A0A096M5A6_POEFO Loading...

Peripheral myelin protein 22

AlphaFold DB , UniProt , Accession A0A096M5A6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 160 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
1M77.6Confident90Very high147 Ų14787.1 Ų87.172%0.72446%0.457SS*.  0-42.50-79170.677.400112.6I3 L4 L5 R159M1-I3 PolarHBondContact O-N 3.41Å; M1-L4 PolarHBondContact O-N 3.39Å; M1-L5 PolarHBondContact O-N 3.03Å; M1-R159 HydrophobicContact CE-CB 3.9Å; M1-R159 WeakPolarHBondContact CE-O 3.41Å; M1-R159 HydrophobicContact SD-CB 3.77Å
2L81.8Confident90.7Very high139 Ų13979.8 Ų79.873%0.72842%0.419SS*.Hα-helixtrans-59.4-45.8-177.6-172.766.9000114.7L4 L5 L6L2-L4 VanDerWaalsContact C-N 3.34Å; L2-L4 PolarHBondContact O-N 3.47Å; L2-L5 WeakPolarHBondContact O-CB 3.45Å; L2-L5 PolarHBondContact O-N 2.87Å; L2-L6 WeakPolarHBondContact O-CB 3.46Å; L2-L6 PolarHBondContact O-N 3.21Å
3I86.8Confident91.2Very high153 Ų15379.5 Ų79.579%0.78542%0.417SS*.Hα-helixtrans-61.3-43.1-179.6-62.6170.3000111.4M1 L6 G7M1-I3 PolarHBondContact O-N 3.41Å; I3-L6 PolarHBondContact O-N 3.38Å; I3-G7 PolarHBondContact O-N 2.92Å
4L87.6Confident91.7Very high100 Ų10076.2 Ų76.252%0.52440%0.403SS..Hα-helixtrans-65.9-40.7177.6-178.2145.8000111.2M1 L2 G7 I8 L156M1-L4 PolarHBondContact O-N 3.39Å; L2-L4 VanDerWaalsContact C-N 3.34Å; L2-L4 PolarHBondContact O-N 3.47Å; L4-G7 PolarHBondContact O-N 2.87Å; L4-I8 HydrophobicContact CD2-CD1 3.45Å; L4-I8 VanDerWaalsContact CD2-CD1 3.45Å; L4-I8 HydrophobicContact CD2-CG1 4.48Å; L4-I8 HydrophobicContact CG-CD1 4.13Å; L4-I8 VanDerWaalsContact O-CG1 3.25Å; L4-I8 WeakPolarHBondContact O-CG1 3.24Å; L4-I8 PolarHBondContact O-N 2.87Å; L4-L156 HydrophobicContact CD2-CD1 3.53Å
5L88.4Confident92.1Very high43 Ų4371.1 Ų71.123%0.22538%0.376CS..Hα-helixtrans-61-47.4174.7-167.878.4000111.5M1 L2 G7 I8 I9 F84 L88M1-L5 PolarHBondContact O-N 3.03Å; L2-L5 WeakPolarHBondContact O-CB 3.45Å; L2-L5 PolarHBondContact O-N 2.87Å; L5-G7 PolarHBondContact O-N 3.4Å; L5-I8 PolarHBondContact O-N 3.37Å; L5-I9 HydrophobicContact CD2-CD1 4.5Å; L5-I9 HydrophobicContact CG-CD1 4.1Å; L5-I9 WeakPolarHBondContact O-CG1 3.45Å; L5-I9 PolarHBondContact O-N 2.73Å; L5-F84 HydrophobicContact CD1-CE1 4.3Å; L5-F84 HydrophobicContact CD1-CE2 4.34Å; L5-F84 HydrophobicContact CD1-CZ 3.51Å; L5-F84 HydrophobicContact CG-CZ 4.42Å; L5-L88 HydrophobicContact CD1-CD1 4.3Å; L5-L88 HydrophobicContact CD1-CD2 3.97Å; L5-L88 HydrophobicContact CD1-CG 4.47Å; L5-L88 HydrophobicContact CD2-CD2 4.08Å
6L91.6Very high92.5Very high119 Ų11968.4 Ų68.462%0.62336%0.362SS*.Hα-helixtrans-60.9-44.8178.2-176.767.7000111.3L2 I3 I8 I9 F10L2-L6 WeakPolarHBondContact O-CB 3.46Å; L2-L6 PolarHBondContact O-N 3.21Å; I3-L6 PolarHBondContact O-N 3.38Å; L6-I8 PolarHBondContact O-N 3.35Å; L6-I9 PolarHBondContact O-N 2.99Å; L6-F10 VanDerWaalsContact O-CB 3.3Å; L6-F10 WeakPolarHBondContact O-CB 3.31Å; L6-F10 PolarHBondContact O-N 2.85Å
7G94Very high92.8Very high39 Ų3969.1 Ų69.140%0.40237%0.369SS..Hα-helixtrans-61.4-41.8177.800000112.9I3 L4 L5 F10 L11I3-G7 PolarHBondContact O-N 2.92Å; L4-G7 PolarHBondContact O-N 2.87Å; L5-G7 PolarHBondContact O-N 3.4Å; G7-F10 PolarHBondContact O-N 3.43Å; G7-L11 WeakPolarHBondContact O-CB 3.41Å; G7-L11 PolarHBondContact O-N 2.86Å
8I93.4Very high93Very high7 Ų767.2 Ų67.24%0.03636%0.359CS..Hα-helixtrans-68.1-43177.8-66.3167.6000111.3L4 L5 L6 F10 L11 H12 I152 Y153 L156L4-I8 HydrophobicContact CD2-CD1 3.45Å; L4-I8 VanDerWaalsContact CD2-CD1 3.45Å; L4-I8 HydrophobicContact CD2-CG1 4.48Å; L4-I8 HydrophobicContact CG-CD1 4.13Å; L4-I8 VanDerWaalsContact O-CG1 3.25Å; L4-I8 WeakPolarHBondContact O-CG1 3.24Å; L4-I8 PolarHBondContact O-N 2.87Å; L5-I8 PolarHBondContact O-N 3.37Å; L6-I8 PolarHBondContact O-N 3.35Å; I8-F10 VanDerWaalsContact C-N 3.35Å; I8-L11 PolarHBondContact O-N 3.47Å; I8-H12 WeakPolarHBondContact O-CB 3.25Å; I8-H12 PolarHBondContact O-N 2.99Å; I8-I152 HydrophobicContact CD1-CG2 3.45Å; I8-I152 VanDerWaalsContact CD1-CG2 3.45Å; I8-I152 HydrophobicContact CG1-CG2 3.7Å; I8-Y153 HydrophobicContact CG2-CD1 3.89Å; I8-Y153 HydrophobicContact CG2-CE1 3.16Å; I8-Y153 HydrophobicContact CG2-CE2 4.17Å; I8-Y153 WeakPolarHBondContact CG2-OH 3.3Å; I8-L156 HydrophobicContact CD1-CD1 4.18Å; I8-L156 HydrophobicContact CD1-CD2 4.07Å
9I94.8Very high93.2Very high33 Ų3363.7 Ų63.717%0.16934%0.34CS..Hα-helixtrans-61.1-46.6175.9-70.4168.2000110.3L5 L6 L11 H12 I13 F84L5-I9 HydrophobicContact CD2-CD1 4.5Å; L5-I9 HydrophobicContact CG-CD1 4.1Å; L5-I9 WeakPolarHBondContact O-CG1 3.45Å; L5-I9 PolarHBondContact O-N 2.73Å; L6-I9 PolarHBondContact O-N 2.99Å; I9-L11 VanDerWaalsContact C-N 3.34Å; I9-L11 PolarHBondContact O-N 2.92Å; I9-H12 PolarHBondContact O-N 2.87Å; I9-I13 HydrophobicContact CG2-CD1 3.63Å; I9-I13 HydrophobicContact CG2-CG1 4.26Å; I9-I13 WeakPolarHBondContact O-CB 3.43Å; I9-I13 WeakPolarHBondContact O-CG1 3.33Å; I9-I13 PolarHBondContact O-N 3.47Å; I9-F84 HydrophobicContact CD1-CE1 3.93Å; I9-F84 HydrophobicContact CG1-CD1 4.34Å; I9-F84 HydrophobicContact CG1-CE1 3.5Å; I9-F84 HydrophobicContact CG1-CZ 4.28Å
10F97Very high93.4Very high144 Ų14466.4 Ų66.463%0.63235%0.349SS*.Hα-helixtrans-60.3-44.7178.2178.7-97.1000111.7L6 G7 I8 I13 S14L6-F10 VanDerWaalsContact O-CB 3.3Å; L6-F10 WeakPolarHBondContact O-CB 3.31Å; L6-F10 PolarHBondContact O-N 2.85Å; G7-F10 PolarHBondContact O-N 3.43Å; I8-F10 VanDerWaalsContact C-N 3.35Å; F10-I13 PolarHBondContact O-N 3.04Å; F10-S14 VanDerWaalsContact O-CB 3.28Å; F10-S14 WeakPolarHBondContact O-CB 3.3Å; F10-S14 PolarHBondContact O-N 3.34Å; F10-S14 PolarHBondContact O-OG 3.33Å
11L97.1Very high93.5Very high34 Ų3465.3 Ų65.318%0.17835%0.345CS..Hα-helixtrans-60.1-46.4176.5-178.766.1000111.6G7 I8 I9 S14 A15 L145 I148 I152G7-L11 WeakPolarHBondContact O-CB 3.41Å; G7-L11 PolarHBondContact O-N 2.86Å; I8-L11 PolarHBondContact O-N 3.47Å; I9-L11 VanDerWaalsContact C-N 3.34Å; I9-L11 PolarHBondContact O-N 2.92Å; L11-S14 PolarHBondContact O-N 3.42Å; L11-A15 PolarHBondContact O-N 3.49Å; L11-L145 HydrophobicContact CD1-CB 4.26Å; L11-L145 HydrophobicContact CD1-CD2 3.57Å; L11-L145 HydrophobicContact CD1-CG 4.48Å; L11-I148 HydrophobicContact CD2-CG2 4.07Å; L11-I152 HydrophobicContact CD2-CD1 4.03Å
12H97.9Very high94.3Very high0 Ų058.3 Ų58.30%031%0.31CS..Hα-helixtrans-62.6-52178.2-166.6147.6000111.3I8 I9 S14 A15 L16 S77 S80 L81 Q104 Y153I8-H12 WeakPolarHBondContact O-CB 3.25Å; I8-H12 PolarHBondContact O-N 2.99Å; I9-H12 PolarHBondContact O-N 2.87Å; H12-S14 VanDerWaalsContact C-N 3.26Å; H12-S14 PolarHBondContact O-N 3.38Å; H12-A15 WeakPolarHBondContact O-CB 3.33Å; H12-A15 PolarHBondContact O-N 3.4Å; H12-A15 VanDerWaalsContact O-N 3.11Å; H12-L16 PolarHBondContact O-N 2.97Å; H12-S77 PolarHBondContact NE2-O 3.45Å; H12-S77 PolarHBondContact NE2-OG 2.91Å; H12-S77 VanDerWaalsContact NE2-OG 3.14Å; H12-S80 PolarHBondContact CE1-OG 2.77Å; H12-L81 PolarHBondContact CE1-N 2.91Å; H12-L81 VanDerWaalsContact CE1-N 3.32Å; H12-Q104 PolarHBondContact CE1-OE1 2.9Å; H12-Q104 VanDerWaalsContact CE1-OE1 3.25Å; H12-Q104 PolarHBondContact NE2-OE1 3.42Å; H12-Q104 VanDerWaalsContact NE2-OE1 3.08Å; H12-Y153 AromaticContact ND1-CE2 3.31Å; H12-Y153 VanDerWaalsContact ND1-CE2 3.31Å; H12-Y153 WeakPolarHBondContact ND1-CE2 3.07Å; H12-Y153 AromaticContact ND1-CZ 3.53Å; H12-Y153 PolarHBondContact ND1-OH 2.84Å
13I98Very high94.9Very high76 Ų7652 Ų5239%0.3928%0.278SS..Hα-helixtrans-59.2-41.4179.9-69.2176.1000110.4I9 F10 A15 L16 V17I9-I13 HydrophobicContact CG2-CD1 3.63Å; I9-I13 HydrophobicContact CG2-CG1 4.26Å; I9-I13 WeakPolarHBondContact O-CB 3.43Å; I9-I13 WeakPolarHBondContact O-CG1 3.33Å; I9-I13 PolarHBondContact O-N 3.47Å; F10-I13 PolarHBondContact O-N 3.04Å; I13-A15 PolarHBondContact O-N 3.41Å; I13-L16 PolarHBondContact O-N 3.49Å; I13-V17 HydrophobicContact CG2-CG2 4.22Å; I13-V17 VanDerWaalsContact O-CG2 3.32Å; I13-V17 WeakPolarHBondContact O-CG2 3.49Å; I13-V17 PolarHBondContact O-N 3.01Å
14S97.9Very high95Very high33 Ų3347.8 Ų47.823%0.23126%0.259CS..Hα-helixtrans-59.4-47.5176-59.50000111.2F10 L11 H12 L16 V17 L18F10-S14 VanDerWaalsContact O-CB 3.28Å; F10-S14 WeakPolarHBondContact O-CB 3.3Å; F10-S14 PolarHBondContact O-N 3.34Å; F10-S14 PolarHBondContact O-OG 3.33Å; L11-S14 PolarHBondContact O-N 3.42Å; H12-S14 VanDerWaalsContact C-N 3.26Å; H12-S14 PolarHBondContact O-N 3.38Å; S14-L16 PolarHBondContact O-N 3.32Å; S14-V17 PolarHBondContact O-N 3.27Å; S14-L18 WeakPolarHBondContact O-CB 3.43Å; S14-L18 VanDerWaalsContact O-CG 3.24Å; S14-L18 WeakPolarHBondContact O-CG 3.32Å; S14-L18 PolarHBondContact O-N 2.88Å
15A97.8Very high94.8Very high0 Ų045.2 Ų45.20%025%0.248CC..Hα-helixtrans-59.8-44.9175.600000111.9L11 H12 I13 L18 L19 L145 A146L11-A15 PolarHBondContact O-N 3.49Å; H12-A15 WeakPolarHBondContact O-CB 3.33Å; H12-A15 PolarHBondContact O-N 3.4Å; H12-A15 VanDerWaalsContact O-N 3.11Å; I13-A15 PolarHBondContact O-N 3.41Å; A15-L18 PolarHBondContact O-N 3.11Å; A15-L19 VanDerWaalsContact O-CG 3.32Å; A15-L19 WeakPolarHBondContact O-CG 3.23Å; A15-L19 PolarHBondContact O-N 3.24Å; A15-L145 HydrophobicContact CB-CB 4.02Å; A15-A146 HydrophobicContact CB-CB 4.24Å
16L97.9Very high93.8Very high28 Ų2845.4 Ų45.415%0.14725%0.252CS..Hα-helixtrans-63.3-43.5180-17962.7000112.4H12 I13 S14 L19 F20 I74 F78 L81H12-L16 PolarHBondContact O-N 2.97Å; I13-L16 PolarHBondContact O-N 3.49Å; S14-L16 PolarHBondContact O-N 3.32Å; L16-L19 PolarHBondContact O-N 3.35Å; L16-F20 WeakPolarHBondContact O-CB 3.48Å; L16-F20 PolarHBondContact O-N 3.03Å; L16-I74 HydrophobicContact CD1-CG2 4.34Å; L16-F78 HydrophobicContact CD2-CD2 4.31Å; L16-L81 HydrophobicContact CD2-CD2 4.23Å
17V98Very high93.4Very high79 Ų7941.2 Ų41.248%0.47923%0.231SC..Hα-helixtrans-62.4-44.3175.6170.20000110.4I13 S14 L19 F20 V21I13-V17 HydrophobicContact CG2-CG2 4.22Å; I13-V17 VanDerWaalsContact O-CG2 3.32Å; I13-V17 WeakPolarHBondContact O-CG2 3.49Å; I13-V17 PolarHBondContact O-N 3.01Å; S14-V17 PolarHBondContact O-N 3.27Å; V17-L19 PolarHBondContact O-N 3.31Å; V17-F20 PolarHBondContact O-N 2.72Å; V17-V21 HydrophobicContact CG1-CG2 4.24Å; V17-V21 WeakPolarHBondContact O-CG2 3.44Å; V17-V21 PolarHBondContact O-N 2.94Å
18L97.1Very high93Very high36 Ų3639.4 Ų39.419%0.18821%0.212CC..Hα-helixtrans-63.2-41.4177.5-69.5177.2000112.3S14 A15 F20 S22 L138 V141 A142 L145S14-L18 WeakPolarHBondContact O-CB 3.43Å; S14-L18 VanDerWaalsContact O-CG 3.24Å; S14-L18 WeakPolarHBondContact O-CG 3.32Å; S14-L18 PolarHBondContact O-N 2.88Å; A15-L18 PolarHBondContact O-N 3.11Å; L18-F20 VanDerWaalsContact C-N 3.33Å; L18-F20 PolarHBondContact O-N 3.3Å; L18-S22 WeakPolarHBondContact O-CB 3.42Å; L18-S22 PolarHBondContact O-N 3.01Å; L18-L138 HydrophobicContact CD2-CD1 4.38Å; L18-L138 HydrophobicContact CD2-CD2 3.93Å; L18-L138 HydrophobicContact CD2-CG 4.49Å; L18-V141 HydrophobicContact CD1-CG1 3.93Å; L18-A142 HydrophobicContact CB-CB 3.85Å; L18-L145 HydrophobicContact CD1-CD1 3.55Å
19L97Very high92.6Very high0 Ų039.4 Ų39.40%021%0.213CC..Hα-helixtrans-60.3-43.4173.6-70.8175.4000111.6A15 L16 V17 T23 I74 V111 A142A15-L19 VanDerWaalsContact O-CG 3.32Å; A15-L19 WeakPolarHBondContact O-CG 3.23Å; A15-L19 PolarHBondContact O-N 3.24Å; L16-L19 PolarHBondContact O-N 3.35Å; V17-L19 PolarHBondContact O-N 3.31Å; L19-T23 WeakPolarHBondContact O-CB 3.33Å; L19-T23 PolarHBondContact O-N 3.4Å; L19-T23 PolarHBondContact O-OG1 3.03Å; L19-I74 HydrophobicContact CB-CG1 3.96Å; L19-V111 HydrophobicContact CD2-CB 3.64Å; L19-V111 HydrophobicContact CD2-CG1 4Å; L19-V111 HydrophobicContact CD2-CG2 3.56Å; L19-A142 HydrophobicContact CD2-CB 3.7Å; L19-A142 HydrophobicContact CG-CB 4Å
20F96.1Very high92.1Very high118 Ų11839.7 Ų39.752%0.51822%0.216SC..Hα-helixtrans-65.5-49.7179.1-168.5-94.7000111.9L16 V17 L18 S22 T23 T24 I74L16-F20 WeakPolarHBondContact O-CB 3.48Å; L16-F20 PolarHBondContact O-N 3.03Å; V17-F20 PolarHBondContact O-N 2.72Å; L18-F20 VanDerWaalsContact C-N 3.33Å; L18-F20 PolarHBondContact O-N 3.3Å; F20-S22 PolarHBondContact O-N 3.45Å; F20-T23 PolarHBondContact O-N 3.36Å; F20-T24 HydrophobicContact CD1-CG2 4.29Å; F20-T24 HydrophobicContact CD2-CG2 4.47Å; F20-T24 HydrophobicContact CE1-CG2 3.98Å; F20-T24 HydrophobicContact CE2-CG2 4.17Å; F20-T24 HydrophobicContact CZ-CG2 3.91Å; F20-T24 WeakPolarHBondContact O-CB 3.28Å; F20-T24 WeakPolarHBondContact O-CG2 3.45Å; F20-T24 PolarHBondContact O-N 3.49Å; F20-T24 PolarHBondContact O-OG1 2.87Å; F20-I74 HydrophobicContact CD2-CD1 4.37Å
21V95.9Very high91.2Very high43 Ų4335.6 Ų35.626%0.26120%0.197SC..Hα-helixtrans-62.6-44.6178.3173.50000110.7V17 T23 T24 V25 L138V17-V21 HydrophobicContact CG1-CG2 4.24Å; V17-V21 WeakPolarHBondContact O-CG2 3.44Å; V17-V21 PolarHBondContact O-N 2.94Å; V21-T23 VanDerWaalsContact C-N 3.3Å; V21-T23 PolarHBondContact O-N 2.9Å; V21-T24 PolarHBondContact O-N 2.88Å; V21-V25 HydrophobicContact CG1-CG2 3.87Å; V21-V25 WeakPolarHBondContact O-CB 3.34Å; V21-V25 WeakPolarHBondContact O-CG2 3.17Å; V21-V25 PolarHBondContact O-N 3.28Å; V21-L138 HydrophobicContact CB-CD1 4.32Å; V21-L138 HydrophobicContact CG1-CD1 3.61Å
