O-N 3.44Å; L145-F148 VanDerWaalsContact O-N 3.14Å; L145-G149 PolarHBondContact O-N 3.22Å
146N88.1Confident88.2Confident36 Ų3660 Ų6019%0.19332%0.321CS..Hα-helixtrans-62.1-40.3174.9-82.4-64.8000112.5A142 Y143 F148 G149 L150 I183A142-N146 PolarHBondContact O-N 2.87Å; A142-N146 VanDerWaalsContact O-N 3.08Å; A142-N146 PolarHBondContact O-ND2 2.77Å; Y143-N146 PolarHBondContact O-N 2.74Å; N146-F148 VanDerWaalsContact C-N 3.28Å; N146-F148 PolarHBondContact O-N 3.12Å; N146-G149 WeakPolarHBondContact O-CA 3.4Å; N146-G149 PolarHBondContact O-N 2.89Å; N146-G149 VanDerWaalsContact O-N 3.13Å; N146-L150 PolarHBondContact O-N 3.25Å; N146-I183 WeakPolarHBondContact OD1-CD1 3.14Å
147C89.5Confident88.3Confident83 Ų8356.6 Ų56.656%0.56131%0.307SS*.Hα-helixtrans-59.7-39.2172.8-69.40000112.1Y143 A144 L145 L150 H151Y143-C147 PolarHBondContact O-N 3.18Å; Y143-C147 PolarHBondContact O-SG 3.37Å; Y143-C147 VanDerWaalsContact O-SG 3.38Å; A144-C147 WeakPolarHBondContact O-CB 3.47Å; A144-C147 PolarHBondContact O-N 3.46Å; L145-C147 PolarHBondContact O-N 3.41Å; C147-L150 PolarHBondContact O-N 3.39Å; C147-H151 PolarHBondContact O-N 3.4Å; C147-H151 VanDerWaalsContact O-N 3.08Å
148F89Confident88.5Confident59 Ų5951.8 Ų51.826%0.25929%0.288SS..Hα-helixtrans-65.1-39.4174.4-166-95.7000112L96 Y100 A144 L145 N146 L150 H151 L152L96-F148 HydrophobicContact CB-CD1 4.12Å; L96-F148 HydrophobicContact CB-CE1 3.81Å; L96-F148 HydrophobicContact CD1-CD1 3.84Å; L96-F148 HydrophobicContact CD1-CE1 4.38Å; L96-F148 HydrophobicContact CD2-CD1 4.03Å; L96-F148 HydrophobicContact CD2-CE1 4.05Å; L96-F148 HydrophobicContact CG-CD1 4.23Å; L96-F148 HydrophobicContact CG-CE1 4.3Å; Y100-F148 HydrophobicContact CD2-CE1 4.35Å; Y100-F148 HydrophobicContact CD2-CE2 4.31Å; Y100-F148 AromaticContact CD2-CZ 3.55Å; Y100-F148 HydrophobicContact CD2-CZ 3.55Å; Y100-F148 HydrophobicContact CE2-CE2 4.37Å; Y100-F148 AromaticContact CE2-CZ 3.99Å; Y100-F148 HydrophobicContact CE2-CZ 3.99Å; Y100-F148 AromaticContact CG-CZ 3.85Å; Y100-F148 HydrophobicContact CG-CZ 3.85Å; A144-F148 PolarHBondContact O-N 2.88Å; A144-F148 VanDerWaalsContact O-N 3.1Å; L145-F148 WeakPolarHBondContact O-CB 3.27Å; L145-F148 PolarHBondContact O-N 3.44Å; L145-F148 VanDerWaalsContact O-N 3.14Å; N146-F148 VanDerWaalsContact C-N 3.28Å; N146-F148 PolarHBondContact O-N 3.12Å; F148-L150 VanDerWaalsContact C-N 3.33Å; F148-L150 PolarHBondContact O-N 2.8Å; F148-H151 WeakPolarHBondContact O-CB 3.39Å; F148-H151 PolarHBondContact O-N 3.49Å; F148-H151 VanDerWaalsContact O-N 3.17Å; F148-L152 HydrophobicContact CD1-CD1 3.89Å; F148-L152 HydrophobicContact CD1-CG 3.96Å; F148-L152 HydrophobicContact CE1-CD1 3.73Å; F148-L152 HydrophobicContact CE1-CD2 3.91Å; F148-L152 HydrophobicContact CE1-CG 3.78Å; F148-L152 HydrophobicContact CZ-CD2 4.32Å; F148-L152 WeakPolarHBondContact O-CG 3.48Å; F148-L152 PolarHBondContact O-N 3.3Å
149G86.9Confident88.8Confident13 Ų1351.5 Ų51.513%0.13429%0.285CS..Hα-helixtrans-56.2-44.9172.100000112.8L145 N146 H151 L152 L153L145-G149 PolarHBondContact O-N 3.22Å; N146-G149 WeakPolarHBondContact O-CA 3.4Å; N146-G149 PolarHBondContact O-N 2.89Å; N146-G149 VanDerWaalsContact O-N 3.13Å; G149-H151 VanDerWaalsContact C-N 3.35Å; G149-H151 PolarHBondContact O-N 3.25Å; G149-L152 PolarHBondContact O-N 3.39Å; G149-L153 WeakPolarHBondContact O-CG 3.4Å; G149-L153 PolarHBondContact O-N 3.45Å
150L90.4Very high89.3Confident104 Ų10450.4 Ų50.455%0.54528%0.277SS..Hα-helixtrans-62.3-39.9175.1-67173.9000112.5N146 C147 F148 L153 Y154 W179N146-L150 PolarHBondContact O-N 3.25Å; C147-L150 PolarHBondContact O-N 3.39Å; F148-L150 VanDerWaalsContact C-N 3.33Å; F148-L150 PolarHBondContact O-N 2.8Å; L150-L153 WeakPolarHBondContact O-CB 3.28Å; L150-L153 PolarHBondContact O-N 3.42Å; L150-Y154 PolarHBondContact O-N 3.15Å; L150-W179 HydrophobicContact CD2-CH2 3.78Å; L150-W179 HydrophobicContact CD2-CZ3 4.46Å; L150-W179 HydrophobicContact CG-CH2 4.43Å
151H92.5Very high89.4Confident68 Ų6858.2 Ų58.232%0.31530%0.298SS..Hα-helixtrans-64-40175175.665.5000112.6Y100 C147 F148 G149 L153 Y154 T155Y100-H151 AromaticContact CE2-NE2 3.82Å; Y100-H151 AromaticContact CZ-NE2 3.8Å; Y100-H151 PolarHBondContact OH-NE2 3.43Å; C147-H151 PolarHBondContact O-N 3.4Å; C147-H151 VanDerWaalsContact O-N 3.08Å; F148-H151 WeakPolarHBondContact O-CB 3.39Å; F148-H151 PolarHBondContact O-N 3.49Å; F148-H151 VanDerWaalsContact O-N 3.17Å; G149-H151 VanDerWaalsContact C-N 3.35Å; G149-H151 PolarHBondContact O-N 3.25Å; H151-L153 VanDerWaalsContact C-N 3.34Å; H151-Y154 PolarHBondContact O-N 3.49Å; H151-T155 WeakPolarHBondContact O-CB 3.49Å; H151-T155 PolarHBondContact O-N 2.96Å; H151-T155 PolarHBondContact O-OG1 2.84Å
152L90.6Very high89.1Confident63 Ų6362.8 Ų62.833%0.3333%0.33SS..Hα-helixtrans-63.5-40.5173.8-70.1-178.7000111.8L96 Y100 F148 G149 T155 L156L96-L152 HydrophobicContact CD2-CD1 3.91Å; Y100-L152 HydrophobicContact CD2-CD2 3.91Å; Y100-L152 HydrophobicContact CE2-CD2 4.16Å; F148-L152 HydrophobicContact CD1-CD1 3.89Å; F148-L152 HydrophobicContact CD1-CG 3.96Å; F148-L152 HydrophobicContact CE1-CD1 3.73Å; F148-L152 HydrophobicContact CE1-CD2 3.91Å; F148-L152 HydrophobicContact CE1-CG 3.78Å; F148-L152 HydrophobicContact CZ-CD2 4.32Å; F148-L152 WeakPolarHBondContact O-CG 3.48Å; F148-L152 PolarHBondContact O-N 3.3Å; G149-L152 PolarHBondContact O-N 3.39Å; L152-T155 PolarHBondContact O-N 3.39Å; L152-L156 WeakPolarHBondContact O-CB 3.02Å; L152-L156 PolarHBondContact O-N 2.87Å
153L90.6Very high89.4Confident43 Ų4363.2 Ų63.223%0.22533%0.332CS..Hα-helixtrans-63.4-42.3174.5-73.1178.8000112.4G149 L150 H151 T155 L156 A157 V176 W179G149-L153 WeakPolarHBondContact O-CG 3.4Å; G149-L153 PolarHBondContact O-N 3.45Å; L150-L153 WeakPolarHBondContact O-CB 3.28Å; L150-L153 PolarHBondContact O-N 3.42Å; H151-L153 VanDerWaalsContact C-N 3.34Å; L153-T155 VanDerWaalsContact C-N 3.34Å; L153-L156 PolarHBondContact O-N 2.85Å; L153-A157 WeakPolarHBondContact O-CB 3.33Å; L153-A157 PolarHBondContact O-N 3.04Å; L153-V176 HydrophobicContact CD2-CG2 3.99Å; L153-W179 HydrophobicContact CD1-CD2 3.96Å; L153-W179 HydrophobicContact CD1-CE3 3.49Å; L153-W179 VanDerWaalsContact CD1-CE3 3.49Å; L153-W179 HydrophobicContact CD1-CH2 3.59Å; L153-W179 HydrophobicContact CD1-CZ2 4.05Å; L153-W179 HydrophobicContact CD1-CZ3 3.29Å
154Y92.8Very high89.5Confident149 Ų14963.1 Ų63.158%0.58435%0.345SS*.Hα-helixtrans-59-48.2173.7168.2-101.7000111.1L150 H151 L156 A157 V158L150-Y154 PolarHBondContact O-N 3.15Å; H151-Y154 PolarHBondContact O-N 3.49Å; Y154-L156 VanDerWaalsContact C-N 3.34Å; Y154-L156 PolarHBondContact O-N 3.37Å; Y154-A157 WeakPolarHBondContact O-CB 3.4Å; Y154-A157 PolarHBondContact O-N 3.04Å; Y154-V158 HydrophobicContact CD2-CG2 4.39Å; Y154-V158 HydrophobicContact CE1-CG2 4.12Å; Y154-V158 HydrophobicContact CE2-CG2 3.89Å; Y154-V158 WeakPolarHBondContact O-CG2 3.2Å; Y154-V158 PolarHBondContact O-N 2.73Å
155T91.9Very high89.7Confident10 Ų1062.7 Ų62.76%0.06133%0.334CS..Hα-helixtrans-58.7-46.5177.8-590000111F104 P105 L108 H151 L152 L153 A157 V158 E159F104-T155 HydrophobicContact CD2-CG2 4.21Å; F104-T155 HydrophobicContact CE2-CG2 3.84Å; P105-T155 HydrophobicContact CG-CG2 4.15Å; L108-T155 HydrophobicContact CD1-CG2 3.76Å; H151-T155 WeakPolarHBondContact O-CB 3.49Å; H151-T155 PolarHBondContact O-N 2.96Å; H151-T155 PolarHBondContact O-OG1 2.84Å; L152-T155 PolarHBondContact O-N 3.39Å; L153-T155 VanDerWaalsContact C-N 3.34Å; T155-A157 PolarHBondContact O-N 2.95Å; T155-V158 PolarHBondContact O-N 3.4Å; T155-E159 PolarHBondContact O-N 3.33Å
156L90.5Very high89.9Confident22 Ų2267.8 Ų67.812%0.11536%0.357CS..Hα-helixtrans-60.8-44.8176.4-179.663.1000111.6L152 L153 Y154 V158 E159 M160 V176 L222 L226L152-L156 WeakPolarHBondContact O-CB 3.02Å; L152-L156 PolarHBondContact O-N 2.87Å; L153-L156 PolarHBondContact O-N 2.85Å; Y154-L156 VanDerWaalsContact C-N 3.34Å; Y154-L156 PolarHBondContact O-N 3.37Å; L156-V158 VanDerWaalsContact C-N 3.28Å; L156-V158 PolarHBondContact O-N 3.4Å; L156-E159 PolarHBondContact O-N 3.22Å; L156-M160 HydrophobicContact CD1-CG 3.94Å; L156-M160 HydrophobicContact CD1-SD 4.46Å; L156-M160 HydrophobicContact CG-CG 4.16Å; L156-M160 WeakPolarHBondContact O-CB 3.02Å; L156-M160 WeakPolarHBondContact O-CG 3.44Å; L156-M160 PolarHBondContact O-N 3.39Å; L156-V176 HydrophobicContact CD2-CG2 4.47Å; L156-L222 HydrophobicContact CD1-CD2 3.72Å; L156-L222 HydrophobicContact CD1-CG 4.19Å; L156-L222 HydrophobicContact CD2-CD2 4.13Å; L156-L222 HydrophobicContact CG-CD2 4.44Å; L156-L226 HydrophobicContact CD1-CD1 3.96Å
157A91.8Very high90.1Very high55 Ų5570 Ų7046%0.45537%0.365SS..Hα-helixtrans-60.2-40177.900000111.6L153 Y154 T155 M160 R161L153-A157 WeakPolarHBondContact O-CB 3.33Å; L153-A157 PolarHBondContact O-N 3.04Å; Y154-A157 WeakPolarHBondContact O-CB 3.4Å; Y154-A157 PolarHBondContact O-N 3.04Å; T155-A157 PolarHBondContact O-N 2.95Å; A157-M160 PolarHBondContact O-N 2.88Å; A157-R161 WeakPolarHBondContact O-CG 3.04Å; A157-R161 PolarHBondContact O-N 2.96Å
158V91.8Very high90.3Very high32 Ų3266 Ų6619%0.19434%0.338CS..Hα-helixtrans-64.2-46.2174.9171.90000111.3L108 Y154 T155 L156 M160 R161L108-V158 HydrophobicContact CD2-CG1 4.36Å; Y154-V158 HydrophobicContact CD2-CG2 4.39Å; Y154-V158 HydrophobicContact CE1-CG2 4.12Å; Y154-V158 HydrophobicContact CE2-CG2 3.89Å; Y154-V158 WeakPolarHBondContact O-CG2 3.2Å; Y154-V158 PolarHBondContact O-N 2.73Å; T155-V158 PolarHBondContact O-N 3.4Å; L156-V158 VanDerWaalsContact C-N 3.28Å; L156-V158 PolarHBondContact O-N 3.4Å; V158-M160 VanDerWaalsContact C-N 3.33Å; V158-M160 PolarHBondContact O-N 3.28Å; V158-R161 PolarHBondContact O-N 3.34Å
