A0A087Y3Y2_POEFO Loading...

COMM domain containing 2

AlphaFold DB , UniProt , Accession A0A087Y3Y2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 203 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
1M59.7Low75.7Confident160 Ų16087.5 Ų87.579%0.78845%0.451SS*.  0115.20178.3179.6170.700106.3D81M1-D81 PolarHBondContact N-OD1 3.2Å; M1-D81 PolarHBondContact N-OD2 3.18Å
2L69Low76.3Confident96 Ų9684.3 Ų84.350%0.50343%0.433SS..  trans-67.5146.5-177.1-63.8171.4000111.2V4 D84L2-V4 PolarHBondContact O-N 2.97Å; L2-D84 HydrophobicContact CD2-CB 3.63Å
3L75.4Confident76.8Confident23 Ų2378 Ų7812%0.1240%0.4CS..  trans-78.9118.8-179.6-157.9149.5000108.9L5 L68 E71 S72 I77 S85L3-L5 HydrophobicContact CD2-CD1 4.32Å; L3-L5 HydrophobicContact CD2-CD2 3.25Å; L3-L5 HydrophobicContact CD2-CG 3.51Å; L3-L5 PolarHBondContact O-N 3.5Å; L3-L68 HydrophobicContact CD1-CD1 4.35Å; L3-L68 HydrophobicContact CD2-CD1 4.4Å; L3-E71 HydrophobicContact CD1-CB 3.87Å; L3-E71 HydrophobicContact CD2-CB 4.36Å; L3-E71 HydrophobicContact CG-CB 4.34Å; L3-S72 WeakPolarHBondContact CD1-OG 3.28Å; L3-I77 HydrophobicContact CB-CD1 3.76Å; L3-I77 HydrophobicContact CD1-CD1 3.54Å; L3-I77 HydrophobicContact CG-CD1 3.94Å; L3-S85 PolarHBondContact N-OG 3.26Å
4V73.3Confident77.2Confident132 Ų13277 Ų7780%0.840%0.404SS*.  trans-88.8100.8179.6-177.60000108.8L2L2-V4 PolarHBondContact O-N 2.97Å
5L75.8Confident77.5Confident13 Ų1374.4 Ų74.47%0.06839%0.388CS..  trans-86.8136.1174.3-65.6169.7000110.3L3 H9 K10 L13 F67 L68 L89L3-L5 HydrophobicContact CD2-CD1 4.32Å; L3-L5 HydrophobicContact CD2-CD2 3.25Å; L3-L5 HydrophobicContact CD2-CG 3.51Å; L3-L5 PolarHBondContact O-N 3.5Å; L5-H9 HydrophobicContact CB-CB 4.41Å; L5-H9 HydrophobicContact CD2-CB 4.31Å; L5-K10 HydrophobicContact CB-CG 4.14Å; L5-K10 WeakPolarHBondContact O-CE 3.39Å; L5-L13 HydrophobicContact CD1-CD1 4.14Å; L5-F67 HydrophobicContact CD2-CD1 3.85Å; L5-F67 HydrophobicContact CD2-CE1 3.74Å; L5-L68 HydrophobicContact CD1-CD1 4.31Å; L5-L89 HydrophobicContact CD1-CD1 3.64Å; L5-L89 HydrophobicContact CD1-CD2 3.72Å; L5-L89 HydrophobicContact CD1-CG 4.1Å
6S79.2Confident77.7Confident54 Ų5469.8 Ų69.838%0.37836%0.364SS..  trans-67.9159.3169.865.60000110.9D8 H9 K10S6-D8 VanDerWaalsContact C-N 3.3Å; S6-D8 PolarHBondContact O-N 3.49Å; S6-H9 PolarHBondContact O-N 3.07Å; S6-H9 VanDerWaalsContact O-N 3.09Å; S6-H9 PolarHBondContact OG-ND1 3Å; S6-K10 PolarHBondContact O-N 3.35Å; S6-K10 VanDerWaalsContact O-N 3.13Å
7E77.5Confident77.9Confident118 Ų11868.7 Ų68.755%0.55136%0.361SS*.Hα-helixtrans-57-42.8-179.9-63.1-54.2130.700112H9 K10 E11E7-H9 VanDerWaalsContact C-N 3.29Å; E7-H9 PolarHBondContact O-N 3.36Å; E7-K10 WeakPolarHBondContact O-CA 3.38Å; E7-K10 WeakPolarHBondContact O-CB 3.47Å; E7-K10 PolarHBondContact O-N 3.02Å; E7-K10 IonicContact OE1-NZ 3.82Å; E7-K10 PolarHBondContact OE1-NZ 3.25Å; E7-K10 IonicContact OE2-NZ 2.85Å; E7-E11 PolarHBondContact O-N 3.16Å
8D78.7Confident78.1Confident106 Ų10675 Ų7557%0.56739%0.385SS*.Hα-helixtrans-56.6-39.8175.7-51.7-14.5000112.9S6 E11 H12S6-D8 VanDerWaalsContact C-N 3.3Å; S6-D8 PolarHBondContact O-N 3.49Å; D8-E11 PolarHBondContact O-N 2.64Å; D8-H12 PolarHBondContact O-CD2 3.22Å; D8-H12 VanDerWaalsContact O-CG 3.26Å; D8-H12 PolarHBondContact O-N 3.19Å
9H79.9Confident78.1Confident47 Ų4772.2 Ų72.222%0.21837%0.374CS..Hα-helixtrans-70.6-34.5177.6-70.6116.2000112L5 S6 E7 E11 H12 L13 F67L5-H9 HydrophobicContact CB-CB 4.41Å; L5-H9 HydrophobicContact CD2-CB 4.31Å; S6-H9 PolarHBondContact O-N 3.07Å; S6-H9 VanDerWaalsContact O-N 3.09Å; S6-H9 PolarHBondContact OG-ND1 3Å; E7-H9 VanDerWaalsContact C-N 3.29Å; E7-H9 PolarHBondContact O-N 3.36Å; H9-E11 VanDerWaalsContact C-N 3.33Å; H9-H12 PolarHBondContact O-N 2.93Å; H9-L13 WeakPolarHBondContact O-CG 3.43Å; H9-L13 PolarHBondContact O-N 3.38Å; H9-L13 VanDerWaalsContact O-N 3.11Å; H9-F67 AromaticContact CD2-CD1 3.73Å; H9-F67 AromaticContact CD2-CG 3.92Å; H9-F67 AromaticContact CE1-CD1 3.93Å; H9-F67 AromaticContact CE1-CE1 3.67Å; H9-F67 AromaticContact CE1-CE2 3.95Å; H9-F67 AromaticContact CE1-CZ 3.68Å; H9-F67 AromaticContact CG-CD1 3.92Å; H9-F67 AromaticContact ND1-CE1 3.71Å; H9-F67 AromaticContact NE2-CD1 3.76Å; H9-F67 AromaticContact NE2-CD2 3.84Å; H9-F67 AromaticContact NE2-CE1 3.98Å; H9-F67 AromaticContact NE2-CG 3.67Å
10K81.8Confident78.3Confident82 Ų8274.6 Ų74.636%0.35739%0.387SS..Hα-helixtrans-65.6-40.2173.4-62.3176.9-173.8167.70110.6L5 S6 E7 L13 S14 L89L5-K10 HydrophobicContact CB-CG 4.14Å; L5-K10 WeakPolarHBondContact O-CE 3.39Å; S6-K10 PolarHBondContact O-N 3.35Å; S6-K10 VanDerWaalsContact O-N 3.13Å; E7-K10 WeakPolarHBondContact O-CA 3.38Å; E7-K10 WeakPolarHBondContact O-CB 3.47Å; E7-K10 PolarHBondContact O-N 3.02Å; E7-K10 IonicContact OE1-NZ 3.82Å; E7-K10 PolarHBondContact OE1-NZ 3.25Å; E7-K10 IonicContact OE2-NZ 2.85Å; K10-L13 PolarHBondContact O-N 2.87Å; K10-S14 PolarHBondContact O-N 3.43Å; K10-L89 HydrophobicContact CB-CD2 4.29Å; K10-L89 HydrophobicContact CG-CD2 3.82Å
11E82.3Confident78.3Confident131 Ų13172.9 Ų72.961%0.61239%0.388SS*.Hα-helixtrans-61.7-45174.8-70.6-175.2179.600111.7E7 D8 H9 L13 S14E7-E11 PolarHBondContact O-N 3.16Å; D8-E11 PolarHBondContact O-N 2.64Å; H9-E11 VanDerWaalsContact C-N 3.33Å; E11-L13 VanDerWaalsContact C-N 3.28Å; E11-L13 PolarHBondContact O-N 3.39Å; E11-S14 WeakPolarHBondContact O-CB 3.44Å; E11-S14 PolarHBondContact O-N 2.79Å; E11-S14 VanDerWaalsContact O-N 3.15Å; E11-S14 PolarHBondContact O-OG 2.89Å
12H82.9Confident79.4Confident50 Ų5069.2 Ų69.223%0.23138%0.378CS..Hα-helixtrans-60-36.3176.2-69.7176.2000113.2D8 H9 H60D8-H12 PolarHBondContact O-CD2 3.22Å; D8-H12 VanDerWaalsContact O-CG 3.26Å; D8-H12 PolarHBondContact O-N 3.19Å; H9-H12 PolarHBondContact O-N 2.93Å; H12-H60 HydrophobicContact CB-CB 4.03Å; H12-H60 AromaticContact CD2-CG 3.66Å; H12-H60 AromaticContact CD2-ND1 3.71Å; H12-H60 AromaticContact CE1-ND1 3.48Å; H12-H60 PolarHBondContact CE1-ND1 3.46Å; H12-H60 AromaticContact ND1-ND1 3.96Å; H12-H60 AromaticContact NE2-CE1 3.67Å; H12-H60 AromaticContact NE2-CG 3.71Å; H12-H60 AromaticContact NE2-ND1 3.27Å; H12-H60 PolarHBondContact NE2-ND1 3.39Å