22S94.8Very high90.1Very high0 Ų039.5 Ų39.50%022%0.224CC..Hα-helixtrans-60-42176.5-179.90000111.2L18 F20 W28 A135 A139L18-S22 WeakPolarHBondContact O-CB 3.42Å; L18-S22 PolarHBondContact O-N 3.01Å; F20-S22 PolarHBondContact O-N 3.45Å; S22-W28 PolarHBondContact O-NE1 2.86Å; S22-W28 WeakPolarHBondContact OG-CZ2 3.17Å; S22-A135 WeakPolarHBondContact CB-O 3.43Å; S22-A135 PolarHBondContact OG-O 3.42Å; S22-A139 WeakPolarHBondContact OG-CB 3.49Å; S22-A139 PolarHBondContact OG-N 3.46Å
23T93.4Very high88.9Confident7 Ų744 Ų444%0.04325%0.246CC..Hα-helixtrans-74.3-32.7-177.9-53.80000113.4L19 F20 V21 L38 W39 M70 I74L19-T23 WeakPolarHBondContact O-CB 3.33Å; L19-T23 PolarHBondContact O-N 3.4Å; L19-T23 PolarHBondContact O-OG1 3.03Å; F20-T23 PolarHBondContact O-N 3.36Å; V21-T23 VanDerWaalsContact C-N 3.3Å; V21-T23 PolarHBondContact O-N 2.9Å; T23-L38 HydrophobicContact CG2-CD1 4.48Å; T23-W39 HydrophobicContact CG2-CZ2 3.98Å; T23-W39 PolarHBondContact O-NE1 3.17Å; T23-M70 HydrophobicContact CG2-CB 3.9Å; T23-M70 WeakPolarHBondContact OG1-CE 3.28Å; T23-I74 HydrophobicContact CG2-CD1 4.05Å; T23-I74 WeakPolarHBondContact OG1-CD1 3.32Å
24T88.9Confident87.9Confident65 Ų6540.6 Ų40.640%0.39923%0.23SC..Hα-helixtrans-99.4-23.6-169.4550000114.5F20 V21F20-T24 HydrophobicContact CD1-CG2 4.29Å; F20-T24 HydrophobicContact CD2-CG2 4.47Å; F20-T24 HydrophobicContact CE1-CG2 3.98Å; F20-T24 HydrophobicContact CE2-CG2 4.17Å; F20-T24 HydrophobicContact CZ-CG2 3.91Å; F20-T24 WeakPolarHBondContact O-CB 3.28Å; F20-T24 WeakPolarHBondContact O-CG2 3.45Å; F20-T24 PolarHBondContact O-N 3.49Å; F20-T24 PolarHBondContact O-OG1 2.87Å; V21-T24 PolarHBondContact O-N 2.88Å
25V83.4Confident86.9Confident46 Ų4641.5 Ų41.528%0.27923%0.234SC..SBendtrans-94.3143.3-172.5-1710000112.9V21 V27 Y134V21-V25 HydrophobicContact CG1-CG2 3.87Å; V21-V25 WeakPolarHBondContact O-CB 3.34Å; V21-V25 WeakPolarHBondContact O-CG2 3.17Å; V21-V25 PolarHBondContact O-N 3.28Å; V25-V27 VanDerWaalsContact C-N 3.28Å; V25-V27 PolarHBondContact O-N 3.37Å; V25-Y134 WeakPolarHBondContact CG1-OH 3.26Å
26S68.2Low85.9Confident47 Ų4741.9 Ų41.933%0.32924%0.237SC..SBendtrans-81.841-159.3-52.10000117.2D37S26-D37 VanDerWaalsContact C-CB 3.5Å; S26-D37 WeakPolarHBondContact CA-OD2 2.9Å; S26-D37 WeakPolarHBondContact CB-OD2 3.25Å; S26-D37 PolarHBondContact OG-OD2 3.39Å
27V83.7Confident84.9Confident30 Ų3040.8 Ų40.818%0.18223%0.231CC..  trans-146.658.3-168.8-159.80000112.6V25 T30 G133 Y134 A135V25-V27 VanDerWaalsContact C-N 3.28Å; V25-V27 PolarHBondContact O-N 3.37Å; V27-T30 HydrophobicContact CG1-CG2 3.35Å; V27-G133 CarbonylContact O-C 3.37Å; V27-G133 VanDerWaalsContact O-C 3.23Å; V27-G133 WeakPolarHBondContact O-CA 3.4Å; V27-Y134 HydrophobicContact CB-CD1 3.88Å; V27-Y134 HydrophobicContact CB-CE1 3.67Å; V27-Y134 HydrophobicContact CG1-CD1 3.92Å; V27-Y134 HydrophobicContact CG1-CE1 4.11Å; V27-Y134 HydrophobicContact CG2-CD1 4.27Å; V27-Y134 HydrophobicContact CG2-CE1 3.61Å; V27-Y134 PolarHBondContact O-N 3.46Å; V27-A135 VanDerWaalsContact O-CB 3.28Å; V27-A135 WeakPolarHBondContact O-CB 3.41Å; V27-A135 PolarHBondContact O-N 3.33Å; V27-A135 VanDerWaalsContact O-N 3.07Å
28W85.8Confident84.1Confident1 Ų137 Ų370%0.00421%0.209CC..SBendtrans-84.9-37.2172.3-85.660.5000112.5S22 S36 L38 V66 M70 Y118 G133 A135 Y136 A139S22-W28 PolarHBondContact O-NE1 2.86Å; S22-W28 WeakPolarHBondContact OG-CZ2 3.17Å; W28-S36 PolarHBondContact N-O 3.42Å; W28-L38 HydrophobicContact CD2-CD1 4.33Å; W28-L38 HydrophobicContact CD2-CD2 3.89Å; W28-L38 HydrophobicContact CD2-CG 3.88Å; W28-L38 HydrophobicContact CE3-CD2 3.92Å; W28-L38 HydrophobicContact CE3-CG 4.42Å; W28-L38 HydrophobicContact CG-CD2 4.49Å; W28-L38 HydrophobicContact CG-CG 4.17Å; W28-L38 HydrophobicContact CH2-CD1 4.29Å; W28-L38 HydrophobicContact CH2-CD2 4.21Å; W28-L38 HydrophobicContact CZ2-CD1 3.63Å; W28-L38 HydrophobicContact CZ2-CD2 4.2Å; W28-L38 HydrophobicContact CZ2-CG 4.1Å; W28-L38 HydrophobicContact CZ3-CD2 4.07Å; W28-V66 HydrophobicContact CH2-CG1 4.4Å; W28-V66 HydrophobicContact CZ3-CG1 4.28Å; W28-M70 HydrophobicContact CH2-CE 4.11Å; W28-M70 HydrophobicContact CH2-CG 4.32Å; W28-M70 HydrophobicContact CH2-SD 3.83Å; W28-M70 HydrophobicContact CZ2-CE 3.71Å; W28-M70 HydrophobicContact CZ2-CG 4.39Å; W28-M70 HydrophobicContact CZ2-SD 4.03Å; W28-Y118 HydrophobicContact CB-CE1 4.34Å; W28-Y118 HydrophobicContact CB-CE2 4.28Å; W28-Y118 WeakPolarHBondContact CB-OH 3.18Å; W28-Y118 HydrophobicContact CD2-CE2 4.44Å; W28-Y118 AromaticContact CE3-CD1 3.78Å; W28-Y118 HydrophobicContact CE3-CD1 3.78Å; W28-Y118 AromaticContact CE3-CD2 3.55Å; W28-Y118 HydrophobicContact CE3-CD2 3.55Å; W28-Y118 AromaticContact CE3-CE1 3.92Å; W28-Y118 HydrophobicContact CE3-CE1 3.92Å; W28-Y118 AromaticContact CE3-CE2 3.71Å; W28-Y118 HydrophobicContact CE3-CE2 3.71Å; W28-Y118 AromaticContact CE3-CG 3.59Å; W28-Y118 HydrophobicContact CE3-CG 3.59Å; W28-Y118 AromaticContact CE3-CZ 3.89Å; W28-Y118 HydrophobicContact CZ3-CD1 4.2Å; W28-Y118 AromaticContact CZ3-CD2 3.89Å; W28-Y118 HydrophobicContact CZ3-CD2 3.89Å; W28-Y118 HydrophobicContact CZ3-CE2 4.49Å; W28-Y118 AromaticContact CZ3-CG 3.73Å; W28-Y118 HydrophobicContact CZ3-CG 3.73Å; W28-G133 PolarHBondContact O-N 3.37Å; W28-A135 HydrophobicContact CG-CB 4.36Å; W28-Y136 HydrophobicContact CE3-CD2 4.01Å; W28-Y136 HydrophobicContact CZ3-CD2 4.07Å; W28-A139 HydrophobicContact CH2-CB 4.05Å; W28-A139 HydrophobicContact CZ2-CB 4.19Å
29T85.1Confident83.6Confident7 Ų739.5 Ų39.54%0.04322%0.215CC..EExtended strand (participates in β ladder)trans-133.6139.6172-68.20000109.4W31 S36 Y118 V126 N130T29-W31 HydrophobicContact CG2-CE3 4.16Å; T29-W31 HydrophobicContact CG2-CZ3 4.33Å; T29-S36 PolarHBondContact N-O 3.48Å; T29-S36 PolarHBondContact O-N 2.96Å; T29-Y118 WeakPolarHBondContact CB-OH 3.24Å; T29-Y118 PolarHBondContact OG1-OH 3.43Å; T29-V126 HydrophobicContact CG2-CG2 3.96Å; T29-N130 HydrophobicContact CG2-CB 4.24Å
30T82.4Confident82.9Confident40 Ų4042.8 Ų42.825%0.24523%0.233CC..EExtended strand (participates in β ladder)trans-125.4144.1178.757.90000110.2V27 T35 N130 S131V27-T30 HydrophobicContact CG1-CG2 3.35Å; T30-T35 HydrophobicContact CG2-CG2 4.12Å; T30-N130 WeakPolarHBondContact O-CA 3.28Å; T30-S131 PolarHBondContact N-O 3.48Å; T30-S131 PolarHBondContact O-N 3.08Å; T30-S131 PolarHBondContact OG1-O 3.41Å
31W79.1Confident82.1Confident57 Ų5739.2 Ų39.222%0.21622%0.219CC..EExtended strand (participates in β ladder)trans-138.9167.8171.560.196.3000110T29 M33 G34 S36 N41 N130T29-W31 HydrophobicContact CG2-CE3 4.16Å; T29-W31 HydrophobicContact CG2-CZ3 4.33Å; W31-M33 VanDerWaalsContact CD1-C 3.49Å; W31-M33 VanDerWaalsContact NE1-C 3.3Å; W31-M33 PolarHBondContact NE1-O 2.93Å; W31-M33 PolarHBondContact O-N 3.35Å; W31-G34 VanDerWaalsContact CE2-C 3.44Å; W31-G34 VanDerWaalsContact CE2-CA 3.47Å; W31-G34 PolarHBondContact N-O 3.06Å; W31-G34 PolarHBondContact O-N 3.47Å; W31-S36 VanDerWaalsContact CH2-N 3.32Å; W31-S36 VanDerWaalsContact CZ3-CB 3.48Å; W31-N41 WeakPolarHBondContact CH2-OD1 3.44Å; W31-N41 VanDerWaalsContact CZ2-OD1 3.3Å; W31-N41 WeakPolarHBondContact CZ2-OD1 3.39Å; W31-N130 HydrophobicContact CB-CB 4.3Å; W31-N130 VanDerWaalsContact CB-CG 3.5Å; W31-N130 WeakPolarHBondContact CB-OD1 3.42Å
32P73.8Confident81.3Confident117 Ų11738.4 Ų38.476%0.7622%0.215SC*.THydrogen-bonded Turntrans-55.7-24-174.3-2936.7000114.8
33M73.8Confident80.4Confident93 Ų9340.3 Ų40.346%0.45823%0.228SC..THydrogen-bonded Turntrans-122.725.9-174.2-49.4-135.9-57.100112.8W31 S43 T44 D45W31-M33 VanDerWaalsContact CD1-C 3.49Å; W31-M33 VanDerWaalsContact NE1-C 3.3Å; W31-M33 PolarHBondContact NE1-O 2.93Å; W31-M33 PolarHBondContact O-N 3.35Å; M33-S43 PolarHBondContact O-OG 3.33Å; M33-T44 VanDerWaalsContact CA-OG1 3.22Å; M33-T44 WeakPolarHBondContact CA-OG1 3.4Å; M33-T44 PolarHBondContact O-N 2.93Å; M33-T44 PolarHBondContact O-OG1 2.88Å; M33-D45 WeakPolarHBondContact CE-OD2 3.48Å
34G75.4Confident79.3Confident5 Ų544.5 Ų44.55%0.05225%0.254CS..EExtended strand (participates in β ladder)trans162.7178.8177.800000116W31 C42W31-G34 VanDerWaalsContact CE2-C 3.44Å; W31-G34 VanDerWaalsContact CE2-CA 3.47Å; W31-G34 PolarHBondContact N-O 3.06Å; W31-G34 PolarHBondContact O-N 3.47Å; G34-C42 CarbonylContact C-O 3.59Å; G34-C42 WeakPolarHBondContact CA-O 3.24Å
35T78.3Confident78.3Confident52 Ų5246.9 Ų46.932%0.31926%0.264SS..EExtended strand (participates in β ladder)trans-138.4137.7-179.857.60000109.6T30 C42T30-T35 HydrophobicContact CG2-CG2 4.12Å; T35-C42 PolarHBondContact N-O 3.31Å; T35-C42 PolarHBondContact O-N 3.45Å
36S76.8Confident77.2Confident8 Ų847.7 Ų47.76%0.05627%0.272CS..EExtended strand (participates in β ladder)trans-117.6142.8171-1680000109.7W28 T29 W31 L40W28-S36 PolarHBondContact N-O 3.42Å; T29-S36 PolarHBondContact N-O 3.48Å; T29-S36 PolarHBondContact O-N 2.96Å; W31-S36 VanDerWaalsContact CH2-N 3.32Å; W31-S36 VanDerWaalsContact CZ3-CB 3.48Å; S36-L40 PolarHBondContact OG-O 3.32Å
37D76.5Confident77.1Confident5 Ų553.3 Ų53.33%0.02730%0.296CS..  trans-117-167.716874.232.1000111S26 W39 L40S26-D37 VanDerWaalsContact C-CB 3.5Å; S26-D37 WeakPolarHBondContact CA-OD2 2.9Å; S26-D37 WeakPolarHBondContact CB-OD2 3.25Å; S26-D37 PolarHBondContact OG-OD2 3.39Å; D37-W39 VanDerWaalsContact C-N 3.26Å; D37-W39 PolarHBondContact O-N 2.9Å; D37-W39 VanDerWaalsContact OD1-CA 3.27Å; D37-W39 WeakPolarHBondContact OD1-CA 3.31Å; D37-W39 WeakPolarHBondContact OD1-CB 3.02Å; D37-W39 PolarHBondContact OD1-N 3.33Å; D37-L40 PolarHBondContact N-O 2.81Å; D37-L40 PolarHBondContact OD1-N 2.64Å
38L81.6Confident76.4Confident1 Ų155.5 Ų55.51%0.00531%0.31CS..SBendtrans-68.4-25.3178.6-69.1170.6000113T23 W28 I63 V66 Q67 M70 Y118T23-L38 HydrophobicContact CG2-CD1 4.48Å; W28-L38 HydrophobicContact CD2-CD1 4.33Å; W28-L38 HydrophobicContact CD2-CD2 3.89Å; W28-L38 HydrophobicContact CD2-CG 3.88Å; W28-L38 HydrophobicContact CE3-CD2 3.92Å; W28-L38 HydrophobicContact CE3-CG 4.42Å; W28-L38 HydrophobicContact CG-CD2 4.49Å; W28-L38 HydrophobicContact CG-CG 4.17Å; W28-L38 HydrophobicContact CH2-CD1 4.29Å; W28-L38 HydrophobicContact CH2-CD2 4.21Å; W28-L38 HydrophobicContact CZ2-CD1 3.63Å; W28-L38 HydrophobicContact CZ2-CD2 4.2Å; W28-L38 HydrophobicContact CZ2-CG 4.1Å; W28-L38 HydrophobicContact CZ3-CD2 4.07Å; L38-I63 HydrophobicContact CD2-CD1 3.92Å; L38-V66 HydrophobicContact CD2-CB 4.3Å; L38-V66 HydrophobicContact CD2-CG1 3.46Å; L38-V66 VanDerWaalsContact CD2-CG1 3.46Å; L38-Q67 HydrophobicContact CB-CG 4.32Å; L38-Q67 PolarHBondContact O-NE2 2.9Å; L38-M70 HydrophobicContact CD1-CB 4.36Å; L38-M70 HydrophobicContact CD1-CG 3.87Å; L38-Y118 HydrophobicContact CD2-CD2 4.32Å; L38-Y118 HydrophobicContact CD2-CE2 4.41Å
39W85.5Confident75.9Confident87 Ų8758.6 Ų58.633%0.3333%0.331SS..SBendtrans-112.2-36.3-167.9-49.1106000113.7T23 D37 G51 A52 Q67 I71T23-W39 HydrophobicContact CG2-CZ2 3.98Å; T23-W39 PolarHBondContact O-NE1 3.17Å; D37-W39 VanDerWaalsContact C-N 3.26Å; D37-W39 PolarHBondContact O-N 2.9Å; D37-W39 VanDerWaalsContact OD1-CA 3.27Å; D37-W39 WeakPolarHBondContact OD1-CA 3.31Å; D37-W39 WeakPolarHBondContact OD1-CB 3.02Å; D37-W39 PolarHBondContact OD1-N 3.33Å; W39-G51 CarbonylContact O-C 3.57Å; W39-G51 WeakPolarHBondContact O-CA 3.37Å; W39-A52 PolarHBondContact O-N 2.9Å; W39-Q67 HydrophobicContact CE3-CG 3.96Å; W39-Q67 HydrophobicContact CH2-CB 3.72Å; W39-Q67 HydrophobicContact CH2-CG 3.76Å; W39-Q67 HydrophobicContact CZ2-CG 4.37Å; W39-Q67 HydrophobicContact CZ3-CB 3.84Å; W39-Q67 HydrophobicContact CZ3-CG 3.55Å; W39-I71 HydrophobicContact CH2-CD1 3.75Å; W39-I71 HydrophobicContact CH2-CG1 4.23Å
40L82.4Confident75.5Confident70 Ų7062.7 Ų62.737%0.36635%0.353SS..EExtended strand (participates in β ladder)trans-134.7144.3-167.8-63.8173.7000110.4S36 D37 D50S36-L40 PolarHBondContact OG-O 3.32Å; D37-L40 PolarHBondContact N-O 2.81Å; D37-L40 PolarHBondContact OD1-N 2.64Å; L40-D50 CarbonylContact C-O 3.6Å; L40-D50 WeakPolarHBondContact CA-O 3.4Å
41N79.1Confident75Confident43 Ų4362.2 Ų62.223%0.2336%0.355CS..EExtended strand (participates in β ladder)trans-120.5114.1170.9-174.6-21000107.9W31 C49 D50W31-N41 WeakPolarHBondContact CH2-OD1 3.44Å; W31-N41 VanDerWaalsContact CZ2-OD1 3.3Å; W31-N41 WeakPolarHBondContact CZ2-OD1 3.39Å; N41-C49 CarbonylContact O-C 3.23Å; N41-C49 WeakPolarHBondContact O-CA 3.47Å; N41-D50 PolarHBondContact N-O 2.89Å; N41-D50 PolarHBondContact O-N 3.29Å