159E90.8Very high90.5Very high13 Ų1365.6 Ų65.66%0.06134%0.338CS..Hα-helixtrans-61.2-41.3176.7-72-56.8140.200112.6P105 K107 T155 L156 R161 L226P105-E159 WeakPolarHBondContact CB-OE1 3.32Å; P105-E159 HydrophobicContact CG-CG 3.75Å; P105-E159 WeakPolarHBondContact CG-OE1 3.26Å; K107-E159 WeakPolarHBondContact CE-OE1 3.3Å; K107-E159 WeakPolarHBondContact CE-OE2 3.27Å; K107-E159 VanDerWaalsContact NZ-CD 3.3Å; K107-E159 IonicContact NZ-OE1 3.79Å; K107-E159 PolarHBondContact NZ-OE1 3.12Å; K107-E159 IonicContact NZ-OE2 2.83Å; K107-E159 PolarHBondContact NZ-OE2 3.31Å; T155-E159 PolarHBondContact O-N 3.33Å; L156-E159 PolarHBondContact O-N 3.22Å; E159-R161 VanDerWaalsContact C-N 3.26Å; E159-R161 PolarHBondContact O-N 3.16Å; E159-L226 HydrophobicContact CB-CD1 4Å
160M90.9Very high90.8Very high21 Ų2172.7 Ų72.710%0.10336%0.361CS..Hα-helixtrans-71.4-16.3-176.7-70.6-59.2-60.200113.6L156 A157 V158 C162 C163 A168 L169 A172 L222 L226L156-M160 HydrophobicContact CD1-CG 3.94Å; L156-M160 HydrophobicContact CD1-SD 4.46Å; L156-M160 HydrophobicContact CG-CG 4.16Å; L156-M160 WeakPolarHBondContact O-CB 3.02Å; L156-M160 WeakPolarHBondContact O-CG 3.44Å; L156-M160 PolarHBondContact O-N 3.39Å; A157-M160 PolarHBondContact O-N 2.88Å; V158-M160 VanDerWaalsContact C-N 3.33Å; V158-M160 PolarHBondContact O-N 3.28Å; M160-C162 PolarHBondContact O-N 2.96Å; M160-C163 HydrophobicContact CE-CB 3.92Å; M160-C163 WeakPolarHBondContact O-CB 3.37Å; M160-C163 PolarHBondContact O-N 2.97Å; M160-C163 HydrophobicContact SD-CB 4.2Å; M160-A168 HydrophobicContact CE-CB 4.47Å; M160-L169 HydrophobicContact CE-CD2 3.61Å; M160-L169 HydrophobicContact CE-CG 4.16Å; M160-A172 HydrophobicContact CE-CB 3.76Å; M160-A172 HydrophobicContact CG-CB 4.36Å; M160-A172 HydrophobicContact SD-CB 4.26Å; M160-L222 HydrophobicContact SD-CD1 4Å; M160-L222 HydrophobicContact SD-CD2 4.22Å; M160-L222 HydrophobicContact SD-CG 4.42Å; M160-L226 HydrophobicContact SD-CD1 3.95Å; M160-L226 HydrophobicContact SD-CD2 4.2Å
161R88.3Confident90.9Very high204 Ų20467.8 Ų67.877%0.7734%0.335SS*.THydrogen-bonded Turntrans-57.9-33.3179.4-77.6179.9-176.6-172.70.4113.4A157 V158 E159A157-R161 WeakPolarHBondContact O-CG 3.04Å; A157-R161 PolarHBondContact O-N 2.96Å; V158-R161 PolarHBondContact O-N 3.34Å; E159-R161 VanDerWaalsContact C-N 3.26Å; E159-R161 PolarHBondContact O-N 3.16Å
162C81.6Confident91Very high111 Ų11165.1 Ų65.175%0.7533%0.325SS*.THydrogen-bonded Turntrans-96.20.1-179-59.10000112.9M160M160-C162 PolarHBondContact O-N 2.96Å
163C88.8Confident91.2Very high24 Ų2469.6 Ų69.616%0.16234%0.342CS..  trans-88.6121.3-176.3-171.20000110.9M160M160-C163 HydrophobicContact CE-CB 3.92Å; M160-C163 WeakPolarHBondContact O-CB 3.37Å; M160-C163 PolarHBondContact O-N 2.97Å; M160-C163 HydrophobicContact SD-CB 4.2Å
164T88.7Confident91.3Very high126 Ų12670.8 Ų70.877%0.77335%0.348SS*.  trans-103.3-8.7178.454.40000113.5Q166T164-Q166 PolarHBondContact O-N 2.89Å
165D91.5Very high91.4Very high50 Ų5064.2 Ų64.227%0.26732%0.324SS..  trans-68.4119.1-179.3-173.2-36.2000110.9K167 A168 L169 Y225D165-K167 VanDerWaalsContact C-N 3.33Å; D165-K167 PolarHBondContact O-N 3.3Å; D165-K167 WeakPolarHBondContact OD1-CA 3.48Å; D165-K167 WeakPolarHBondContact OD1-CB 3.22Å; D165-K167 PolarHBondContact OD1-N 3.45Å; D165-A168 HydrophobicContact CB-CB 3.98Å; D165-A168 PolarHBondContact O-N 3.47Å; D165-A168 PolarHBondContact OD1-N 2.97Å; D165-L169 WeakPolarHBondContact O-CG 3.31Å; D165-L169 PolarHBondContact O-N 3.35Å; D165-Y225 WeakPolarHBondContact CB-OH 3.36Å; D165-Y225 PolarHBondContact OD2-OH 3.37Å
166Q91.3Very high91.6Very high138 Ų13866.3 Ų66.365%0.64534%0.336SS*.Hα-helixtrans-65.7-32.4-178.1-65.8-59.6-42.900113.4T164 R170T164-Q166 PolarHBondContact O-N 2.89Å; Q166-R170 WeakPolarHBondContact O-CB 3.42Å; Q166-R170 PolarHBondContact O-N 3.46Å
167K91.4Very high91.8Very high82 Ų8268 Ų6836%0.35735%0.354SS..Hα-helixtrans-67.6-44.4175.2-72.5-172.9166.6-166.50109.9D165 R170 L171 L239 D245D165-K167 VanDerWaalsContact C-N 3.33Å; D165-K167 PolarHBondContact O-N 3.3Å; D165-K167 WeakPolarHBondContact OD1-CA 3.48Å; D165-K167 WeakPolarHBondContact OD1-CB 3.22Å; D165-K167 PolarHBondContact OD1-N 3.45Å; K167-R170 PolarHBondContact O-N 3.33Å; K167-L171 WeakPolarHBondContact O-CB 3.44Å; K167-L171 PolarHBondContact O-N 3.09Å; K167-L239 HydrophobicContact CB-CB 4.28Å; K167-L239 HydrophobicContact CB-CD1 4.22Å; K167-L239 HydrophobicContact CD-CB 4.36Å; K167-L239 WeakPolarHBondContact CD-O 3.29Å; K167-L239 PolarHBondContact NZ-O 3.13Å; K167-D245 IonicContact NZ-OD2 2.75Å
168A93.4Very high92Very high0 Ų067.3 Ų67.30%034%0.342CS..Hα-helixtrans-64.2-42.6177.200000112M160 D165 R170 L171 A172 L222 Y225 L239M160-A168 HydrophobicContact CE-CB 4.47Å; D165-A168 HydrophobicContact CB-CB 3.98Å; D165-A168 PolarHBondContact O-N 3.47Å; D165-A168 PolarHBondContact OD1-N 2.97Å; A168-R170 PolarHBondContact O-N 2.99Å; A168-L171 PolarHBondContact O-N 3.27Å; A168-A172 WeakPolarHBondContact O-CB 3.5Å; A168-A172 PolarHBondContact O-N 2.95Å; A168-L222 HydrophobicContact CB-CD1 4.09Å; A168-Y225 HydrophobicContact CB-CD1 4.13Å; A168-Y225 HydrophobicContact CB-CE1 3.71Å; A168-L239 HydrophobicContact CB-CD1 3.92Å
169L93.8Very high92.2Very high49 Ų4968 Ų6826%0.25734%0.342SS..Hα-helixtrans-62.9-39.8175.9-70.7167.2000112.5M160 D165 A172 K173M160-L169 HydrophobicContact CE-CD2 3.61Å; M160-L169 HydrophobicContact CE-CG 4.16Å; D165-L169 WeakPolarHBondContact O-CG 3.31Å; D165-L169 PolarHBondContact O-N 3.35Å; L169-A172 PolarHBondContact O-N 3.42Å; L169-K173 WeakPolarHBondContact O-CG 3.12Å; L169-K173 PolarHBondContact O-N 3.26Å; L169-K173 VanDerWaalsContact O-N 3.08Å
170R92.8Very high92.5Very high162 Ų16270.8 Ų70.861%0.61136%0.359SS*.Hα-helixtrans-64.9-45.7174.8-172.8-175.8-58.5-179.41.1111.1Q166 K167 A168 A172 K173 L174Q166-R170 WeakPolarHBondContact O-CB 3.42Å; Q166-R170 PolarHBondContact O-N 3.46Å; K167-R170 PolarHBondContact O-N 3.33Å; A168-R170 PolarHBondContact O-N 2.99Å; R170-A172 VanDerWaalsContact C-N 3.3Å; R170-A172 PolarHBondContact O-N 3.38Å; R170-K173 PolarHBondContact O-N 3.45Å; R170-L174 HydrophobicContact CG-CD1 4.2Å; R170-L174 WeakPolarHBondContact O-CG 3.42Å; R170-L174 PolarHBondContact O-N 2.05Å
171L93.4Very high92.8Very high1 Ų174.1 Ų74.11%0.00538%0.377CS..Hα-helixtrans-60.8-41.1178-177.559.7000111.4K167 A168 L174 S175 Y218 T221 L222 L239 P252K167-L171 WeakPolarHBondContact O-CB 3.44Å; K167-L171 PolarHBondContact O-N 3.09Å; A168-L171 PolarHBondContact O-N 3.27Å; L171-L174 PolarHBondContact O-N 3.19Å; L171-S175 WeakPolarHBondContact O-CB 3.46Å; L171-S175 PolarHBondContact O-N 2.87Å; L171-Y218 HydrophobicContact CD1-CD1 3.5Å; L171-Y218 VanDerWaalsContact CD1-CD1 3.5Å; L171-Y218 HydrophobicContact CD1-CE1 4.23Å; L171-Y218 HydrophobicContact CD1-CG 4Å; L171-T221 HydrophobicContact CD2-CG2 4.06Å; L171-L222 HydrophobicContact CD2-CB 3.86Å; L171-L222 HydrophobicContact CD2-CD1 4.41Å; L171-L222 HydrophobicContact CG-CB 4.13Å; L171-L239 HydrophobicContact CD2-CD1 4.13Å; L171-L239 HydrophobicContact CD2-CD2 4Å; L171-P252 HydrophobicContact CD1-CB 3.7Å; L171-P252 HydrophobicContact CD1-CG 3.64Å; L171-P252 HydrophobicContact CD2-CB 4.19Å
172A94.6Very high93.2Very high12 Ų1264.4 Ų64.410%0.09934%0.341CS..Hα-helixtrans-59.9-49.1174.400000112.1M160 A168 L169 R170 L174 S175 V176 L222M160-A172 HydrophobicContact CE-CB 3.76Å; M160-A172 HydrophobicContact CG-CB 4.36Å; M160-A172 HydrophobicContact SD-CB 4.26Å; A168-A172 WeakPolarHBondContact O-CB 3.5Å; A168-A172 PolarHBondContact O-N 2.95Å; L169-A172 PolarHBondContact O-N 3.42Å; R170-A172 VanDerWaalsContact C-N 3.3Å; R170-A172 PolarHBondContact O-N 3.38Å; A172-L174 VanDerWaalsContact C-N 3.34Å; A172-L174 PolarHBondContact O-N 3.08Å; A172-S175 PolarHBondContact O-N 3.1Å; A172-V176 WeakPolarHBondContact O-CB 3.38Å; A172-V176 VanDerWaalsContact O-CG2 3.28Å; A172-V176 WeakPolarHBondContact O-CG2 3.46Å; A172-V176 PolarHBondContact O-N 3.32Å; A172-L222 VanDerWaalsContact CA-CD2 3.47Å; A172-L222 HydrophobicContact CB-CD2 3.5Å; A172-L222 VanDerWaalsContact CB-CD2 3.5Å
173K93.9Very high93.8Very high158 Ų15860.2 Ų60.269%0.68731%0.31SS*.Hα-helixtrans-59.2-44.9177.4-71.7175.5-175.7-179.60111.9L169 R170 A177L169-K173 WeakPolarHBondContact O-CG 3.12Å; L169-K173 PolarHBondContact O-N 3.26Å; L169-K173 VanDerWaalsContact O-N 3.08Å; R170-K173 PolarHBondContact O-N 3.45Å; K173-A177 VanDerWaalsContact O-CB 3.27Å; K173-A177 WeakPolarHBondContact O-CB 3.48Å; K173-A177 PolarHBondContact O-N 3.45Å
174L93.9Very high94.1Very high68 Ų6861.9 Ų61.936%0.35632%0.322SS..Hα-helixtrans-65.3-45.5178.7-70.2173000111.8R170 L171 A172 V176 A177 L178 Y218R170-L174 HydrophobicContact CG-CD1 4.2Å; R170-L174 WeakPolarHBondContact O-CG 3.42Å; R170-L174 PolarHBondContact O-N 2.05Å; L171-L174 PolarHBondContact O-N 3.19Å; A172-L174 VanDerWaalsContact C-N 3.34Å; A172-L174 PolarHBondContact O-N 3.08Å; L174-V176 PolarHBondContact O-N 3.27Å; L174-A177 PolarHBondContact O-N 3.36Å; L174-L178 WeakPolarHBondContact O-CB 3.24Å; L174-L178 WeakPolarHBondContact O-CG 3.46Å; L174-L178 PolarHBondContact O-N 3.47Å; L174-Y218 HydrophobicContact CB-CD1 4.06Å; L174-Y218 HydrophobicContact CB-CE1 4.27Å; L174-Y218 HydrophobicContact CD1-CE1 4.23Å
175S94.6Very high94.5Very high11 Ų1156.5 Ų56.58%0.07729%0.29CS..Hα-helixtrans-59.5-45.9176.9179.30000111.8L171 A172 L178 W179 A215 G219L171-S175 WeakPolarHBondContact O-CB 3.46Å; L171-S175 PolarHBondContact O-N 2.87Å; A172-S175 PolarHBondContact O-N 3.1Å; S175-L178 PolarHBondContact O-N 3.48Å; S175-W179 WeakPolarHBondContact O-CB 3.25Å; S175-W179 PolarHBondContact O-N 3.29Å; S175-A215 PolarHBondContact OG-O 3.09Å; S175-G219 VanDerWaalsContact OG-CA 3.23Å; S175-G219 WeakPolarHBondContact OG-CA 3.41Å; S175-G219 PolarHBondContact OG-N 2.97Å
176V95.1Very high94.7Very high53 Ų5355.2 Ų55.232%0.32128%0.281SS..Hα-helixtrans-65-43.2177173.50000111.2L153 L156 A172 L174 W179 V180L153-V176 HydrophobicContact CD2-CG2 3.99Å; L156-V176 HydrophobicContact CD2-CG2 4.47Å; A172-V176 WeakPolarHBondContact O-CB 3.38Å; A172-V176 VanDerWaalsContact O-CG2 3.28Å; A172-V176 WeakPolarHBondContact O-CG2 3.46Å; A172-V176 PolarHBondContact O-N 3.32Å; L174-V176 PolarHBondContact O-N 3.27Å; V176-W179 PolarHBondContact O-N 2.95Å; V176-V180 HydrophobicContact CG1-CG2 4.25Å; V176-V180 WeakPolarHBondContact O-CB 3.45Å; V176-V180 WeakPolarHBondContact O-CG2 3.19Å; V176-V180 PolarHBondContact O-N 3.12Å