13L83.1Confident80.2Confident2 Ų265.8 Ų65.81%0.0136%0.361CS..Hα-helixtrans-82.8-18.7178.5-66.9172.3000113L5 H9 K10 E11 F15 L16 L65 L89 F91L5-L13 HydrophobicContact CD1-CD1 4.14Å; H9-L13 WeakPolarHBondContact O-CG 3.43Å; H9-L13 PolarHBondContact O-N 3.38Å; H9-L13 VanDerWaalsContact O-N 3.11Å; K10-L13 PolarHBondContact O-N 2.87Å; E11-L13 VanDerWaalsContact C-N 3.28Å; E11-L13 PolarHBondContact O-N 3.39Å; L13-F15 PolarHBondContact O-N 3.33Å; L13-L16 HydrophobicContact CD2-CD1 3.69Å; L13-L16 WeakPolarHBondContact O-CB 3.18Å; L13-L16 PolarHBondContact O-N 3.27Å; L13-L65 HydrophobicContact CD2-CD2 4.18Å; L13-L65 HydrophobicContact CD2-CG 4.26Å; L13-L89 HydrophobicContact CD1-CD1 3.76Å; L13-L89 HydrophobicContact CD1-CD2 4.49Å; L13-F91 HydrophobicContact CB-CZ 4.3Å
14S81.9Confident80.7Confident64 Ų6464.7 Ų64.745%0.44836%0.355SS..Hα-helixtrans-59.9-31.9-176.974.50000113.3K10 E11 L16 T17K10-S14 PolarHBondContact O-N 3.43Å; E11-S14 WeakPolarHBondContact O-CB 3.44Å; E11-S14 PolarHBondContact O-N 2.79Å; E11-S14 VanDerWaalsContact O-N 3.15Å; E11-S14 PolarHBondContact O-OG 2.89Å; S14-L16 VanDerWaalsContact C-N 3.27Å; S14-L16 PolarHBondContact O-N 3.48Å; S14-T17 PolarHBondContact O-N 3Å; S14-T17 PolarHBondContact O-OG1 2.96Å
15F81.4Confident81.2Confident38 Ų3861.6 Ų61.617%0.16733%0.332CS..G310 helixtrans-62.7-35.3175.5168.4-112.4000112.1L13 T17 K18 F27 V53 M57L13-F15 PolarHBondContact O-N 3.33Å; F15-T17 VanDerWaalsContact C-N 3.26Å; F15-T17 PolarHBondContact O-N 3.48Å; F15-K18 PolarHBondContact O-N 3Å; F15-F27 HydrophobicContact CE1-CE2 4.21Å; F15-V53 HydrophobicContact CE2-CG1 4.03Å; F15-V53 HydrophobicContact CZ-CB 4.5Å; F15-V53 HydrophobicContact CZ-CG1 4.02Å; F15-V53 HydrophobicContact CZ-CG2 4.2Å; F15-M57 HydrophobicContact CB-SD 4.18Å; F15-M57 HydrophobicContact CD2-CE 4.43Å; F15-M57 HydrophobicContact CD2-SD 3.39Å; F15-M57 WeakPolarHBondContact CD2-SD 3.5Å; F15-M57 HydrophobicContact CE2-CE 4.45Å; F15-M57 HydrophobicContact CE2-SD 3.9Å; F15-M57 HydrophobicContact CG-SD 3.8Å
16L81.1Confident81.8Confident0 Ų065.4 Ų65.40%035%0.35CS..G310 helixtrans-71.9-20.9-176.1-58175.9000112.8L13 S14 K18 A19 V24 F27 L65 F91L13-L16 HydrophobicContact CD2-CD1 3.69Å; L13-L16 WeakPolarHBondContact O-CB 3.18Å; L13-L16 PolarHBondContact O-N 3.27Å; S14-L16 VanDerWaalsContact C-N 3.27Å; S14-L16 PolarHBondContact O-N 3.48Å; L16-K18 PolarHBondContact O-N 3.37Å; L16-A19 PolarHBondContact O-N 3.4Å; L16-V24 HydrophobicContact CB-CG2 4.26Å; L16-V24 HydrophobicContact CD2-CG2 4.44Å; L16-F27 HydrophobicContact CD2-CD2 3.55Å; L16-F27 HydrophobicContact CD2-CE2 3.98Å; L16-L65 HydrophobicContact CD1-CD1 3.81Å; L16-L65 HydrophobicContact CD1-CD2 3.96Å; L16-L65 HydrophobicContact CD1-CG 3.67Å; L16-F91 HydrophobicContact CB-CE1 3.54Å; L16-F91 HydrophobicContact CB-CZ 3.88Å; L16-F91 HydrophobicContact CD1-CZ 4.36Å
17T81.6Confident82.4Confident52 Ų5263 Ų6332%0.31933%0.333SS..G310 helixtrans-67.7-21.7174.865.70000112.7S14 F15 F91S14-T17 PolarHBondContact O-N 3Å; S14-T17 PolarHBondContact O-OG1 2.96Å; F15-T17 VanDerWaalsContact C-N 3.26Å; F15-T17 PolarHBondContact O-N 3.48Å; T17-F91 HydrophobicContact CG2-CD1 4.29Å; T17-F91 HydrophobicContact CG2-CE1 4.28Å; T17-F91 HydrophobicContact CG2-CG 4.46Å; T17-F91 HydrophobicContact CG2-CZ 4.43Å
18K80.3Confident82.9Confident182 Ų18257.4 Ų57.479%0.79131%0.306SS*.G310 helixtrans-99.8-8.3179-61.3176.9-177.1172.60113.2F15 L16F15-K18 PolarHBondContact O-N 3Å; L16-K18 PolarHBondContact O-N 3.37Å
19A78.7Confident83.4Confident21 Ų2158.1 Ų58.117%0.17430%0.301CS..SBendtrans-87.8151.5-177.800000111L16 V24L16-A19 PolarHBondContact O-N 3.4Å; A19-V24 HydrophobicContact CB-CG2 4.05Å
20D81.6Confident83.9Confident120 Ų12056.8 Ų56.864%0.64230%0.295SS*.  trans-62.6148.8177.1-69.5-39.7000111.9S22 V23 V24D20-S22 VanDerWaalsContact C-N 3.25Å; D20-S22 PolarHBondContact O-N 2.98Å; D20-V23 HydrophobicContact CB-CG2 4.16Å; D20-V23 WeakPolarHBondContact O-CB 3.46Å; D20-V23 PolarHBondContact O-N 3.33Å; D20-V24 PolarHBondContact O-N 3.25Å
21G79.4Confident84.4Confident39 Ų3952.9 Ų52.940%0.40228%0.278SS..Hα-helixtrans-52.2-41.8-178.500000114.3V23 V24 E25G21-V23 VanDerWaalsContact C-N 3.32Å; G21-V23 PolarHBondContact O-N 3.21Å; G21-V24 PolarHBondContact O-N 3.09Å; G21-E25 PolarHBondContact O-N 2.99Å
22S83.6Confident84.7Confident84 Ų8447 Ų4759%0.58725%0.251SS*.Hα-helixtrans-66.3-32.117958.60000113.3D20 E26D20-S22 VanDerWaalsContact C-N 3.25Å; D20-S22 PolarHBondContact O-N 2.98Å; S22-E26 PolarHBondContact O-N 3.35Å; S22-E26 VanDerWaalsContact O-N 3.14Å
23V85.4Confident85Confident23 Ų2348.4 Ų48.414%0.13926%0.258CS..Hα-helixtrans-73.3-43179.2177.80000110.1D20 G21 E25 E26 F27 L51D20-V23 HydrophobicContact CB-CG2 4.16Å; D20-V23 WeakPolarHBondContact O-CB 3.46Å; D20-V23 PolarHBondContact O-N 3.33Å; G21-V23 VanDerWaalsContact C-N 3.32Å; G21-V23 PolarHBondContact O-N 3.21Å; V23-E25 VanDerWaalsContact C-N 3.32Å; V23-E25 PolarHBondContact O-N 3.34Å; V23-E26 PolarHBondContact O-N 3.02Å; V23-F27 HydrophobicContact CG1-CD2 4.14Å; V23-F27 HydrophobicContact CG1-CE1 4.14Å; V23-F27 HydrophobicContact CG1-CE2 3.74Å; V23-F27 HydrophobicContact CG1-CZ 3.76Å; V23-F27 VanDerWaalsContact O-CG 3.3Å; V23-F27 WeakPolarHBondContact O-CG 3.43Å; V23-F27 PolarHBondContact O-N 3.13Å; V23-L51 HydrophobicContact CB-CD2 4.43Å; V23-L51 HydrophobicContact CG1-CD1 3.65Å; V23-L51 HydrophobicContact CG1-CD2 3.79Å; V23-L51 HydrophobicContact CG1-CG 4.37Å; V23-L51 HydrophobicContact CG2-CD2 3.72Å
24V84.5Confident85.4Confident0 Ų048.8 Ų48.80%026%0.259CS..Hα-helixtrans-65.1-38.3177.1-178.20000110.9L16 A19 D20 G21 F27 G28 L95 L99L16-V24 HydrophobicContact CB-CG2 4.26Å; L16-V24 HydrophobicContact CD2-CG2 4.44Å; A19-V24 HydrophobicContact CB-CG2 4.05Å; D20-V24 PolarHBondContact O-N 3.25Å; G21-V24 PolarHBondContact O-N 3.09Å; V24-F27 PolarHBondContact O-N 3.28Å; V24-G28 PolarHBondContact O-N 3.43Å; V24-L95 HydrophobicContact CB-CD2 3.58Å; V24-L95 HydrophobicContact CG1-CD2 3.85Å; V24-L95 HydrophobicContact CG2-CD2 3.91Å; V24-L99 HydrophobicContact CG1-CD2 4.35Å
25E85.4Confident85.7Confident67 Ų6747.8 Ų47.831%0.31325%0.249SC..Hα-helixtrans-62-45.6174.7-164-169.8161.500111.5G21 V23 F27 G28 R29G21-E25 PolarHBondContact O-N 2.99Å; V23-E25 VanDerWaalsContact C-N 3.32Å; V23-E25 PolarHBondContact O-N 3.34Å; E25-F27 VanDerWaalsContact C-N 3.34Å; E25-F27 PolarHBondContact O-N 3.11Å; E25-G28 PolarHBondContact O-N 3.15Å; E25-R29 WeakPolarHBondContact O-CG 3.48Å; E25-R29 PolarHBondContact O-N 3.35Å; E25-R29 IonicContact OE1-CZ 2.73Å; E25-R29 IonicContact OE1-NE 3.53Å; E25-R29 IonicContact OE1-NH2 3.5Å; E25-R29 PolarHBondContact OE1-NH2 2.91Å