42C79.6Confident74.5Confident25 Ų2559.9 Ų59.917%0.16935%0.348CS..EExtended strand (participates in β ladder)trans-112125.2-176.8-62.20000110.2G34 T35 C49G34-C42 CarbonylContact C-O 3.59Å; G34-C42 WeakPolarHBondContact CA-O 3.24Å; T35-C42 PolarHBondContact N-O 3.31Å; T35-C42 PolarHBondContact O-N 3.45Å; C42-C49 HydrophobicContact CB-CB 4.14Å; C42-C49 WeakPolarHBondContact CB-SG 3.34Å; C42-C49 WeakPolarHBondContact SG-CB 2.94Å; C42-C49 CovalentContact SG-SG 2.04Å; C42-C49 PolarHBondContact SG-SG 2.66Å
43S76.8Confident73.9Confident40 Ų4056.1 Ų56.128%0.2833%0.325SS..EExtended strand (participates in β ladder)trans-102.1135.9171.3-176.70000110.3M33 D45M33-S43 PolarHBondContact O-OG 3.33Å; S43-D45 PolarHBondContact O-N 3.36Å
44T70Confident73Confident95 Ų9556.2 Ų56.258%0.58333%0.331SS*.THydrogen-bonded Turntrans-68.6-22.317842.80000112.8M33M33-T44 VanDerWaalsContact CA-OG1 3.22Å; M33-T44 WeakPolarHBondContact CA-OG1 3.4Å; M33-T44 PolarHBondContact O-N 2.93Å; M33-T44 PolarHBondContact O-OG1 2.88Å
45D66.4Low71.9Confident116 Ų11657.6 Ų57.662%0.6234%0.344SS*.THydrogen-bonded Turntrans-79.9-26.4-178.3-77.6-2.7000113.5M33 S43M33-D45 WeakPolarHBondContact CE-OD2 3.48Å; S43-D45 PolarHBondContact O-N 3.36Å
46S60.4Low70.5Confident62 Ų6262 Ų6243%0.43437%0.371SS..THydrogen-bonded Turntrans-104.8-12.1-173.157.40000114.6V48S46-V48 WeakPolarHBondContact O-CG2 3.37Å; S46-V48 PolarHBondContact O-N 3.13Å; S46-V48 PolarHBondContact OG-O 3Å
47I66.5Low69Low165 Ų16569.9 Ų69.985%0.84641%0.405SS*.SBendtrans53.210.7-170.3-53.5170.7000112.1
48V70.3Confident67.6Low77 Ų7776.3 Ų76.347%0.46744%0.439SS..  trans-114.1126.2-177.2174.30000107.4S46S46-V48 WeakPolarHBondContact O-CG2 3.37Å; S46-V48 PolarHBondContact O-N 3.13Å; S46-V48 PolarHBondContact OG-O 3Å
49C75.4Confident66.3Low65 Ų6580.3 Ų80.344%0.43947%0.465SS..EExtended strand (participates in β ladder)trans-101.7117.5171.4-64.10000108.4N41 C42N41-C49 CarbonylContact O-C 3.23Å; N41-C49 WeakPolarHBondContact O-CA 3.47Å; C42-C49 HydrophobicContact CB-CB 4.14Å; C42-C49 WeakPolarHBondContact CB-SG 3.34Å; C42-C49 WeakPolarHBondContact SG-CB 2.94Å; C42-C49 CovalentContact SG-SG 2.04Å; C42-C49 PolarHBondContact SG-SG 2.66Å
50D75.6Confident65.3Low94 Ų9476.8 Ų76.850%0.50345%0.453SS..EExtended strand (participates in β ladder)trans-94.2159.4175.4-68.2-46.1000110.3L40 N41L40-D50 CarbonylContact C-O 3.6Å; L40-D50 WeakPolarHBondContact CA-O 3.4Å; N41-D50 PolarHBondContact N-O 2.89Å; N41-D50 PolarHBondContact O-N 3.29Å
51G71.2Confident64.9Low29 Ų2981 Ų8130%0.29947%0.473SS..EExtended strand (participates in β ladder)trans-63.6138.5173.900000111W39 S53 T54W39-G51 CarbonylContact O-C 3.57Å; W39-G51 WeakPolarHBondContact O-CA 3.37Å; G51-S53 PolarHBondContact O-N 3.38Å; G51-T54 PolarHBondContact N-OG1 3.41Å; G51-T54 PolarHBondContact O-N 3.19Å; G51-T54 PolarHBondContact O-OG1 2.91Å
52A69.5Low65.2Low8 Ų881.4 Ų81.47%0.06647%0.472CS..THydrogen-bonded Turntrans-56.8-21.4176.200000112.6W39W39-A52 PolarHBondContact O-N 2.9Å
53S61.8Low65.5Low39 Ų3980.6 Ų80.627%0.27347%0.466SS..THydrogen-bonded Turntrans-83.6-8.7177.7-51.20000115.4G51G51-S53 PolarHBondContact O-N 3.38Å
54T53.9Low66.1Low95 Ų9583.3 Ų83.358%0.58347%0.474SS*.  trans-100.113.7-170.355.90000114.6G51G51-T54 PolarHBondContact N-OG1 3.41Å; G51-T54 PolarHBondContact O-N 3.19Å; G51-T54 PolarHBondContact O-OG1 2.91Å
55G53.3Low67.1Low33 Ų3380.7 Ų80.734%0.3446%0.461SS..  trans-62136.8175.800000113.4F57G55-F57 VanDerWaalsContact C-N 3.28Å; G55-F57 PolarHBondContact O-N 2.82Å
56V47Very low68.4Low144 Ų14475.1 Ų75.187%0.87343%0.432SS*.SBendtrans-69.3-18.2-173.2177.50000113.7
57F46.7Very low70Confident175 Ų17573.4 Ų73.477%0.76842%0.417SS*.SBendtrans-110.7103.9176.6-96.6-95.5000110.5G55G55-F57 VanDerWaalsContact C-N 3.28Å; G55-F57 PolarHBondContact O-N 2.82Å
58N45.8Very low71.3Confident139 Ų13967.9 Ų67.974%0.74340%0.396SS*.SBendtrans56.898.1174.8-65.9-57.4000115.5S60N58-S60 PolarHBondContact O-N 3.32Å
59P54.1Low72.6Confident86 Ų8665.6 Ų65.656%0.55838%0.381SS*.  trans-69.3109.2-17828.7-31.6000111.1M61P59-M61 VanDerWaalsContact C-N 3.29Å; P59-M61 PolarHBondContact O-N 2.98Å
60S65Low73.6Confident12 Ų1262.5 Ų62.58%0.08436%0.36CS..  64.36.1112.976.50000120.1N58 W62 I63 Q64N58-S60 PolarHBondContact O-N 3.32Å; S60-W62 VanDerWaalsContact C-N 3.27Å; S60-W62 PolarHBondContact O-N 3.39Å; S60-I63 VanDerWaalsContact O-CG2 3.24Å; S60-I63 WeakPolarHBondContact O-CG2 3.35Å; S60-I63 PolarHBondContact O-N 3.14Å; S60-Q64 WeakPolarHBondContact O-CG 3.43Å; S60-Q64 PolarHBondContact O-N 3.01Å
61M75.4Confident74.6Confident158 Ų15861.6 Ų61.678%0.77835%0.354SS*.Hα-helixtrans-62.7-37.7178-65.8-176.1-176.300111.9P59 A65P59-M61 VanDerWaalsContact C-N 3.29Å; P59-M61 PolarHBondContact O-N 2.98Å; M61-A65 PolarHBondContact O-N 2.87Å
62W85.1Confident75.9Confident53 Ų5363.3 Ų63.320%0.20136%0.356CS..Hα-helixtrans-69.3-4017869.9-96.4000111.8S60 Q64 A65 V66 I117 Y118 M121 W125S60-W62 VanDerWaalsContact C-N 3.27Å; S60-W62 PolarHBondContact O-N 3.39Å; W62-Q64 VanDerWaalsContact C-N 3.34Å; W62-Q64 PolarHBondContact O-N 3.43Å; W62-A65 WeakPolarHBondContact O-CB 3.25Å; W62-A65 PolarHBondContact O-N 3.46Å; W62-V66 HydrophobicContact CE3-CG2 4.23Å; W62-V66 WeakPolarHBondContact O-CG2 3.38Å; W62-V66 PolarHBondContact O-N 3.25Å; W62-I117 HydrophobicContact CB-CG2 4.3Å; W62-I117 HydrophobicContact CE3-CG2 4.47Å; W62-Y118 HydrophobicContact CH2-CD2 4.33Å; W62-Y118 HydrophobicContact CH2-CE2 4.3Å; W62-Y118 AromaticContact CZ3-CD2 3.79Å; W62-Y118 HydrophobicContact CZ3-CD2 3.79Å; W62-Y118 HydrophobicContact CZ3-CE2 4.19Å; W62-M121 HydrophobicContact CB-CG 4.03Å; W62-M121 HydrophobicContact CD2-CB 3.65Å; W62-M121 HydrophobicContact CD2-CG 4.08Å; W62-M121 HydrophobicContact CE3-CB 3.74Å; W62-M121 HydrophobicContact CE3-CG 4.25Å; W62-M121 HydrophobicContact CG-CB 4.04Å; W62-M121 HydrophobicContact CG-CG 3.99Å; W62-M121 HydrophobicContact CH2-CB 4.5Å; W62-M121 HydrophobicContact CZ2-CB 4.43Å; W62-M121 HydrophobicContact CZ3-CB 4.17Å; W62-W125 HydrophobicContact CZ2-CG 4.48Å
63I85.8Confident77.2Confident8 Ų862.9 Ų62.94%0.04135%0.353CS..Hα-helixtrans-68.7-36.2178.3-165.169.6000110.6L38 S60 A65 V66 Q67 Y118L38-I63 HydrophobicContact CD2-CD1 3.92Å; S60-I63 VanDerWaalsContact O-CG2 3.24Å; S60-I63 WeakPolarHBondContact O-CG2 3.35Å; S60-I63 PolarHBondContact O-N 3.14Å; I63-A65 VanDerWaalsContact C-N 3.32Å; I63-A65 PolarHBondContact O-N 3.29Å; I63-V66 PolarHBondContact O-N 2.88Å; I63-Q67 VanDerWaalsContact O-CG 3.26Å; I63-Q67 WeakPolarHBondContact O-CG 3.32Å; I63-Q67 PolarHBondContact O-N 3.48Å; I63-Y118 HydrophobicContact CD1-CD2 4.1Å; I63-Y118 HydrophobicContact CD1-CE2 3.96Å
64Q88.9Confident79Confident97 Ų9762.7 Ų62.745%0.45335%0.348SS..Hα-helixtrans-62.5-39171.3-72.2176.511.700112.2S60 W62 Q67 A68S60-Q64 WeakPolarHBondContact O-CG 3.43Å; S60-Q64 PolarHBondContact O-N 3.01Å; W62-Q64 VanDerWaalsContact C-N 3.34Å; W62-Q64 PolarHBondContact O-N 3.43Å; Q64-Q67 PolarHBondContact O-N 3.11Å; Q64-A68 WeakPolarHBondContact O-CB 3.47Å; Q64-A68 PolarHBondContact O-N 3.32Å
65A91.4Very high81.1Confident39 Ų3962 Ų6232%0.32234%0.34SS..Hα-helixtrans-62.4-43.9172.900000111.4M61 W62 I63 A68 L69M61-A65 PolarHBondContact O-N 2.87Å; W62-A65 WeakPolarHBondContact O-CB 3.25Å; W62-A65 PolarHBondContact O-N 3.46Å; I63-A65 VanDerWaalsContact C-N 3.32Å; I63-A65 PolarHBondContact O-N 3.29Å; A65-A68 PolarHBondContact O-N 3.23Å; A65-L69 WeakPolarHBondContact O-CB 3.42Å; A65-L69 WeakPolarHBondContact O-CD1 3.34Å; A65-L69 WeakPolarHBondContact O-CG 3.49Å; A65-L69 PolarHBondContact O-N 3.45Å
66V93.2Very high83.2Confident0 Ų062.4 Ų62.40%033%0.333CS..Hα-helixtrans-61.3-47.5175.2-179.90000110.8W28 L38 W62 I63 A68 L69 M70 I117W28-V66 HydrophobicContact CH2-CG1 4.4Å; W28-V66 HydrophobicContact CZ3-CG1 4.28Å; L38-V66 HydrophobicContact CD2-CB 4.3Å; L38-V66 HydrophobicContact CD2-CG1 3.46Å; L38-V66 VanDerWaalsContact CD2-CG1 3.46Å; W62-V66 HydrophobicContact CE3-CG2 4.23Å; W62-V66 WeakPolarHBondContact O-CG2 3.38Å; W62-V66 PolarHBondContact O-N 3.25Å; I63-V66 PolarHBondContact O-N 2.88Å; V66-A68 PolarHBondContact O-N 2.91Å; V66-L69 PolarHBondContact O-N 3.3Å; V66-M70 HydrophobicContact CG1-CG 4.19Å; V66-M70 VanDerWaalsContact O-CG 3.26Å; V66-M70 WeakPolarHBondContact O-CG 3.43Å; V66-M70 PolarHBondContact O-N 3.14Å; V66-I117 HydrophobicContact CG2-CB 3.94Å; V66-I117 HydrophobicContact CG2-CG2 3.66Å
67Q93.4Very high85.7Confident26 Ų2655.5 Ų55.512%0.12129%0.291CS..Hα-helixtrans-55.1-48.9176.6-72.8168.2-1200111.7L38 W39 I63 Q64 L69 M70 I71L38-Q67 HydrophobicContact CB-CG 4.32Å; L38-Q67 PolarHBondContact O-NE2 2.9Å; W39-Q67 HydrophobicContact CE3-CG 3.96Å; W39-Q67 HydrophobicContact CH2-CB 3.72Å; W39-Q67 HydrophobicContact CH2-CG 3.76Å; W39-Q67 HydrophobicContact CZ2-CG 4.37Å; W39-Q67 HydrophobicContact CZ3-CB 3.84Å; W39-Q67 HydrophobicContact CZ3-CG 3.55Å; I63-Q67 VanDerWaalsContact O-CG 3.26Å; I63-Q67 WeakPolarHBondContact O-CG 3.32Å; I63-Q67 PolarHBondContact O-N 3.48Å; Q64-Q67 PolarHBondContact O-N 3.11Å; Q67-L69 PolarHBondContact O-N 3.01Å; Q67-M70 PolarHBondContact O-N 3.08Å; Q67-I71 WeakPolarHBondContact O-CG1 3.49Å; Q67-I71 PolarHBondContact O-N 3.48Å
68A94.8Very high88.1Confident48 Ų4852.3 Ų52.340%0.39728%0.277SS..Hα-helixtrans-61.9-43.5178.600000111.8Q64 A65 V66 I71 L72Q64-A68 WeakPolarHBondContact O-CB 3.47Å; Q64-A68 PolarHBondContact O-N 3.32Å; A65-A68 PolarHBondContact O-N 3.23Å; V66-A68 PolarHBondContact O-N 2.91Å; A68-I71 PolarHBondContact O-N 3.21Å; A68-L72 WeakPolarHBondContact O-CB 3.32Å; A68-L72 VanDerWaalsContact O-CG 3.26Å; A68-L72 WeakPolarHBondContact O-CG 3.47Å; A68-L72 PolarHBondContact O-N 3.32Å
69L96.9Very high90.6Very high29 Ų2949 Ų4915%0.15226%0.259CS..Hα-helixtrans-63.6-41.3177.2-71.6167.7000112A65 V66 Q67 L72 S73 F110 I117A65-L69 WeakPolarHBondContact O-CB 3.42Å; A65-L69 WeakPolarHBondContact O-CD1 3.34Å; A65-L69 WeakPolarHBondContact O-CG 3.49Å; A65-L69 PolarHBondContact O-N 3.45Å; V66-L69 PolarHBondContact O-N 3.3Å; Q67-L69 PolarHBondContact O-N 3.01Å; L69-L72 PolarHBondContact O-N 3.37Å; L69-S73 WeakPolarHBondContact O-CB 3.16Å; L69-S73 PolarHBondContact O-N 3.12Å; L69-F110 HydrophobicContact CD2-CB 4.33Å; L69-F110 HydrophobicContact CD2-CD1 3.62Å; L69-F110 HydrophobicContact CD2-CE1 4.39Å; L69-F110 HydrophobicContact CD2-CG 4.35Å; L69-F110 WeakPolarHBondContact O-CB 3.44Å; L69-I117 HydrophobicContact CD1-CD1 3.64Å
70M96.6Very high92.7Very high0 Ų044.9 Ų44.90%023%0.232CC..Hα-helixtrans-65.1-44.7176.8-67-60-63.600111.5T23 W28 L38 V66 Q67 L72 S73 I74 V111 A139T23-M70 HydrophobicContact CG2-CB 3.9Å; T23-M70 WeakPolarHBondContact OG1-CE 3.28Å; W28-M70 HydrophobicContact CH2-CE 4.11Å; W28-M70 HydrophobicContact CH2-CG 4.32Å; W28-M70 HydrophobicContact CH2-SD 3.83Å; W28-M70 HydrophobicContact CZ2-CE 3.71Å; W28-M70 HydrophobicContact CZ2-CG 4.39Å; W28-M70 HydrophobicContact CZ2-SD 4.03Å; L38-M70 HydrophobicContact CD1-CB 4.36Å; L38-M70 HydrophobicContact CD1-CG 3.87Å; V66-M70 HydrophobicContact CG1-CG 4.19Å; V66-M70 VanDerWaalsContact O-CG 3.26Å; V66-M70 WeakPolarHBondContact O-CG 3.43Å; V66-M70 PolarHBondContact O-N 3.14Å; Q67-M70 PolarHBondContact O-N 3.08Å; M70-L72 PolarHBondContact O-N 3.25Å; M70-S73 PolarHBondContact O-N 2.97Å; M70-S73 PolarHBondContact O-OG 2.85Å; M70-I74 PolarHBondContact O-N 3.22Å; M70-V111 HydrophobicContact CE-CG2 4.38Å; M70-V111 HydrophobicContact SD-CG2 4.13Å; M70-A139 HydrophobicContact CE-CB 4.43Å
71I97.1Very high94.2Very high75 Ų7545.2 Ų45.239%0.38523%0.233SC..Hα-helixtrans-60.1-48.2174.4-69.5167.2000111W39 Q67 A68 S73 I74 I75W39-I71 HydrophobicContact CH2-CD1 3.75Å; W39-I71 HydrophobicContact CH2-CG1 4.23Å; Q67-I71 WeakPolarHBondContact O-CG1 3.49Å; Q67-I71 PolarHBondContact O-N 3.48Å; A68-I71 PolarHBondContact O-N 3.21Å; I71-S73 VanDerWaalsContact C-N 3.27Å; I71-S73 PolarHBondContact O-N 2.98Å; I71-I74 PolarHBondContact O-N 3.32Å; I71-I75 HydrophobicContact CG2-CD1 3.64Å; I71-I75 HydrophobicContact CG2-CG1 4.29Å; I71-I75 WeakPolarHBondContact O-CG1 3.24Å; I71-I75 PolarHBondContact O-N 3.44Å
72L97.9Very high95.2Very high65 Ų6541.5 Ų41.534%0.3422%0.216SC..Hα-helixtrans-60.2-38.4178.4-74.6170.8000111.5A68 L69 M70 I74 I75 F76 F110A68-L72 WeakPolarHBondContact O-CB 3.32Å; A68-L72 VanDerWaalsContact O-CG 3.26Å; A68-L72 WeakPolarHBondContact O-CG 3.47Å; A68-L72 PolarHBondContact O-N 3.32Å; L69-L72 PolarHBondContact O-N 3.37Å; M70-L72 PolarHBondContact O-N 3.25Å; L72-I74 VanDerWaalsContact C-N 3.35Å; L72-I74 PolarHBondContact O-N 3.32Å; L72-I75 PolarHBondContact O-N 3.46Å; L72-F76 HydrophobicContact CD2-CE2 4.05Å; L72-F76 WeakPolarHBondContact O-CB 3.22Å; L72-F76 WeakPolarHBondContact O-CD2 3.3Å; L72-F76 PolarHBondContact O-N 3.03Å; L72-F110 HydrophobicContact CB-CD2 3.76Å; L72-F110 HydrophobicContact CB-CE2 3.99Å; L72-F110 HydrophobicContact CB-CG 4.13Å; L72-F110 HydrophobicContact CD1-CE1 4.46Å; L72-F110 HydrophobicContact CD1-CZ 4.42Å