177A96.1Very high94.8Very high59 Ų5952.2 Ų52.249%0.48827%0.269SS..Hα-helixtrans-62.2-44.5178.200000112.1K173 L174 V180 L181K173-A177 VanDerWaalsContact O-CB 3.27Å; K173-A177 WeakPolarHBondContact O-CB 3.48Å; K173-A177 PolarHBondContact O-N 3.45Å; L174-A177 PolarHBondContact O-N 3.36Å; A177-V180 PolarHBondContact O-N 3.46Å; A177-L181 WeakPolarHBondContact O-CB 3.33Å; A177-L181 PolarHBondContact O-N 2.94Å
178L95.9Very high95Very high40 Ų4049.6 Ų49.621%0.20926%0.261CS..Hα-helixtrans-61.1-44175.2-73169.9000111.4L174 S175 L181 A182 L211 M214 A215 Y218L174-L178 WeakPolarHBondContact O-CB 3.24Å; L174-L178 WeakPolarHBondContact O-CG 3.46Å; L174-L178 PolarHBondContact O-N 3.47Å; S175-L178 PolarHBondContact O-N 3.48Å; L178-L181 PolarHBondContact O-N 2.79Å; L178-A182 WeakPolarHBondContact O-CB 3.15Å; L178-A182 PolarHBondContact O-N 3.37Å; L178-L211 HydrophobicContact CD2-CD2 4.11Å; L178-M214 HydrophobicContact CD1-CB 4.4Å; L178-A215 HydrophobicContact CB-CB 3.78Å; L178-Y218 HydrophobicContact CD1-CD1 4.23Å; L178-Y218 HydrophobicContact CD1-CD2 4.33Å; L178-Y218 HydrophobicContact CD1-CG 4.14Å
179W95.8Very high95.1Very high46 Ų4649.6 Ų49.617%0.17426%0.261CS..Hα-helixtrans-63.8-46.4177.6-177.288.5000112.1L150 L153 S175 V176 L181 A182 I183 A215L150-W179 HydrophobicContact CD2-CH2 3.78Å; L150-W179 HydrophobicContact CD2-CZ3 4.46Å; L150-W179 HydrophobicContact CG-CH2 4.43Å; L153-W179 HydrophobicContact CD1-CD2 3.96Å; L153-W179 HydrophobicContact CD1-CE3 3.49Å; L153-W179 VanDerWaalsContact CD1-CE3 3.49Å; L153-W179 HydrophobicContact CD1-CH2 3.59Å; L153-W179 HydrophobicContact CD1-CZ2 4.05Å; L153-W179 HydrophobicContact CD1-CZ3 3.29Å; S175-W179 WeakPolarHBondContact O-CB 3.25Å; S175-W179 PolarHBondContact O-N 3.29Å; V176-W179 PolarHBondContact O-N 2.95Å; W179-L181 VanDerWaalsContact C-N 3.31Å; W179-L181 PolarHBondContact O-N 2.98Å; W179-A182 WeakPolarHBondContact O-CB 3.4Å; W179-A182 PolarHBondContact O-N 3.41Å; W179-I183 HydrophobicContact CD2-CG1 3.92Å; W179-I183 HydrophobicContact CE3-CG1 4.17Å; W179-I183 HydrophobicContact CH2-CG1 3.95Å; W179-I183 HydrophobicContact CZ2-CD1 4.31Å; W179-I183 HydrophobicContact CZ2-CG1 3.67Å; W179-I183 HydrophobicContact CZ3-CG1 4.18Å; W179-I183 WeakPolarHBondContact O-CG1 3.28Å; W179-I183 PolarHBondContact O-N 3.43Å; W179-A215 HydrophobicContact CB-CB 4.16Å
180V96.2Very high94.9Very high72 Ų7251.5 Ų51.544%0.43627%0.265SS..Hα-helixtrans-61-43177.8168.90000110.6V176 A177 I183 S184V176-V180 HydrophobicContact CG1-CG2 4.25Å; V176-V180 WeakPolarHBondContact O-CB 3.45Å; V176-V180 WeakPolarHBondContact O-CG2 3.19Å; V176-V180 PolarHBondContact O-N 3.12Å; A177-V180 PolarHBondContact O-N 3.46Å; V180-I183 PolarHBondContact O-N 3.29Å; V180-S184 WeakPolarHBondContact O-CB 3.29Å; V180-S184 PolarHBondContact O-N 3.24Å; V180-S184 PolarHBondContact O-OG 3.36Å
181L97.1Very high94.9Very high91 Ų9149.9 Ų49.948%0.47627%0.267SS..Hα-helixtrans-63.7-44.1177-17463.7000111.2A177 L178 W179 S184 C185 L211A177-L181 WeakPolarHBondContact O-CB 3.33Å; A177-L181 PolarHBondContact O-N 2.94Å; L178-L181 PolarHBondContact O-N 2.79Å; W179-L181 VanDerWaalsContact C-N 3.31Å; W179-L181 PolarHBondContact O-N 2.98Å; L181-S184 WeakPolarHBondContact O-CB 3.2Å; L181-S184 PolarHBondContact O-N 3.31Å; L181-C185 PolarHBondContact O-N 3.14Å; L181-C185 PolarHBondContact O-SG 2.65Å; L181-C185 VanDerWaalsContact O-SG 3.36Å; L181-L211 HydrophobicContact CB-CD1 4.17Å; L181-L211 HydrophobicContact CD2-CD1 3.75Å; L181-L211 HydrophobicContact CD2-CD2 3.99Å; L181-L211 HydrophobicContact CG-CD1 3.59Å
182A96.6Very high94.9Very high0 Ų052.5 Ų52.50%029%0.285CS..Hα-helixtrans-56.4-55.7175.700000110.6L178 W179 S184 C185 W186 W208 L211 I212L178-A182 WeakPolarHBondContact O-CB 3.15Å; L178-A182 PolarHBondContact O-N 3.37Å; W179-A182 WeakPolarHBondContact O-CB 3.4Å; W179-A182 PolarHBondContact O-N 3.41Å; A182-S184 PolarHBondContact O-N 2.94Å; A182-C185 WeakPolarHBondContact O-CB 3.48Å; A182-C185 PolarHBondContact O-N 3.18Å; A182-W186 PolarHBondContact O-N 3.06Å; A182-W208 VanDerWaalsContact O-CD1 3.23Å; A182-L211 HydrophobicContact CB-CB 3.64Å; A182-L211 HydrophobicContact CB-CD1 4.49Å; A182-I212 HydrophobicContact CB-CB 4.28Å; A182-I212 HydrophobicContact CB-CD1 4.29Å
183I94.9Very high94.8Very high22 Ų2253.2 Ų53.211%0.11329%0.289CS..Hα-helixtrans-60.9-35.2-179.5-63.5-50.3000111.4N146 W179 V180 W186 I187N146-I183 WeakPolarHBondContact OD1-CD1 3.14Å; W179-I183 HydrophobicContact CD2-CG1 3.92Å; W179-I183 HydrophobicContact CE3-CG1 4.17Å; W179-I183 HydrophobicContact CH2-CG1 3.95Å; W179-I183 HydrophobicContact CZ2-CD1 4.31Å; W179-I183 HydrophobicContact CZ2-CG1 3.67Å; W179-I183 HydrophobicContact CZ3-CG1 4.18Å; W179-I183 WeakPolarHBondContact O-CG1 3.28Å; W179-I183 PolarHBondContact O-N 3.43Å; V180-I183 PolarHBondContact O-N 3.29Å; I183-W186 PolarHBondContact O-N 2.71Å; I183-I187 HydrophobicContact CG2-CD1 3.7Å; I183-I187 HydrophobicContact CG2-CG1 4.11Å; I183-I187 WeakPolarHBondContact O-CB 3.45Å; I183-I187 VanDerWaalsContact O-CG1 3.29Å; I183-I187 WeakPolarHBondContact O-CG1 3.44Å; I183-I187 PolarHBondContact O-N 3.13Å
184S95.8Very high94.8Very high60 Ų6050.2 Ų50.242%0.4229%0.288SS..Hα-helixtrans-62.8-44.3174.5-57.90000111.7V180 L181 A182 S188V180-S184 WeakPolarHBondContact O-CB 3.29Å; V180-S184 PolarHBondContact O-N 3.24Å; V180-S184 PolarHBondContact O-OG 3.36Å; L181-S184 WeakPolarHBondContact O-CB 3.2Å; L181-S184 PolarHBondContact O-N 3.31Å; A182-S184 PolarHBondContact O-N 2.94Å; S184-S188 WeakPolarHBondContact O-CB 3.16Å; S184-S188 PolarHBondContact O-N 3.46Å
185C96.6Very high94.7Very high13 Ų1351.7 Ų51.79%0.08829%0.292CS..Hα-helixtrans-59.6-46.8173.4-67.50000111.4L181 A182 S188 D189 L204 W208L181-C185 PolarHBondContact O-N 3.14Å; L181-C185 PolarHBondContact O-SG 2.65Å; L181-C185 VanDerWaalsContact O-SG 3.36Å; A182-C185 WeakPolarHBondContact O-CB 3.48Å; A182-C185 PolarHBondContact O-N 3.18Å; C185-S188 PolarHBondContact O-N 2.92Å; C185-D189 WeakPolarHBondContact O-CB 3.35Å; C185-D189 PolarHBondContact O-N 3.43Å; C185-L204 HydrophobicContact CB-CB 4.38Å; C185-L204 HydrophobicContact CB-CD2 4.49Å; C185-W208 HydrophobicContact CB-CB 4.29Å
186W95.8Very high94.7Very high23 Ų2353.5 Ų53.59%0.08730%0.297CS..Hα-helixtrans-60.1-48.2179.1-175.796.4000112.9W14 A142 Y143 A182 I183 R190 H205 W208W14-W186 AromaticContact CH2-CD1 3.82Å; W14-W186 AromaticContact CH2-CE2 3.63Å; W14-W186 AromaticContact CH2-CZ2 3.96Å; W14-W186 HydrophobicContact CH2-CZ2 3.96Å; W14-W186 AromaticContact CH2-NE1 3.15Å; W14-W186 AromaticContact CZ3-NE1 3.75Å; A142-W186 HydrophobicContact CB-CH2 4.39Å; A142-W186 HydrophobicContact CB-CZ2 3.88Å; Y143-W186 HydrophobicContact CE1-CH2 4.37Å; A182-W186 PolarHBondContact O-N 3.06Å; I183-W186 PolarHBondContact O-N 2.71Å; W186-R190 PolarHBondContact O-N 3.36Å; W186-H205 AromaticContact CD1-CE1 3.68Å; W186-H205 AromaticContact CD1-ND1 3.83Å; W186-H205 AromaticContact NE1-CE1 3.97Å; W186-W208 HydrophobicContact CB-CB 4.38Å; W186-W208 HydrophobicContact CB-CG 3.96Å; W186-W208 AromaticContact CD1-CD2 3.88Å; W186-W208 AromaticContact CD1-CE2 3.89Å; W186-W208 HydrophobicContact CG-CG 4.49Å
187I94.1Very high94.5Very high75 Ų7555.4 Ų55.439%0.38530%0.302SS..Hα-helixtrans-65.5-44.1178.9-67.9175.4000110.2I183 R190 L191I183-I187 HydrophobicContact CG2-CD1 3.7Å; I183-I187 HydrophobicContact CG2-CG1 4.11Å; I183-I187 WeakPolarHBondContact O-CB 3.45Å; I183-I187 VanDerWaalsContact O-CG1 3.29Å; I183-I187 WeakPolarHBondContact O-CG1 3.44Å; I183-I187 PolarHBondContact O-N 3.13Å; I187-R190 PolarHBondContact O-N 3.27Å; I187-L191 HydrophobicContact CG2-CD1 3.65Å; I187-L191 HydrophobicContact CG2-CG 4.14Å; I187-L191 WeakPolarHBondContact O-CB 3.39Å; I187-L191 PolarHBondContact O-N 3.32Å
188S94.8Very high94.3Very high26 Ų2661.7 Ų61.718%0.18231%0.313CS..Hα-helixtrans-65.8-40.1-177.3-177.10000112S184 C185 R190 C192 W196 L204S184-S188 WeakPolarHBondContact O-CB 3.16Å; S184-S188 PolarHBondContact O-N 3.46Å; C185-S188 PolarHBondContact O-N 2.92Å; S188-R190 VanDerWaalsContact C-N 3.32Å; S188-R190 PolarHBondContact O-N 3.28Å; S188-C192 CarbonylContact O-C 3.58Å; S188-C192 WeakPolarHBondContact O-CA 3.22Å; S188-C192 VanDerWaalsContact O-CB 3.26Å; S188-C192 WeakPolarHBondContact O-CB 3.39Å; S188-C192 PolarHBondContact O-N 3.1Å; S188-W196 PolarHBondContact O-NE1 3.1Å; S188-W196 VanDerWaalsContact OG-CE2 3.23Å; S188-W196 VanDerWaalsContact OG-CZ2 3.23Å; S188-W196 WeakPolarHBondContact OG-CZ2 3.33Å; S188-W196 PolarHBondContact OG-NE1 2.94Å; S188-L204 WeakPolarHBondContact OG-CD1 3.42Å
189D94.3Very high94.1Very high1 Ų163.4 Ų63.41%0.00532%0.322CS..Hα-helixtrans-58.7-45.9172.5-162.893.8000110.7C15 C185 C193 L204 H205C15-D189 VanDerWaalsContact CB-OD2 3.31Å; C15-D189 WeakPolarHBondContact CB-OD2 3.41Å; C15-D189 PolarHBondContact N-OD2 3.43Å; C15-D189 VanDerWaalsContact N-OD2 3.09Å; C185-D189 WeakPolarHBondContact O-CB 3.35Å; C185-D189 PolarHBondContact O-N 3.43Å; D189-C193 WeakPolarHBondContact O-CB 3.38Å; D189-L204 HydrophobicContact CB-CB 3.89Å; D189-L204 WeakPolarHBondContact OD1-CB 3.17Å; D189-H205 HydrophobicContact CB-CB 4.36Å; D189-H205 PolarHBondContact OD1-N 2.93Å
190R91.2Very high93.9Very high89 Ų8967 Ų6734%0.33635%0.345SS..Hα-helixtrans-73.6-44.5-176-167.265.6179.91745.4114.4D13 W186 I187 S188D13-R190 PolarHBondContact O-NH1 2.88Å; W186-R190 PolarHBondContact O-N 3.36Å; I187-R190 PolarHBondContact O-N 3.27Å; S188-R190 VanDerWaalsContact C-N 3.32Å; S188-R190 PolarHBondContact O-N 3.28Å