26E88.1Confident85.8Confident94 Ų9451.9 Ų51.944%0.43926%0.263SS..Hα-helixtrans-63.9-40.1176.9-171.366.4-177.200111.6S22 V23 G28 R29 I30S22-E26 PolarHBondContact O-N 3.35Å; S22-E26 VanDerWaalsContact O-N 3.14Å; V23-E26 PolarHBondContact O-N 3.02Å; E26-G28 VanDerWaalsContact C-N 3.33Å; E26-G28 PolarHBondContact O-N 2.92Å; E26-R29 WeakPolarHBondContact O-CB 3.22Å; E26-R29 PolarHBondContact O-N 3.33Å; E26-R29 IonicContact OE2-NH1 3.79Å; E26-I30 HydrophobicContact CG-CD1 4.18Å; E26-I30 VanDerWaalsContact O-CG1 3.3Å; E26-I30 WeakPolarHBondContact O-CG1 3.35Å; E26-I30 PolarHBondContact O-N 3.2Å
27F90.6Very high86Confident4 Ų459.6 Ų59.62%0.01830%0.296CS..Hα-helixtrans-64.2-37.3173.3-70.7-10000112.7F15 L16 V23 V24 E25 R29 I30 A31 A47 L51 V58 V62 L65F15-F27 HydrophobicContact CE1-CE2 4.21Å; L16-F27 HydrophobicContact CD2-CD2 3.55Å; L16-F27 HydrophobicContact CD2-CE2 3.98Å; V23-F27 HydrophobicContact CG1-CD2 4.14Å; V23-F27 HydrophobicContact CG1-CE1 4.14Å; V23-F27 HydrophobicContact CG1-CE2 3.74Å; V23-F27 HydrophobicContact CG1-CZ 3.76Å; V23-F27 VanDerWaalsContact O-CG 3.3Å; V23-F27 WeakPolarHBondContact O-CG 3.43Å; V23-F27 PolarHBondContact O-N 3.13Å; V24-F27 PolarHBondContact O-N 3.28Å; E25-F27 VanDerWaalsContact C-N 3.34Å; E25-F27 PolarHBondContact O-N 3.11Å; F27-R29 VanDerWaalsContact C-N 3.34Å; F27-I30 HydrophobicContact CD1-CD1 4.27Å; F27-I30 PolarHBondContact O-N 2.7Å; F27-A31 VanDerWaalsContact O-CB 3.29Å; F27-A31 WeakPolarHBondContact O-CB 3.39Å; F27-A31 PolarHBondContact O-N 3.28Å; F27-A47 HydrophobicContact CE1-CB 4.06Å; F27-L51 HydrophobicContact CE1-CD1 3.91Å; F27-L51 HydrophobicContact CE2-CD1 4.21Å; F27-L51 HydrophobicContact CZ-CD1 3.3Å; F27-V58 HydrophobicContact CE1-CG1 3.92Å; F27-V58 HydrophobicContact CZ-CG1 3.79Å; F27-V58 HydrophobicContact CZ-CG2 4.34Å; F27-V62 HydrophobicContact CB-CG2 4.17Å; F27-V62 HydrophobicContact CD1-CG2 4.18Å; F27-V62 HydrophobicContact CG-CG2 4.11Å; F27-L65 HydrophobicContact CB-CD1 3.78Å
28G88.8Confident86.1Confident0 Ų059 Ų590%030%0.301CS..Hα-helixtrans-60.3-43.1171.600000111.8V24 E25 E26 A31 L32V24-G28 PolarHBondContact O-N 3.43Å; E25-G28 PolarHBondContact O-N 3.15Å; E26-G28 VanDerWaalsContact C-N 3.33Å; E26-G28 PolarHBondContact O-N 2.92Å; G28-A31 WeakPolarHBondContact O-CB 3.5Å; G28-A31 PolarHBondContact O-N 3.18Å; G28-L32 VanDerWaalsContact O-CG 3.28Å; G28-L32 WeakPolarHBondContact O-CG 3.49Å; G28-L32 PolarHBondContact O-N 3.15Å
29R88.9Confident86.5Confident121 Ų12154.6 Ų54.646%0.45729%0.29SS..Hα-helixtrans-65-43.9175.3-66.5174.7-169.6175.90.6112.2E25 E26 F27 A31 L32 E33 L102E25-R29 WeakPolarHBondContact O-CG 3.48Å; E25-R29 PolarHBondContact O-N 3.35Å; E25-R29 IonicContact OE1-CZ 2.73Å; E25-R29 IonicContact OE1-NE 3.53Å; E25-R29 IonicContact OE1-NH2 3.5Å; E25-R29 PolarHBondContact OE1-NH2 2.91Å; E26-R29 WeakPolarHBondContact O-CB 3.22Å; E26-R29 PolarHBondContact O-N 3.33Å; E26-R29 IonicContact OE2-NH1 3.79Å; F27-R29 VanDerWaalsContact C-N 3.34Å; R29-A31 VanDerWaalsContact C-N 3.34Å; R29-L32 PolarHBondContact O-N 3.19Å; R29-E33 PolarHBondContact O-N 3.2Å; R29-L102 HydrophobicContact CG-CD2 4.48Å
30I90.5Very high87Confident18 Ų1856.7 Ų56.79%0.09230%0.298CS..Hα-helixtrans-62-43.6176.4-68.1165.4000110.5E26 F27 L32 E33 F34 I43 V62E26-I30 HydrophobicContact CG-CD1 4.18Å; E26-I30 VanDerWaalsContact O-CG1 3.3Å; E26-I30 WeakPolarHBondContact O-CG1 3.35Å; E26-I30 PolarHBondContact O-N 3.2Å; F27-I30 HydrophobicContact CD1-CD1 4.27Å; F27-I30 PolarHBondContact O-N 2.7Å; I30-L32 VanDerWaalsContact C-N 3.31Å; I30-L32 PolarHBondContact O-N 3.38Å; I30-E33 PolarHBondContact O-N 3.33Å; I30-F34 HydrophobicContact CG2-CD2 3.84Å; I30-F34 HydrophobicContact CG2-CE1 4.2Å; I30-F34 HydrophobicContact CG2-CE2 3.43Å; I30-F34 VanDerWaalsContact CG2-CE2 3.43Å; I30-F34 HydrophobicContact CG2-CG 4.37Å; I30-F34 HydrophobicContact CG2-CZ 3.66Å; I30-F34 WeakPolarHBondContact O-CG 3.42Å; I30-F34 PolarHBondContact O-N 2.73Å; I30-I43 HydrophobicContact CD1-CG2 3.87Å; I30-I43 HydrophobicContact CG1-CG2 4.24Å; I30-I43 HydrophobicContact CG2-CG2 4.03Å; I30-V62 HydrophobicContact CG2-CG1 4.05Å; I30-V62 HydrophobicContact CG2-CG2 4.48Å
31A91.4Very high87.4Confident0 Ų055 Ų550%029%0.293CS..Hα-helixtrans-57-45.9175.800000111.3F27 G28 R29 F34 L35 V62 L65 M66F27-A31 VanDerWaalsContact O-CB 3.29Å; F27-A31 WeakPolarHBondContact O-CB 3.39Å; F27-A31 PolarHBondContact O-N 3.28Å; G28-A31 WeakPolarHBondContact O-CB 3.5Å; G28-A31 PolarHBondContact O-N 3.18Å; R29-A31 VanDerWaalsContact C-N 3.34Å; A31-F34 PolarHBondContact O-N 2.97Å; A31-L35 WeakPolarHBondContact O-CG 3.29Å; A31-L35 PolarHBondContact O-N 2.85Å; A31-V62 HydrophobicContact CB-CG1 4.15Å; A31-L65 HydrophobicContact CB-CB 4.01Å; A31-M66 HydrophobicContact CB-CB 4.44Å; A31-M66 HydrophobicContact CB-CG 3.51Å
32L89.5Confident87.9Confident8 Ų860.6 Ų60.64%0.04231%0.307CS..Hα-helixtrans-65.6-38.6176.7-69.2166.8000112.9G28 R29 I30 L35 R36 L102 H106 I110G28-L32 VanDerWaalsContact O-CG 3.28Å; G28-L32 WeakPolarHBondContact O-CG 3.49Å; G28-L32 PolarHBondContact O-N 3.15Å; R29-L32 PolarHBondContact O-N 3.19Å; I30-L32 VanDerWaalsContact C-N 3.31Å; I30-L32 PolarHBondContact O-N 3.38Å; L32-L35 PolarHBondContact O-N 3.3Å; L32-R36 WeakPolarHBondContact O-CG 3.31Å; L32-R36 PolarHBondContact O-N 2.98Å; L32-L102 HydrophobicContact CD1-CB 4.4Å; L32-L102 HydrophobicContact CD1-CD2 4.03Å; L32-H106 HydrophobicContact CD1-CB 4.33Å; L32-H106 WeakPolarHBondContact CD1-CD2 3.5Å; L32-H106 HydrophobicContact CD2-CB 3.74Å; L32-I110 HydrophobicContact CD2-CD1 3.73Å; L32-I110 HydrophobicContact CD2-CG1 4.3Å
33E89.8Confident88.1Confident79 Ų7959.2 Ų59.237%0.36929%0.292SS..Hα-helixtrans-63.6-41.9173.7-77.9-140.2119.300112R29 I30 R36 K37R29-E33 PolarHBondContact O-N 3.2Å; I30-E33 PolarHBondContact O-N 3.33Å; E33-R36 PolarHBondContact O-N 3.41Å; E33-K37 PolarHBondContact O-N 2.91Å; E33-K37 IonicContact OE1-NZ 2.68Å; E33-K37 PolarHBondContact OE1-NZ 3.31Å