73S98.1Very high95.7Very high0 Ų041.6 Ų41.60%022%0.22CC..Hα-helixtrans-60.1-43.1176.7800000112.4L69 M70 I71 S77 A107L69-S73 WeakPolarHBondContact O-CB 3.16Å; L69-S73 PolarHBondContact O-N 3.12Å; M70-S73 PolarHBondContact O-N 2.97Å; M70-S73 PolarHBondContact O-OG 2.85Å; I71-S73 VanDerWaalsContact C-N 3.27Å; I71-S73 PolarHBondContact O-N 2.98Å; S73-S77 WeakPolarHBondContact O-CB 3.29Å; S73-S77 PolarHBondContact O-N 3.32Å; S73-A107 WeakPolarHBondContact CB-O 3.36Å; S73-A107 WeakPolarHBondContact O-CB 3.31Å
74I98.3Very high96.1Very high34 Ų3441.2 Ų41.217%0.17422%0.218CC..Hα-helixtrans-66.7-47.8177.3-66.3170.1000110.5L16 L19 F20 T23 M70 I71 L72 F76 S77 F78L16-I74 HydrophobicContact CD1-CG2 4.34Å; L19-I74 HydrophobicContact CB-CG1 3.96Å; F20-I74 HydrophobicContact CD2-CD1 4.37Å; T23-I74 HydrophobicContact CG2-CD1 4.05Å; T23-I74 WeakPolarHBondContact OG1-CD1 3.32Å; M70-I74 PolarHBondContact O-N 3.22Å; I71-I74 PolarHBondContact O-N 3.32Å; L72-I74 VanDerWaalsContact C-N 3.35Å; L72-I74 PolarHBondContact O-N 3.32Å; I74-F76 VanDerWaalsContact C-N 3.34Å; I74-F76 PolarHBondContact O-N 2.89Å; I74-S77 PolarHBondContact O-N 3.16Å; I74-F78 WeakPolarHBondContact O-CB 3.19Å; I74-F78 PolarHBondContact O-N 2.63Å
75I98.3Very high96.3Very high80 Ų8040.8 Ų40.841%0.4122%0.215SC..Hα-helixtrans-58.8-47.8-179.1-68.9172.1000110.4I71 L72 F78 L79I71-I75 HydrophobicContact CG2-CD1 3.64Å; I71-I75 HydrophobicContact CG2-CG1 4.29Å; I71-I75 WeakPolarHBondContact O-CG1 3.24Å; I71-I75 PolarHBondContact O-N 3.44Å; L72-I75 PolarHBondContact O-N 3.46Å; I75-F78 PolarHBondContact O-N 3.03Å; I75-L79 HydrophobicContact CG2-CD1 3.87Å; I75-L79 HydrophobicContact CG2-CG 4.46Å; I75-L79 WeakPolarHBondContact O-CB 3.39Å; I75-L79 VanDerWaalsContact O-CG 3.32Å; I75-L79 WeakPolarHBondContact O-CG 3.46Å; I75-L79 PolarHBondContact O-N 3.3Å
76F98.3Very high96.3Very high42 Ų4242.3 Ų42.318%0.18422%0.222CC..Hα-helixtrans-68.6-38.1-178.5-84.3-115.2000112L72 I74 L79 S80 F103 L106 A107 F110L72-F76 HydrophobicContact CD2-CE2 4.05Å; L72-F76 WeakPolarHBondContact O-CB 3.22Å; L72-F76 WeakPolarHBondContact O-CD2 3.3Å; L72-F76 PolarHBondContact O-N 3.03Å; I74-F76 VanDerWaalsContact C-N 3.34Å; I74-F76 PolarHBondContact O-N 2.89Å; F76-L79 PolarHBondContact O-N 3.38Å; F76-S80 WeakPolarHBondContact O-CB 3.41Å; F76-S80 PolarHBondContact O-N 3.08Å; F76-F103 HydrophobicContact CB-CD1 4.5Å; F76-F103 AromaticContact CD1-CD1 3.48Å; F76-F103 HydrophobicContact CD1-CD1 3.48Å; F76-F103 VanDerWaalsContact CD1-CD1 3.48Å; F76-F103 HydrophobicContact CD1-CE1 4.01Å; F76-F103 HydrophobicContact CD1-CG 4.4Å; F76-F103 AromaticContact CE1-CD1 3.87Å; F76-F103 HydrophobicContact CE1-CD1 3.87Å; F76-F103 AromaticContact CE1-CE1 3.92Å; F76-F103 HydrophobicContact CE1-CE1 3.92Å; F76-F103 HydrophobicContact CG-CD1 4.13Å; F76-L106 HydrophobicContact CD1-CB 3.71Å; F76-L106 HydrophobicContact CD1-CD1 3.98Å; F76-L106 HydrophobicContact CE1-CB 4.15Å; F76-L106 HydrophobicContact CE1-CD1 3.69Å; F76-A107 HydrophobicContact CB-CB 3.92Å; F76-F110 HydrophobicContact CD1-CE2 4.1Å; F76-F110 HydrophobicContact CD2-CD2 4.47Å; F76-F110 AromaticContact CD2-CE2 3.93Å; F76-F110 HydrophobicContact CD2-CE2 3.93Å; F76-F110 HydrophobicContact CE1-CE2 4.15Å; F76-F110 AromaticContact CE2-CE2 3.96Å; F76-F110 HydrophobicContact CE2-CE2 3.96Å; F76-F110 HydrophobicContact CG-CD2 4.44Å; F76-F110 AromaticContact CG-CE2 4Å; F76-F110 HydrophobicContact CG-CE2 4Å; F76-F110 HydrophobicContact CZ-CE2 4.07Å
77S98.2Very high96.3Very high0 Ų043.2 Ų43.20%023%0.226CC..Hα-helixtrans-66.1-42.9174.7-174.50000111.3H12 S73 I74 L79 S80 L81 Q104H12-S77 PolarHBondContact NE2-O 3.45Å; H12-S77 PolarHBondContact NE2-OG 2.91Å; H12-S77 VanDerWaalsContact NE2-OG 3.14Å; S73-S77 WeakPolarHBondContact O-CB 3.29Å; S73-S77 PolarHBondContact O-N 3.32Å; I74-S77 PolarHBondContact O-N 3.16Å; S77-L79 PolarHBondContact O-N 3.18Å; S77-S80 WeakPolarHBondContact O-CB 3.46Å; S77-S80 PolarHBondContact O-N 3.33Å; S77-L81 PolarHBondContact O-N 3.34Å; S77-Q104 PolarHBondContact OG-NE2 3.32Å; S77-Q104 PolarHBondContact OG-OE1 3.18Å; S77-Q104 VanDerWaalsContact OG-OE1 3.12Å
78F98.2Very high96.1Very high108 Ų10844 Ų4447%0.47423%0.231SC..Hα-helixtrans-62.9-43.9176.2-172.8-102.5000112.4L16 I74 I75 S80 L81 L82L16-F78 HydrophobicContact CD2-CD2 4.31Å; I74-F78 WeakPolarHBondContact O-CB 3.19Å; I74-F78 PolarHBondContact O-N 2.63Å; I75-F78 PolarHBondContact O-N 3.03Å; F78-S80 VanDerWaalsContact C-N 3.32Å; F78-S80 PolarHBondContact O-N 3.04Å; F78-L81 WeakPolarHBondContact O-CB 3.43Å; F78-L81 PolarHBondContact O-N 3.39Å; F78-L82 HydrophobicContact CD1-CD1 4Å; F78-L82 HydrophobicContact CD1-CG 4.36Å; F78-L82 HydrophobicContact CE1-CD1 3.61Å; F78-L82 HydrophobicContact CE1-CD2 4.45Å; F78-L82 HydrophobicContact CE1-CG 4.06Å; F78-L82 HydrophobicContact CZ-CD1 4.34Å; F78-L82 HydrophobicContact CZ-CD2 4.39Å; F78-L82 HydrophobicContact CZ-CG 4.42Å; F78-L82 PolarHBondContact O-N 3.26Å
79L98Very high95.7Very high68 Ų6849.9 Ų49.936%0.35625%0.248SC..Hα-helixtrans-60.5-41.5173.7-75.9169.5000111.8I75 F76 S77 L81 L82 L83 F103I75-L79 HydrophobicContact CG2-CD1 3.87Å; I75-L79 HydrophobicContact CG2-CG 4.46Å; I75-L79 WeakPolarHBondContact O-CB 3.39Å; I75-L79 VanDerWaalsContact O-CG 3.32Å; I75-L79 WeakPolarHBondContact O-CG 3.46Å; I75-L79 PolarHBondContact O-N 3.3Å; F76-L79 PolarHBondContact O-N 3.38Å; S77-L79 PolarHBondContact O-N 3.18Å; L79-L81 VanDerWaalsContact C-N 3.31Å; L79-L81 PolarHBondContact O-N 3.42Å; L79-L82 PolarHBondContact O-N 3.14Å; L79-L83 WeakPolarHBondContact O-CB 3.44Å; L79-L83 VanDerWaalsContact O-CG 3.29Å; L79-L83 WeakPolarHBondContact O-CG 3.45Å; L79-L83 PolarHBondContact O-N 3.42Å; L79-F103 HydrophobicContact CB-CD1 4.19Å; L79-F103 HydrophobicContact CD1-CD1 4.39Å; L79-F103 HydrophobicContact CD1-CE1 4.13Å
80S97.4Very high95.3Very high0 Ų053.8 Ų53.80%027%0.273CS..Hα-helixtrans-58.7-44174.3179.90000111.3H12 F76 S77 F78 L82 L83 F84 T100H12-S80 PolarHBondContact CE1-OG 2.77Å; F76-S80 WeakPolarHBondContact O-CB 3.41Å; F76-S80 PolarHBondContact O-N 3.08Å; S77-S80 WeakPolarHBondContact O-CB 3.46Å; S77-S80 PolarHBondContact O-N 3.33Å; F78-S80 VanDerWaalsContact C-N 3.32Å; F78-S80 PolarHBondContact O-N 3.04Å; S80-L82 PolarHBondContact O-N 3.36Å; S80-L83 PolarHBondContact O-N 2.67Å; S80-F84 WeakPolarHBondContact O-CB 3.5Å; S80-F84 PolarHBondContact O-N 3.49Å; S80-T100 WeakPolarHBondContact OG-CG2 3.47Å; S80-T100 PolarHBondContact OG-O 2.96Å
81L96.6Very high94.9Very high20 Ų2055.2 Ų55.211%0.10528%0.281CS..Hα-helixtrans-62.2-43.1177.7-173.362.3000112H12 L16 S77 F78 L79 F84 F85H12-L81 PolarHBondContact CE1-N 2.91Å; H12-L81 VanDerWaalsContact CE1-N 3.32Å; L16-L81 HydrophobicContact CD2-CD2 4.23Å; S77-L81 PolarHBondContact O-N 3.34Å; F78-L81 WeakPolarHBondContact O-CB 3.43Å; F78-L81 PolarHBondContact O-N 3.39Å; L79-L81 VanDerWaalsContact C-N 3.31Å; L79-L81 PolarHBondContact O-N 3.42Å; L81-F84 WeakPolarHBondContact O-CB 3.35Å; L81-F84 PolarHBondContact O-N 3.49Å; L81-F85 HydrophobicContact CD1-CD2 4.29Å; L81-F85 HydrophobicContact CD1-CE2 3.72Å; L81-F85 HydrophobicContact CD2-CE2 4.49Å; L81-F85 HydrophobicContact CG-CD2 4.19Å; L81-F85 HydrophobicContact CG-CE2 3.84Å; L81-F85 WeakPolarHBondContact O-CD2 3.48Å; L81-F85 PolarHBondContact O-N 2.93Å; L81-F85 VanDerWaalsContact O-N 3.16Å
82L96.4Very high94.4Very high80 Ų8056.1 Ų56.142%0.41929%0.292SS..Hα-helixtrans-62.7-47.7175.2-67.7-179.9000111.7F78 L79 S80 F84 F85 C86F78-L82 HydrophobicContact CD1-CD1 4Å; F78-L82 HydrophobicContact CD1-CG 4.36Å; F78-L82 HydrophobicContact CE1-CD1 3.61Å; F78-L82 HydrophobicContact CE1-CD2 4.45Å; F78-L82 HydrophobicContact CE1-CG 4.06Å; F78-L82 HydrophobicContact CZ-CD1 4.34Å; F78-L82 HydrophobicContact CZ-CD2 4.39Å; F78-L82 HydrophobicContact CZ-CG 4.42Å; F78-L82 PolarHBondContact O-N 3.26Å; L79-L82 PolarHBondContact O-N 3.14Å; S80-L82 PolarHBondContact O-N 3.36Å; L82-F84 PolarHBondContact O-N 2.9Å; L82-F85 PolarHBondContact O-N 2.96Å; L82-C86 PolarHBondContact O-N 2.9Å; L82-C86 PolarHBondContact O-SG 3.4Å; L82-C86 VanDerWaalsContact O-SG 3.33Å
83L95.4Very high93.7Very high54 Ų5459.9 Ų59.928%0.28331%0.305SS..Hα-helixtrans-58.8-37.9176.7-72.7175.3000111.6L79 S80 C86 Q87 P99 F103L79-L83 WeakPolarHBondContact O-CB 3.44Å; L79-L83 VanDerWaalsContact O-CG 3.29Å; L79-L83 WeakPolarHBondContact O-CG 3.45Å; L79-L83 PolarHBondContact O-N 3.42Å; S80-L83 PolarHBondContact O-N 2.67Å; L83-C86 PolarHBondContact O-N 3.12Å; L83-Q87 VanDerWaalsContact O-CB 3.3Å; L83-Q87 WeakPolarHBondContact O-CB 3.36Å; L83-Q87 VanDerWaalsContact O-CG 3.22Å; L83-Q87 WeakPolarHBondContact O-CG 3.37Å; L83-Q87 PolarHBondContact O-N 3.36Å; L83-P99 HydrophobicContact CD1-CB 4.39Å; L83-F103 HydrophobicContact CD1-CD2 3.45Å; L83-F103 VanDerWaalsContact CD1-CD2 3.45Å; L83-F103 HydrophobicContact CD1-CE2 3.71Å; L83-F103 HydrophobicContact CD1-CG 4.13Å
84F94.4Very high92.9Very high0 Ų061.1 Ų61.10%032%0.318CS..Hα-helixtrans-60.3-48.7176.3179.3-115.9000111.8L5 I9 S80 L81 L82 Q87 L88 F97 T100 Y153L5-F84 HydrophobicContact CD1-CE1 4.3Å; L5-F84 HydrophobicContact CD1-CE2 4.34Å; L5-F84 HydrophobicContact CD1-CZ 3.51Å; L5-F84 HydrophobicContact CG-CZ 4.42Å; I9-F84 HydrophobicContact CD1-CE1 3.93Å; I9-F84 HydrophobicContact CG1-CD1 4.34Å; I9-F84 HydrophobicContact CG1-CE1 3.5Å; I9-F84 HydrophobicContact CG1-CZ 4.28Å; S80-F84 WeakPolarHBondContact O-CB 3.5Å; S80-F84 PolarHBondContact O-N 3.49Å; L81-F84 WeakPolarHBondContact O-CB 3.35Å; L81-F84 PolarHBondContact O-N 3.49Å; L82-F84 PolarHBondContact O-N 2.9Å; F84-Q87 PolarHBondContact O-N 3.28Å; F84-L88 HydrophobicContact CD1-CD1 3.87Å; F84-L88 HydrophobicContact CE1-CD1 3.46Å; F84-L88 VanDerWaalsContact CE1-CD1 3.46Å; F84-L88 HydrophobicContact CE2-CD1 4.2Å; F84-L88 HydrophobicContact CG-CD1 4.42Å; F84-L88 HydrophobicContact CZ-CD1 3.69Å; F84-L88 HydrophobicContact CZ-CG 4.4Å; F84-L88 PolarHBondContact O-N 3.41Å; F84-F97 AromaticContact CD2-CD1 3.74Å; F84-F97 HydrophobicContact CD2-CD1 3.74Å; F84-F97 AromaticContact CD2-CE1 3.94Å; F84-F97 HydrophobicContact CD2-CE1 3.94Å; F84-F97 AromaticContact CE2-CD1 3.98Å; F84-F97 HydrophobicContact CE2-CD1 3.98Å; F84-F97 AromaticContact CE2-CE1 3.88Å; F84-F97 HydrophobicContact CE2-CE1 3.88Å; F84-T100 WeakPolarHBondContact CA-OG1 3.33Å; F84-T100 HydrophobicContact CB-CG2 3.65Å; F84-T100 HydrophobicContact CD2-CG2 4.17Å; F84-T100 HydrophobicContact CG-CG2 4.31Å; F84-T100 PolarHBondContact N-OG1 3.17Å; F84-Y153 HydrophobicContact CB-CE1 4.47Å; F84-Y153 HydrophobicContact CD1-CE1 4.34Å; F84-Y153 AromaticContact CD2-CD1 3.83Å; F84-Y153 HydrophobicContact CD2-CD1 3.83Å; F84-Y153 AromaticContact CD2-CE1 3.26Å; F84-Y153 HydrophobicContact CD2-CE1 3.26Å; F84-Y153 HydrophobicContact CE1-CE1 4.41Å; F84-Y153 AromaticContact CE2-CD1 3.97Å; F84-Y153 HydrophobicContact CE2-CD1 3.97Å; F84-Y153 AromaticContact CE2-CE1 3.37Å; F84-Y153 HydrophobicContact CE2-CE1 3.37Å; F84-Y153 AromaticContact CG-CE1 3.76Å; F84-Y153 HydrophobicContact CG-CE1 3.76Å; F84-Y153 AromaticContact CZ-CE1 3.92Å; F84-Y153 HydrophobicContact CZ-CE1 3.92Å
85F92.9Very high92.3Very high88 Ų8860.2 Ų60.239%0.38632%0.317SS..Hα-helixtrans-63.2-42.8175.8-76.8-66.7000112L81 L82 Q87 L88 F89L81-F85 HydrophobicContact CD1-CD2 4.29Å; L81-F85 HydrophobicContact CD1-CE2 3.72Å; L81-F85 HydrophobicContact CD2-CE2 4.49Å; L81-F85 HydrophobicContact CG-CD2 4.19Å; L81-F85 HydrophobicContact CG-CE2 3.84Å; L81-F85 WeakPolarHBondContact O-CD2 3.48Å; L81-F85 PolarHBondContact O-N 2.93Å; L81-F85 VanDerWaalsContact O-N 3.16Å; L82-F85 PolarHBondContact O-N 2.96Å; F85-Q87 VanDerWaalsContact C-N 3.35Å; F85-Q87 PolarHBondContact O-N 3.29Å; F85-L88 HydrophobicContact CD1-CD1 4.28Å; F85-L88 WeakPolarHBondContact O-CB 3.11Å; F85-L88 PolarHBondContact O-N 3.38Å; F85-F89 WeakPolarHBondContact O-CD2 3.34Å
86C92.7Very high91.9Very high71 Ų7164 Ų6448%0.4833%0.326SS..Hα-helixtrans-60-45174.9-66.90000111.6L82 L83 L88 F89 T90L82-C86 PolarHBondContact O-N 2.9Å; L82-C86 PolarHBondContact O-SG 3.4Å; L82-C86 VanDerWaalsContact O-SG 3.33Å; L83-C86 PolarHBondContact O-N 3.12Å; C86-L88 VanDerWaalsContact C-N 3.34Å; C86-L88 PolarHBondContact O-N 3.4Å; C86-F89 PolarHBondContact O-N 2.68Å; C86-T90 WeakPolarHBondContact O-CB 3.38Å; C86-T90 WeakPolarHBondContact O-CG2 3.34Å; C86-T90 PolarHBondContact O-N 3.18Å; C86-T90 PolarHBondContact O-OG1 3.07Å
87Q91.4Very high91.6Very high19 Ų1962.3 Ų62.39%0.08932%0.319CS..Hα-helixtrans-69-30.1-179.7-74.1-175.7-32.200112.8L83 F84 F85 F89 L91 F97 T100L83-Q87 VanDerWaalsContact O-CB 3.3Å; L83-Q87 WeakPolarHBondContact O-CB 3.36Å; L83-Q87 VanDerWaalsContact O-CG 3.22Å; L83-Q87 WeakPolarHBondContact O-CG 3.37Å; L83-Q87 PolarHBondContact O-N 3.36Å; F84-Q87 PolarHBondContact O-N 3.28Å; F85-Q87 VanDerWaalsContact C-N 3.35Å; F85-Q87 PolarHBondContact O-N 3.29Å; Q87-F89 PolarHBondContact O-N 3.07Å; Q87-L91 HydrophobicContact CB-CB 4.4Å; Q87-L91 WeakPolarHBondContact O-CB 3.34Å; Q87-L91 PolarHBondContact O-N 2.85Å; Q87-F97 HydrophobicContact CB-CD1 3.66Å; Q87-F97 HydrophobicContact CB-CE1 3.71Å; Q87-T100 PolarHBondContact OE1-OG1 3.49Å