191L93.1Very high93.7Very high128 Ų12867.7 Ų67.767%0.6734%0.342SS*.Hα-helixtrans-95-25.5-171.5-61.6-174.6000113.4I187I187-L191 HydrophobicContact CG2-CD1 3.65Å; I187-L191 HydrophobicContact CG2-CG 4.14Å; I187-L191 WeakPolarHBondContact O-CB 3.39Å; I187-L191 PolarHBondContact O-N 3.32Å
192C93.3Very high93.4Very high56 Ų5663.7 Ų63.738%0.37832%0.322SS..SBendtrans-115.223.4-174.7-56.90000112.2S188 S194 F195 W196S188-C192 CarbonylContact O-C 3.58Å; S188-C192 WeakPolarHBondContact O-CA 3.22Å; S188-C192 VanDerWaalsContact O-CB 3.26Å; S188-C192 WeakPolarHBondContact O-CB 3.39Å; S188-C192 PolarHBondContact O-N 3.1Å; C192-S194 VanDerWaalsContact C-N 3.29Å; C192-S194 PolarHBondContact O-N 3.33Å; C192-F195 HydrophobicContact CB-CB 4.46Å; C192-F195 WeakPolarHBondContact O-CB 3.37Å; C192-F195 PolarHBondContact O-N 2.65Å; C192-W196 PolarHBondContact O-N 3.35Å
193C92.6Very high93.3Very high27 Ų2766.1 Ų66.118%0.18233%0.331CS..Hα-helixtrans-54.6-42-174.9-178.30000113.7C15 D189 F195 W196 Q197C15-C193 WeakPolarHBondContact CA-SG 3.48Å; C15-C193 HydrophobicContact CB-CB 3.8Å; C15-C193 WeakPolarHBondContact CB-SG 3.39Å; C15-C193 WeakPolarHBondContact SG-CA 3.4Å; C15-C193 WeakPolarHBondContact SG-CB 3.45Å; C15-C193 PolarHBondContact SG-O 3.43Å; C15-C193 CovalentContact SG-SG 2.05Å; C15-C193 PolarHBondContact SG-SG 3.38Å; D189-C193 WeakPolarHBondContact O-CB 3.38Å; C193-F195 PolarHBondContact O-N 2.94Å; C193-W196 PolarHBondContact O-N 2.66Å; C193-Q197 WeakPolarHBondContact O-CB 3.32Å; C193-Q197 WeakPolarHBondContact O-CG 3.32Å; C193-Q197 PolarHBondContact O-N 3.08Å; C193-Q197 PolarHBondContact SG-NE2 2.97Å
194S92.2Very high93.4Very high94 Ų9465.7 Ų65.766%0.65733%0.329SS*.Hα-helixtrans-58.6-34.5177.655.60000113.5C192 W198C192-S194 VanDerWaalsContact C-N 3.29Å; C192-S194 PolarHBondContact O-N 3.33Å; S194-W198 PolarHBondContact O-N 2.92Å; S194-W198 VanDerWaalsContact O-N 3.14Å
195F93.1Very high93.5Very high100 Ų10062.9 Ų62.944%0.43931%0.309SS..Hα-helixtrans-70-41.2175170.6-98.6000111.7C192 C193 W198 L199C192-F195 HydrophobicContact CB-CB 4.46Å; C192-F195 WeakPolarHBondContact O-CB 3.37Å; C192-F195 PolarHBondContact O-N 2.65Å; C193-F195 PolarHBondContact O-N 2.94Å; F195-W198 HydrophobicContact CD2-CE3 4.45Å; F195-W198 HydrophobicContact CE2-CE3 4.42Å; F195-W198 HydrophobicContact CE2-CZ3 4.43Å; F195-W198 WeakPolarHBondContact O-CB 3.47Å; F195-W198 PolarHBondContact O-N 3.15Å; F195-L199 HydrophobicContact CD1-CD1 4.19Å; F195-L199 HydrophobicContact CE1-CD1 3.48Å; F195-L199 VanDerWaalsContact CE1-CD1 3.48Å; F195-L199 HydrophobicContact CE1-CG 4.49Å; F195-L199 HydrophobicContact CE2-CD1 4.16Å; F195-L199 HydrophobicContact CZ-CD1 3.47Å; F195-L199 VanDerWaalsContact CZ-CD1 3.47Å; F195-L199 HydrophobicContact CZ-CG 4.33Å; F195-L199 PolarHBondContact O-N 2.95Å; F195-L199 VanDerWaalsContact O-N 3.12Å
196W93.1Very high93.5Very high49 Ų4962.5 Ų62.519%0.18631%0.308CS..Hα-helixtrans-71.7-36.1179.1-64.4113.5000112.9S188 C192 C193 W198 L199 N200 F201 L204S188-W196 PolarHBondContact O-NE1 3.1Å; S188-W196 VanDerWaalsContact OG-CE2 3.23Å; S188-W196 VanDerWaalsContact OG-CZ2 3.23Å; S188-W196 WeakPolarHBondContact OG-CZ2 3.33Å; S188-W196 PolarHBondContact OG-NE1 2.94Å; C192-W196 PolarHBondContact O-N 3.35Å; C193-W196 PolarHBondContact O-N 2.66Å; W196-W198 VanDerWaalsContact C-N 3.34Å; W196-L199 HydrophobicContact CE3-CD1 4.14Å; W196-L199 HydrophobicContact CZ3-CD1 4.12Å; W196-L199 CarbonylContact O-C 3.59Å; W196-L199 PolarHBondContact O-N 3.47Å; W196-N200 PolarHBondContact O-N 3.34Å; W196-F201 HydrophobicContact CE3-CB 4.28Å; W196-F201 AromaticContact CE3-CD1 3.84Å; W196-F201 HydrophobicContact CE3-CD1 3.84Å; W196-F201 AromaticContact CZ3-CD1 3.91Å; W196-F201 HydrophobicContact CZ3-CD1 3.91Å; W196-F201 PolarHBondContact O-N 3.37Å; W196-L204 HydrophobicContact CD2-CD1 3.62Å; W196-L204 HydrophobicContact CD2-CG 4.42Å; W196-L204 HydrophobicContact CE3-CD1 4.2Å; W196-L204 HydrophobicContact CG-CD1 4.01Å; W196-L204 HydrophobicContact CH2-CD1 4.14Å; W196-L204 HydrophobicContact CZ2-CD1 3.57Å; W196-L204 HydrophobicContact CZ3-CD1 4.42Å
197Q91.4Very high93.6Very high93 Ų9364 Ų6444%0.43532%0.317SS..Hα-helixtrans-60.8-43.5170-74.9177.1-15.400111.2C193 L199 N200 C202C193-Q197 WeakPolarHBondContact O-CB 3.32Å; C193-Q197 WeakPolarHBondContact O-CG 3.32Å; C193-Q197 PolarHBondContact O-N 3.08Å; C193-Q197 PolarHBondContact SG-NE2 2.97Å; Q197-L199 VanDerWaalsContact C-N 3.26Å; Q197-L199 PolarHBondContact O-N 2.86Å; Q197-N200 PolarHBondContact O-N 3.15Å; Q197-C202 VanDerWaalsContact CA-SG 3.55Å; Q197-C202 WeakPolarHBondContact CG-SG 3.18Å
198W92.3Very high93.8Very high191 Ų19162 Ų6272%0.72331%0.305SS*.Hα-helixtrans-60.2-36.9174.7176.173.1000112.6S194 F195 W196 N200S194-W198 PolarHBondContact O-N 2.92Å; S194-W198 VanDerWaalsContact O-N 3.14Å; F195-W198 HydrophobicContact CD2-CE3 4.45Å; F195-W198 HydrophobicContact CE2-CE3 4.42Å; F195-W198 HydrophobicContact CE2-CZ3 4.43Å; F195-W198 WeakPolarHBondContact O-CB 3.47Å; F195-W198 PolarHBondContact O-N 3.15Å; W196-W198 VanDerWaalsContact C-N 3.34Å; W198-N200 VanDerWaalsContact C-N 3.29Å; W198-N200 PolarHBondContact O-N 3.35Å
199L92.1Very high93.9Very high76 Ų7660.8 Ų60.840%0.39830%0.296SS..THydrogen-bonded Turntrans-80-3.2174.7-70.4-179.8000114.5F195 W196 Q197 F201F195-L199 HydrophobicContact CD1-CD1 4.19Å; F195-L199 HydrophobicContact CE1-CD1 3.48Å; F195-L199 VanDerWaalsContact CE1-CD1 3.48Å; F195-L199 HydrophobicContact CE1-CG 4.49Å; F195-L199 HydrophobicContact CE2-CD1 4.16Å; F195-L199 HydrophobicContact CZ-CD1 3.47Å; F195-L199 VanDerWaalsContact CZ-CD1 3.47Å; F195-L199 HydrophobicContact CZ-CG 4.33Å; F195-L199 PolarHBondContact O-N 2.95Å; F195-L199 VanDerWaalsContact O-N 3.12Å; W196-L199 HydrophobicContact CE3-CD1 4.14Å; W196-L199 HydrophobicContact CZ3-CD1 4.12Å; W196-L199 CarbonylContact O-C 3.59Å; W196-L199 PolarHBondContact O-N 3.47Å; Q197-L199 VanDerWaalsContact C-N 3.26Å; Q197-L199 PolarHBondContact O-N 2.86Å; L199-F201 HydrophobicContact CB-CB 4.43Å; L199-F201 PolarHBondContact O-N 2.86Å
200N90.4Very high94.1Very high122 Ų12263.3 Ų63.365%0.65231%0.309SS*.THydrogen-bonded Turntrans53.637.6-170.5-59.7-82.8000113.2W196 Q197 W198W196-N200 PolarHBondContact O-N 3.34Å; Q197-N200 PolarHBondContact O-N 3.15Å; W198-N200 VanDerWaalsContact C-N 3.29Å; W198-N200 PolarHBondContact O-N 3.35Å
201F92.1Very high94.4Very high86 Ų8660.3 Ų60.338%0.37730%0.299SS..  trans-130.466.3-177.9-168.8-100.9000111.9W196 L199 Y203 L204 I207W196-F201 HydrophobicContact CE3-CB 4.28Å; W196-F201 AromaticContact CE3-CD1 3.84Å; W196-F201 HydrophobicContact CE3-CD1 3.84Å; W196-F201 AromaticContact CZ3-CD1 3.91Å; W196-F201 HydrophobicContact CZ3-CD1 3.91Å; W196-F201 PolarHBondContact O-N 3.37Å; L199-F201 HydrophobicContact CB-CB 4.43Å; L199-F201 PolarHBondContact O-N 2.86Å; F201-Y203 VanDerWaalsContact C-N 3.34Å; F201-Y203 HydrophobicContact CD2-CD2 4.01Å; F201-Y203 HydrophobicContact CE2-CD2 4.16Å; F201-Y203 PolarHBondContact O-N 2.92Å; F201-L204 HydrophobicContact CD1-CD2 4.41Å; F201-L204 HydrophobicContact CD1-CG 4.49Å; F201-L204 HydrophobicContact CE1-CD2 3.82Å; F201-L204 HydrophobicContact CE1-CG 4.3Å; F201-I207 HydrophobicContact CE1-CD1 4.13Å; F201-I207 HydrophobicContact CZ-CD1 3.81Å
202C92.4Very high94.6Very high7 Ų755.3 Ų55.35%0.04727%0.273CS..  trans-94.442.2-176.7-56.70000113.5C15 E16 Q197C15-C202 HydrophobicContact CB-CB 4.36Å; C15-C202 VanDerWaalsContact O-CB 3.23Å; C15-C202 WeakPolarHBondContact O-CB 3.43Å; E16-C202 WeakPolarHBondContact CA-O 3.21Å; Q197-C202 VanDerWaalsContact CA-SG 3.55Å; Q197-C202 WeakPolarHBondContact CG-SG 3.18Å
203Y94.6Very high94.8Very high50 Ų5052.7 Ų52.720%0.19626%0.255CS..  trans-117.814.6-173.9-47.4-60.6000113Y21 F29 F201 H205 G206 I207Y21-Y203 HydrophobicContact CE2-CE1 4.5Å; Y21-Y203 PolarHBondContact OH-OH 3.46Å; F29-Y203 HydrophobicContact CB-CD1 3.93Å; F29-Y203 AromaticContact CD2-CD1 3.38Å; F29-Y203 HydrophobicContact CD2-CD1 3.38Å; F29-Y203 AromaticContact CD2-CE1 3.14Å; F29-Y203 HydrophobicContact CD2-CE1 3.14Å; F29-Y203 HydrophobicContact CD2-CG 4.42Å; F29-Y203 AromaticContact CE2-CD1 3.92Å; F29-Y203 HydrophobicContact CE2-CD1 3.92Å; F29-Y203 AromaticContact CE2-CE1 3.33Å; F29-Y203 HydrophobicContact CE2-CE1 3.33Å; F29-Y203 AromaticContact CE2-CZ 3.74Å; F29-Y203 AromaticContact CG-CD1 3.73Å; F29-Y203 HydrophobicContact CG-CD1 3.73Å; F29-Y203 AromaticContact CG-CE1 3.98Å; F29-Y203 HydrophobicContact CG-CE1 3.98Å; F29-Y203 HydrophobicContact CZ-CE1 4.32Å; F201-Y203 VanDerWaalsContact C-N 3.34Å; F201-Y203 HydrophobicContact CD2-CD2 4.01Å; F201-Y203 HydrophobicContact CE2-CD2 4.16Å; F201-Y203 PolarHBondContact O-N 2.92Å; Y203-H205 VanDerWaalsContact C-N 3.34Å; Y203-H205 PolarHBondContact O-N 2.95Å; Y203-G206 PolarHBondContact O-N 2.96Å; Y203-I207 WeakPolarHBondContact O-CG1 3.47Å; Y203-I207 PolarHBondContact O-N 2.97Å; Y203-I207 VanDerWaalsContact O-N 3.07Å
204L96.4Very high95Very high13 Ų1353.2 Ų53.27%0.06826%0.256CS..Hα-helixtrans-67.4-36.1-175.5-74.4-177.7000112.1C185 S188 D189 W196 F201 I207 W208C185-L204 HydrophobicContact CB-CB 4.38Å; C185-L204 HydrophobicContact CB-CD2 4.49Å; S188-L204 WeakPolarHBondContact OG-CD1 3.42Å; D189-L204 HydrophobicContact CB-CB 3.89Å; D189-L204 WeakPolarHBondContact OD1-CB 3.17Å; W196-L204 HydrophobicContact CD2-CD1 3.62Å; W196-L204 HydrophobicContact CD2-CG 4.42Å; W196-L204 HydrophobicContact CE3-CD1 4.2Å; W196-L204 HydrophobicContact CG-CD1 4.01Å; W196-L204 HydrophobicContact CH2-CD1 4.14Å; W196-L204 HydrophobicContact CZ2-CD1 3.57Å; W196-L204 HydrophobicContact CZ3-CD1 4.42Å; F201-L204 HydrophobicContact CD1-CD2 4.41Å; F201-L204 HydrophobicContact CD1-CG 4.49Å; F201-L204 HydrophobicContact CE1-CD2 3.82Å; F201-L204 HydrophobicContact CE1-CG 4.3Å; L204-I207 HydrophobicContact CD2-CD1 4.3Å; L204-I207 WeakPolarHBondContact O-CB 3.47Å; L204-I207 PolarHBondContact O-N 2.9Å; L204-W208 PolarHBondContact O-N 2.93Å