34F91.3Very high88.3Confident11 Ų1158.7 Ų58.75%0.04829%0.288CS..Hα-helixtrans-66.6-35.9177.8-72.3-13.6000113.1I30 A31 R36 G38 T39 N40 I43 Y44 V62 M66I30-F34 HydrophobicContact CG2-CD2 3.84Å; I30-F34 HydrophobicContact CG2-CE1 4.2Å; I30-F34 HydrophobicContact CG2-CE2 3.43Å; I30-F34 VanDerWaalsContact CG2-CE2 3.43Å; I30-F34 HydrophobicContact CG2-CG 4.37Å; I30-F34 HydrophobicContact CG2-CZ 3.66Å; I30-F34 WeakPolarHBondContact O-CG 3.42Å; I30-F34 PolarHBondContact O-N 2.73Å; A31-F34 PolarHBondContact O-N 2.97Å; F34-R36 PolarHBondContact O-N 3.37Å; F34-G38 WeakPolarHBondContact CD1-O 3.33Å; F34-G38 VanDerWaalsContact O-CA 3.28Å; F34-G38 WeakPolarHBondContact O-CA 3.34Å; F34-G38 PolarHBondContact O-N 3.49Å; F34-T39 HydrophobicContact CB-CG2 4.24Å; F34-T39 HydrophobicContact CD2-CG2 4.08Å; F34-T39 HydrophobicContact CG-CG2 4.2Å; F34-N40 HydrophobicContact CE1-CB 3.89Å; F34-N40 VanDerWaalsContact CE1-N 3.31Å; F34-N40 HydrophobicContact CZ-CB 4.31Å; F34-I43 HydrophobicContact CE1-CD1 3.88Å; F34-I43 HydrophobicContact CZ-CB 4.04Å; F34-I43 HydrophobicContact CZ-CD1 4.16Å; F34-I43 HydrophobicContact CZ-CG2 4.29Å; F34-Y44 HydrophobicContact CD2-CE1 4.4Å; F34-Y44 WeakPolarHBondContact CD2-OH 3.46Å; F34-Y44 HydrophobicContact CE2-CD1 4.37Å; F34-Y44 AromaticContact CE2-CE1 3.54Å; F34-Y44 HydrophobicContact CE2-CE1 3.54Å; F34-Y44 HydrophobicContact CE2-CE2 4.16Å; F34-Y44 AromaticContact CE2-CZ 3.4Å; F34-Y44 VanDerWaalsContact CE2-CZ 3.4Å; F34-Y44 VanDerWaalsContact CE2-OH 3.29Å; F34-Y44 WeakPolarHBondContact CE2-OH 3.45Å; F34-Y44 HydrophobicContact CZ-CE1 4.39Å; F34-V62 HydrophobicContact CD2-CG1 3.84Å; F34-V62 HydrophobicContact CE2-CG1 4.05Å; F34-M66 HydrophobicContact CB-CE 3.79Å; F34-M66 HydrophobicContact CB-SD 3.69Å; F34-M66 HydrophobicContact CD2-SD 4.08Å; F34-M66 HydrophobicContact CG-SD 4.42Å
35L87.4Confident88.6Confident42 Ų4263.5 Ų63.522%0.2231%0.31CS..Hα-helixtrans-61-26171.4-71.8172.9000112.6A31 L32 M66 M69 T70 I110A31-L35 WeakPolarHBondContact O-CG 3.29Å; A31-L35 PolarHBondContact O-N 2.85Å; L32-L35 PolarHBondContact O-N 3.3Å; L35-M66 HydrophobicContact CD2-CB 4.35Å; L35-M66 HydrophobicContact CD2-CE 3.72Å; L35-M66 HydrophobicContact CG-CB 4.47Å; L35-M66 HydrophobicContact CG-CE 3.99Å; L35-M66 HydrophobicContact CG-CG 4.29Å; L35-M69 HydrophobicContact CD1-CB 4.41Å; L35-T70 WeakPolarHBondContact CD2-OG1 3.5Å; L35-I110 HydrophobicContact CD1-CD1 4.05Å; L35-I110 HydrophobicContact CD1-CG1 4.21Å
36R84.1Confident88.7Confident124 Ų12461.8 Ų61.847%0.46831%0.311SS..Hα-helixtrans-92.3-44.5179.8-66178.6-172.2154.19.2113.9L32 E33 F34 H106L32-R36 WeakPolarHBondContact O-CG 3.31Å; L32-R36 PolarHBondContact O-N 2.98Å; E33-R36 PolarHBondContact O-N 3.41Å; F34-R36 PolarHBondContact O-N 3.37Å; R36-H106 PolarHBondContact NH2-CE1 3.19Å; R36-H106 PolarHBondContact NH2-ND1 3.22Å
37K85.5Confident88.7Confident162 Ų16258 Ų5870%0.70430%0.295SS*.Hα-helixtrans-111.4-6.9-167.2-62.8174.2-174.91610113.5E33E33-K37 PolarHBondContact O-N 2.91Å; E33-K37 IonicContact OE1-NZ 2.68Å; E33-K37 PolarHBondContact OE1-NZ 3.31Å
38G83.9Confident88.6Confident41 Ų4158 Ų5842%0.42330%0.296SS..  trans88.1164.8-170.400000112.9F34F34-G38 WeakPolarHBondContact CD1-O 3.33Å; F34-G38 VanDerWaalsContact O-CA 3.28Å; F34-G38 WeakPolarHBondContact O-CA 3.34Å; F34-G38 PolarHBondContact O-N 3.49Å
39T88.6Confident88.6Confident89 Ų8967.2 Ų67.255%0.54633%0.331SS..  trans-75.7143.9-176.551.10000112F34F34-T39 HydrophobicContact CB-CG2 4.24Å; F34-T39 HydrophobicContact CD2-CG2 4.08Å; F34-T39 HydrophobicContact CG-CG2 4.2Å
40N89.5Confident88.5Confident65 Ų6570.1 Ų70.135%0.34835%0.347SS..  trans-127.7112.5176.9-176.1-10.9000110.9F34 K42 I43F34-N40 HydrophobicContact CE1-CB 3.89Å; F34-N40 VanDerWaalsContact CE1-N 3.31Å; F34-N40 HydrophobicContact CZ-CB 4.31Å; N40-K42 PolarHBondContact O-N 2.96Å; N40-K42 WeakPolarHBondContact OD1-CB 3.42Å; N40-K42 PolarHBondContact OD1-N 2.87Å; N40-K42 VanDerWaalsContact OD1-N 3.15Å; N40-I43 HydrophobicContact CB-CD1 4.18Å; N40-I43 HydrophobicContact CB-CG1 4.18Å; N40-I43 PolarHBondContact O-N 3.28Å
41P88.5Confident88.2Confident84 Ų8472.2 Ų72.255%0.54536%0.358SS..Hα-helixtrans-63-27.8-174.624.3-33.4000113.7I43 Y44 E45P41-I43 PolarHBondContact O-N 3.49Å; P41-Y44 WeakPolarHBondContact O-CB 3.3Å; P41-Y44 PolarHBondContact O-N 3.43Å; P41-E45 PolarHBondContact O-N 3.08Å
42K90Very high87.9Confident157 Ų15777.9 Ų77.968%0.68340%0.396SS*.Hα-helixtrans-64.2-30.3179.8-63.7-177.8178.4179.40112.8N40 G46N40-K42 PolarHBondContact O-N 2.96Å; N40-K42 WeakPolarHBondContact OD1-CB 3.42Å; N40-K42 PolarHBondContact OD1-N 2.87Å; N40-K42 VanDerWaalsContact OD1-N 3.15Å; K42-G46 PolarHBondContact O-N 3.42Å
43I88.9Confident87.8Confident54 Ų5479 Ų7928%0.27740%0.403SS..Hα-helixtrans-71.7-39179.3-59.6-173.9000109.8I30 F34 N40 P41 G46 A47I30-I43 HydrophobicContact CD1-CG2 3.87Å; I30-I43 HydrophobicContact CG1-CG2 4.24Å; I30-I43 HydrophobicContact CG2-CG2 4.03Å; F34-I43 HydrophobicContact CE1-CD1 3.88Å; F34-I43 HydrophobicContact CZ-CB 4.04Å; F34-I43 HydrophobicContact CZ-CD1 4.16Å; F34-I43 HydrophobicContact CZ-CG2 4.29Å; N40-I43 HydrophobicContact CB-CD1 4.18Å; N40-I43 HydrophobicContact CB-CG1 4.18Å; N40-I43 PolarHBondContact O-N 3.28Å; P41-I43 PolarHBondContact O-N 3.49Å; I43-G46 PolarHBondContact O-N 3.2Å; I43-A47 WeakPolarHBondContact O-CB 3.44Å; I43-A47 PolarHBondContact O-N 2.83Å
44Y89.6Confident87.7Confident12 Ų1279.2 Ų79.25%0.04741%0.412CS..Hα-helixtrans-61-46.9173.6-60.7-50.7000111.6F34 P41 G46 A47 A48 V58 Q59 V62F34-Y44 HydrophobicContact CD2-CE1 4.4Å; F34-Y44 WeakPolarHBondContact CD2-OH 3.46Å; F34-Y44 HydrophobicContact CE2-CD1 4.37Å; F34-Y44 AromaticContact CE2-CE1 3.54Å; F34-Y44 HydrophobicContact CE2-CE1 3.54Å; F34-Y44 HydrophobicContact CE2-CE2 4.16Å; F34-Y44 AromaticContact CE2-CZ 3.4Å; F34-Y44 VanDerWaalsContact CE2-CZ 3.4Å; F34-Y44 VanDerWaalsContact CE2-OH 3.29Å; F34-Y44 WeakPolarHBondContact CE2-OH 3.45Å; F34-Y44 HydrophobicContact CZ-CE1 4.39Å; P41-Y44 WeakPolarHBondContact O-CB 3.3Å; P41-Y44 PolarHBondContact O-N 3.43Å; Y44-G46 VanDerWaalsContact C-N 3.34Å; Y44-G46 PolarHBondContact O-N 3.17Å; Y44-A47 PolarHBondContact O-N 2.76Å; Y44-A48 WeakPolarHBondContact O-CB 3.42Å; Y44-A48 PolarHBondContact O-N 3.37Å; Y44-V58 HydrophobicContact CD1-CG1 4.18Å; Y44-Q59 HydrophobicContact CD1-CB 4.33Å; Y44-Q59 HydrophobicContact CD2-CG 4.43Å; Y44-Q59 HydrophobicContact CE1-CB 4.35Å; Y44-Q59 HydrophobicContact CE1-CG 4.4Å; Y44-Q59 HydrophobicContact CE2-CG 4.11Å; Y44-Q59 HydrophobicContact CG-CB 4.41Å; Y44-V62 HydrophobicContact CE1-CB 3.87Å; Y44-V62 HydrophobicContact CE1-CG1 3.98Å; Y44-V62 HydrophobicContact CE1-CG2 4.15Å
45E89.6Confident87.7Confident102 Ų10281.7 Ų81.748%0.47743%0.427SS..Hα-helixtrans-61.3-41.2177.5-68.4176.1-17300112.5P41 R49 V55P41-E45 PolarHBondContact O-N 3.08Å; E45-R49 WeakPolarHBondContact O-CB 3.36Å; E45-R49 PolarHBondContact O-N 3.01Å; E45-V55 HydrophobicContact CG-CG1 4.49Å; E45-V55 HydrophobicContact CG-CG2 4.48Å