88L89.1Confident91.3Very high43 Ų4365.4 Ų65.423%0.22534%0.335CS..Hα-helixtrans-54-44.2173.3-102.2150.1000111.6L5 F84 F85 C86 K158L5-L88 HydrophobicContact CD1-CD1 4.3Å; L5-L88 HydrophobicContact CD1-CD2 3.97Å; L5-L88 HydrophobicContact CD1-CG 4.47Å; L5-L88 HydrophobicContact CD2-CD2 4.08Å; F84-L88 HydrophobicContact CD1-CD1 3.87Å; F84-L88 HydrophobicContact CE1-CD1 3.46Å; F84-L88 VanDerWaalsContact CE1-CD1 3.46Å; F84-L88 HydrophobicContact CE2-CD1 4.2Å; F84-L88 HydrophobicContact CG-CD1 4.42Å; F84-L88 HydrophobicContact CZ-CD1 3.69Å; F84-L88 HydrophobicContact CZ-CG 4.4Å; F84-L88 PolarHBondContact O-N 3.41Å; F85-L88 HydrophobicContact CD1-CD1 4.28Å; F85-L88 WeakPolarHBondContact O-CB 3.11Å; F85-L88 PolarHBondContact O-N 3.38Å; C86-L88 VanDerWaalsContact C-N 3.34Å; C86-L88 PolarHBondContact O-N 3.4Å; L88-K158 PolarHBondContact O-NZ 2.83Å
89F87.9Confident91.2Very high172 Ų17263 Ų6375%0.75433%0.33SS*.Hα-helixtrans-91.4-38.9-177.8-58.2-67.7000113.9F85 C86 Q87F85-F89 WeakPolarHBondContact O-CD2 3.34Å; C86-F89 PolarHBondContact O-N 2.68Å; Q87-F89 PolarHBondContact O-N 3.07Å
90T87.9Confident91.1Very high110 Ų11059.7 Ų59.768%0.67531%0.313SS*.Hα-helixtrans-88.6-24.3-172.158.40000114.2C86C86-T90 WeakPolarHBondContact O-CB 3.38Å; C86-T90 WeakPolarHBondContact O-CG2 3.34Å; C86-T90 PolarHBondContact O-N 3.18Å; C86-T90 PolarHBondContact O-OG1 3.07Å
91L87.8Confident91Very high31 Ų3159.7 Ų59.716%0.16231%0.313CS..SBendtrans-74.8130.4-172.1-162.372.9000111Q87 G95 F97 K158Q87-L91 HydrophobicContact CB-CB 4.4Å; Q87-L91 WeakPolarHBondContact O-CB 3.34Å; Q87-L91 PolarHBondContact O-N 2.85Å; L91-G95 VanDerWaalsContact CD2-C 3.45Å; L91-F97 HydrophobicContact CD2-CD2 4.39Å; L91-F97 HydrophobicContact CD2-CE2 4.26Å; L91-F97 HydrophobicContact CD2-CZ 4.36Å; L91-K158 HydrophobicContact CB-CD 4.33Å; L91-K158 HydrophobicContact CD2-CB 4.41Å; L91-K158 WeakPolarHBondContact O-CD 3.24Å; L91-K158 WeakPolarHBondContact O-CE 3.35Å; L91-K158 PolarHBondContact O-NZ 2.96Å
92P87.2Confident91.1Very high94 Ų9462.9 Ų62.961%0.6133%0.329SS*.PPolyproline II helixtrans-66.7160175.427.5-33.9000111.4G94 G95P92-G94 PolarHBondContact O-N 3.49Å; P92-G95 PolarHBondContact O-N 3.44Å
93K83.6Confident91.1Very high144 Ų14462.1 Ų62.163%0.62632%0.322SS*.THydrogen-bonded Turntrans-55.2135.9176.2-61.6-171.9-175.6-139.60109.9G95 E160K93-G95 VanDerWaalsContact C-N 3.28Å; K93-G95 PolarHBondContact O-N 2.84Å; K93-E160 VanDerWaalsContact CE-OXT 3.24Å; K93-E160 WeakPolarHBondContact CE-OXT 3.38Å; K93-E160 PolarHBondContact NZ-OXT 2.88Å
94G80.5Confident91.3Very high25 Ų2559.6 Ų59.626%0.25831%0.309SS..THydrogen-bonded Turntrans81.6-3.2-17700000115.4P92 R157 K158P92-G94 PolarHBondContact O-N 3.49Å; G94-R157 WeakPolarHBondContact O-CG 3.46Å; G94-R157 PolarHBondContact O-NE 3.36Å; G94-K158 VanDerWaalsContact CA-O 3.31Å; G94-K158 WeakPolarHBondContact CA-O 3.35Å; G94-K158 PolarHBondContact N-O 3.48Å
95G85.9Confident91.4Very high16 Ų1661.6 Ų61.617%0.16532%0.319CS..  trans-67.8160.3172.200000113.1L91 P92 K93 R157 K158L91-G95 VanDerWaalsContact CD2-C 3.45Å; P92-G95 PolarHBondContact O-N 3.44Å; K93-G95 VanDerWaalsContact C-N 3.28Å; K93-G95 PolarHBondContact O-N 2.84Å; G95-R157 WeakPolarHBondContact O-CA 3.33Å; G95-K158 PolarHBondContact O-N 3.4Å
96R89Confident91.7Very high159 Ų15960.4 Ų60.460%0.632%0.316SS*.BIsolated β-bridgetrans-114148.5179.8-62.6-179.4-175.8175.8-0.1111.2I98 L156 R157R96-I98 HydrophobicContact CB-CD1 4.12Å; R96-I98 HydrophobicContact CB-CG1 3.69Å; R96-I98 PolarHBondContact O-N 2.87Å; R96-L156 WeakPolarHBondContact CA-O 3.12Å; R96-R157 HydrophobicContact CG-CG 4.47Å
97F92.9Very high92Very high7 Ų757 Ų573%0.03129%0.294CS..  trans-85.242.9-179.8-63.9-100.1000112.3F84 Q87 L91 T100 G101 Y153 L156 K158F84-F97 AromaticContact CD2-CD1 3.74Å; F84-F97 HydrophobicContact CD2-CD1 3.74Å; F84-F97 AromaticContact CD2-CE1 3.94Å; F84-F97 HydrophobicContact CD2-CE1 3.94Å; F84-F97 AromaticContact CE2-CD1 3.98Å; F84-F97 HydrophobicContact CE2-CD1 3.98Å; F84-F97 AromaticContact CE2-CE1 3.88Å; F84-F97 HydrophobicContact CE2-CE1 3.88Å; Q87-F97 HydrophobicContact CB-CD1 3.66Å; Q87-F97 HydrophobicContact CB-CE1 3.71Å; L91-F97 HydrophobicContact CD2-CD2 4.39Å; L91-F97 HydrophobicContact CD2-CE2 4.26Å; L91-F97 HydrophobicContact CD2-CZ 4.36Å; F97-T100 PolarHBondContact O-N 3.49Å; F97-G101 PolarHBondContact O-N 3.37Å; F97-Y153 WeakPolarHBondContact CB-O 3.22Å; F97-L156 HydrophobicContact CD2-CB 4.01Å; F97-L156 HydrophobicContact CD2-CD2 3.69Å; F97-L156 HydrophobicContact CD2-CG 3.93Å; F97-L156 HydrophobicContact CE2-CD2 3.75Å; F97-L156 HydrophobicContact CE2-CG 4.13Å; F97-L156 HydrophobicContact CG-CD2 4.33Å; F97-L156 HydrophobicContact CZ-CD2 4.43Å; F97-L156 PolarHBondContact N-O 2.86Å; F97-K158 HydrophobicContact CE2-CB 4.21Å
98I92.9Very high92.3Very high64 Ų6456.1 Ų56.133%0.32829%0.289SS..Hα-helixtrans-62.5-50.8-172.5-59.2-65.3000112.4R96 T100 G101 I102 A154R96-I98 HydrophobicContact CB-CD1 4.12Å; R96-I98 HydrophobicContact CB-CG1 3.69Å; R96-I98 PolarHBondContact O-N 2.87Å; I98-T100 PolarHBondContact O-N 3.24Å; I98-G101 PolarHBondContact O-N 2.9Å; I98-G101 VanDerWaalsContact O-N 3.13Å; I98-I102 HydrophobicContact CG2-CD1 3.69Å; I98-I102 HydrophobicContact CG2-CG1 4.22Å; I98-I102 WeakPolarHBondContact O-CG1 3.37Å; I98-I102 PolarHBondContact O-N 3.19Å; I98-A154 HydrophobicContact CD1-CB 4.48Å; I98-A154 WeakPolarHBondContact CD1-O 3.3Å
99P94.3Very high92.7Very high57 Ų5757.5 Ų57.537%0.3730%0.297SS..Hα-helixtrans-52.4-50.4175.1-29.532.9000113.5L83 G101 I102 F103L83-P99 HydrophobicContact CD1-CB 4.39Å; P99-G101 VanDerWaalsContact C-N 3.31Å; P99-G101 PolarHBondContact O-N 2.6Å; P99-I102 PolarHBondContact O-N 3.21Å; P99-F103 WeakPolarHBondContact O-CD2 3.45Å; P99-F103 PolarHBondContact O-N 3.44Å; P99-F103 VanDerWaalsContact O-N 3.12Å
100T96.4Very high93.2Very high0 Ų051.5 Ų51.50%027%0.27CS..Hα-helixtrans-53.4-48.9175.9-62.50000111.4S80 F84 Q87 F97 I98 I102 F103 Q104 Y153S80-T100 WeakPolarHBondContact OG-CG2 3.47Å; S80-T100 PolarHBondContact OG-O 2.96Å; F84-T100 WeakPolarHBondContact CA-OG1 3.33Å; F84-T100 HydrophobicContact CB-CG2 3.65Å; F84-T100 HydrophobicContact CD2-CG2 4.17Å; F84-T100 HydrophobicContact CG-CG2 4.31Å; F84-T100 PolarHBondContact N-OG1 3.17Å; Q87-T100 PolarHBondContact OE1-OG1 3.49Å; F97-T100 PolarHBondContact O-N 3.49Å; I98-T100 PolarHBondContact O-N 3.24Å; T100-I102 PolarHBondContact O-N 2.94Å; T100-F103 PolarHBondContact O-N 2.71Å; T100-Q104 PolarHBondContact O-N 3.39Å; T100-Q104 VanDerWaalsContact O-N 3.14Å; T100-Y153 HydrophobicContact CG2-CD1 3.73Å; T100-Y153 HydrophobicContact CG2-CD2 3.66Å; T100-Y153 HydrophobicContact CG2-CE1 3.95Å; T100-Y153 HydrophobicContact CG2-CE2 3.89Å; T100-Y153 HydrophobicContact CG2-CG 3.58Å
101G95.9Very high93.7Very high0 Ų046.2 Ų46.20%024%0.238CC..Hα-helixtrans-61.3-43.2178.200000113.4F97 I98 P99 Q104 I105 G150F97-G101 PolarHBondContact O-N 3.37Å; I98-G101 PolarHBondContact O-N 2.9Å; I98-G101 VanDerWaalsContact O-N 3.13Å; P99-G101 VanDerWaalsContact C-N 3.31Å; P99-G101 PolarHBondContact O-N 2.6Å; G101-Q104 PolarHBondContact O-N 3.18Å; G101-I105 WeakPolarHBondContact O-CB 3.47Å; G101-I105 VanDerWaalsContact O-CG1 3.25Å; G101-I105 WeakPolarHBondContact O-CG1 3.46Å; G101-I105 PolarHBondContact O-N 2.64Å; G101-G150 WeakPolarHBondContact CA-O 3.4Å
102I97.5Very high94.2Very high87 Ų8747.1 Ų47.145%0.44624%0.242SC..Hα-helixtrans-60.1-50.4179-69.3167.9000111I98 P99 T100 Q104 I105 L106I98-I102 HydrophobicContact CG2-CD1 3.69Å; I98-I102 HydrophobicContact CG2-CG1 4.22Å; I98-I102 WeakPolarHBondContact O-CG1 3.37Å; I98-I102 PolarHBondContact O-N 3.19Å; P99-I102 PolarHBondContact O-N 3.21Å; T100-I102 PolarHBondContact O-N 2.94Å; I102-Q104 VanDerWaalsContact C-N 3.28Å; I102-Q104 PolarHBondContact O-N 2.86Å; I102-I105 PolarHBondContact O-N 3.5Å; I102-L106 HydrophobicContact CG2-CD1 4Å; I102-L106 HydrophobicContact CG2-CG 4.43Å; I102-L106 WeakPolarHBondContact O-CG 3.33Å; I102-L106 PolarHBondContact O-N 3.45Å
103F98Very high94.7Very high64 Ų6444.7 Ų44.728%0.28123%0.227SC..Hα-helixtrans-61.4-38.4179.5-83.9-89.3000111.9F76 L79 L83 P99 T100 L106 A107F76-F103 HydrophobicContact CB-CD1 4.5Å; F76-F103 AromaticContact CD1-CD1 3.48Å; F76-F103 HydrophobicContact CD1-CD1 3.48Å; F76-F103 VanDerWaalsContact CD1-CD1 3.48Å; F76-F103 HydrophobicContact CD1-CE1 4.01Å; F76-F103 HydrophobicContact CD1-CG 4.4Å; F76-F103 AromaticContact CE1-CD1 3.87Å; F76-F103 HydrophobicContact CE1-CD1 3.87Å; F76-F103 AromaticContact CE1-CE1 3.92Å; F76-F103 HydrophobicContact CE1-CE1 3.92Å; F76-F103 HydrophobicContact CG-CD1 4.13Å; L79-F103 HydrophobicContact CB-CD1 4.19Å; L79-F103 HydrophobicContact CD1-CD1 4.39Å; L79-F103 HydrophobicContact CD1-CE1 4.13Å; L83-F103 HydrophobicContact CD1-CD2 3.45Å; L83-F103 VanDerWaalsContact CD1-CD2 3.45Å; L83-F103 HydrophobicContact CD1-CE2 3.71Å; L83-F103 HydrophobicContact CD1-CG 4.13Å; P99-F103 WeakPolarHBondContact O-CD2 3.45Å; P99-F103 PolarHBondContact O-N 3.44Å; P99-F103 VanDerWaalsContact O-N 3.12Å; T100-F103 PolarHBondContact O-N 2.71Å; F103-L106 PolarHBondContact O-N 3Å; F103-A107 PolarHBondContact O-N 2.63Å
104Q97.9Very high95.2Very high0 Ų037.9 Ų37.90%020%0.198CC..Hα-helixtrans-70.6-37.3178-165.164.83.400112.8H12 S77 T100 G101 I102 A107 S108 A146 Y153H12-Q104 PolarHBondContact CE1-OE1 2.9Å; H12-Q104 VanDerWaalsContact CE1-OE1 3.25Å; H12-Q104 PolarHBondContact NE2-OE1 3.42Å; H12-Q104 VanDerWaalsContact NE2-OE1 3.08Å; S77-Q104 PolarHBondContact OG-NE2 3.32Å; S77-Q104 PolarHBondContact OG-OE1 3.18Å; S77-Q104 VanDerWaalsContact OG-OE1 3.12Å; T100-Q104 PolarHBondContact O-N 3.39Å; T100-Q104 VanDerWaalsContact O-N 3.14Å; G101-Q104 PolarHBondContact O-N 3.18Å; I102-Q104 VanDerWaalsContact C-N 3.28Å; I102-Q104 PolarHBondContact O-N 2.86Å; Q104-A107 WeakPolarHBondContact O-CB 3.36Å; Q104-A107 PolarHBondContact O-N 3.38Å; Q104-S108 PolarHBondContact O-N 3.41Å; Q104-A146 WeakPolarHBondContact CG-O 2.98Å; Q104-Y153 HydrophobicContact CB-CD2 4.41Å
105I98.3Very high95.8Very high43 Ų4336.7 Ų36.722%0.22119%0.186CC..Hα-helixtrans-64.9-44.6173.6-68.9166.8000109.8G101 I102 A107 S108 L109 L147 L151G101-I105 WeakPolarHBondContact O-CB 3.47Å; G101-I105 VanDerWaalsContact O-CG1 3.25Å; G101-I105 WeakPolarHBondContact O-CG1 3.46Å; G101-I105 PolarHBondContact O-N 2.64Å; I102-I105 PolarHBondContact O-N 3.5Å; I105-A107 VanDerWaalsContact C-N 3.32Å; I105-A107 PolarHBondContact O-N 2.93Å; I105-S108 WeakPolarHBondContact O-CB 3.32Å; I105-S108 PolarHBondContact O-N 2.9Å; I105-S108 VanDerWaalsContact O-N 3.08Å; I105-S108 PolarHBondContact O-OG 3.48Å; I105-L109 HydrophobicContact CG2-CD1 4.3Å; I105-L109 HydrophobicContact CG2-CG 4.49Å; I105-L109 WeakPolarHBondContact O-CG 3.29Å; I105-L109 PolarHBondContact O-N 3.47Å; I105-L147 HydrophobicContact CG2-CD1 4.4Å; I105-L151 HydrophobicContact CD1-CD2 4.19Å
106L98.3Very high96.2Very high62 Ų6239 Ų3933%0.32519%0.194SC..Hα-helixtrans-59.8-42.1175.4-71.5174.2000111.9F76 I102 F103 S108 L109 F110F76-L106 HydrophobicContact CD1-CB 3.71Å; F76-L106 HydrophobicContact CD1-CD1 3.98Å; F76-L106 HydrophobicContact CE1-CB 4.15Å; F76-L106 HydrophobicContact CE1-CD1 3.69Å; I102-L106 HydrophobicContact CG2-CD1 4Å; I102-L106 HydrophobicContact CG2-CG 4.43Å; I102-L106 WeakPolarHBondContact O-CG 3.33Å; I102-L106 PolarHBondContact O-N 3.45Å; F103-L106 PolarHBondContact O-N 3Å; L106-S108 VanDerWaalsContact C-N 3.3Å; L106-S108 PolarHBondContact O-N 3.38Å; L106-L109 HydrophobicContact CD2-CD1 4.44Å; L106-L109 PolarHBondContact O-N 3.14Å; L106-L109 VanDerWaalsContact O-N 3.17Å; L106-F110 HydrophobicContact CB-CE2 4.39Å; L106-F110 VanDerWaalsContact O-CD2 3.23Å; L106-F110 WeakPolarHBondContact O-CD2 3.47Å; L106-F110 WeakPolarHBondContact O-CG 3.44Å; L106-F110 PolarHBondContact O-N 3.3Å
107A98.4Very high96.4Very high0 Ų033.8 Ų33.80%018%0.177CC..Hα-helixtrans-56.1-44.8172.500000111.9S73 F76 F103 Q104 I105 L109 F110 V111S73-A107 WeakPolarHBondContact CB-O 3.36Å; S73-A107 WeakPolarHBondContact O-CB 3.31Å; F76-A107 HydrophobicContact CB-CB 3.92Å; F103-A107 PolarHBondContact O-N 2.63Å; Q104-A107 WeakPolarHBondContact O-CB 3.36Å; Q104-A107 PolarHBondContact O-N 3.38Å; I105-A107 VanDerWaalsContact C-N 3.32Å; I105-A107 PolarHBondContact O-N 2.93Å; A107-L109 VanDerWaalsContact C-N 3.35Å; A107-L109 PolarHBondContact O-N 2.9Å; A107-F110 PolarHBondContact O-N 3.44Å; A107-V111 PolarHBondContact O-N 3.46Å; A107-V111 VanDerWaalsContact O-N 3.14Å