205H97.3Very high95.2Very high1 Ų149 Ų491%0.00523%0.226CC..Hα-helixtrans-63.3-42.1174.7-163.772.3000112.5W14 H77 W186 D189 Y203 I207 W208 H209W14-H205 HydrophobicContact CB-CB 4.49Å; W14-H205 HydrophobicContact CD2-CB 4.24Å; W14-H205 AromaticContact CD2-CD2 3.75Å; W14-H205 AromaticContact CD2-CE1 3.57Å; W14-H205 AromaticContact CD2-CG 3.53Å; W14-H205 AromaticContact CD2-ND1 3.42Å; W14-H205 AromaticContact CD2-NE2 3.77Å; W14-H205 AromaticContact CE2-CD2 3.83Å; W14-H205 AromaticContact CE2-CE1 3.28Å; W14-H205 AromaticContact CE2-CG 3.99Å; W14-H205 AromaticContact CE2-ND1 3.67Å; W14-H205 AromaticContact CE2-NE2 3.38Å; W14-H205 HydrophobicContact CE3-CB 4.08Å; W14-H205 AromaticContact CE3-CE1 3.6Å; W14-H205 AromaticContact CE3-CG 3.55Å; W14-H205 AromaticContact CE3-ND1 3.11Å; W14-H205 HydrophobicContact CG-CB 4.43Å; W14-H205 AromaticContact CG-CD2 3.99Å; W14-H205 AromaticContact CG-CG 3.98Å; W14-H205 AromaticContact CH2-CE1 3.24Å; W14-H205 WeakPolarHBondContact CH2-CE1 3.36Å; W14-H205 AromaticContact CH2-ND1 3.53Å; W14-H205 AromaticContact CZ2-CE1 3.12Å; W14-H205 WeakPolarHBondContact CZ2-CE1 3.31Å; W14-H205 AromaticContact CZ2-ND1 3.74Å; W14-H205 AromaticContact CZ2-NE2 3.59Å; W14-H205 AromaticContact CZ3-CE1 3.44Å; W14-H205 VanDerWaalsContact CZ3-CE1 3.44Å; W14-H205 WeakPolarHBondContact CZ3-CE1 3.41Å; W14-H205 AromaticContact CZ3-ND1 3.16Å; W14-H205 WeakPolarHBondContact CZ3-ND1 3.31Å; W14-H205 AromaticContact NE1-NE2 3.72Å; H77-H205 AromaticContact CE1-CD2 3.37Å; H77-H205 PolarHBondContact CE1-CD2 3.03Å; H77-H205 AromaticContact CE1-NE2 3.36Å; H77-H205 PolarHBondContact CE1-NE2 2.71Å; H77-H205 AromaticContact NE2-CD2 3.75Å; H77-H205 AromaticContact NE2-NE2 3.51Å; W186-H205 AromaticContact CD1-CE1 3.68Å; W186-H205 AromaticContact CD1-ND1 3.83Å; W186-H205 AromaticContact NE1-CE1 3.97Å; D189-H205 HydrophobicContact CB-CB 4.36Å; D189-H205 PolarHBondContact OD1-N 2.93Å; Y203-H205 VanDerWaalsContact C-N 3.34Å; Y203-H205 PolarHBondContact O-N 2.95Å; H205-I207 VanDerWaalsContact C-N 3.3Å; H205-I207 PolarHBondContact O-N 3.25Å; H205-W208 AromaticContact CE1-CE3 3.48Å; H205-W208 VanDerWaalsContact CE1-CE3 3.48Å; H205-W208 AromaticContact CE1-CZ3 3.74Å; H205-W208 AromaticContact NE2-CE3 3.69Å; H205-W208 AromaticContact NE2-CZ3 3.77Å; H205-W208 WeakPolarHBondContact O-CA 3.3Å; H205-W208 VanDerWaalsContact O-CB 3.25Å; H205-W208 WeakPolarHBondContact O-CB 3.25Å; H205-W208 PolarHBondContact O-N 3.23Å; H205-H209 AromaticContact CD2-CE1 3.74Å; H205-H209 AromaticContact CD2-NE2 3.78Å; H205-H209 AromaticContact NE2-CE1 3.91Å; H205-H209 AromaticContact NE2-NE2 3.48Å; H205-H209 PolarHBondContact NE2-NE2 3.42Å; H205-H209 PolarHBondContact O-N 2.97Å
206G97.1Very high95.3Very high5 Ų546.5 Ų46.55%0.05222%0.219CC..Hα-helixtrans-63.2-34.5172.800000113.4N30 S33 Y203 W208 H209N30-G206 WeakPolarHBondContact OD1-CA 3.24Å; N30-G206 PolarHBondContact OD1-N 2.89Å; S33-G206 VanDerWaalsContact CB-O 3.26Å; S33-G206 WeakPolarHBondContact CB-O 3.28Å; S33-G206 WeakPolarHBondContact OG-CA 3.43Å; S33-G206 PolarHBondContact OG-O 2.92Å; Y203-G206 PolarHBondContact O-N 2.96Å; G206-W208 VanDerWaalsContact C-N 3.32Å; G206-H209 WeakPolarHBondContact O-CB 3.3Å; G206-H209 PolarHBondContact O-N 2.93Å
207I97.8Very high95.5Very high56 Ų5644.2 Ų44.229%0.28721%0.211SC..Hα-helixtrans-65.8-36.8171.7-67.7166.3000110.8F201 Y203 L204 H205 H209 I210 L211F201-I207 HydrophobicContact CE1-CD1 4.13Å; F201-I207 HydrophobicContact CZ-CD1 3.81Å; Y203-I207 WeakPolarHBondContact O-CG1 3.47Å; Y203-I207 PolarHBondContact O-N 2.97Å; Y203-I207 VanDerWaalsContact O-N 3.07Å; L204-I207 HydrophobicContact CD2-CD1 4.3Å; L204-I207 WeakPolarHBondContact O-CB 3.47Å; L204-I207 PolarHBondContact O-N 2.9Å; H205-I207 VanDerWaalsContact C-N 3.3Å; H205-I207 PolarHBondContact O-N 3.25Å; I207-H209 VanDerWaalsContact C-N 3.34Å; I207-H209 PolarHBondContact O-N 3.02Å; I207-I210 PolarHBondContact O-N 3.48Å; I207-L211 HydrophobicContact CG2-CD1 3.6Å; I207-L211 HydrophobicContact CG2-CG 4.01Å; I207-L211 WeakPolarHBondContact O-CB 3.32Å; I207-L211 VanDerWaalsContact O-CG 3.31Å; I207-L211 WeakPolarHBondContact O-CG 3.37Å; I207-L211 PolarHBondContact O-N 3.29Å
208W97.8Very high95.7Very high32 Ų3240.4 Ų40.412%0.12119%0.192CC..Hα-helixtrans-57.7-43.9173.6166.781.6000111.8A182 C185 W186 L204 H205 G206 I210 L211 I212A182-W208 VanDerWaalsContact O-CD1 3.23Å; C185-W208 HydrophobicContact CB-CB 4.29Å; W186-W208 HydrophobicContact CB-CB 4.38Å; W186-W208 HydrophobicContact CB-CG 3.96Å; W186-W208 AromaticContact CD1-CD2 3.88Å; W186-W208 AromaticContact CD1-CE2 3.89Å; W186-W208 HydrophobicContact CG-CG 4.49Å; L204-W208 PolarHBondContact O-N 2.93Å; H205-W208 AromaticContact CE1-CE3 3.48Å; H205-W208 VanDerWaalsContact CE1-CE3 3.48Å; H205-W208 AromaticContact CE1-CZ3 3.74Å; H205-W208 AromaticContact NE2-CE3 3.69Å; H205-W208 AromaticContact NE2-CZ3 3.77Å; H205-W208 WeakPolarHBondContact O-CA 3.3Å; H205-W208 VanDerWaalsContact O-CB 3.25Å; H205-W208 WeakPolarHBondContact O-CB 3.25Å; H205-W208 PolarHBondContact O-N 3.23Å; G206-W208 VanDerWaalsContact C-N 3.32Å; W208-I210 VanDerWaalsContact C-N 3.32Å; W208-I210 PolarHBondContact O-N 3.49Å; W208-L211 PolarHBondContact O-N 3.01Å; W208-I212 HydrophobicContact CD2-CG2 4.36Å; W208-I212 HydrophobicContact CZ2-CG1 4.39Å; W208-I212 HydrophobicContact CZ2-CG2 4.15Å; W208-I212 WeakPolarHBondContact O-CB 3.35Å; W208-I212 VanDerWaalsContact O-CG2 3.27Å; W208-I212 WeakPolarHBondContact O-CG2 3.41Å; W208-I212 PolarHBondContact O-N 3.26Å
209H98.1Very high95.8Very high1 Ų131.9 Ų31.91%0.00516%0.164CC..Hα-helixtrans-53-47.9175.9-68.2149.8000112.8N30 S33 S34 F37 S73 H77 H205 G206 I207 I212 V213N30-H209 PolarHBondContact O-CE1 3.38Å; N30-H209 PolarHBondContact O-ND1 3.01Å; S33-H209 PolarHBondContact OG-ND1 2.81Å; S34-H209 PolarHBondContact OG-CE1 2.83Å; S34-H209 PolarHBondContact OG-ND1 2.71Å; F37-H209 HydrophobicContact CE2-CB 4.12Å; S73-H209 PolarHBondContact OG-NE2 3.46Å; H77-H209 AromaticContact CD2-CE1 3.46Å; H77-H209 PolarHBondContact CD2-CE1 3.24Å; H77-H209 VanDerWaalsContact CD2-CE1 3.46Å; H77-H209 AromaticContact CD2-NE2 3.86Å; H77-H209 AromaticContact CE1-CE1 3.99Å; H77-H209 AromaticContact NE2-CE1 3.18Å; H77-H209 PolarHBondContact NE2-CE1 2.79Å; H77-H209 AromaticContact NE2-NE2 3.25Å; H77-H209 PolarHBondContact NE2-NE2 2.66Å; H205-H209 AromaticContact CD2-CE1 3.74Å; H205-H209 AromaticContact CD2-NE2 3.78Å; H205-H209 AromaticContact NE2-CE1 3.91Å; H205-H209 AromaticContact NE2-NE2 3.48Å; H205-H209 PolarHBondContact NE2-NE2 3.42Å; H205-H209 PolarHBondContact O-N 2.97Å; G206-H209 WeakPolarHBondContact O-CB 3.3Å; G206-H209 PolarHBondContact O-N 2.93Å; I207-H209 VanDerWaalsContact C-N 3.34Å; I207-H209 PolarHBondContact O-N 3.02Å; H209-I212 WeakPolarHBondContact O-CG2 3.07Å; H209-V213 WeakPolarHBondContact O-CG1 3.1Å; H209-V213 PolarHBondContact O-N 2.83Å
210I98Very high96Very high53 Ų5328.7 Ų28.727%0.27215%0.148SC..Hα-helixtrans-69.1-45.2-177.9-57.9173.5000110F36 I207 W208 V213 M214F36-I210 HydrophobicContact CB-CG1 4.46Å; F36-I210 HydrophobicContact CD1-CG1 4.35Å; F36-I210 HydrophobicContact CD1-CG2 4.12Å; F36-I210 HydrophobicContact CD2-CD1 3.99Å; F36-I210 HydrophobicContact CD2-CG1 3.8Å; F36-I210 HydrophobicContact CE1-CD1 4.5Å; F36-I210 HydrophobicContact CE1-CG2 4.25Å; F36-I210 HydrophobicContact CE2-CD1 3.72Å; F36-I210 HydrophobicContact CE2-CG1 4.06Å; F36-I210 HydrophobicContact CG-CD1 4.49Å; F36-I210 HydrophobicContact CG-CG1 3.95Å; F36-I210 HydrophobicContact CG-CG2 4.5Å; F36-I210 HydrophobicContact CZ-CD1 4Å; F36-I210 HydrophobicContact CZ-CG1 4.45Å; I207-I210 PolarHBondContact O-N 3.48Å; W208-I210 VanDerWaalsContact C-N 3.32Å; W208-I210 PolarHBondContact O-N 3.49Å; I210-V213 WeakPolarHBondContact O-CG1 3.39Å; I210-M214 WeakPolarHBondContact O-CB 3.41Å; I210-M214 WeakPolarHBondContact O-CG 3.34Å; I210-M214 PolarHBondContact O-N 3.37Å
211L97.8Very high96.2Very high26 Ų2622.9 Ų22.914%0.13612%0.117CC..Hα-helixtrans-67.9-39.8-178.4-68.9175.1000112.4L178 L181 A182 I207 W208 M214 A215L178-L211 HydrophobicContact CD2-CD2 4.11Å; L181-L211 HydrophobicContact CB-CD1 4.17Å; L181-L211 HydrophobicContact CD2-CD1 3.75Å; L181-L211 HydrophobicContact CD2-CD2 3.99Å; L181-L211 HydrophobicContact CG-CD1 3.59Å; A182-L211 HydrophobicContact CB-CB 3.64Å; A182-L211 HydrophobicContact CB-CD1 4.49Å; I207-L211 HydrophobicContact CG2-CD1 3.6Å; I207-L211 HydrophobicContact CG2-CG 4.01Å; I207-L211 WeakPolarHBondContact O-CB 3.32Å; I207-L211 VanDerWaalsContact O-CG 3.31Å; I207-L211 WeakPolarHBondContact O-CG 3.37Å; I207-L211 PolarHBondContact O-N 3.29Å; W208-L211 PolarHBondContact O-N 3.01Å; L211-M214 PolarHBondContact O-N 2.96Å; L211-A215 VanDerWaalsContact O-CB 3.32Å; L211-A215 WeakPolarHBondContact O-CB 3.44Å; L211-A215 PolarHBondContact O-N 3.36Å
212I97.1Very high96.4Very high24 Ų2418.8 Ų18.812%0.12310%0.099CC..Hα-helixtrans-69.7-41.3-176.8-162.662.3000111.2F37 A182 W208 H209 M214 A215 V216F37-I212 HydrophobicContact CZ-CG2 4.05Å; A182-I212 HydrophobicContact CB-CB 4.28Å; A182-I212 HydrophobicContact CB-CD1 4.29Å; W208-I212 HydrophobicContact CD2-CG2 4.36Å; W208-I212 HydrophobicContact CZ2-CG1 4.39Å; W208-I212 HydrophobicContact CZ2-CG2 4.15Å; W208-I212 WeakPolarHBondContact O-CB 3.35Å; W208-I212 VanDerWaalsContact O-CG2 3.27Å; W208-I212 WeakPolarHBondContact O-CG2 3.41Å; W208-I212 PolarHBondContact O-N 3.26Å; H209-I212 WeakPolarHBondContact O-CG2 3.07Å; I212-M214 VanDerWaalsContact C-N 3.31Å; I212-M214 PolarHBondContact O-N 3.21Å; I212-A215 PolarHBondContact O-N 3.46Å; I212-V216 VanDerWaalsContact O-CG2 3.28Å; I212-V216 WeakPolarHBondContact O-CG2 3.47Å; I212-V216 PolarHBondContact O-N 2.77Å