46G88.8Confident87.7Confident31 Ų3181 Ų8132%0.3243%0.431SS..Hα-helixtrans-64.9-44.3177.900000112.8K42 I43 Y44 K50K42-G46 PolarHBondContact O-N 3.42Å; I43-G46 PolarHBondContact O-N 3.2Å; Y44-G46 VanDerWaalsContact C-N 3.34Å; Y44-G46 PolarHBondContact O-N 3.17Å; G46-K50 WeakPolarHBondContact O-CG 3.3Å; G46-K50 PolarHBondContact O-N 3.39Å
47A87.1Confident87.8Confident14 Ų1478.9 Ų78.912%0.11643%0.427CS..Hα-helixtrans-68.1-42.917700000112.1F27 I43 Y44 R49 K50 L51 V58F27-A47 HydrophobicContact CE1-CB 4.06Å; I43-A47 WeakPolarHBondContact O-CB 3.44Å; I43-A47 PolarHBondContact O-N 2.83Å; Y44-A47 PolarHBondContact O-N 2.76Å; A47-R49 VanDerWaalsContact C-N 3.3Å; A47-R49 PolarHBondContact O-N 3.12Å; A47-K50 PolarHBondContact O-N 3.16Å; A47-K50 VanDerWaalsContact O-N 3.16Å; A47-L51 WeakPolarHBondContact O-CB 3.21Å; A47-L51 WeakPolarHBondContact O-CG 3.32Å; A47-L51 PolarHBondContact O-N 2.88Å; A47-V58 HydrophobicContact CB-CG1 3.82Å
48A88.8Confident88Confident5 Ų571.2 Ų71.24%0.04139%0.394CS..Hα-helixtrans-57.9-42.1176.300000112.2Y44 L51 C52 V53 V55 V58Y44-A48 WeakPolarHBondContact O-CB 3.42Å; Y44-A48 PolarHBondContact O-N 3.37Å; A48-L51 PolarHBondContact O-N 3.01Å; A48-C52 WeakPolarHBondContact O-CA 3.38Å; A48-C52 PolarHBondContact O-N 3.19Å; A48-V53 WeakPolarHBondContact CB-O 3.3Å; A48-V53 PolarHBondContact O-N 3.4Å; A48-V55 HydrophobicContact CB-CB 4.26Å; A48-V55 HydrophobicContact CB-CG2 3.74Å; A48-V58 HydrophobicContact CB-CG2 4.02Å
49R89.1Confident88.2Confident193 Ų19372.7 Ų72.773%0.72839%0.39SS*.Hα-helixtrans-66-37.7176.9-166.8-177.4-57.9164.44.6112.9E45 A47E45-R49 WeakPolarHBondContact O-CB 3.36Å; E45-R49 PolarHBondContact O-N 3.01Å; A47-R49 VanDerWaalsContact C-N 3.3Å; A47-R49 PolarHBondContact O-N 3.12Å
50K86.6Confident88.3Confident181 Ų18172 Ų7279%0.78738%0.38SS*.Hα-helixtrans-71-37.5178.9-74.3177.9179.2-178.30112.6G46 A47G46-K50 WeakPolarHBondContact O-CG 3.3Å; G46-K50 PolarHBondContact O-N 3.39Å; A47-K50 PolarHBondContact O-N 3.16Å; A47-K50 VanDerWaalsContact O-N 3.16Å
51L83.8Confident88.3Confident62 Ų6268.9 Ų68.933%0.32536%0.363SS..Hα-helixtrans-92.1-3.3-176.2-66.3166.3000112.8V23 F27 A47 A48 V53V23-L51 HydrophobicContact CB-CD2 4.43Å; V23-L51 HydrophobicContact CG1-CD1 3.65Å; V23-L51 HydrophobicContact CG1-CD2 3.79Å; V23-L51 HydrophobicContact CG1-CG 4.37Å; V23-L51 HydrophobicContact CG2-CD2 3.72Å; F27-L51 HydrophobicContact CE1-CD1 3.91Å; F27-L51 HydrophobicContact CE2-CD1 4.21Å; F27-L51 HydrophobicContact CZ-CD1 3.3Å; A47-L51 WeakPolarHBondContact O-CB 3.21Å; A47-L51 WeakPolarHBondContact O-CG 3.32Å; A47-L51 PolarHBondContact O-N 2.88Å; A48-L51 PolarHBondContact O-N 3.01Å; L51-V53 HydrophobicContact CB-CG2 3.76Å; L51-V53 PolarHBondContact O-N 2.84Å
52C84.9Confident88.4Confident119 Ų11964.9 Ų64.980%0.80434%0.338SS*.THydrogen-bonded Turntrans53.337.4-176.7-64.50000113.4A48A48-C52 WeakPolarHBondContact O-CA 3.38Å; A48-C52 PolarHBondContact O-N 3.19Å
53V87.1Confident88.4Confident32 Ų3260.6 Ų60.619%0.19432%0.32CS..SBendtrans-119.3158.1178.6-68.70000111.1F15 A48 L51 M57 V58F15-V53 HydrophobicContact CE2-CG1 4.03Å; F15-V53 HydrophobicContact CZ-CB 4.5Å; F15-V53 HydrophobicContact CZ-CG1 4.02Å; F15-V53 HydrophobicContact CZ-CG2 4.2Å; A48-V53 WeakPolarHBondContact CB-O 3.3Å; A48-V53 PolarHBondContact O-N 3.4Å; L51-V53 HydrophobicContact CB-CG2 3.76Å; L51-V53 PolarHBondContact O-N 2.84Å; V53-M57 HydrophobicContact CB-CE 4.34Å; V53-M57 HydrophobicContact CG1-CE 4.34Å; V53-V58 HydrophobicContact CG2-CG2 3.6Å
54P89.4Confident88.5Confident84 Ų8458.1 Ų58.155%0.54531%0.307SS..  trans-58.3142.8174.3-2334.2000112.1G56 M57 V58P54-G56 PolarHBondContact O-N 3.37Å; P54-M57 HydrophobicContact CG-CE 4.32Å; P54-M57 PolarHBondContact O-N 2.88Å; P54-V58 PolarHBondContact O-N 3.24Å
55V89.7Confident88.5Confident62 Ų6257.5 Ų57.538%0.37631%0.305SS..Hα-helixtrans-55.2-38.4178.6-174.70000111.6E45 A48 M57 V58 Q59E45-V55 HydrophobicContact CG-CG1 4.49Å; E45-V55 HydrophobicContact CG-CG2 4.48Å; A48-V55 HydrophobicContact CB-CB 4.26Å; A48-V55 HydrophobicContact CB-CG2 3.74Å; V55-M57 VanDerWaalsContact C-N 3.33Å; V55-M57 PolarHBondContact O-N 3.48Å; V55-V58 PolarHBondContact O-N 3.42Å; V55-Q59 PolarHBondContact O-N 2.84Å
56G88.2Confident88.6Confident29 Ų2954.1 Ų54.130%0.29929%0.29SS..Hα-helixtrans-59.4-38176.700000113.6P54 V58 Q59 H60P54-G56 PolarHBondContact O-N 3.37Å; G56-V58 PolarHBondContact O-N 2.84Å; G56-Q59 PolarHBondContact O-N 3.21Å; G56-H60 WeakPolarHBondContact O-CB 3.33Å; G56-H60 PolarHBondContact O-CD2 2.96Å; G56-H60 VanDerWaalsContact O-CG 3.25Å; G56-H60 PolarHBondContact O-N 3.14Å
57M86.1Confident88.7Confident78 Ų7855.7 Ų55.738%0.38429%0.288SS..Hα-helixtrans-66.3-39.7177.6-100.4-154.2-7800112F15 V53 P54 V55 G61F15-M57 HydrophobicContact CB-SD 4.18Å; F15-M57 HydrophobicContact CD2-CE 4.43Å; F15-M57 HydrophobicContact CD2-SD 3.39Å; F15-M57 WeakPolarHBondContact CD2-SD 3.5Å; F15-M57 HydrophobicContact CE2-CE 4.45Å; F15-M57 HydrophobicContact CE2-SD 3.9Å; F15-M57 HydrophobicContact CG-SD 3.8Å; V53-M57 HydrophobicContact CB-CE 4.34Å; V53-M57 HydrophobicContact CG1-CE 4.34Å; P54-M57 HydrophobicContact CG-CE 4.32Å; P54-M57 PolarHBondContact O-N 2.88Å; V55-M57 VanDerWaalsContact C-N 3.33Å; V55-M57 PolarHBondContact O-N 3.48Å; M57-G61 PolarHBondContact O-N 3.48Å
58V89.1Confident88.8Confident1 Ų155 Ų551%0.00628%0.282CS..Hα-helixtrans-66.6-43.5175.7-178.60000110.6F27 Y44 A47 A48 V53 P54 V55 G56 G61 V62F27-V58 HydrophobicContact CE1-CG1 3.92Å; F27-V58 HydrophobicContact CZ-CG1 3.79Å; F27-V58 HydrophobicContact CZ-CG2 4.34Å; Y44-V58 HydrophobicContact CD1-CG1 4.18Å; A47-V58 HydrophobicContact CB-CG1 3.82Å; A48-V58 HydrophobicContact CB-CG2 4.02Å; V53-V58 HydrophobicContact CG2-CG2 3.6Å; P54-V58 PolarHBondContact O-N 3.24Å; V55-V58 PolarHBondContact O-N 3.42Å; G56-V58 PolarHBondContact O-N 2.84Å; V58-G61 PolarHBondContact O-N 3.18Å; V58-V62 HydrophobicContact CG1-CG2 4.38Å; V58-V62 WeakPolarHBondContact O-CG2 3.43Å; V58-V62 PolarHBondContact O-N 2.96Å
59Q90.1Very high88.9Confident72 Ų7254.8 Ų54.834%0.33628%0.28SS..Hα-helixtrans-59.2-51.7177.6-177.2177.1-4.700111.1Y44 V55 G56 G61 V62 E63Y44-Q59 HydrophobicContact CD1-CB 4.33Å; Y44-Q59 HydrophobicContact CD2-CG 4.43Å; Y44-Q59 HydrophobicContact CE1-CB 4.35Å; Y44-Q59 HydrophobicContact CE1-CG 4.4Å; Y44-Q59 HydrophobicContact CE2-CG 4.11Å; Y44-Q59 HydrophobicContact CG-CB 4.41Å; V55-Q59 PolarHBondContact O-N 2.84Å; G56-Q59 PolarHBondContact O-N 3.21Å; Q59-G61 VanDerWaalsContact C-N 3.35Å; Q59-G61 PolarHBondContact O-N 3.47Å; Q59-V62 PolarHBondContact O-N 3.49Å; Q59-E63 HydrophobicContact CG-CG 4.28Å; Q59-E63 WeakPolarHBondContact CG-OE1 3.29Å; Q59-E63 PolarHBondContact NE2-OE1 3.35Å; Q59-E63 WeakPolarHBondContact O-CB 3.27Å; Q59-E63 VanDerWaalsContact O-CG 3.31Å; Q59-E63 WeakPolarHBondContact O-CG 3.41Å; Q59-E63 PolarHBondContact O-N 3.06Å