108S98.3Very high96.2Very high0 Ų033.9 Ų33.90%018%0.177CC..Hα-helixtrans-63.3-37.7177.279.90000113Q104 I105 L106 V111 M112 F143Q104-S108 PolarHBondContact O-N 3.41Å; I105-S108 WeakPolarHBondContact O-CB 3.32Å; I105-S108 PolarHBondContact O-N 2.9Å; I105-S108 VanDerWaalsContact O-N 3.08Å; I105-S108 PolarHBondContact O-OG 3.48Å; L106-S108 VanDerWaalsContact C-N 3.3Å; L106-S108 PolarHBondContact O-N 3.38Å; S108-V111 WeakPolarHBondContact O-CG1 3.42Å; S108-M112 VanDerWaalsContact O-CB 3.29Å; S108-M112 WeakPolarHBondContact O-CB 3.34Å; S108-M112 PolarHBondContact O-N 2.9Å; S108-F143 WeakPolarHBondContact O-CD2 3.26Å
109L98.1Very high95.9Very high72 Ų7232.8 Ų32.838%0.37717%0.174SC..Hα-helixtrans-69.1-37.2177.9-68175.3000111.8I105 L106 A107 M112 S113I105-L109 HydrophobicContact CG2-CD1 4.3Å; I105-L109 HydrophobicContact CG2-CG 4.49Å; I105-L109 WeakPolarHBondContact O-CG 3.29Å; I105-L109 PolarHBondContact O-N 3.47Å; L106-L109 HydrophobicContact CD2-CD1 4.44Å; L106-L109 PolarHBondContact O-N 3.14Å; L106-L109 VanDerWaalsContact O-N 3.17Å; A107-L109 VanDerWaalsContact C-N 3.35Å; A107-L109 PolarHBondContact O-N 2.9Å; L109-M112 HydrophobicContact CD2-CE 3.88Å; L109-S113 VanDerWaalsContact O-CB 3.31Å; L109-S113 WeakPolarHBondContact O-CB 3.47Å; L109-S113 PolarHBondContact O-N 2.96Å; L109-S113 PolarHBondContact O-OG 2.71Å
110F98.3Very high95.5Very high46 Ų4635.9 Ų35.920%0.20219%0.187CC..Hα-helixtrans-67-47.1176.8-67.1-42.9000112.3L69 L72 F76 L106 A107 M112 S113 G114L69-F110 HydrophobicContact CD2-CB 4.33Å; L69-F110 HydrophobicContact CD2-CD1 3.62Å; L69-F110 HydrophobicContact CD2-CE1 4.39Å; L69-F110 HydrophobicContact CD2-CG 4.35Å; L69-F110 WeakPolarHBondContact O-CB 3.44Å; L72-F110 HydrophobicContact CB-CD2 3.76Å; L72-F110 HydrophobicContact CB-CE2 3.99Å; L72-F110 HydrophobicContact CB-CG 4.13Å; L72-F110 HydrophobicContact CD1-CE1 4.46Å; L72-F110 HydrophobicContact CD1-CZ 4.42Å; F76-F110 HydrophobicContact CD1-CE2 4.1Å; F76-F110 HydrophobicContact CD2-CD2 4.47Å; F76-F110 AromaticContact CD2-CE2 3.93Å; F76-F110 HydrophobicContact CD2-CE2 3.93Å; F76-F110 HydrophobicContact CE1-CE2 4.15Å; F76-F110 AromaticContact CE2-CE2 3.96Å; F76-F110 HydrophobicContact CE2-CE2 3.96Å; F76-F110 HydrophobicContact CG-CD2 4.44Å; F76-F110 AromaticContact CG-CE2 4Å; F76-F110 HydrophobicContact CG-CE2 4Å; F76-F110 HydrophobicContact CZ-CE2 4.07Å; L106-F110 HydrophobicContact CB-CE2 4.39Å; L106-F110 VanDerWaalsContact O-CD2 3.23Å; L106-F110 WeakPolarHBondContact O-CD2 3.47Å; L106-F110 WeakPolarHBondContact O-CG 3.44Å; L106-F110 PolarHBondContact O-N 3.3Å; A107-F110 PolarHBondContact O-N 3.44Å; F110-M112 VanDerWaalsContact C-N 3.35Å; F110-M112 PolarHBondContact O-N 2.91Å; F110-S113 PolarHBondContact O-N 3.33Å; F110-G114 PolarHBondContact O-N 3Å
111V98.1Very high94.8Very high0 Ų039.7 Ų39.70%021%0.205CC..Hα-helixtrans-63.5-40.6176.261.90000111.7L19 M70 A107 S108 S113 G114 A115 A139 F143L19-V111 HydrophobicContact CD2-CB 3.64Å; L19-V111 HydrophobicContact CD2-CG1 4Å; L19-V111 HydrophobicContact CD2-CG2 3.56Å; M70-V111 HydrophobicContact CE-CG2 4.38Å; M70-V111 HydrophobicContact SD-CG2 4.13Å; A107-V111 PolarHBondContact O-N 3.46Å; A107-V111 VanDerWaalsContact O-N 3.14Å; S108-V111 WeakPolarHBondContact O-CG1 3.42Å; V111-S113 PolarHBondContact O-N 2.93Å; V111-G114 PolarHBondContact O-N 2.93Å; V111-A115 WeakPolarHBondContact O-CB 3.44Å; V111-A115 PolarHBondContact O-N 2.71Å; V111-A139 HydrophobicContact CG2-CB 3.94Å; V111-F143 HydrophobicContact CG1-CB 4.02Å
112M97.8Very high93.5Very high50 Ų5039.8 Ų39.825%0.24621%0.206CC..Hα-helixtrans-60.3-47.1175.7-176.9-17470.700111S108 L109 F110 A115 I116 F143S108-M112 VanDerWaalsContact O-CB 3.29Å; S108-M112 WeakPolarHBondContact O-CB 3.34Å; S108-M112 PolarHBondContact O-N 2.9Å; L109-M112 HydrophobicContact CD2-CE 3.88Å; F110-M112 VanDerWaalsContact C-N 3.35Å; F110-M112 PolarHBondContact O-N 2.91Å; M112-A115 PolarHBondContact O-N 2.83Å; M112-I116 HydrophobicContact CG-CD1 3.79Å; M112-I116 WeakPolarHBondContact O-CB 3.24Å; M112-I116 VanDerWaalsContact O-CG1 3.24Å; M112-I116 WeakPolarHBondContact O-CG1 3.45Å; M112-I116 PolarHBondContact O-N 2.86Å; M112-F143 HydrophobicContact CB-CD2 3.71Å; M112-F143 HydrophobicContact CB-CE2 3.95Å; M112-F143 HydrophobicContact CB-CG 4.11Å; M112-F143 HydrophobicContact CG-CD2 4.23Å; M112-F143 HydrophobicContact CG-CE1 4.47Å; M112-F143 HydrophobicContact CG-CE2 4.11Å; M112-F143 HydrophobicContact CG-CG 4.46Å; M112-F143 HydrophobicContact CG-CZ 4.24Å; M112-F143 HydrophobicContact SD-CD2 4.4Å; M112-F143 HydrophobicContact SD-CE1 4.26Å; M112-F143 HydrophobicContact SD-CE2 3.7Å; M112-F143 HydrophobicContact SD-CZ 3.62Å
113S97.4Very high91.8Very high43 Ų4339.6 Ų39.630%0.30121%0.21SC..Hα-helixtrans-63.3-44.3179.4-570000111.4L109 F110 V111 I116 I117L109-S113 VanDerWaalsContact O-CB 3.31Å; L109-S113 WeakPolarHBondContact O-CB 3.47Å; L109-S113 PolarHBondContact O-N 2.96Å; L109-S113 PolarHBondContact O-OG 2.71Å; F110-S113 PolarHBondContact O-N 3.33Å; V111-S113 PolarHBondContact O-N 2.93Å; S113-I116 PolarHBondContact O-N 3.26Å; S113-I117 VanDerWaalsContact O-CG1 3.26Å; S113-I117 WeakPolarHBondContact O-CG1 3.44Å; S113-I117 PolarHBondContact O-N 2.92Å
114G94.9Very high89.9Confident0 Ų043.3 Ų43.30%023%0.233CC..Hα-helixtrans-61.3-45.9176.900000112.3F110 V111 I117 Y118F110-G114 PolarHBondContact O-N 3Å; V111-G114 PolarHBondContact O-N 2.93Å; G114-I117 PolarHBondContact O-N 3.01Å; G114-Y118 WeakPolarHBondContact O-CB 3.41Å; G114-Y118 PolarHBondContact O-N 2.98Å
115A93.8Very high87.7Confident1 Ų148.2 Ų48.21%0.00825%0.252CS..Hα-helixtrans-64.4-40.6177.600000112.4V111 M112 Y118 T119 A139 W140V111-A115 WeakPolarHBondContact O-CB 3.44Å; V111-A115 PolarHBondContact O-N 2.71Å; M112-A115 PolarHBondContact O-N 2.83Å; A115-Y118 PolarHBondContact O-N 2.95Å; A115-T119 WeakPolarHBondContact O-CB 3.26Å; A115-T119 PolarHBondContact O-N 3.41Å; A115-T119 PolarHBondContact O-OG1 3.23Å; A115-A139 HydrophobicContact CB-CB 4.48Å; A115-W140 HydrophobicContact CB-CD2 4.21Å; A115-W140 HydrophobicContact CB-CZ2 3.96Å
116I94.6Very high85.6Confident65 Ų6547.9 Ų47.933%0.33325%0.251SS..Hα-helixtrans-64.5-48.7176.6-71.3169.1000111M112 S113 Y118 T119 L120 W140M112-I116 HydrophobicContact CG-CD1 3.79Å; M112-I116 WeakPolarHBondContact O-CB 3.24Å; M112-I116 VanDerWaalsContact O-CG1 3.24Å; M112-I116 WeakPolarHBondContact O-CG1 3.45Å; M112-I116 PolarHBondContact O-N 2.86Å; S113-I116 PolarHBondContact O-N 3.26Å; I116-Y118 VanDerWaalsContact C-N 3.27Å; I116-Y118 PolarHBondContact O-N 3Å; I116-T119 WeakPolarHBondContact O-CB 3.31Å; I116-T119 PolarHBondContact O-N 2.96Å; I116-T119 VanDerWaalsContact O-N 3.08Å; I116-L120 HydrophobicContact CG2-CD1 3.77Å; I116-L120 HydrophobicContact CG2-CG 4.27Å; I116-L120 WeakPolarHBondContact O-CG 3.23Å; I116-L120 PolarHBondContact O-N 2.87Å; I116-W140 HydrophobicContact CD1-CH2 4.38Å; I116-W140 HydrophobicContact CG1-CH2 3.65Å; I116-W140 HydrophobicContact CG1-CZ2 4.06Å
117I91.9Very high83.6Confident49 Ų4951.1 Ų51.125%0.25127%0.269SS..Hα-helixtrans-58.3-44.8178.4-68.1164.6000109.8W62 V66 L69 S113 G114 T119 L120 M121W62-I117 HydrophobicContact CB-CG2 4.3Å; W62-I117 HydrophobicContact CE3-CG2 4.47Å; V66-I117 HydrophobicContact CG2-CB 3.94Å; V66-I117 HydrophobicContact CG2-CG2 3.66Å; L69-I117 HydrophobicContact CD1-CD1 3.64Å; S113-I117 VanDerWaalsContact O-CG1 3.26Å; S113-I117 WeakPolarHBondContact O-CG1 3.44Å; S113-I117 PolarHBondContact O-N 2.92Å; G114-I117 PolarHBondContact O-N 3.01Å; I117-T119 VanDerWaalsContact C-N 3.33Å; I117-T119 PolarHBondContact O-N 3.4Å; I117-L120 PolarHBondContact O-N 2.76Å; I117-M121 HydrophobicContact CG2-CG 4.22Å; I117-M121 WeakPolarHBondContact O-CB 3.22Å; I117-M121 VanDerWaalsContact O-CG 3.29Å; I117-M121 WeakPolarHBondContact O-CG 3.39Å; I117-M121 PolarHBondContact O-N 2.67Å
118Y88.4Confident81.4Confident8 Ų858.8 Ų58.83%0.03132%0.316CS..Hα-helixtrans-59.2-45.3175.4-165.5-88.2000111.7W28 T29 L38 W62 I63 G114 A115 I116 L120 M121 S122 F132 Y136W28-Y118 HydrophobicContact CB-CE1 4.34Å; W28-Y118 HydrophobicContact CB-CE2 4.28Å; W28-Y118 WeakPolarHBondContact CB-OH 3.18Å; W28-Y118 HydrophobicContact CD2-CE2 4.44Å; W28-Y118 AromaticContact CE3-CD1 3.78Å; W28-Y118 HydrophobicContact CE3-CD1 3.78Å; W28-Y118 AromaticContact CE3-CD2 3.55Å; W28-Y118 HydrophobicContact CE3-CD2 3.55Å; W28-Y118 AromaticContact CE3-CE1 3.92Å; W28-Y118 HydrophobicContact CE3-CE1 3.92Å; W28-Y118 AromaticContact CE3-CE2 3.71Å; W28-Y118 HydrophobicContact CE3-CE2 3.71Å; W28-Y118 AromaticContact CE3-CG 3.59Å; W28-Y118 HydrophobicContact CE3-CG 3.59Å; W28-Y118 AromaticContact CE3-CZ 3.89Å; W28-Y118 HydrophobicContact CZ3-CD1 4.2Å; W28-Y118 AromaticContact CZ3-CD2 3.89Å; W28-Y118 HydrophobicContact CZ3-CD2 3.89Å; W28-Y118 HydrophobicContact CZ3-CE2 4.49Å; W28-Y118 AromaticContact CZ3-CG 3.73Å; W28-Y118 HydrophobicContact CZ3-CG 3.73Å; T29-Y118 WeakPolarHBondContact CB-OH 3.24Å; T29-Y118 PolarHBondContact OG1-OH 3.43Å; L38-Y118 HydrophobicContact CD2-CD2 4.32Å; L38-Y118 HydrophobicContact CD2-CE2 4.41Å; W62-Y118 HydrophobicContact CH2-CD2 4.33Å; W62-Y118 HydrophobicContact CH2-CE2 4.3Å; W62-Y118 AromaticContact CZ3-CD2 3.79Å; W62-Y118 HydrophobicContact CZ3-CD2 3.79Å; W62-Y118 HydrophobicContact CZ3-CE2 4.19Å; I63-Y118 HydrophobicContact CD1-CD2 4.1Å; I63-Y118 HydrophobicContact CD1-CE2 3.96Å; G114-Y118 WeakPolarHBondContact O-CB 3.41Å; G114-Y118 PolarHBondContact O-N 2.98Å; A115-Y118 PolarHBondContact O-N 2.95Å; I116-Y118 VanDerWaalsContact C-N 3.27Å; I116-Y118 PolarHBondContact O-N 3Å; Y118-L120 VanDerWaalsContact C-N 3.34Å; Y118-L120 PolarHBondContact O-N 2.68Å; Y118-M121 PolarHBondContact O-N 3.42Å; Y118-S122 WeakPolarHBondContact O-CA 3.44Å; Y118-S122 WeakPolarHBondContact O-CB 2.98Å; Y118-S122 PolarHBondContact O-N 3.35Å; Y118-S122 PolarHBondContact O-OG 3Å; Y118-F132 HydrophobicContact CD1-CE1 4.21Å; Y118-F132 HydrophobicContact CE1-CD1 4.3Å; Y118-F132 HydrophobicContact CE1-CE1 4.18Å; Y118-Y136 AromaticContact CD1-CD2 3.72Å; Y118-Y136 HydrophobicContact CD1-CD2 3.72Å; Y118-Y136 AromaticContact CD1-CE2 3.96Å; Y118-Y136 HydrophobicContact CD1-CE2 3.96Å; Y118-Y136 HydrophobicContact CE1-CD2 4.27Å; Y118-Y136 HydrophobicContact CG-CD2 4.48Å
119T87.8Confident79.5Confident41 Ų4161.3 Ų61.325%0.25234%0.341SS..Hα-helixtrans-61.8-41179.7-49.60000112.3A115 I116 I117 S122 P123 F132 Y136A115-T119 WeakPolarHBondContact O-CB 3.26Å; A115-T119 PolarHBondContact O-N 3.41Å; A115-T119 PolarHBondContact O-OG1 3.23Å; I116-T119 WeakPolarHBondContact O-CB 3.31Å; I116-T119 PolarHBondContact O-N 2.96Å; I116-T119 VanDerWaalsContact O-N 3.08Å; I117-T119 VanDerWaalsContact C-N 3.33Å; I117-T119 PolarHBondContact O-N 3.4Å; T119-S122 PolarHBondContact O-OG 3.42Å; T119-P123 VanDerWaalsContact O-CD 3.22Å; T119-P123 WeakPolarHBondContact O-CD 3.33Å; T119-F132 HydrophobicContact CG2-CZ 4.34Å; T119-Y136 WeakPolarHBondContact CG2-OH 3.33Å; T119-Y136 WeakPolarHBondContact OG1-CE2 3.22Å; T119-Y136 PolarHBondContact OG1-OH 2.9Å
120L86.4Confident78.2Confident123 Ų12359.7 Ų59.764%0.64433%0.333SS*.Hα-helixtrans-76.7-33.9-177.1-70.2174.8000113.1I116 I117 Y118 P123I116-L120 HydrophobicContact CG2-CD1 3.77Å; I116-L120 HydrophobicContact CG2-CG 4.27Å; I116-L120 WeakPolarHBondContact O-CG 3.23Å; I116-L120 PolarHBondContact O-N 2.87Å; I117-L120 PolarHBondContact O-N 2.76Å; Y118-L120 VanDerWaalsContact C-N 3.34Å; Y118-L120 PolarHBondContact O-N 2.68Å; L120-P123 WeakPolarHBondContact O-CD 3.37Å
121M80.9Confident77.5Confident79 Ų7960.9 Ų60.939%0.38935%0.347SS..Hα-helixtrans-92.9-22.8-177.1-61.4-63.5-179.200112.6W62 I117 Y118 D124W62-M121 HydrophobicContact CB-CG 4.03Å; W62-M121 HydrophobicContact CD2-CB 3.65Å; W62-M121 HydrophobicContact CD2-CG 4.08Å; W62-M121 HydrophobicContact CE3-CB 3.74Å; W62-M121 HydrophobicContact CE3-CG 4.25Å; W62-M121 HydrophobicContact CG-CB 4.04Å; W62-M121 HydrophobicContact CG-CG 3.99Å; W62-M121 HydrophobicContact CH2-CB 4.5Å; W62-M121 HydrophobicContact CZ2-CB 4.43Å; W62-M121 HydrophobicContact CZ3-CB 4.17Å; I117-M121 HydrophobicContact CG2-CG 4.22Å; I117-M121 WeakPolarHBondContact O-CB 3.22Å; I117-M121 VanDerWaalsContact O-CG 3.29Å; I117-M121 WeakPolarHBondContact O-CG 3.39Å; I117-M121 PolarHBondContact O-N 2.67Å; Y118-M121 PolarHBondContact O-N 3.42Å; M121-D124 PolarHBondContact O-N 2.98Å
122S68.7Low76.9Confident3 Ų364.9 Ų64.92%0.02137%0.365CS..G310 helixtrans-59.9-34178.677.10000114.6Y118 T119 D124 W125 V126 F132Y118-S122 WeakPolarHBondContact O-CA 3.44Å; Y118-S122 WeakPolarHBondContact O-CB 2.98Å; Y118-S122 PolarHBondContact O-N 3.35Å; Y118-S122 PolarHBondContact O-OG 3Å; T119-S122 PolarHBondContact O-OG 3.42Å; S122-D124 PolarHBondContact O-N 3.25Å; S122-W125 CarbonylContact O-C 3.54Å; S122-W125 WeakPolarHBondContact O-CA 3.48Å; S122-W125 WeakPolarHBondContact O-CB 3.45Å; S122-W125 PolarHBondContact O-N 3.5Å; S122-V126 VanDerWaalsContact O-CB 3.23Å; S122-V126 WeakPolarHBondContact O-CB 3.21Å; S122-V126 WeakPolarHBondContact O-CG2 3.43Å; S122-V126 PolarHBondContact O-N 3.49Å; S122-F132 WeakPolarHBondContact OG-CE1 3.32Å; S122-F132 WeakPolarHBondContact OG-CZ 3.23Å