213V97.4Very high96.5Very high0 Ų020.6 Ų20.60%011%0.11CC..Hα-helixtrans-65.9-36.7177.172.20000111.5F36 F37 V40 M66 H209 I210 V216 A217F36-V213 HydrophobicContact CB-CG1 4.45Å; F37-V213 HydrophobicContact CD1-CB 4.18Å; F37-V213 HydrophobicContact CD1-CG2 3.83Å; F37-V213 HydrophobicContact CD2-CB 4.3Å; F37-V213 HydrophobicContact CD2-CG2 4.49Å; F37-V213 HydrophobicContact CE1-CB 3.98Å; F37-V213 HydrophobicContact CE1-CG2 4.05Å; F37-V213 HydrophobicContact CE2-CB 4.1Å; F37-V213 HydrophobicContact CE2-CG1 4.49Å; F37-V213 HydrophobicContact CG-CB 4.35Å; F37-V213 HydrophobicContact CG-CG2 4.07Å; F37-V213 HydrophobicContact CZ-CB 3.93Å; F37-V213 HydrophobicContact CZ-CG2 4.47Å; V40-V213 HydrophobicContact CB-CG1 4.46Å; V40-V213 HydrophobicContact CB-CG2 3.79Å; V40-V213 HydrophobicContact CG1-CG2 3.85Å; V40-V213 HydrophobicContact CG2-CG1 4.09Å; V40-V213 HydrophobicContact CG2-CG2 4.33Å; M66-V213 HydrophobicContact CE-CG2 3.94Å; H209-V213 WeakPolarHBondContact O-CG1 3.1Å; H209-V213 PolarHBondContact O-N 2.83Å; I210-V213 WeakPolarHBondContact O-CG1 3.39Å; V213-V216 PolarHBondContact O-N 3Å; V213-A217 PolarHBondContact O-N 2.67Å
214M97Very high96.6Very high38 Ų3818.2 Ų18.219%0.18710%0.101CC..Hα-helixtrans-67.5-42.5173.3-68.7-58.9-63.700111.9V40 L178 I210 L211 I212 V216 A217 Y218 F251V40-M214 HydrophobicContact CG2-SD 3.95Å; L178-M214 HydrophobicContact CD1-CB 4.4Å; I210-M214 WeakPolarHBondContact O-CB 3.41Å; I210-M214 WeakPolarHBondContact O-CG 3.34Å; I210-M214 PolarHBondContact O-N 3.37Å; L211-M214 PolarHBondContact O-N 2.96Å; I212-M214 VanDerWaalsContact C-N 3.31Å; I212-M214 PolarHBondContact O-N 3.21Å; M214-V216 VanDerWaalsContact C-N 3.31Å; M214-V216 PolarHBondContact O-N 2.83Å; M214-A217 WeakPolarHBondContact O-CB 3.5Å; M214-A217 PolarHBondContact O-N 3Å; M214-Y218 HydrophobicContact CE-CE2 3.88Å; M214-Y218 VanDerWaalsContact O-CD2 3.24Å; M214-Y218 WeakPolarHBondContact O-CD2 3.16Å; M214-Y218 PolarHBondContact O-N 2.98Å; M214-F251 HydrophobicContact CE-CD1 4.35Å; M214-F251 HydrophobicContact CE-CE1 3.58Å; M214-F251 HydrophobicContact CE-CZ 3.78Å; M214-F251 HydrophobicContact SD-CE1 3.52Å; M214-F251 VanDerWaalsContact SD-CE1 3.52Å; M214-F251 HydrophobicContact SD-CZ 3.61Å
215A96.1Very high96.5Very high5 Ų518.7 Ų18.74%0.04110%0.102CC..Hα-helixtrans-60.2-41.7175.700000111.5S175 L178 W179 L211 I212 Y218 G219S175-A215 PolarHBondContact OG-O 3.09Å; L178-A215 HydrophobicContact CB-CB 3.78Å; W179-A215 HydrophobicContact CB-CB 4.16Å; L211-A215 VanDerWaalsContact O-CB 3.32Å; L211-A215 WeakPolarHBondContact O-CB 3.44Å; L211-A215 PolarHBondContact O-N 3.36Å; I212-A215 PolarHBondContact O-N 3.46Å; A215-Y218 PolarHBondContact O-N 2.87Å; A215-G219 PolarHBondContact O-N 2.95Å
216V95.5Very high96.4Very high49 Ų4919.5 Ų19.530%0.29711%0.106SC..Hα-helixtrans-66.6-40.1175.8171.60000111.4W63 M66 I212 V213 M214 Y218 G219 S220W63-V216 HydrophobicContact CH2-CG1 4.05Å; W63-V216 HydrophobicContact CZ2-CG1 4.49Å; M66-V216 HydrophobicContact CE-CB 4.37Å; M66-V216 HydrophobicContact CE-CG1 4.07Å; M66-V216 HydrophobicContact SD-CG1 4.45Å; I212-V216 VanDerWaalsContact O-CG2 3.28Å; I212-V216 WeakPolarHBondContact O-CG2 3.47Å; I212-V216 PolarHBondContact O-N 2.77Å; V213-V216 PolarHBondContact O-N 3Å; M214-V216 VanDerWaalsContact C-N 3.31Å; M214-V216 PolarHBondContact O-N 2.83Å; V216-Y218 PolarHBondContact O-N 3.43Å; V216-G219 PolarHBondContact O-N 2.9Å; V216-S220 WeakPolarHBondContact O-CB 3.48Å; V216-S220 PolarHBondContact O-N 2.92Å; V216-S220 PolarHBondContact O-OG 3.35Å
217A96.6Very high96.3Very high0 Ų019.8 Ų19.80%011%0.106CC..Hα-helixtrans-58.8-48.117400000111.7V40 M44 W63 V213 M214 S220 T221 F251V40-A217 HydrophobicContact CG1-CB 3.91Å; M44-A217 HydrophobicContact CE-CB 4.27Å; M44-A217 HydrophobicContact CG-CB 3.82Å; M44-A217 HydrophobicContact SD-CB 3.85Å; W63-A217 HydrophobicContact CH2-CB 3.93Å; W63-A217 HydrophobicContact CZ2-CB 4.45Å; V213-A217 PolarHBondContact O-N 2.67Å; M214-A217 WeakPolarHBondContact O-CB 3.5Å; M214-A217 PolarHBondContact O-N 3Å; A217-S220 PolarHBondContact O-OG 3.47Å; A217-T221 PolarHBondContact O-N 3.21Å; A217-T221 PolarHBondContact O-OG1 3.44Å; A217-F251 HydrophobicContact CB-CD1 4.27Å; A217-F251 HydrophobicContact CB-CE1 4.28Å
218Y95.7Very high96.1Very high13 Ų1317.1 Ų17.15%0.0519%0.092CC..Hα-helixtrans-68-44.2179.2-81.1-126.3000111.9L171 L174 L178 M214 A215 V216 L222 G250 P252L171-Y218 HydrophobicContact CD1-CD1 3.5Å; L171-Y218 VanDerWaalsContact CD1-CD1 3.5Å; L171-Y218 HydrophobicContact CD1-CE1 4.23Å; L171-Y218 HydrophobicContact CD1-CG 4Å; L174-Y218 HydrophobicContact CB-CD1 4.06Å; L174-Y218 HydrophobicContact CB-CE1 4.27Å; L174-Y218 HydrophobicContact CD1-CE1 4.23Å; L178-Y218 HydrophobicContact CD1-CD1 4.23Å; L178-Y218 HydrophobicContact CD1-CD2 4.33Å; L178-Y218 HydrophobicContact CD1-CG 4.14Å; M214-Y218 HydrophobicContact CE-CE2 3.88Å; M214-Y218 VanDerWaalsContact O-CD2 3.24Å; M214-Y218 WeakPolarHBondContact O-CD2 3.16Å; M214-Y218 PolarHBondContact O-N 2.98Å; A215-Y218 PolarHBondContact O-N 2.87Å; V216-Y218 PolarHBondContact O-N 3.43Å; Y218-L222 PolarHBondContact O-N 3.46Å; Y218-L222 VanDerWaalsContact O-N 3.13Å; Y218-G250 PolarHBondContact OH-O 3.4Å; Y218-P252 HydrophobicContact CD1-CG 4.04Å; Y218-P252 HydrophobicContact CD2-CG 3.76Å; Y218-P252 HydrophobicContact CE1-CG 4.24Å; Y218-P252 HydrophobicContact CE2-CG 3.98Å; Y218-P252 HydrophobicContact CG-CG 3.78Å
219G95.1Very high95.9Very high13 Ų1317.6 Ų17.613%0.13410%0.101CC..Hα-helixtrans-67.2-43.4-178.400000112.6S175 A215 V216 L222 V223S175-G219 VanDerWaalsContact OG-CA 3.23Å; S175-G219 WeakPolarHBondContact OG-CA 3.41Å; S175-G219 PolarHBondContact OG-N 2.97Å; A215-G219 PolarHBondContact O-N 2.95Å; V216-G219 PolarHBondContact O-N 2.9Å; G219-L222 WeakPolarHBondContact O-CB 3.47Å; G219-L222 PolarHBondContact O-N 3.38Å; G219-V223 WeakPolarHBondContact O-CB 3.43Å; G219-V223 VanDerWaalsContact O-CG2 3.29Å; G219-V223 WeakPolarHBondContact O-CG2 3.47Å; G219-V223 PolarHBondContact O-N 3.23Å
220S95.4Very high95.5Very high9 Ų922.2 Ų22.26%0.06313%0.126CC..Hα-helixtrans-67.1-36178.161.10000112.6W63 V216 A217 L222 V223 A224W63-S220 VanDerWaalsContact CZ2-OG 3.25Å; W63-S220 WeakPolarHBondContact CZ2-OG 3.46Å; V216-S220 WeakPolarHBondContact O-CB 3.48Å; V216-S220 PolarHBondContact O-N 2.92Å; V216-S220 PolarHBondContact O-OG 3.35Å; A217-S220 PolarHBondContact O-OG 3.47Å; S220-L222 VanDerWaalsContact C-N 3.35Å; S220-V223 PolarHBondContact O-N 2.79Å; S220-A224 VanDerWaalsContact O-CB 3.25Å; S220-A224 WeakPolarHBondContact O-CB 3.31Å; S220-A224 PolarHBondContact O-N 3.43Å
221T95.9Very high95.2Very high0 Ų022.3 Ų22.30%013%0.125CC..Hα-helixtrans-63-42.8171.3-67.40000111.5M44 L171 A217 A224 Y225 L239 P252M44-T221 VanDerWaalsContact CE-OG1 3.24Å; M44-T221 WeakPolarHBondContact CE-OG1 3.07Å; L171-T221 HydrophobicContact CD2-CG2 4.06Å; A217-T221 PolarHBondContact O-N 3.21Å; A217-T221 PolarHBondContact O-OG1 3.44Å; T221-A224 PolarHBondContact O-N 3.24Å; T221-Y225 WeakPolarHBondContact O-CB 3.25Å; T221-Y225 PolarHBondContact O-N 2.97Å; T221-L239 HydrophobicContact CG2-CD2 3.76Å; T221-P252 HydrophobicContact CG2-CB 4.04Å; T221-P252 PolarHBondContact OG1-O 3.28Å
222L95.6Very high94.9Very high0 Ų021.5 Ų21.50%012%0.121CC..Hα-helixtrans-62.4-45.8176.1178.661000111.5L156 M160 A168 L171 A172 Y218 G219 S220 A224 Y225 L226L156-L222 HydrophobicContact CD1-CD2 3.72Å; L156-L222 HydrophobicContact CD1-CG 4.19Å; L156-L222 HydrophobicContact CD2-CD2 4.13Å; L156-L222 HydrophobicContact CG-CD2 4.44Å; M160-L222 HydrophobicContact SD-CD1 4Å; M160-L222 HydrophobicContact SD-CD2 4.22Å; M160-L222 HydrophobicContact SD-CG 4.42Å; A168-L222 HydrophobicContact CB-CD1 4.09Å; L171-L222 HydrophobicContact CD2-CB 3.86Å; L171-L222 HydrophobicContact CD2-CD1 4.41Å; L171-L222 HydrophobicContact CG-CB 4.13Å; A172-L222 VanDerWaalsContact CA-CD2 3.47Å; A172-L222 HydrophobicContact CB-CD2 3.5Å; A172-L222 VanDerWaalsContact CB-CD2 3.5Å; Y218-L222 PolarHBondContact O-N 3.46Å; Y218-L222 VanDerWaalsContact O-N 3.13Å; G219-L222 WeakPolarHBondContact O-CB 3.47Å; G219-L222 PolarHBondContact O-N 3.38Å; S220-L222 VanDerWaalsContact C-N 3.35Å; L222-A224 VanDerWaalsContact C-N 3.33Å; L222-A224 PolarHBondContact O-N 3.24Å; L222-Y225 WeakPolarHBondContact O-CB 3.37Å; L222-Y225 PolarHBondContact O-N 3.05Å; L222-L226 HydrophobicContact CD1-CD1 4.39Å; L222-L226 HydrophobicContact CD1-CG 4.44Å; L222-L226 HydrophobicContact CG-CD1 4.2Å; L222-L226 WeakPolarHBondContact O-CG 3.31Å; L222-L226 PolarHBondContact O-N 2.93Å
223V95.3Very high94.6Very high45 Ų4524 Ų2427%0.27314%0.138SC..Hα-helixtrans-62.4-41.1176.41700000111W103 G219 S220 Y225 L226 D227W103-V223 HydrophobicContact CB-CG1 3.4Å; W103-V223 VanDerWaalsContact CB-CG1 3.4Å; W103-V223 HydrophobicContact CD2-CG1 3.85Å; W103-V223 HydrophobicContact CE3-CG1 4.2Å; W103-V223 HydrophobicContact CG-CG1 3.53Å; G219-V223 WeakPolarHBondContact O-CB 3.43Å; G219-V223 VanDerWaalsContact O-CG2 3.29Å; G219-V223 WeakPolarHBondContact O-CG2 3.47Å; G219-V223 PolarHBondContact O-N 3.23Å; S220-V223 PolarHBondContact O-N 2.79Å; V223-Y225 PolarHBondContact O-N 2.77Å; V223-L226 PolarHBondContact O-N 3.23Å; V223-D227 WeakPolarHBondContact O-CB 3.44Å; V223-D227 PolarHBondContact O-N 3.47Å
224A95.4Very high94.3Very high0 Ų031 Ų310%017%0.166CC..Hα-helixtrans-62.1-41.5174.800000112L48 Y51 S220 T221 L222 A228L48-A224 HydrophobicContact CD2-CB 4.17Å; Y51-A224 HydrophobicContact CD1-CB 3.83Å; Y51-A224 HydrophobicContact CE1-CB 3.46Å; Y51-A224 VanDerWaalsContact CE1-CB 3.46Å; S220-A224 VanDerWaalsContact O-CB 3.25Å; S220-A224 WeakPolarHBondContact O-CB 3.31Å; S220-A224 PolarHBondContact O-N 3.43Å; T221-A224 PolarHBondContact O-N 3.24Å; L222-A224 VanDerWaalsContact C-N 3.33Å; L222-A224 PolarHBondContact O-N 3.24Å; A224-A228 WeakPolarHBondContact O-CB 3.39Å; A224-A228 PolarHBondContact O-N 2.95Å