60H90Very high88.9Confident74 Ų7446.9 Ų46.934%0.34325%0.253SS..Hα-helixtrans-60.1-41.9177.8-68.9-45.5000112.5H12 G56 G64H12-H60 HydrophobicContact CB-CB 4.03Å; H12-H60 AromaticContact CD2-CG 3.66Å; H12-H60 AromaticContact CD2-ND1 3.71Å; H12-H60 AromaticContact CE1-ND1 3.48Å; H12-H60 PolarHBondContact CE1-ND1 3.46Å; H12-H60 AromaticContact ND1-ND1 3.96Å; H12-H60 AromaticContact NE2-CE1 3.67Å; H12-H60 AromaticContact NE2-CG 3.71Å; H12-H60 AromaticContact NE2-ND1 3.27Å; H12-H60 PolarHBondContact NE2-ND1 3.39Å; G56-H60 WeakPolarHBondContact O-CB 3.33Å; G56-H60 PolarHBondContact O-CD2 2.96Å; G56-H60 VanDerWaalsContact O-CG 3.25Å; G56-H60 PolarHBondContact O-N 3.14Å; H60-G64 PolarHBondContact O-N 3.05Å
61G89.1Confident89Confident0 Ų040.2 Ų40.20%023%0.225CC..Hα-helixtrans-62.1-46.3176.800000112.8M57 V58 Q59 G64 L65M57-G61 PolarHBondContact O-N 3.48Å; V58-G61 PolarHBondContact O-N 3.18Å; Q59-G61 VanDerWaalsContact C-N 3.35Å; Q59-G61 PolarHBondContact O-N 3.47Å; G61-G64 PolarHBondContact O-N 3.26Å; G61-L65 WeakPolarHBondContact O-CG 3.5Å; G61-L65 PolarHBondContact O-N 2.68Å; G61-L65 VanDerWaalsContact O-N 3.08Å
62V91.3Very high89.2Confident1 Ų137.2 Ų37.21%0.00621%0.21CC..Hα-helixtrans-67.9-44.1178.3173.80000111.3F27 I30 A31 F34 Y44 V58 Q59 G64 L65 M66F27-V62 HydrophobicContact CB-CG2 4.17Å; F27-V62 HydrophobicContact CD1-CG2 4.18Å; F27-V62 HydrophobicContact CG-CG2 4.11Å; I30-V62 HydrophobicContact CG2-CG1 4.05Å; I30-V62 HydrophobicContact CG2-CG2 4.48Å; A31-V62 HydrophobicContact CB-CG1 4.15Å; F34-V62 HydrophobicContact CD2-CG1 3.84Å; F34-V62 HydrophobicContact CE2-CG1 4.05Å; Y44-V62 HydrophobicContact CE1-CB 3.87Å; Y44-V62 HydrophobicContact CE1-CG1 3.98Å; Y44-V62 HydrophobicContact CE1-CG2 4.15Å; V58-V62 HydrophobicContact CG1-CG2 4.38Å; V58-V62 WeakPolarHBondContact O-CG2 3.43Å; V58-V62 PolarHBondContact O-N 2.96Å; Q59-V62 PolarHBondContact O-N 3.49Å; V62-G64 VanDerWaalsContact C-N 3.33Å; V62-G64 PolarHBondContact O-N 2.94Å; V62-L65 PolarHBondContact O-N 3.39Å; V62-M66 HydrophobicContact CG1-CG 4.45Å; V62-M66 HydrophobicContact CG1-SD 4.31Å; V62-M66 WeakPolarHBondContact O-CG 3.35Å; V62-M66 PolarHBondContact O-N 2.92Å
63E90.1Very high89.4Confident67 Ų6731.6 Ų31.631%0.31317%0.171SC..Hα-helixtrans-63.8-38.4177.1-73.9175.9-178.700111.8Q59 M66 F67Q59-E63 HydrophobicContact CG-CG 4.28Å; Q59-E63 WeakPolarHBondContact CG-OE1 3.29Å; Q59-E63 PolarHBondContact NE2-OE1 3.35Å; Q59-E63 WeakPolarHBondContact O-CB 3.27Å; Q59-E63 VanDerWaalsContact O-CG 3.31Å; Q59-E63 WeakPolarHBondContact O-CG 3.41Å; Q59-E63 PolarHBondContact O-N 3.06Å; E63-M66 WeakPolarHBondContact O-CB 3.21Å; E63-M66 PolarHBondContact O-N 2.88Å; E63-F67 WeakPolarHBondContact O-CB 3.43Å; E63-F67 PolarHBondContact O-N 3.38Å
64G90.1Very high89.3Confident1 Ų133.9 Ų33.91%0.0118%0.179CC..Hα-helixtrans-60.2-44.3172.700000112.1H60 G61 V62 F67 L68H60-G64 PolarHBondContact O-N 3.05Å; G61-G64 PolarHBondContact O-N 3.26Å; V62-G64 VanDerWaalsContact C-N 3.33Å; V62-G64 PolarHBondContact O-N 2.94Å; G64-F67 PolarHBondContact O-N 3.13Å; G64-L68 WeakPolarHBondContact O-CB 3.35Å; G64-L68 PolarHBondContact O-N 2.94Å
65L90.8Very high89Confident0 Ų034.8 Ų34.80%018%0.175CC..Hα-helixtrans-66.8-39.9174.6-71.6174.2000112.1L13 L16 F27 A31 G61 V62 F67 L68 M69 L99L13-L65 HydrophobicContact CD2-CD2 4.18Å; L13-L65 HydrophobicContact CD2-CG 4.26Å; L16-L65 HydrophobicContact CD1-CD1 3.81Å; L16-L65 HydrophobicContact CD1-CD2 3.96Å; L16-L65 HydrophobicContact CD1-CG 3.67Å; F27-L65 HydrophobicContact CB-CD1 3.78Å; A31-L65 HydrophobicContact CB-CB 4.01Å; G61-L65 WeakPolarHBondContact O-CG 3.5Å; G61-L65 PolarHBondContact O-N 2.68Å; G61-L65 VanDerWaalsContact O-N 3.08Å; V62-L65 PolarHBondContact O-N 3.39Å; L65-F67 VanDerWaalsContact C-N 3.32Å; L65-F67 PolarHBondContact O-N 3.34Å; L65-L68 HydrophobicContact CD2-CD2 4.43Å; L65-L68 PolarHBondContact O-N 3.29Å; L65-M69 WeakPolarHBondContact O-CB 3.42Å; L65-M69 WeakPolarHBondContact O-CG 3.43Å; L65-M69 PolarHBondContact O-N 3.45Å; L65-L99 HydrophobicContact CD2-CD1 4.49Å; L65-L99 HydrophobicContact CD2-CD2 3.94Å
66M90.9Very high88.7Confident30 Ų3036 Ų3615%0.14818%0.178CC..Hα-helixtrans-58.1-46.6173.7-73.6177.566.900110.9A31 F34 L35 V62 E63 M69 T70A31-M66 HydrophobicContact CB-CB 4.44Å; A31-M66 HydrophobicContact CB-CG 3.51Å; F34-M66 HydrophobicContact CB-CE 3.79Å; F34-M66 HydrophobicContact CB-SD 3.69Å; F34-M66 HydrophobicContact CD2-SD 4.08Å; F34-M66 HydrophobicContact CG-SD 4.42Å; L35-M66 HydrophobicContact CD2-CB 4.35Å; L35-M66 HydrophobicContact CD2-CE 3.72Å; L35-M66 HydrophobicContact CG-CB 4.47Å; L35-M66 HydrophobicContact CG-CE 3.99Å; L35-M66 HydrophobicContact CG-CG 4.29Å; V62-M66 HydrophobicContact CG1-CG 4.45Å; V62-M66 HydrophobicContact CG1-SD 4.31Å; V62-M66 WeakPolarHBondContact O-CG 3.35Å; V62-M66 PolarHBondContact O-N 2.92Å; E63-M66 WeakPolarHBondContact O-CB 3.21Å; E63-M66 PolarHBondContact O-N 2.88Å; M66-M69 PolarHBondContact O-N 3.42Å; M66-T70 VanDerWaalsContact O-CB 3.27Å; M66-T70 WeakPolarHBondContact O-CB 3.47Å; M66-T70 PolarHBondContact O-N 3.2Å; M66-T70 PolarHBondContact O-OG1 3.29Å
67F89.6Confident88.7Confident64 Ų6435.2 Ų35.228%0.28117%0.167SC..Hα-helixtrans-62.7-49178-176.2-100.8000111.4L5 H9 E63 G64 L65 M69 T70 E71L5-F67 HydrophobicContact CD2-CD1 3.85Å; L5-F67 HydrophobicContact CD2-CE1 3.74Å; H9-F67 AromaticContact CD2-CD1 3.73Å; H9-F67 AromaticContact CD2-CG 3.92Å; H9-F67 AromaticContact CE1-CD1 3.93Å; H9-F67 AromaticContact CE1-CE1 3.67Å; H9-F67 AromaticContact CE1-CE2 3.95Å; H9-F67 AromaticContact CE1-CZ 3.68Å; H9-F67 AromaticContact CG-CD1 3.92Å; H9-F67 AromaticContact ND1-CE1 3.71Å; H9-F67 AromaticContact NE2-CD1 3.76Å; H9-F67 AromaticContact NE2-CD2 3.84Å; H9-F67 AromaticContact NE2-CE1 3.98Å; H9-F67 AromaticContact NE2-CG 3.67Å; E63-F67 WeakPolarHBondContact O-CB 3.43Å; E63-F67 PolarHBondContact O-N 3.38Å; G64-F67 PolarHBondContact O-N 3.13Å; L65-F67 VanDerWaalsContact C-N 3.32Å; L65-F67 PolarHBondContact O-N 3.34Å; F67-M69 PolarHBondContact O-N 3.38Å; F67-T70 PolarHBondContact O-N 3.27Å; F67-E71 HydrophobicContact CD1-CG 4.29Å; F67-E71 HydrophobicContact CD2-CG 4.22Å; F67-E71 HydrophobicContact CE1-CG 3.81Å; F67-E71 HydrophobicContact CE2-CG 3.72Å; F67-E71 HydrophobicContact CG-CG 4.49Å; F67-E71 HydrophobicContact CZ-CG 3.5Å; F67-E71 VanDerWaalsContact CZ-CG 3.5Å; F67-E71 PolarHBondContact O-N 3.45Å