123P61.3Low76.4Confident83 Ų8362.7 Ų62.754%0.53936%0.355SS..G310 helixtrans-62.5-26.3-179.3-23.335.6000114.1T119 L120 W125T119-P123 VanDerWaalsContact O-CD 3.22Å; T119-P123 WeakPolarHBondContact O-CD 3.33Å; L120-P123 WeakPolarHBondContact O-CD 3.37Å; P123-W125 PolarHBondContact O-N 3.36Å
124D57.4Low76.1Confident142 Ų14265.9 Ų65.976%0.75936%0.361SS*.G310 helixtrans-73.4-11.2172.2-67.5-32.2000112.5M121 S122M121-D124 PolarHBondContact O-N 2.98Å; S122-D124 PolarHBondContact O-N 3.25Å
125W52.3Low76Confident103 Ų10365.9 Ų65.939%0.3936%0.361SS..THydrogen-bonded Turntrans-117.4-23.2-179.5-101.760.4000113.8W62 S122 P123 N127W62-W125 HydrophobicContact CZ2-CG 4.48Å; S122-W125 CarbonylContact O-C 3.54Å; S122-W125 WeakPolarHBondContact O-CA 3.48Å; S122-W125 WeakPolarHBondContact O-CB 3.45Å; S122-W125 PolarHBondContact O-N 3.5Å; P123-W125 PolarHBondContact O-N 3.36Å; W125-N127 PolarHBondContact O-N 3.34Å
126V54.6Low75.9Confident35 Ų3566.9 Ų66.921%0.21237%0.365CS..  trans-9786.1-175.9171.30000106.5T29 S122 N130T29-V126 HydrophobicContact CG2-CG2 3.96Å; S122-V126 VanDerWaalsContact O-CB 3.23Å; S122-V126 WeakPolarHBondContact O-CB 3.21Å; S122-V126 WeakPolarHBondContact O-CG2 3.43Å; S122-V126 PolarHBondContact O-N 3.49Å; V126-N130 HydrophobicContact CB-CB 4.02Å; V126-N130 HydrophobicContact CG1-CB 3.41Å; V126-N130 VanDerWaalsContact CG1-CB 3.41Å; V126-N130 VanDerWaalsContact CG1-O 3.32Å; V126-N130 WeakPolarHBondContact CG1-O 3.39Å; V126-N130 HydrophobicContact CG2-CB 4.25Å
127N55.8Low75.8Confident130 Ų13068.1 Ų68.170%0.69537%0.372SS*.  trans-52.6155.3168.8-91.3-51.5000110.5W125 G129 N130W125-N127 PolarHBondContact O-N 3.34Å; N127-G129 VanDerWaalsContact C-N 3.35Å; N127-G129 PolarHBondContact O-N 2.83Å; N127-N130 PolarHBondContact O-N 3.44Å
128V53.4Low76Confident162 Ų16267.7 Ų67.798%0.98237%0.369SS*.THydrogen-bonded Turntrans-55.294.8176.2-169.10000109.1
129G58.4Low76.4Confident52 Ų5267.3 Ų67.354%0.53637%0.368SS..THydrogen-bonded Turntrans141.4-18.7-172.300000115.6N127N127-G129 VanDerWaalsContact C-N 3.35Å; N127-G129 PolarHBondContact O-N 2.83Å
130N71.1Confident76.8Confident39 Ų3969.4 Ų69.421%0.20937%0.371CS..  trans-86.3141.8177.5-65.66.5000110.4T29 T30 W31 V126 N127T29-N130 HydrophobicContact CG2-CB 4.24Å; T30-N130 WeakPolarHBondContact O-CA 3.28Å; W31-N130 HydrophobicContact CB-CB 4.3Å; W31-N130 VanDerWaalsContact CB-CG 3.5Å; W31-N130 WeakPolarHBondContact CB-OD1 3.42Å; V126-N130 HydrophobicContact CB-CB 4.02Å; V126-N130 HydrophobicContact CG1-CB 3.41Å; V126-N130 VanDerWaalsContact CG1-CB 3.41Å; V126-N130 VanDerWaalsContact CG1-O 3.32Å; V126-N130 WeakPolarHBondContact CG1-O 3.39Å; V126-N130 HydrophobicContact CG2-CB 4.25Å; N127-N130 PolarHBondContact O-N 3.44Å
131S81.9Confident77.3Confident71 Ų7166.7 Ų66.750%0.49736%0.36SS..EExtended strand (participates in β ladder)trans-121148.9-176.5-64.80000111.7T30 G133T30-S131 PolarHBondContact N-O 3.48Å; T30-S131 PolarHBondContact O-N 3.08Å; T30-S131 PolarHBondContact OG1-O 3.41Å; S131-G133 PolarHBondContact O-N 2.99Å
132F86.1Confident78.1Confident84 Ų8463 Ų6337%0.36834%0.341SS..EExtended strand (participates in β ladder)trans-64.5129.1170.3-69.5-65.1000110.4Y118 T119 S122 Y136Y118-F132 HydrophobicContact CD1-CE1 4.21Å; Y118-F132 HydrophobicContact CE1-CD1 4.3Å; Y118-F132 HydrophobicContact CE1-CE1 4.18Å; T119-F132 HydrophobicContact CG2-CZ 4.34Å; S122-F132 WeakPolarHBondContact OG-CE1 3.32Å; S122-F132 WeakPolarHBondContact OG-CZ 3.23Å; F132-Y136 HydrophobicContact CB-CD1 3.65Å; F132-Y136 HydrophobicContact CB-CE1 4.04Å; F132-Y136 HydrophobicContact CB-CG 4.33Å; F132-Y136 AromaticContact CD1-CD1 3.71Å; F132-Y136 HydrophobicContact CD1-CD1 3.71Å; F132-Y136 HydrophobicContact CD1-CD2 4.1Å; F132-Y136 AromaticContact CD1-CE1 3.73Å; F132-Y136 HydrophobicContact CD1-CE1 3.73Å; F132-Y136 HydrophobicContact CD1-CE2 4.11Å; F132-Y136 AromaticContact CD1-CG 3.88Å; F132-Y136 HydrophobicContact CD1-CG 3.88Å; F132-Y136 AromaticContact CD1-CZ 3.9Å; F132-Y136 HydrophobicContact CD2-CE1 4.09Å; F132-Y136 HydrophobicContact CE1-CD2 4.43Å; F132-Y136 HydrophobicContact CE1-CE1 4.2Å; F132-Y136 HydrophobicContact CE1-CE2 4.07Å; F132-Y136 AromaticContact CE1-CZ 3.92Å; F132-Y136 AromaticContact CG-CD1 3.72Å; F132-Y136 HydrophobicContact CG-CD1 3.72Å; F132-Y136 AromaticContact CG-CE1 3.67Å; F132-Y136 HydrophobicContact CG-CE1 3.67Å; F132-Y136 HydrophobicContact CG-CG 4.34Å
133G87.6Confident79.5Confident4 Ų464.7 Ų64.74%0.04135%0.348CS..  trans-81.9168.5177.900000112.6V27 W28 S131 A135 Y136 I137V27-G133 CarbonylContact O-C 3.37Å; V27-G133 VanDerWaalsContact O-C 3.23Å; V27-G133 WeakPolarHBondContact O-CA 3.4Å; W28-G133 PolarHBondContact O-N 3.37Å; S131-G133 PolarHBondContact O-N 2.99Å; G133-A135 VanDerWaalsContact C-N 3.27Å; G133-A135 PolarHBondContact O-N 2.89Å; G133-Y136 WeakPolarHBondContact O-CB 3.17Å; G133-Y136 PolarHBondContact O-N 3.48Å; G133-I137 PolarHBondContact O-N 2.97Å
134Y90.6Very high81.2Confident109 Ų10963.1 Ų63.143%0.42734%0.338SS..Hα-helixtrans-65.8-29.4-175.579.1-93000112.8V25 V27 Y136 I137 L138V25-Y134 WeakPolarHBondContact CG1-OH 3.26Å; V27-Y134 HydrophobicContact CB-CD1 3.88Å; V27-Y134 HydrophobicContact CB-CE1 3.67Å; V27-Y134 HydrophobicContact CG1-CD1 3.92Å; V27-Y134 HydrophobicContact CG1-CE1 4.11Å; V27-Y134 HydrophobicContact CG2-CD1 4.27Å; V27-Y134 HydrophobicContact CG2-CE1 3.61Å; V27-Y134 PolarHBondContact O-N 3.46Å; Y134-Y136 VanDerWaalsContact C-N 3.26Å; Y134-Y136 PolarHBondContact O-N 2.96Å; Y134-I137 WeakPolarHBondContact O-CA 3.09Å; Y134-I137 WeakPolarHBondContact O-CB 3.48Å; Y134-I137 PolarHBondContact O-N 3.33Å; Y134-I137 VanDerWaalsContact O-N 3.07Å; Y134-L138 HydrophobicContact CD2-CD1 3.79Å; Y134-L138 HydrophobicContact CD2-CG 4.11Å; Y134-L138 HydrophobicContact CE2-CD1 3.91Å; Y134-L138 WeakPolarHBondContact O-CG 3.19Å; Y134-L138 PolarHBondContact O-N 2.88Å
135A92.1Very high83.1Confident0 Ų058.6 Ų58.60%031%0.314CS..Hα-helixtrans-64.9-34.4-179.500000111.5S22 V27 W28 G133 L138 A139S22-A135 WeakPolarHBondContact CB-O 3.43Å; S22-A135 PolarHBondContact OG-O 3.42Å; V27-A135 VanDerWaalsContact O-CB 3.28Å; V27-A135 WeakPolarHBondContact O-CB 3.41Å; V27-A135 PolarHBondContact O-N 3.33Å; V27-A135 VanDerWaalsContact O-N 3.07Å; W28-A135 HydrophobicContact CG-CB 4.36Å; G133-A135 VanDerWaalsContact C-N 3.27Å; G133-A135 PolarHBondContact O-N 2.89Å; A135-L138 PolarHBondContact O-N 2.95Å; A135-A139 PolarHBondContact O-N 3.21Å
136Y92.1Very high85.3Confident22 Ų2253.7 Ų53.79%0.08630%0.295CS..Hα-helixtrans-65-43.3170.7167.3-92.5000111.6W28 Y118 T119 F132 G133 Y134 L138 A139 W140W28-Y136 HydrophobicContact CE3-CD2 4.01Å; W28-Y136 HydrophobicContact CZ3-CD2 4.07Å; Y118-Y136 AromaticContact CD1-CD2 3.72Å; Y118-Y136 HydrophobicContact CD1-CD2 3.72Å; Y118-Y136 AromaticContact CD1-CE2 3.96Å; Y118-Y136 HydrophobicContact CD1-CE2 3.96Å; Y118-Y136 HydrophobicContact CE1-CD2 4.27Å; Y118-Y136 HydrophobicContact CG-CD2 4.48Å; T119-Y136 WeakPolarHBondContact CG2-OH 3.33Å; T119-Y136 WeakPolarHBondContact OG1-CE2 3.22Å; T119-Y136 PolarHBondContact OG1-OH 2.9Å; F132-Y136 HydrophobicContact CB-CD1 3.65Å; F132-Y136 HydrophobicContact CB-CE1 4.04Å; F132-Y136 HydrophobicContact CB-CG 4.33Å; F132-Y136 AromaticContact CD1-CD1 3.71Å; F132-Y136 HydrophobicContact CD1-CD1 3.71Å; F132-Y136 HydrophobicContact CD1-CD2 4.1Å; F132-Y136 AromaticContact CD1-CE1 3.73Å; F132-Y136 HydrophobicContact CD1-CE1 3.73Å; F132-Y136 HydrophobicContact CD1-CE2 4.11Å; F132-Y136 AromaticContact CD1-CG 3.88Å; F132-Y136 HydrophobicContact CD1-CG 3.88Å; F132-Y136 AromaticContact CD1-CZ 3.9Å; F132-Y136 HydrophobicContact CD2-CE1 4.09Å; F132-Y136 HydrophobicContact CE1-CD2 4.43Å; F132-Y136 HydrophobicContact CE1-CE1 4.2Å; F132-Y136 HydrophobicContact CE1-CE2 4.07Å; F132-Y136 AromaticContact CE1-CZ 3.92Å; F132-Y136 AromaticContact CG-CD1 3.72Å; F132-Y136 HydrophobicContact CG-CD1 3.72Å; F132-Y136 AromaticContact CG-CE1 3.67Å; F132-Y136 HydrophobicContact CG-CE1 3.67Å; F132-Y136 HydrophobicContact CG-CG 4.34Å; G133-Y136 WeakPolarHBondContact O-CB 3.17Å; G133-Y136 PolarHBondContact O-N 3.48Å; Y134-Y136 VanDerWaalsContact C-N 3.26Å; Y134-Y136 PolarHBondContact O-N 2.96Å; Y136-L138 VanDerWaalsContact C-N 3.29Å; Y136-L138 PolarHBondContact O-N 2.75Å; Y136-A139 WeakPolarHBondContact O-CB 3.4Å; Y136-A139 PolarHBondContact O-N 3.4Å; Y136-W140 AromaticContact CE1-CD1 3.54Å; Y136-W140 AromaticContact CE1-NE1 3.62Å; Y136-W140 AromaticContact CE2-CD1 3.9Å; Y136-W140 AromaticContact CE2-NE1 3.45Å; Y136-W140 AromaticContact CZ-CD1 3.47Å; Y136-W140 VanDerWaalsContact CZ-CD1 3.47Å; Y136-W140 AromaticContact CZ-NE1 3.05Å; Y136-W140 PolarHBondContact O-N 2.91Å; Y136-W140 PolarHBondContact OH-NE1 2.67Å
137I93.5Very high87.3Confident92 Ų9254.4 Ų54.447%0.47230%0.298SS..Hα-helixtrans-61.2-40.7175.7-58.4173.6000110.4G133 Y134 A139 W140 V141G133-I137 PolarHBondContact O-N 2.97Å; Y134-I137 WeakPolarHBondContact O-CA 3.09Å; Y134-I137 WeakPolarHBondContact O-CB 3.48Å; Y134-I137 PolarHBondContact O-N 3.33Å; Y134-I137 VanDerWaalsContact O-N 3.07Å; I137-A139 VanDerWaalsContact C-N 3.32Å; I137-A139 PolarHBondContact O-N 3.2Å; I137-W140 PolarHBondContact O-N 2.95Å; I137-W140 VanDerWaalsContact O-N 3.14Å; I137-V141 HydrophobicContact CG2-CG2 4.46Å; I137-V141 WeakPolarHBondContact O-CG2 3.39Å; I137-V141 PolarHBondContact O-N 2.94Å
138L95.6Very high89.3Confident39 Ų3952.3 Ų52.320%0.20429%0.285CS..Hα-helixtrans-62.9-34.4177-65.3-173.5000112.7L18 V21 Y134 A135 Y136 W140 V141 A142L18-L138 HydrophobicContact CD2-CD1 4.38Å; L18-L138 HydrophobicContact CD2-CD2 3.93Å; L18-L138 HydrophobicContact CD2-CG 4.49Å; V21-L138 HydrophobicContact CB-CD1 4.32Å; V21-L138 HydrophobicContact CG1-CD1 3.61Å; Y134-L138 HydrophobicContact CD2-CD1 3.79Å; Y134-L138 HydrophobicContact CD2-CG 4.11Å; Y134-L138 HydrophobicContact CE2-CD1 3.91Å; Y134-L138 WeakPolarHBondContact O-CG 3.19Å; Y134-L138 PolarHBondContact O-N 2.88Å; A135-L138 PolarHBondContact O-N 2.95Å; Y136-L138 VanDerWaalsContact C-N 3.29Å; Y136-L138 PolarHBondContact O-N 2.75Å; L138-W140 VanDerWaalsContact C-N 3.35Å; L138-V141 PolarHBondContact O-N 2.85Å; L138-A142 VanDerWaalsContact O-CB 3.28Å; L138-A142 WeakPolarHBondContact O-CB 3.44Å; L138-A142 PolarHBondContact O-N 2.85Å
139A95.9Very high91.4Very high0 Ų044.6 Ų44.60%024%0.239CC..Hα-helixtrans-61.5-43.6172.300000111.5S22 W28 M70 V111 A115 A135 Y136 I137 V141 A142 F143S22-A139 WeakPolarHBondContact OG-CB 3.49Å; S22-A139 PolarHBondContact OG-N 3.46Å; W28-A139 HydrophobicContact CH2-CB 4.05Å; W28-A139 HydrophobicContact CZ2-CB 4.19Å; M70-A139 HydrophobicContact CE-CB 4.43Å; V111-A139 HydrophobicContact CG2-CB 3.94Å; A115-A139 HydrophobicContact CB-CB 4.48Å; A135-A139 PolarHBondContact O-N 3.21Å; Y136-A139 WeakPolarHBondContact O-CB 3.4Å; Y136-A139 PolarHBondContact O-N 3.4Å; I137-A139 VanDerWaalsContact C-N 3.32Å; I137-A139 PolarHBondContact O-N 3.2Å; A139-V141 VanDerWaalsContact C-N 3.32Å; A139-V141 PolarHBondContact O-N 2.63Å; A139-A142 PolarHBondContact O-N 3.41Å; A139-F143 PolarHBondContact O-N 3.41Å
140W96.6Very high93.2Very high86 Ų8642.1 Ų42.133%0.32621%0.213SC..Hα-helixtrans-67.7-29177-81.7112.9000113.9A115 I116 Y136 I137 L138 F143 P144A115-W140 HydrophobicContact CB-CD2 4.21Å; A115-W140 HydrophobicContact CB-CZ2 3.96Å; I116-W140 HydrophobicContact CD1-CH2 4.38Å; I116-W140 HydrophobicContact CG1-CH2 3.65Å; I116-W140 HydrophobicContact CG1-CZ2 4.06Å; Y136-W140 AromaticContact CE1-CD1 3.54Å; Y136-W140 AromaticContact CE1-NE1 3.62Å; Y136-W140 AromaticContact CE2-CD1 3.9Å; Y136-W140 AromaticContact CE2-NE1 3.45Å; Y136-W140 AromaticContact CZ-CD1 3.47Å; Y136-W140 VanDerWaalsContact CZ-CD1 3.47Å; Y136-W140 AromaticContact CZ-NE1 3.05Å; Y136-W140 PolarHBondContact O-N 2.91Å; Y136-W140 PolarHBondContact OH-NE1 2.67Å; I137-W140 PolarHBondContact O-N 2.95Å; I137-W140 VanDerWaalsContact O-N 3.14Å; L138-W140 VanDerWaalsContact C-N 3.35Å; W140-F143 HydrophobicContact CE3-CD1 4.3Å; W140-F143 HydrophobicContact CZ3-CD1 4.34Å; W140-P144 WeakPolarHBondContact O-CD 3.36Å
141V97.4Very high94.4Very high66 Ų6644.5 Ų44.540%0.423%0.226SC..Hα-helixtrans-76.8-36.6171.3179.10000111L18 I137 L138 A139 F143 P144 L145L18-V141 HydrophobicContact CD1-CG1 3.93Å; I137-V141 HydrophobicContact CG2-CG2 4.46Å; I137-V141 WeakPolarHBondContact O-CG2 3.39Å; I137-V141 PolarHBondContact O-N 2.94Å; L138-V141 PolarHBondContact O-N 2.85Å; A139-V141 VanDerWaalsContact C-N 3.32Å; A139-V141 PolarHBondContact O-N 2.63Å; V141-F143 PolarHBondContact O-N 2.79Å; V141-P144 VanDerWaalsContact O-CD 3.25Å; V141-P144 WeakPolarHBondContact O-CD 3.22Å; V141-P144 WeakPolarHBondContact O-CG 3.29Å; V141-L145 HydrophobicContact CG1-CD1 3.93Å; V141-L145 WeakPolarHBondContact O-CD1 3.15Å; V141-L145 VanDerWaalsContact O-CG 3.32Å; V141-L145 WeakPolarHBondContact O-CG 3.04Å