225Y95.5Very high93.9Very high22 Ų2229.3 Ų29.39%0.08616%0.158CC..Hα-helixtrans-63-44.9174.8168.7-92.2000112.1D165 A168 T221 L222 V223 A228 S229 P237 L239D165-Y225 WeakPolarHBondContact CB-OH 3.36Å; D165-Y225 PolarHBondContact OD2-OH 3.37Å; A168-Y225 HydrophobicContact CB-CD1 4.13Å; A168-Y225 HydrophobicContact CB-CE1 3.71Å; T221-Y225 WeakPolarHBondContact O-CB 3.25Å; T221-Y225 PolarHBondContact O-N 2.97Å; L222-Y225 WeakPolarHBondContact O-CB 3.37Å; L222-Y225 PolarHBondContact O-N 3.05Å; V223-Y225 PolarHBondContact O-N 2.77Å; Y225-A228 PolarHBondContact O-N 3.34Å; Y225-S229 WeakPolarHBondContact O-CB 3.46Å; Y225-S229 PolarHBondContact O-N 2.99Å; Y225-S229 PolarHBondContact O-OG 3.4Å; Y225-P237 HydrophobicContact CD2-CB 4.12Å; Y225-P237 HydrophobicContact CE2-CB 4.42Å; Y225-P237 WeakPolarHBondContact CE2-O 3.45Å; Y225-L239 HydrophobicContact CD1-CD1 4.39Å; Y225-L239 HydrophobicContact CD2-CD1 4.15Å; Y225-L239 HydrophobicContact CD2-CD2 4.13Å; Y225-L239 HydrophobicContact CD2-CG 3.72Å; Y225-L239 HydrophobicContact CE2-CD1 4.4Å; Y225-L239 HydrophobicContact CE2-CG 4.18Å; Y225-L239 HydrophobicContact CG-CD1 4.12Å; Y225-L239 HydrophobicContact CG-CD2 4.15Å; Y225-L239 HydrophobicContact CG-CG 4.04Å
226L94.4Very high93.7Very high18 Ų1834.4 Ų34.49%0.09418%0.183CC..Hα-helixtrans-66.1-44.3177-66.7170.2000111.6L156 E159 M160 L222 V223 S229 N230L156-L226 HydrophobicContact CD1-CD1 3.96Å; E159-L226 HydrophobicContact CB-CD1 4Å; M160-L226 HydrophobicContact SD-CD1 3.95Å; M160-L226 HydrophobicContact SD-CD2 4.2Å; L222-L226 HydrophobicContact CD1-CD1 4.39Å; L222-L226 HydrophobicContact CD1-CG 4.44Å; L222-L226 HydrophobicContact CG-CD1 4.2Å; L222-L226 WeakPolarHBondContact O-CG 3.31Å; L222-L226 PolarHBondContact O-N 2.93Å; V223-L226 PolarHBondContact O-N 3.23Å; L226-S229 PolarHBondContact O-N 2.95Å; L226-N230 PolarHBondContact O-N 3.41Å; L226-N230 VanDerWaalsContact O-N 3.16Å; L226-N230 PolarHBondContact O-ND2 2.76Å
227D94.2Very high93.6Very high11 Ų1133.1 Ų33.16%0.05918%0.176CC..Hα-helixtrans-61.8-45.6175.1173.991.1000110.7Y51 R55 V223 S229 N230 E231Y51-D227 VanDerWaalsContact OH-CG 3.27Å; Y51-D227 PolarHBondContact OH-OD2 3.43Å; R55-D227 WeakPolarHBondContact CD-OD2 3.35Å; R55-D227 WeakPolarHBondContact CG-OD2 3.26Å; R55-D227 IonicContact CZ-OD1 3.83Å; R55-D227 IonicContact CZ-OD2 3.13Å; R55-D227 IonicContact NE-OD1 3.16Å; R55-D227 PolarHBondContact NE-OD1 3.18Å; R55-D227 IonicContact NE-OD2 3.13Å; R55-D227 PolarHBondContact NE-OD2 3.16Å; R55-D227 IonicContact NH2-OD1 3.74Å; R55-D227 PolarHBondContact NH2-OD1 3.32Å; R55-D227 VanDerWaalsContact NH2-OD1 3.13Å; R55-D227 IonicContact NH2-OD2 2.7Å; V223-D227 WeakPolarHBondContact O-CB 3.44Å; V223-D227 PolarHBondContact O-N 3.47Å; D227-S229 VanDerWaalsContact C-N 3.33Å; D227-S229 PolarHBondContact O-N 3.06Å; D227-N230 PolarHBondContact O-N 2.82Å; D227-E231 VanDerWaalsContact O-CB 3.31Å; D227-E231 WeakPolarHBondContact O-CB 3.22Å; D227-E231 WeakPolarHBondContact O-CG 3.18Å; D227-E231 PolarHBondContact O-N 3.09Å
228A94.1Very high93.4Very high0 Ų034.4 Ų34.40%019%0.189CC..Hα-helixtrans-61.4-41.4177.800000112.3Y51 A224 Y225 N230 I232 P237 I254 L256Y51-A228 HydrophobicContact CD2-CB 4.1Å; Y51-A228 HydrophobicContact CE2-CB 3.88Å; A224-A228 WeakPolarHBondContact O-CB 3.39Å; A224-A228 PolarHBondContact O-N 2.95Å; Y225-A228 PolarHBondContact O-N 3.34Å; A228-N230 PolarHBondContact O-N 2.98Å; A228-I232 HydrophobicContact CB-CD1 4.13Å; A228-I232 HydrophobicContact CB-CG1 3.9Å; A228-I232 CarbonylContact O-C 3.39Å; A228-I232 WeakPolarHBondContact O-CA 3.46Å; A228-I232 WeakPolarHBondContact O-CG1 3.44Å; A228-I232 PolarHBondContact O-N 3.43Å; A228-P237 HydrophobicContact CB-CB 3.85Å; A228-P237 HydrophobicContact CB-CG 4.1Å; A228-I254 HydrophobicContact CB-CD1 3.59Å; A228-L256 HydrophobicContact CB-CD2 4.5Å
229S92.9Very high93.3Very high43 Ų4334.2 Ų34.230%0.30119%0.189SC..Hα-helixtrans-63.2-32.1178.5-60.90000112.4Y225 L226 D227 P237Y225-S229 WeakPolarHBondContact O-CB 3.46Å; Y225-S229 PolarHBondContact O-N 2.99Å; Y225-S229 PolarHBondContact O-OG 3.4Å; L226-S229 PolarHBondContact O-N 2.95Å; D227-S229 VanDerWaalsContact C-N 3.33Å; D227-S229 PolarHBondContact O-N 3.06Å; S229-P237 WeakPolarHBondContact OG-CG 3.36Å
230N90.7Very high93.2Very high97 Ų9737.8 Ų37.852%0.51920%0.202SC..Hα-helixtrans-89.6-41.6-179.4-71.4-58.4000113.1L226 D227 A228L226-N230 PolarHBondContact O-N 3.41Å; L226-N230 VanDerWaalsContact O-N 3.16Å; L226-N230 PolarHBondContact O-ND2 2.76Å; D227-N230 PolarHBondContact O-N 2.82Å; A228-N230 PolarHBondContact O-N 2.98Å
231E91.5Very high93Very high55 Ų5538.8 Ų38.826%0.25721%0.205SC..Hα-helixtrans-99-29.2-168.2-63-84.3171.300113R55 R106 D227 P233R55-E231 IonicContact NH2-OE2 2.65Å; R106-E231 VanDerWaalsContact CD-OE1 3.28Å; R106-E231 WeakPolarHBondContact CD-OE1 3.46Å; R106-E231 WeakPolarHBondContact CG-OE1 3.2Å; R106-E231 IonicContact CZ-OE1 3.9Å; R106-E231 IonicContact CZ-OE2 2.76Å; R106-E231 IonicContact NE-OE1 3.75Å; R106-E231 PolarHBondContact NE-OE1 2.95Å; R106-E231 IonicContact NE-OE2 3.54Å; R106-E231 PolarHBondContact NE-OE2 3.37Å; R106-E231 VanDerWaalsContact NE-OE2 3.16Å; R106-E231 IonicContact NH2-OE1 3.45Å; R106-E231 IonicContact NH2-OE2 4Å; R106-E231 PolarHBondContact NH2-OE2 3.43Å; D227-E231 VanDerWaalsContact O-CB 3.31Å; D227-E231 WeakPolarHBondContact O-CB 3.22Å; D227-E231 WeakPolarHBondContact O-CG 3.18Å; D227-E231 PolarHBondContact O-N 3.09Å; E231-P233 VanDerWaalsContact C-CD 3.48Å
232I92.3Very high92.8Very high9 Ų943.7 Ų43.75%0.04622%0.223CC..  trans-134.154.3179.555.2166.7000111.9Y51 Q54 R55 A228 Y234 S235 L256Y51-I232 HydrophobicContact CD2-CD1 4.3Å; Y51-I232 HydrophobicContact CE2-CD1 4.43Å; Q54-I232 HydrophobicContact CB-CD1 4.06Å; R55-I232 HydrophobicContact CB-CD1 4.31Å; A228-I232 HydrophobicContact CB-CD1 4.13Å; A228-I232 HydrophobicContact CB-CG1 3.9Å; A228-I232 CarbonylContact O-C 3.39Å; A228-I232 WeakPolarHBondContact O-CA 3.46Å; A228-I232 WeakPolarHBondContact O-CG1 3.44Å; A228-I232 PolarHBondContact O-N 3.43Å; I232-Y234 HydrophobicContact CB-CD1 4.47Å; I232-Y234 HydrophobicContact CB-CE1 3.81Å; I232-Y234 HydrophobicContact CG2-CE1 3.86Å; I232-Y234 WeakPolarHBondContact CG2-OH 3.47Å; I232-Y234 PolarHBondContact O-N 2.66Å; I232-S235 WeakPolarHBondContact O-CB 3.44Å; I232-S235 PolarHBondContact O-N 2.84Å; I232-S235 PolarHBondContact O-OG 3.11Å; I232-L256 HydrophobicContact CD1-CD1 4.3Å
233P90.4Very high92.4Very high76 Ų7647.3 Ų47.349%0.49425%0.247SC..G310 helixtrans-59.4-25.7-174.223.7-34.7000113.9E231 S235 L236E231-P233 VanDerWaalsContact C-CD 3.48Å; P233-S235 PolarHBondContact O-N 3.42Å; P233-L236 PolarHBondContact O-N 3.37Å; P233-L236 VanDerWaalsContact O-N 3.15Å
234Y90Very high91.8Very high149 Ų14947.5 Ų47.558%0.58425%0.25SC*.G310 helixtrans-63.5-17.2175.961.8-96.3000114I232 L236I232-Y234 HydrophobicContact CB-CD1 4.47Å; I232-Y234 HydrophobicContact CB-CE1 3.81Å; I232-Y234 HydrophobicContact CG2-CE1 3.86Å; I232-Y234 WeakPolarHBondContact CG2-OH 3.47Å; I232-Y234 PolarHBondContact O-N 2.66Å; Y234-L236 VanDerWaalsContact C-N 3.26Å
235S89.8Confident91.2Very high2 Ų251.1 Ų51.11%0.01427%0.269CS..G310 helixtrans-81.6-4.2177.468.80000113.6I232 P233 L256 S257I232-S235 WeakPolarHBondContact O-CB 3.44Å; I232-S235 PolarHBondContact O-N 2.84Å; I232-S235 PolarHBondContact O-OG 3.11Å; P233-S235 PolarHBondContact O-N 3.42Å; S235-L256 CarbonylContact O-C 3.08Å; S235-S257 CarbonylContact C-O 3.56Å; S235-S257 PolarHBondContact O-N 3.08Å; S235-S257 VanDerWaalsContact O-O 3.09Å
236L90.8Very high90.4Very high111 Ų11159.2 Ų59.258%0.58131%0.305SS*.  trans44.666.6178.7-61.6175.3000111.8P233 Y234 G238P233-L236 PolarHBondContact O-N 3.37Å; P233-L236 VanDerWaalsContact O-N 3.15Å; Y234-L236 VanDerWaalsContact C-N 3.26Å; L236-G238 PolarHBondContact O-N 3.34Å
237P93.1Very high89.5Confident23 Ų2366 Ų6615%0.14933%0.329CS..EExtended strand (participates in β ladder)trans-65134.4-173.928-35.2000111.4Y225 A228 S229 I254 V255 L256Y225-P237 HydrophobicContact CD2-CB 4.12Å; Y225-P237 HydrophobicContact CE2-CB 4.42Å; Y225-P237 WeakPolarHBondContact CE2-O 3.45Å; A228-P237 HydrophobicContact CB-CB 3.85Å; A228-P237 HydrophobicContact CB-CG 4.1Å; S229-P237 WeakPolarHBondContact OG-CG 3.36Å; P237-I254 HydrophobicContact CB-CD1 3.97Å; P237-I254 HydrophobicContact CB-CG1 4.28Å; P237-V255 WeakPolarHBondContact CA-O 3.3Å; P237-L256 HydrophobicContact CB-CD2 4Å
238G93Very high88Confident26 Ų2669.8 Ų69.827%0.26836%0.363SS..EExtended strand (participates in β ladder)trans-125.8168173.600000112L236 I254 V255L236-G238 PolarHBondContact O-N 3.34Å; G238-I254 WeakPolarHBondContact O-CA 3.34Å; G238-V255 PolarHBondContact N-O 3.22Å; G238-V255 PolarHBondContact O-N 2.93Å
239L93.5Very high87Confident10 Ų1075.7 Ų75.75%0.05240%0.398CS..EExtended strand (participates in β ladder)trans-119.5128.5178.2-71.5171.3000110.9K167 A168 L171 T221 Y225K167-L239 HydrophobicContact CB-CB 4.28Å; K167-L239 HydrophobicContact CB-CD1 4.22Å; K167-L239 HydrophobicContact CD-CB 4.36Å; K167-L239 WeakPolarHBondContact CD-O 3.29Å; K167-L239 PolarHBondContact NZ-O 3.13Å; A168-L239 HydrophobicContact CB-CD1 3.92Å; L171-L239 HydrophobicContact CD2-CD1 4.13Å; L171-L239 HydrophobicContact CD2-CD2 4Å; T221-L239 HydrophobicContact CG2-CD2 3.76Å; Y225-L239 HydrophobicContact CD1-CD1 4.39Å; Y225-L239 HydrophobicContact CD2-CD1 4.15Å; Y225-L239 HydrophobicContact CD2-CD2 4.13Å; Y225-L239 HydrophobicContact CD2-CG 3.72Å; Y225-L239 HydrophobicContact CE2-CD1 4.4Å; Y225-L239 HydrophobicContact CE2-CG 4.18Å; Y225-L239 HydrophobicContact CG-CD1 4.12Å; Y225-L239 HydrophobicContact CG-CD2 4.15Å; Y225-L239 HydrophobicContact CG-CG 4.04Å
240E92.6Very high86.6Confident88 Ų8873.8 Ų73.841%0.41139%0.385SS..EExtended strand (participates in β ladder)trans-137.9161.3177-67-174.1-174.300111.2D245 H253 V255E240-D245 WeakPolarHBondContact CA-OD1 3.35Å; E240-H253 PolarHBondContact N-O 3.02Å; E240-H253 VanDerWaalsContact N-O 3.09Å; E240-H253 PolarHBondContact O-N 3.31Å; E240-H253 PolarHBondContact O-ND1 2.92Å; E240-V255 HydrophobicContact CB-CG2 3.94Å; E240-V255 HydrophobicContact CG-CG2 3.82Å