68L90Very high88.8Confident0 Ų034 Ų340%017%0.166CC..Hα-helixtrans-54.1-50.1177-178.673.2000111.5L3 L5 G64 L65 T70 S72 F82 V86L3-L68 HydrophobicContact CD1-CD1 4.35Å; L3-L68 HydrophobicContact CD2-CD1 4.4Å; L5-L68 HydrophobicContact CD1-CD1 4.31Å; G64-L68 WeakPolarHBondContact O-CB 3.35Å; G64-L68 PolarHBondContact O-N 2.94Å; L65-L68 HydrophobicContact CD2-CD2 4.43Å; L65-L68 PolarHBondContact O-N 3.29Å; L68-T70 PolarHBondContact O-N 3.35Å; L68-S72 VanDerWaalsContact O-CB 3.23Å; L68-S72 WeakPolarHBondContact O-CB 3.22Å; L68-S72 PolarHBondContact O-N 2.87Å; L68-S72 PolarHBondContact O-OG 3.32Å; L68-F82 HydrophobicContact CD2-CE2 4.44Å; L68-F82 HydrophobicContact CD2-CZ 4.31Å; L68-F82 HydrophobicContact CG-CE2 4.31Å; L68-V86 HydrophobicContact CD1-CG2 4.46Å; L68-V86 HydrophobicContact CD2-CG2 4.11Å
69M90.4Very high88.9Confident1 Ų138.4 Ų38.41%0.00519%0.187CC..Hα-helixtrans-66.3-37.4-178.9-66.9-65.9173.900112.2L35 L65 M66 F67 S73 L99 L102 I110L35-M69 HydrophobicContact CD1-CB 4.41Å; L65-M69 WeakPolarHBondContact O-CB 3.42Å; L65-M69 WeakPolarHBondContact O-CG 3.43Å; L65-M69 PolarHBondContact O-N 3.45Å; M66-M69 PolarHBondContact O-N 3.42Å; F67-M69 PolarHBondContact O-N 3.38Å; M69-S73 VanDerWaalsContact O-CB 3.28Å; M69-S73 WeakPolarHBondContact O-CB 3.37Å; M69-S73 PolarHBondContact O-N 2.81Å; M69-S73 VanDerWaalsContact O-N 3.07Å; M69-S73 PolarHBondContact O-OG 2.96Å; M69-L99 HydrophobicContact CE-CB 4.49Å; M69-L99 HydrophobicContact CE-CD2 3.95Å; M69-L102 HydrophobicContact CE-CB 4.25Å; M69-I110 HydrophobicContact CB-CD1 3.88Å
70T89.5Confident88.8Confident26 Ų2639.7 Ų39.716%0.1620%0.199CC..Hα-helixtrans-68.3-52.4179.1-58.30000111.4L35 M66 F67 L68 S72 S73 K74 L114L35-T70 WeakPolarHBondContact CD2-OG1 3.5Å; M66-T70 VanDerWaalsContact O-CB 3.27Å; M66-T70 WeakPolarHBondContact O-CB 3.47Å; M66-T70 PolarHBondContact O-N 3.2Å; M66-T70 PolarHBondContact O-OG1 3.29Å; F67-T70 PolarHBondContact O-N 3.27Å; L68-T70 PolarHBondContact O-N 3.35Å; T70-S72 PolarHBondContact O-N 3.24Å; T70-S73 PolarHBondContact O-N 3.08Å; T70-K74 VanDerWaalsContact O-CB 3.29Å; T70-K74 WeakPolarHBondContact O-CB 3.34Å; T70-K74 PolarHBondContact O-N 3.46Å; T70-L114 HydrophobicContact CG2-CD1 4.06Å; T70-L114 HydrophobicContact CG2-CD2 3.97Å
71E88.1Confident88.7Confident41 Ų4138.3 Ų38.319%0.19219%0.194CC..Hα-helixtrans-64.3-39.8179.2-76.6-62.2124.300111.8L3 F67 S73 K74 H75L3-E71 HydrophobicContact CD1-CB 3.87Å; L3-E71 HydrophobicContact CD2-CB 4.36Å; L3-E71 HydrophobicContact CG-CB 4.34Å; F67-E71 HydrophobicContact CD1-CG 4.29Å; F67-E71 HydrophobicContact CD2-CG 4.22Å; F67-E71 HydrophobicContact CE1-CG 3.81Å; F67-E71 HydrophobicContact CE2-CG 3.72Å; F67-E71 HydrophobicContact CG-CG 4.49Å; F67-E71 HydrophobicContact CZ-CG 3.5Å; F67-E71 VanDerWaalsContact CZ-CG 3.5Å; F67-E71 PolarHBondContact O-N 3.45Å; E71-S73 VanDerWaalsContact C-N 3.34Å; E71-S73 PolarHBondContact O-N 3.05Å; E71-K74 PolarHBondContact O-N 2.69Å; E71-K74 IonicContact OE1-NZ 3.61Å; E71-H75 PolarHBondContact O-CD2 3.04Å; E71-H75 PolarHBondContact O-N 3.38Å; E71-H75 IonicContact OE2-CD2 2.87Å; E71-H75 IonicContact OE2-NE2 3.79Å; E71-H75 PolarHBondContact OE2-NE2 2.93Å
72S89.2Confident88.7Confident0 Ų038.4 Ų38.40%020%0.195CC..Hα-helixtrans-59.5-45.2174.4-58.20000111.8L3 L68 T70 M76 I77 F82 Y103L3-S72 WeakPolarHBondContact CD1-OG 3.28Å; L68-S72 VanDerWaalsContact O-CB 3.23Å; L68-S72 WeakPolarHBondContact O-CB 3.22Å; L68-S72 PolarHBondContact O-N 2.87Å; L68-S72 PolarHBondContact O-OG 3.32Å; T70-S72 PolarHBondContact O-N 3.24Å; S72-M76 PolarHBondContact O-N 3.06Å; S72-I77 PolarHBondContact O-N 3.39Å; S72-F82 WeakPolarHBondContact OG-CD2 3.36Å; S72-F82 WeakPolarHBondContact OG-CE2 3.49Å; S72-Y103 PolarHBondContact O-OH 3.06Å
73S88.4Confident88.5Confident0 Ų041.8 Ų41.80%021%0.211CC..Hα-helixtrans-73.1-34.7-178.8-57.80000112.8M69 T70 E71 M76 R111M69-S73 VanDerWaalsContact O-CB 3.28Å; M69-S73 WeakPolarHBondContact O-CB 3.37Å; M69-S73 PolarHBondContact O-N 2.81Å; M69-S73 VanDerWaalsContact O-N 3.07Å; M69-S73 PolarHBondContact O-OG 2.96Å; T70-S73 PolarHBondContact O-N 3.08Å; E71-S73 VanDerWaalsContact C-N 3.34Å; E71-S73 PolarHBondContact O-N 3.05Å; S73-M76 PolarHBondContact O-N 2.92Å; S73-R111 PolarHBondContact O-NH1 3.48Å
74K85.1Confident88.3Confident80 Ų8042.7 Ų42.735%0.34822%0.218SC..Hα-helixtrans-60.7-48.4174.7-178.4-177.3178.4-175.40110.6T70 E71 R111 L114 K203T70-K74 VanDerWaalsContact O-CB 3.29Å; T70-K74 WeakPolarHBondContact O-CB 3.34Å; T70-K74 PolarHBondContact O-N 3.46Å; E71-K74 PolarHBondContact O-N 2.69Å; E71-K74 IonicContact OE1-NZ 3.61Å; K74-R111 PolarHBondContact O-NH1 2.99Å; K74-L114 HydrophobicContact CB-CD1 4.24Å; K74-K203 VanDerWaalsContact CE-O 3.24Å; K74-K203 WeakPolarHBondContact CE-O 3.37Å
75H83.9Confident88.1Confident103 Ų10343.2 Ų43.248%0.47722%0.222SC..Hα-helixtrans-84.6-3.9-178-72.7-61.1000115E71 I77E71-H75 PolarHBondContact O-CD2 3.04Å; E71-H75 PolarHBondContact O-N 3.38Å; E71-H75 IonicContact OE2-CD2 2.87Å; E71-H75 IonicContact OE2-NE2 3.79Å; E71-H75 PolarHBondContact OE2-NE2 2.93Å; H75-I77 VanDerWaalsContact C-N 3.25Å; H75-I77 HydrophobicContact CB-CD1 4.26Å; H75-I77 HydrophobicContact CB-CG1 3.75Å; H75-I77 PolarHBondContact O-N 3.27Å
76M83.3Confident87.8Confident87 Ų8743.2 Ų43.243%0.42922%0.222SC..THydrogen-bonded Turntrans50.448-176.5-64.9-66.3-66.300111.8S72 S73S72-M76 PolarHBondContact O-N 3.06Å; S73-M76 PolarHBondContact O-N 2.92Å
77I87.6Confident87.5Confident13 Ų1346.5 Ų46.57%0.06724%0.24CC..  trans-63139.6-176.6-58.6-171.1000109.6L3 S72 H75 D81 F82 Y103L3-I77 HydrophobicContact CB-CD1 3.76Å; L3-I77 HydrophobicContact CD1-CD1 3.54Å; L3-I77 HydrophobicContact CG-CD1 3.94Å; S72-I77 PolarHBondContact O-N 3.39Å; H75-I77 VanDerWaalsContact C-N 3.25Å; H75-I77 HydrophobicContact CB-CD1 4.26Å; H75-I77 HydrophobicContact CB-CG1 3.75Å; H75-I77 PolarHBondContact O-N 3.27Å; I77-D81 HydrophobicContact CG2-CB 3.36Å; I77-F82 HydrophobicContact CG2-CB 4.27Å; I77-Y103 PolarHBondContact N-OH 2.93Å; I77-Y103 PolarHBondContact O-OH 2.9Å