142A97.3Very high95Very high0 Ų044.1 Ų44.10%022%0.217CC..Hα-helixtrans-64.7-37.917800000112.4L18 L19 L138 A139 L145 A146L18-A142 HydrophobicContact CB-CB 3.85Å; L19-A142 HydrophobicContact CD2-CB 3.7Å; L19-A142 HydrophobicContact CG-CB 4Å; L138-A142 VanDerWaalsContact O-CB 3.28Å; L138-A142 WeakPolarHBondContact O-CB 3.44Å; L138-A142 PolarHBondContact O-N 2.85Å; A139-A142 PolarHBondContact O-N 3.41Å; A142-L145 PolarHBondContact O-N 2.71Å; A142-A146 VanDerWaalsContact O-CB 3.31Å; A142-A146 WeakPolarHBondContact O-CB 3.41Å; A142-A146 PolarHBondContact O-N 2.83Å
143F97.6Very high95.4Very high39 Ų3940.1 Ų40.117%0.17120%0.2CC..Hα-helixtrans-50.5-63.4178159.5-122.7000113.9S108 V111 M112 A139 W140 V141 L145 A146 L147S108-F143 WeakPolarHBondContact O-CD2 3.26Å; V111-F143 HydrophobicContact CG1-CB 4.02Å; M112-F143 HydrophobicContact CB-CD2 3.71Å; M112-F143 HydrophobicContact CB-CE2 3.95Å; M112-F143 HydrophobicContact CB-CG 4.11Å; M112-F143 HydrophobicContact CG-CD2 4.23Å; M112-F143 HydrophobicContact CG-CE1 4.47Å; M112-F143 HydrophobicContact CG-CE2 4.11Å; M112-F143 HydrophobicContact CG-CG 4.46Å; M112-F143 HydrophobicContact CG-CZ 4.24Å; M112-F143 HydrophobicContact SD-CD2 4.4Å; M112-F143 HydrophobicContact SD-CE1 4.26Å; M112-F143 HydrophobicContact SD-CE2 3.7Å; M112-F143 HydrophobicContact SD-CZ 3.62Å; A139-F143 PolarHBondContact O-N 3.41Å; W140-F143 HydrophobicContact CE3-CD1 4.3Å; W140-F143 HydrophobicContact CZ3-CD1 4.34Å; V141-F143 PolarHBondContact O-N 2.79Å; F143-L145 VanDerWaalsContact C-N 3.3Å; F143-L145 PolarHBondContact O-N 3.37Å; F143-A146 PolarHBondContact O-N 3.21Å; F143-L147 HydrophobicContact CE2-CB 4.23Å; F143-L147 HydrophobicContact CE2-CD2 4.01Å; F143-L147 HydrophobicContact CZ-CD2 4.02Å; F143-L147 WeakPolarHBondContact O-CB 3.39Å; F143-L147 PolarHBondContact O-N 3.37Å
144P97.8Very high95.6Very high51 Ų5141.4 Ų41.433%0.33121%0.21SC..Hα-helixtrans-66.2-33.1-176.727-35.2000111.7W140 V141 L147 I148W140-P144 WeakPolarHBondContact O-CD 3.36Å; V141-P144 VanDerWaalsContact O-CD 3.25Å; V141-P144 WeakPolarHBondContact O-CD 3.22Å; V141-P144 WeakPolarHBondContact O-CG 3.29Å; P144-L147 PolarHBondContact O-N 2.68Å; P144-I148 VanDerWaalsContact O-CB 3.3Å; P144-I148 WeakPolarHBondContact O-CB 3.26Å; P144-I148 WeakPolarHBondContact O-CD1 3.39Å; P144-I148 WeakPolarHBondContact O-CG1 3.38Å; P144-I148 PolarHBondContact O-N 3.48Å
145L97.6Very high95.6Very high47 Ų4742 Ų4225%0.24623%0.225CC..Hα-helixtrans-64.3-45175.9-65.9174.1000111.5L11 A15 L18 V141 A142 F143 S149L11-L145 HydrophobicContact CD1-CB 4.26Å; L11-L145 HydrophobicContact CD1-CD2 3.57Å; L11-L145 HydrophobicContact CD1-CG 4.48Å; A15-L145 HydrophobicContact CB-CB 4.02Å; L18-L145 HydrophobicContact CD1-CD1 3.55Å; V141-L145 HydrophobicContact CG1-CD1 3.93Å; V141-L145 WeakPolarHBondContact O-CD1 3.15Å; V141-L145 VanDerWaalsContact O-CG 3.32Å; V141-L145 WeakPolarHBondContact O-CG 3.04Å; A142-L145 PolarHBondContact O-N 2.71Å; F143-L145 VanDerWaalsContact C-N 3.3Å; F143-L145 PolarHBondContact O-N 3.37Å; L145-S149 VanDerWaalsContact O-CB 3.24Å; L145-S149 WeakPolarHBondContact O-CB 3.33Å; L145-S149 PolarHBondContact O-N 3.2Å
146A97.7Very high95.4Very high0 Ų043.5 Ų43.50%023%0.232CC..Hα-helixtrans-64-44.817500000111.4A15 Q104 A142 F143 S149 G150A15-A146 HydrophobicContact CB-CB 4.24Å; Q104-A146 WeakPolarHBondContact CG-O 2.98Å; A142-A146 VanDerWaalsContact O-CB 3.31Å; A142-A146 WeakPolarHBondContact O-CB 3.41Å; A142-A146 PolarHBondContact O-N 2.83Å; F143-A146 PolarHBondContact O-N 3.21Å; A146-S149 WeakPolarHBondContact O-CB 3.42Å; A146-S149 PolarHBondContact O-N 2.95Å; A146-G150 PolarHBondContact O-N 3.32Å
147L98Very high95.1Very high50 Ų5049.9 Ų49.926%0.26226%0.256SS..Hα-helixtrans-62.9-49.3179.6-18066.1000111.6I105 F143 P144 S149 G150 L151I105-L147 HydrophobicContact CG2-CD1 4.4Å; F143-L147 HydrophobicContact CE2-CB 4.23Å; F143-L147 HydrophobicContact CE2-CD2 4.01Å; F143-L147 HydrophobicContact CZ-CD2 4.02Å; F143-L147 WeakPolarHBondContact O-CB 3.39Å; F143-L147 PolarHBondContact O-N 3.37Å; P144-L147 PolarHBondContact O-N 2.68Å; L147-S149 VanDerWaalsContact C-N 3.31Å; L147-S149 PolarHBondContact O-N 3.47Å; L147-G150 PolarHBondContact O-N 3.4Å; L147-G150 VanDerWaalsContact O-N 3.17Å; L147-L151 HydrophobicContact CD1-CD1 4.44Å; L147-L151 HydrophobicContact CD1-CG 4.41Å; L147-L151 HydrophobicContact CG-CD1 4.17Å; L147-L151 WeakPolarHBondContact O-CG 3.27Å; L147-L151 PolarHBondContact O-N 2.93Å
148I97.8Very high94.5Very high85 Ų8547.9 Ų47.944%0.43624%0.244SC..Hα-helixtrans-60.4-44.3177.5-68.7165.3000110L11 P144 G150 L151 I152L11-I148 HydrophobicContact CD2-CG2 4.07Å; P144-I148 VanDerWaalsContact O-CB 3.3Å; P144-I148 WeakPolarHBondContact O-CB 3.26Å; P144-I148 WeakPolarHBondContact O-CD1 3.39Å; P144-I148 WeakPolarHBondContact O-CG1 3.38Å; P144-I148 PolarHBondContact O-N 3.48Å; I148-G150 VanDerWaalsContact C-N 3.32Å; I148-G150 PolarHBondContact O-N 2.83Å; I148-L151 PolarHBondContact O-N 3.41Å; I148-I152 HydrophobicContact CG2-CD1 3.67Å; I148-I152 HydrophobicContact CG2-CG1 4.3Å; I148-I152 VanDerWaalsContact O-CG1 3.23Å; I148-I152 WeakPolarHBondContact O-CG1 3.39Å; I148-I152 PolarHBondContact O-N 3Å
149S96.6Very high93.5Very high0 Ų055.2 Ų55.20%027%0.269CS..Hα-helixtrans-57-46.1175.2-172.70000111.7L145 A146 L147 I152 Y153L145-S149 VanDerWaalsContact O-CB 3.24Å; L145-S149 WeakPolarHBondContact O-CB 3.33Å; L145-S149 PolarHBondContact O-N 3.2Å; A146-S149 WeakPolarHBondContact O-CB 3.42Å; A146-S149 PolarHBondContact O-N 2.95Å; L147-S149 VanDerWaalsContact C-N 3.31Å; L147-S149 PolarHBondContact O-N 3.47Å; S149-I152 PolarHBondContact O-N 2.95Å; S149-Y153 WeakPolarHBondContact O-CD2 2.95Å; S149-Y153 PolarHBondContact O-N 2.93Å; S149-Y153 VanDerWaalsContact OG-CE2 3.24Å; S149-Y153 WeakPolarHBondContact OG-CE2 3.04Å
150G96.3Very high91.7Very high0 Ų064.7 Ų64.70%031%0.314CS..Hα-helixtrans-64.4-42.317900000113.5G101 A146 L147 I148 Y153 A154G101-G150 WeakPolarHBondContact CA-O 3.4Å; A146-G150 PolarHBondContact O-N 3.32Å; L147-G150 PolarHBondContact O-N 3.4Å; L147-G150 VanDerWaalsContact O-N 3.17Å; I148-G150 VanDerWaalsContact C-N 3.32Å; I148-G150 PolarHBondContact O-N 2.83Å; G150-Y153 PolarHBondContact O-N 2.04Å; G150-A154 PolarHBondContact O-N 2.95Å
151L96.6Very high91.4Very high90 Ų9063.7 Ų63.747%0.47131%0.313SS..Hα-helixtrans-63.4-42.2175-69174.5000111.7I105 L147 I148 Y153 A154 V155I105-L151 HydrophobicContact CD1-CD2 4.19Å; L147-L151 HydrophobicContact CD1-CD1 4.44Å; L147-L151 HydrophobicContact CD1-CG 4.41Å; L147-L151 HydrophobicContact CG-CD1 4.17Å; L147-L151 WeakPolarHBondContact O-CG 3.27Å; L147-L151 PolarHBondContact O-N 2.93Å; I148-L151 PolarHBondContact O-N 3.41Å; L151-Y153 PolarHBondContact O-N 2.95Å; L151-A154 PolarHBondContact O-N 3.02Å; L151-V155 WeakPolarHBondContact O-CG2 3.46Å; L151-V155 PolarHBondContact O-N 3.18Å; L151-V155 VanDerWaalsContact O-N 3.11Å
152I94.9Very high91.1Very high63 Ų6363.5 Ų63.532%0.32331%0.308SS..Hα-helixtrans-61.5-45.4175.9-67.2166000110.2I8 L11 I148 S149 A154 V155 L156I8-I152 HydrophobicContact CD1-CG2 3.45Å; I8-I152 VanDerWaalsContact CD1-CG2 3.45Å; I8-I152 HydrophobicContact CG1-CG2 3.7Å; L11-I152 HydrophobicContact CD2-CD1 4.03Å; I148-I152 HydrophobicContact CG2-CD1 3.67Å; I148-I152 HydrophobicContact CG2-CG1 4.3Å; I148-I152 VanDerWaalsContact O-CG1 3.23Å; I148-I152 WeakPolarHBondContact O-CG1 3.39Å; I148-I152 PolarHBondContact O-N 3Å; S149-I152 PolarHBondContact O-N 2.95Å; I152-A154 VanDerWaalsContact C-N 3.32Å; I152-A154 PolarHBondContact O-N 3.5Å; I152-V155 PolarHBondContact O-N 3.37Å; I152-L156 WeakPolarHBondContact O-CB 3.19Å; I152-L156 PolarHBondContact O-N 3.36Å
153Y93.6Very high90.8Very high0 Ų067.1 Ų67.10%033%0.325CS..Hα-helixtrans-59.8-40.6175.5-72.8-53.3000112.9I8 H12 F84 F97 T100 Q104 S149 G150 L151 V155 L156I8-Y153 HydrophobicContact CG2-CD1 3.89Å; I8-Y153 HydrophobicContact CG2-CE1 3.16Å; I8-Y153 HydrophobicContact CG2-CE2 4.17Å; I8-Y153 WeakPolarHBondContact CG2-OH 3.3Å; H12-Y153 AromaticContact ND1-CE2 3.31Å; H12-Y153 VanDerWaalsContact ND1-CE2 3.31Å; H12-Y153 WeakPolarHBondContact ND1-CE2 3.07Å; H12-Y153 AromaticContact ND1-CZ 3.53Å; H12-Y153 PolarHBondContact ND1-OH 2.84Å; F84-Y153 HydrophobicContact CB-CE1 4.47Å; F84-Y153 HydrophobicContact CD1-CE1 4.34Å; F84-Y153 AromaticContact CD2-CD1 3.83Å; F84-Y153 HydrophobicContact CD2-CD1 3.83Å; F84-Y153 AromaticContact CD2-CE1 3.26Å; F84-Y153 HydrophobicContact CD2-CE1 3.26Å; F84-Y153 HydrophobicContact CE1-CE1 4.41Å; F84-Y153 AromaticContact CE2-CD1 3.97Å; F84-Y153 HydrophobicContact CE2-CD1 3.97Å; F84-Y153 AromaticContact CE2-CE1 3.37Å; F84-Y153 HydrophobicContact CE2-CE1 3.37Å; F84-Y153 AromaticContact CG-CE1 3.76Å; F84-Y153 HydrophobicContact CG-CE1 3.76Å; F84-Y153 AromaticContact CZ-CE1 3.92Å; F84-Y153 HydrophobicContact CZ-CE1 3.92Å; F97-Y153 WeakPolarHBondContact CB-O 3.22Å; T100-Y153 HydrophobicContact CG2-CD1 3.73Å; T100-Y153 HydrophobicContact CG2-CD2 3.66Å; T100-Y153 HydrophobicContact CG2-CE1 3.95Å; T100-Y153 HydrophobicContact CG2-CE2 3.89Å; T100-Y153 HydrophobicContact CG2-CG 3.58Å; Q104-Y153 HydrophobicContact CB-CD2 4.41Å; S149-Y153 WeakPolarHBondContact O-CD2 2.95Å; S149-Y153 PolarHBondContact O-N 2.93Å; S149-Y153 VanDerWaalsContact OG-CE2 3.24Å; S149-Y153 WeakPolarHBondContact OG-CE2 3.04Å; G150-Y153 PolarHBondContact O-N 2.04Å; L151-Y153 PolarHBondContact O-N 2.95Å; Y153-V155 VanDerWaalsContact C-N 3.31Å; Y153-V155 PolarHBondContact O-N 2.79Å; Y153-L156 PolarHBondContact O-N 3.36Å
154A91.2Very high90.4Very high30 Ų3068.7 Ų68.725%0.24834%0.335CS..Hα-helixtrans-64.5-34.7179.300000112.8I98 G150 L151 I152I98-A154 HydrophobicContact CD1-CB 4.48Å; I98-A154 WeakPolarHBondContact CD1-O 3.3Å; G150-A154 PolarHBondContact O-N 2.95Å; L151-A154 PolarHBondContact O-N 3.02Å; I152-A154 VanDerWaalsContact C-N 3.32Å; I152-A154 PolarHBondContact O-N 3.5Å
155V90.5Very high89.9Confident123 Ų12369.8 Ų69.875%0.74534%0.335SS*.Hα-helixtrans-85-24178.3178.10000112L151 I152 Y153 R157L151-V155 WeakPolarHBondContact O-CG2 3.46Å; L151-V155 PolarHBondContact O-N 3.18Å; L151-V155 VanDerWaalsContact O-N 3.11Å; I152-V155 PolarHBondContact O-N 3.37Å; Y153-V155 VanDerWaalsContact C-N 3.31Å; Y153-V155 PolarHBondContact O-N 2.79Å; V155-R157 PolarHBondContact O-N 2.98Å
156L88.7Confident89.4Confident30 Ų3071.3 Ų71.316%0.15734%0.341CS..  trans-62.7129.6-176.1-164.371.6000111.5L4 I8 R96 F97 I152 Y153L4-L156 HydrophobicContact CD2-CD1 3.53Å; I8-L156 HydrophobicContact CD1-CD1 4.18Å; I8-L156 HydrophobicContact CD1-CD2 4.07Å; R96-L156 WeakPolarHBondContact CA-O 3.12Å; F97-L156 HydrophobicContact CD2-CB 4.01Å; F97-L156 HydrophobicContact CD2-CD2 3.69Å; F97-L156 HydrophobicContact CD2-CG 3.93Å; F97-L156 HydrophobicContact CE2-CD2 3.75Å; F97-L156 HydrophobicContact CE2-CG 4.13Å; F97-L156 HydrophobicContact CG-CD2 4.33Å; F97-L156 HydrophobicContact CZ-CD2 4.43Å; F97-L156 PolarHBondContact N-O 2.86Å; I152-L156 WeakPolarHBondContact O-CB 3.19Å; I152-L156 PolarHBondContact O-N 3.36Å; Y153-L156 PolarHBondContact O-N 3.36Å
157R86.3Confident88.8Confident157 Ų15776.4 Ų76.459%0.59237%0.365SS*.BIsolated β-bridgetrans-117.6132.5173.3-167.8-179.4-170.4-165.8-2.2109.4G94 G95 R96 V155 R159G94-R157 WeakPolarHBondContact O-CG 3.46Å; G94-R157 PolarHBondContact O-NE 3.36Å; G95-R157 WeakPolarHBondContact O-CA 3.33Å; R96-R157 HydrophobicContact CG-CG 4.47Å; V155-R157 PolarHBondContact O-N 2.98Å; R157-R159 PolarHBondContact O-N 3.31Å
158K81.5Confident88.1Confident49 Ų4978.5 Ų78.521%0.21337%0.373CS..  trans-64.5104.3172.5-172.3168.5179.4172.70108.6L88 L91 G94 G95 F97L88-K158 PolarHBondContact O-NZ 2.83Å; L91-K158 HydrophobicContact CB-CD 4.33Å; L91-K158 HydrophobicContact CD2-CB 4.41Å; L91-K158 WeakPolarHBondContact O-CD 3.24Å; L91-K158 WeakPolarHBondContact O-CE 3.35Å; L91-K158 PolarHBondContact O-NZ 2.96Å; G94-K158 VanDerWaalsContact CA-O 3.31Å; G94-K158 WeakPolarHBondContact CA-O 3.35Å; G94-K158 PolarHBondContact N-O 3.48Å; G95-K158 PolarHBondContact O-N 3.4Å; F97-K158 HydrophobicContact CE2-CB 4.21Å
159R74.3Confident87.3Confident194 Ų19477.9 Ų77.973%0.73237%0.368SS*.  trans-76167.1166.3-64.4-160.1-176.5-154.33.3109.2M1 R157M1-R159 HydrophobicContact CE-CB 3.9Å; M1-R159 WeakPolarHBondContact CE-O 3.41Å; M1-R159 HydrophobicContact SD-CB 3.77Å; R157-R159 PolarHBondContact O-N 3.31Å
160E57.1Low86.5Confident199 Ų19985 Ų8593%0.9340%0.401SS*.  trans-42.60-167.2-66.2-176.6171.100116.5K93K93-E160 VanDerWaalsContact CE-OXT 3.24Å; K93-E160 WeakPolarHBondContact CE-OXT 3.38Å; K93-E160 PolarHBondContact NZ-OXT 2.88Å

Retrieved 160 of 160 residues in 32.1 ms (Link to these results)

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