241Y91.9Very high86.6Confident29 Ų2970.6 Ų70.611%0.11437%0.367CS..EExtended strand (participates in β ladder)trans-109.3133177.1-64.1-101.6000112.2C244 D245 F251 P252Y241-C244 CarbonylContact O-C 3.47Å; Y241-C244 PolarHBondContact O-N 3.08Å; Y241-D245 PolarHBondContact N-OD1 3.02Å; Y241-D245 PolarHBondContact O-N 3.48Å; Y241-F251 WeakPolarHBondContact CA-O 2.98Å; Y241-P252 HydrophobicContact CD1-CB 4.16Å; Y241-P252 HydrophobicContact CE1-CB 3.9Å
242W91.6Very high86.7Confident103 Ų10368 Ų6839%0.3936%0.355SS..EExtended strand (participates in β ladder)trans-97.9141.1173.6-17892.1000110.6I43 L47 G250 F251I43-W242 HydrophobicContact CG2-CE3 4.45Å; I43-W242 HydrophobicContact CG2-CZ3 4.49Å; L47-W242 HydrophobicContact CD1-CB 4.04Å; L47-W242 HydrophobicContact CD1-CG 4.4Å; L47-W242 HydrophobicContact CD2-CB 3.8Å; L47-W242 HydrophobicContact CD2-CD2 4.47Å; L47-W242 HydrophobicContact CD2-CG 3.76Å; W242-G250 CarbonylContact O-C 2.98Å; W242-G250 WeakPolarHBondContact O-CA 3.42Å; W242-F251 HydrophobicContact CE3-CD2 4.34Å; W242-F251 PolarHBondContact N-O 3.37Å; W242-F251 PolarHBondContact O-N 3.04Å
243P86.7Confident86.7Confident76 Ų7669.1 Ų69.149%0.49436%0.36SS..SBendcis-82.7-11.80.833.1-35.7000114W247P243-W247 HydrophobicContact CG-CE3 4.04Å; P243-W247 HydrophobicContact CG-CZ3 3.94Å
244C84.4Confident86.9Confident49 Ų4965.6 Ų65.633%0.33134%0.337SS..  trans-138.4129.3-178.8-173.40000111.1Y241 K246 W247Y241-C244 CarbonylContact O-C 3.47Å; Y241-C244 PolarHBondContact O-N 3.08Å; C244-K246 PolarHBondContact O-N 3.4Å; C244-K246 VanDerWaalsContact O-N 3.07Å; C244-W247 HydrophobicContact CB-CB 4.49Å; C244-W247 HydrophobicContact CB-CD2 4.3Å; C244-W247 HydrophobicContact CB-CG 4.03Å; C244-W247 WeakPolarHBondContact O-CB 3.3Å; C244-W247 PolarHBondContact O-N 2.97Å
245D81.3Confident87Confident76 Ų7660.7 Ų60.741%0.40632%0.322SS..THydrogen-bonded Turntrans-62.5-20.5-178.7-160.548.4000113.2K167 E240 Y241 W247K167-D245 IonicContact NZ-OD2 2.75Å; E240-D245 WeakPolarHBondContact CA-OD1 3.35Å; Y241-D245 PolarHBondContact N-OD1 3.02Å; Y241-D245 PolarHBondContact O-N 3.48Å; D245-W247 VanDerWaalsContact C-N 3.33Å
246K79Confident87.1Confident193 Ų19361.7 Ų61.784%0.83933%0.327SS*.THydrogen-bonded Turntrans-80.5-14177.4-61.9-177-179.4178.90113.2C244C244-K246 PolarHBondContact O-N 3.4Å; C244-K246 VanDerWaalsContact O-N 3.07Å
247W75.8Confident86.8Confident159 Ų15959.8 Ų59.860%0.60232%0.323SS*.  trans-85.6117.1-177.7-76.512.1000110.7P243 C244 D245 V249 G250P243-W247 HydrophobicContact CG-CE3 4.04Å; P243-W247 HydrophobicContact CG-CZ3 3.94Å; C244-W247 HydrophobicContact CB-CB 4.49Å; C244-W247 HydrophobicContact CB-CD2 4.3Å; C244-W247 HydrophobicContact CB-CG 4.03Å; C244-W247 WeakPolarHBondContact O-CB 3.3Å; C244-W247 PolarHBondContact O-N 2.97Å; D245-W247 VanDerWaalsContact C-N 3.33Å; W247-V249 PolarHBondContact O-N 3.09Å; W247-V249 VanDerWaalsContact O-N 3.11Å; W247-G250 PolarHBondContact O-N 3.33Å
248A63.5Low85.2Confident92 Ų9263.1 Ų63.176%0.7635%0.347SS*.THydrogen-bonded Turntrans-63.6-15.5177.700000113.9
249V71.7Confident83.2Confident124 Ų12465.9 Ų65.975%0.75236%0.362SS*.THydrogen-bonded Turntrans-107.75.5-177-157.30000112W247W247-V249 PolarHBondContact O-N 3.09Å; W247-V249 VanDerWaalsContact O-N 3.11Å
250G85Confident80.9Confident3 Ų370.6 Ų70.63%0.03139%0.394CS..SBendtrans-65.3164179.100000113.3Y218 W242 W247Y218-G250 PolarHBondContact OH-O 3.4Å; W242-G250 CarbonylContact O-C 2.98Å; W242-G250 WeakPolarHBondContact O-CA 3.42Å; W247-G250 PolarHBondContact O-N 3.33Å
251F91.3Very high78.6Confident30 Ų3075.8 Ų75.813%0.13242%0.415CS..EExtended strand (participates in β ladder)trans-78.7123.8170.1-79-81.9000110V40 I43 M44 L47 M214 A217 Y241 W242V40-F251 HydrophobicContact CG1-CE1 3.79Å; V40-F251 HydrophobicContact CG1-CZ 4.35Å; V40-F251 HydrophobicContact CG2-CE1 4.2Å; V40-F251 HydrophobicContact CG2-CZ 3.97Å; I43-F251 HydrophobicContact CD1-CE2 4.2Å; I43-F251 HydrophobicContact CG2-CB 4.48Å; I43-F251 HydrophobicContact CG2-CD2 4.11Å; I43-F251 HydrophobicContact CG2-CG 4.15Å; M44-F251 HydrophobicContact SD-CB 4.42Å; M44-F251 HydrophobicContact SD-CD1 3.88Å; M44-F251 HydrophobicContact SD-CG 4.49Å; L47-F251 HydrophobicContact CD1-CB 3.75Å; M214-F251 HydrophobicContact CE-CD1 4.35Å; M214-F251 HydrophobicContact CE-CE1 3.58Å; M214-F251 HydrophobicContact CE-CZ 3.78Å; M214-F251 HydrophobicContact SD-CE1 3.52Å; M214-F251 VanDerWaalsContact SD-CE1 3.52Å; M214-F251 HydrophobicContact SD-CZ 3.61Å; A217-F251 HydrophobicContact CB-CD1 4.27Å; A217-F251 HydrophobicContact CB-CE1 4.28Å; Y241-F251 WeakPolarHBondContact CA-O 2.98Å; W242-F251 HydrophobicContact CE3-CD2 4.34Å; W242-F251 PolarHBondContact N-O 3.37Å; W242-F251 PolarHBondContact O-N 3.04Å
252P93Very high76.2Confident1 Ų180.7 Ų80.71%0.00645%0.448CS..EExtended strand (participates in β ladder)trans-71.5137.2176.730.7-34.3000109.3L171 Y218 T221 Y241L171-P252 HydrophobicContact CD1-CB 3.7Å; L171-P252 HydrophobicContact CD1-CG 3.64Å; L171-P252 HydrophobicContact CD2-CB 4.19Å; Y218-P252 HydrophobicContact CD1-CG 4.04Å; Y218-P252 HydrophobicContact CD2-CG 3.76Å; Y218-P252 HydrophobicContact CE1-CG 4.24Å; Y218-P252 HydrophobicContact CE2-CG 3.98Å; Y218-P252 HydrophobicContact CG-CG 3.78Å; T221-P252 HydrophobicContact CG2-CB 4.04Å; T221-P252 PolarHBondContact OG1-O 3.28Å; Y241-P252 HydrophobicContact CD1-CB 4.16Å; Y241-P252 HydrophobicContact CE1-CB 3.9Å
253H93Very high73.5Confident32 Ų3284.2 Ų84.215%0.14847%0.469CS..EExtended strand (participates in β ladder)trans-139.5158.7173.173.2-60.1000111.7L47 E240L47-H253 HydrophobicContact CB-CB 3.79Å; L47-H253 HydrophobicContact CD1-CB 4.2Å; L47-H253 HydrophobicContact CD2-CB 4.22Å; L47-H253 HydrophobicContact CG-CB 4.28Å; E240-H253 PolarHBondContact N-O 3.02Å; E240-H253 VanDerWaalsContact N-O 3.09Å; E240-H253 PolarHBondContact O-N 3.31Å; E240-H253 PolarHBondContact O-ND1 2.92Å
254I93.6Very high71.3Confident2 Ų290 Ų901%0.0149%0.486CS..EExtended strand (participates in β ladder)trans-88.5132.7176.8-171.3178.6000109.7L48 Y51 A228 P237 G238 L256L48-I254 HydrophobicContact CD2-CG2 3.89Å; Y51-I254 VanDerWaalsContact CB-CG2 3.48Å; Y51-I254 HydrophobicContact CD1-CG2 4.46Å; Y51-I254 HydrophobicContact CD2-CD1 4.08Å; Y51-I254 HydrophobicContact CG-CD1 4.35Å; Y51-I254 HydrophobicContact CG-CG2 4.01Å; A228-I254 HydrophobicContact CB-CD1 3.59Å; P237-I254 HydrophobicContact CB-CD1 3.97Å; P237-I254 HydrophobicContact CB-CG1 4.28Å; G238-I254 WeakPolarHBondContact O-CA 3.34Å; I254-L256 HydrophobicContact CD1-CD2 3.77Å; I254-L256 HydrophobicContact CG1-CD2 3.96Å
255V92.9Very high69Low45 Ų4599.1 Ų99.127%0.27351%0.514SS..EExtended strand (participates in β ladder)trans-110.6134.1172.2-177.10000108.2P237 G238 E240P237-V255 WeakPolarHBondContact CA-O 3.3Å; G238-V255 PolarHBondContact N-O 3.22Å; G238-V255 PolarHBondContact O-N 2.93Å; E240-V255 HydrophobicContact CB-CG2 3.94Å; E240-V255 HydrophobicContact CG-CG2 3.82Å
256L92Very high67Low24 Ų24104.9 Ų104.913%0.12656%0.558CS.*EExtended strand (participates in β ladder)trans-110.6119.3177.7-58.7-173.6000108.5Q54 A228 I232 S235 P237 I254 S258Q54-L256 HydrophobicContact CB-CD1 3.92Å; Q54-L256 HydrophobicContact CG-CD1 3.82Å; A228-L256 HydrophobicContact CB-CD2 4.5Å; I232-L256 HydrophobicContact CD1-CD1 4.3Å; S235-L256 CarbonylContact O-C 3.08Å; P237-L256 HydrophobicContact CB-CD2 4Å; I254-L256 HydrophobicContact CD1-CD2 3.77Å; I254-L256 HydrophobicContact CG1-CD2 3.96Å; L256-S258 PolarHBondContact O-N 2.88Å
257S83.6Confident66.4Low70 Ų70100.5 Ų100.549%0.4954%0.544SS..  trans-84.8110.5175.1-1630000109.1S235 S259S235-S257 CarbonylContact C-O 3.56Å; S235-S257 PolarHBondContact O-N 3.08Å; S235-S257 VanDerWaalsContact O-O 3.09Å; S257-S259 PolarHBondContact O-N 3.1Å; S257-S259 VanDerWaalsContact O-N 3.12Å
258S59.9Low65.9Low94 Ų9497.4 Ų97.466%0.65754%0.541SS*.  trans-68.5110.5171.155.30000109.2L256L256-S258 PolarHBondContact O-N 2.88Å
259S49.9Very low66.1Low83 Ų8397.7 Ų97.758%0.5853%0.529SS*.  trans-54.9134.1150.6-177.40000106.7S257 K261S257-S259 PolarHBondContact O-N 3.1Å; S257-S259 VanDerWaalsContact O-N 3.12Å; S259-K261 PolarHBondContact O-N 2.67Å
260P45.3Very low65.7Low110 Ų11096.2 Ų96.271%0.71452%0.515SS*.  trans-55.4115.2174.9-9.921.3000105.5T262P260-T262 VanDerWaalsContact C-N 3.33Å; P260-T262 PolarHBondContact O-N 3.17Å
261K45.8Very low64.5Low196 Ų196102 Ų10285%0.85255%0.546SS*.  trans-47.2112.3161.5-74.3-179.3178.1178.80103.6S259 Q263S259-K261 PolarHBondContact O-N 2.67Å; K261-Q263 VanDerWaalsContact C-N 3.27Å; K261-Q263 PolarHBondContact O-N 3.36Å
262T40.8Very low62.7Low132 Ų132106.8 Ų106.881%0.8157%0.573SS**  trans-44.7104.3174.930.50000105.9P260 K264P260-T262 VanDerWaalsContact C-N 3.33Å; P260-T262 PolarHBondContact O-N 3.17Å; T262-K264 VanDerWaalsContact C-N 3.33Å; T262-K264 PolarHBondContact O-N 3.4Å
263Q35.8Very low60.6Low178 Ų178114.4 Ų114.483%0.83261%0.614SS**  trans-61.3107178.5-151.5174.77.200101.8K261 R265K261-Q263 VanDerWaalsContact C-N 3.27Å; K261-Q263 PolarHBondContact O-N 3.36Å; Q263-R265 PolarHBondContact O-N 3.01Å
264K40.8Very low58.1Low198 Ų198120.7 Ų120.786%0.86165%0.65SS**  trans-57.7100.9168.2-80.2-173.5176.1-176.70104.2T262 C266T262-K264 VanDerWaalsContact C-N 3.33Å; T262-K264 PolarHBondContact O-N 3.4Å; K264-C266 PolarHBondContact O-N 3.2Å; K264-C266 VanDerWaalsContact O-N 3.1Å
265R35.2Very low55.1Low239 Ų239130.6 Ų130.690%0.90270%0.703SS**  trans-59.7111.4163-80.1-178.4169.7-178.8-3.9104.4Q263Q263-R265 PolarHBondContact O-N 3.01Å
266C39.5Very low51.7Low198 Ų198138.4 Ų138.4100%1.33874%0.742SS**  trans-61.10155-660000108.5K264K264-C266 PolarHBondContact O-N 3.2Å; K264-C266 VanDerWaalsContact O-N 3.1Å

Retrieved 266 of 266 residues in 341.3 ms (Link to these results)

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