78S89.1Confident87.2Confident53 Ų5347.6 Ų47.637%0.37126%0.26SS..  trans-67.2157.8176.975.60000110.8V80 D81 F82S78-V80 VanDerWaalsContact C-N 3.25Å; S78-V80 PolarHBondContact O-N 2.68Å; S78-D81 PolarHBondContact O-N 3.21Å; S78-D81 WeakPolarHBondContact OG-CB 3.3Å; S78-D81 PolarHBondContact OG-N 3.33Å; S78-D81 VanDerWaalsContact OG-N 3.15Å; S78-D81 PolarHBondContact OG-OD2 2.92Å; S78-F82 WeakPolarHBondContact O-CB 3.28Å; S78-F82 PolarHBondContact O-N 3.48Å
79E89.8Confident86.8Confident94 Ų9449 Ų4944%0.43927%0.268SS..Hα-helixtrans-60.7-38.6-179.4-65.2175.2-16000111.7F82 M83 L100 V104E79-F82 PolarHBondContact O-N 3.18Å; E79-M83 WeakPolarHBondContact O-CG 3.47Å; E79-M83 PolarHBondContact O-N 3.39Å; E79-L100 HydrophobicContact CB-CD1 3.95Å; E79-L100 HydrophobicContact CG-CD1 4.12Å; E79-V104 HydrophobicContact CG-CG2 3.95Å
80V87.6Confident86.3Confident99 Ų9951.5 Ų51.560%0.629%0.294SS*.Hα-helixtrans-66.1-50.1177.1-174.90000111S78 F82 M83 D84S78-V80 VanDerWaalsContact C-N 3.25Å; S78-V80 PolarHBondContact O-N 2.68Å; V80-F82 PolarHBondContact O-N 3.45Å; V80-M83 PolarHBondContact O-N 3.43Å; V80-D84 PolarHBondContact O-N 3.05Å
81D88.3Confident86Confident44 Ų4450.8 Ų50.824%0.23529%0.288CS..Hα-helixtrans-61.6-34.2178.1-73.7-64.4000111.9M1 I77 S78 S85M1-D81 PolarHBondContact N-OD1 3.2Å; M1-D81 PolarHBondContact N-OD2 3.18Å; I77-D81 HydrophobicContact CG2-CB 3.36Å; S78-D81 PolarHBondContact O-N 3.21Å; S78-D81 WeakPolarHBondContact OG-CB 3.3Å; S78-D81 PolarHBondContact OG-N 3.33Å; S78-D81 VanDerWaalsContact OG-N 3.15Å; S78-D81 PolarHBondContact OG-OD2 2.92Å; D81-S85 WeakPolarHBondContact O-CB 3.24Å; D81-S85 PolarHBondContact O-N 3.42Å; D81-S85 PolarHBondContact O-OG 3.25Å
82F88.9Confident85.6Confident2 Ų250.9 Ų50.91%0.00930%0.3CS..Hα-helixtrans-66.9-48.7176.4-179.8-90.7000110.6L68 S72 I77 S78 E79 V80 D84 S85 V86 L99 L100 Y103L68-F82 HydrophobicContact CD2-CE2 4.44Å; L68-F82 HydrophobicContact CD2-CZ 4.31Å; L68-F82 HydrophobicContact CG-CE2 4.31Å; S72-F82 WeakPolarHBondContact OG-CD2 3.36Å; S72-F82 WeakPolarHBondContact OG-CE2 3.49Å; I77-F82 HydrophobicContact CG2-CB 4.27Å; S78-F82 WeakPolarHBondContact O-CB 3.28Å; S78-F82 PolarHBondContact O-N 3.48Å; E79-F82 PolarHBondContact O-N 3.18Å; V80-F82 PolarHBondContact O-N 3.45Å; F82-D84 VanDerWaalsContact C-N 3.33Å; F82-D84 PolarHBondContact O-N 3.48Å; F82-S85 PolarHBondContact O-N 2.98Å; F82-V86 HydrophobicContact CD1-CG2 4.12Å; F82-V86 HydrophobicContact CE1-CG2 3.74Å; F82-V86 HydrophobicContact CE2-CG2 4.23Å; F82-V86 HydrophobicContact CZ-CG2 3.81Å; F82-V86 WeakPolarHBondContact O-CG2 3.29Å; F82-V86 PolarHBondContact O-N 2.66Å; F82-L99 HydrophobicContact CE1-CB 4.4Å; F82-L100 HydrophobicContact CB-CD1 4.4Å; F82-L100 HydrophobicContact CD1-CB 4.35Å; F82-L100 HydrophobicContact CD1-CD1 3.66Å; F82-L100 HydrophobicContact CE1-CB 4.32Å; F82-L100 HydrophobicContact CE1-CD1 4.34Å; F82-L100 HydrophobicContact CG-CD1 4.31Å; F82-Y103 HydrophobicContact CD2-CD1 4.2Å; F82-Y103 HydrophobicContact CD2-CG 4.29Å; F82-Y103 HydrophobicContact CE2-CG 4.19Å; F82-Y103 HydrophobicContact CG-CD1 4.25Å; F82-Y103 HydrophobicContact CZ-CG 4.5Å
83M87.8Confident85.3Confident73 Ų7358 Ų5836%0.3633%0.334SS..Hα-helixtrans-57-47.2176.5-73.4-17965.400111.5E79 V80 S85 V86 L87 I96 L100E79-M83 WeakPolarHBondContact O-CG 3.47Å; E79-M83 PolarHBondContact O-N 3.39Å; V80-M83 PolarHBondContact O-N 3.43Å; M83-S85 VanDerWaalsContact C-N 3.31Å; M83-S85 PolarHBondContact O-N 2.83Å; M83-V86 PolarHBondContact O-N 2.72Å; M83-L87 VanDerWaalsContact O-CB 3.22Å; M83-L87 WeakPolarHBondContact O-CB 3.37Å; M83-L87 PolarHBondContact O-N 2.93Å; M83-I96 HydrophobicContact CB-CG2 4.23Å; M83-I96 HydrophobicContact CE-CG2 4.33Å; M83-I96 HydrophobicContact CG-CG2 3.93Å; M83-L100 HydrophobicContact CG-CD1 4.41Å; M83-L100 HydrophobicContact CG-CD2 3.99Å; M83-L100 HydrophobicContact SD-CD2 3.84Å
84D86.2Confident85.1Confident86 Ų8664.3 Ų64.346%0.4637%0.367SS..Hα-helixtrans-61.5-39.5178.6-70.1-19000112.1L2 V80 F82 A88L2-D84 HydrophobicContact CD2-CB 3.63Å; V80-D84 PolarHBondContact O-N 3.05Å; F82-D84 VanDerWaalsContact C-N 3.33Å; F82-D84 PolarHBondContact O-N 3.48Å; D84-A88 PolarHBondContact O-N 3.32Å; D84-A88 VanDerWaalsContact O-N 3.16Å
85S85.4Confident85Confident11 Ų1161.5 Ų61.58%0.07736%0.356CS..Hα-helixtrans-67.6-39.1178.3-57.70000112.3L3 D81 F82 M83L3-S85 PolarHBondContact N-OG 3.26Å; D81-S85 WeakPolarHBondContact O-CB 3.24Å; D81-S85 PolarHBondContact O-N 3.42Å; D81-S85 PolarHBondContact O-OG 3.25Å; F82-S85 PolarHBondContact O-N 2.98Å; M83-S85 VanDerWaalsContact C-N 3.31Å; M83-S85 PolarHBondContact O-N 2.83Å
86V84.8Confident85.2Confident0 Ų056.9 Ų56.90%034%0.335CS..Hα-helixtrans-77.4-34.2178.4-178.30000111.3L68 F82 M83 A88 L89 F91 I96 L99L68-V86 HydrophobicContact CD1-CG2 4.46Å; L68-V86 HydrophobicContact CD2-CG2 4.11Å; F82-V86 HydrophobicContact CD1-CG2 4.12Å; F82-V86 HydrophobicContact CE1-CG2 3.74Å; F82-V86 HydrophobicContact CE2-CG2 4.23Å; F82-V86 HydrophobicContact CZ-CG2 3.81Å; F82-V86 WeakPolarHBondContact O-CG2 3.29Å; F82-V86 PolarHBondContact O-N 2.66Å; M83-V86 PolarHBondContact O-N 2.72Å; V86-A88 VanDerWaalsContact C-N 3.28Å; V86-A88 PolarHBondContact O-N 3.07Å; V86-L89 VanDerWaalsContact O-CB 3.3Å; V86-L89 WeakPolarHBondContact O-CB 3.41Å; V86-L89 PolarHBondContact O-N 2.87Å; V86-F91 HydrophobicContact CG1-CB 4.14Å; V86-F91 HydrophobicContact CG1-CD2 3.48Å; V86-F91 VanDerWaalsContact CG1-CD2 3.48Å; V86-F91 HydrophobicContact CG1-CE2 4.18Å; V86-F91 HydrophobicContact CG1-CG 4.02Å; V86-I96 HydrophobicContact CB-CG1 4.46Å; V86-I96 HydrophobicContact CG1-CG1 3.88Å; V86-L99 HydrophobicContact CG1-CD1 4.22Å
87L85.2Confident85.4Confident100 Ų10058 Ų5852%0.52434%0.339SS..Hα-helixtrans-62.4-36.7175.3-171.7135.5000111.6M83 L89 G90 I96M83-L87 VanDerWaalsContact O-CB 3.22Å; M83-L87 WeakPolarHBondContact O-CB 3.37Å; M83-L87 PolarHBondContact O-N 2.93Å; L87-L89 PolarHBondContact O-N 3.41Å; L87-L89 VanDerWaalsContact O-N 3.12Å; L87-G90 PolarHBondContact O-N 3.35Å; L87-I96 HydrophobicContact CB-CD1 4Å; L87-I96 HydrophobicContact CD1-CD1 4.22Å; L87-I96 HydrophobicContact CG-CD1 4.36Å
88A83.5Confident85.4Confident87 Ų8759.2 Ų59.272%0.71935%0.349SS*.THydrogen-bonded Turntrans-61.7-17.2173.400000114.2D84 V86D84-A88 PolarHBondContact O-N 3.32Å; D84-A88 VanDerWaalsContact O-N 3.16Å; V86-A88 VanDerWaalsContact C-N 3.28Å; V86-A88 PolarHBondContact O-N 3.07Å
89L80.6Confident85.3Confident30 Ų3056.8 Ų56.816%0.15733%0.332CS..THydrogen-bonded Turntrans-87.4-6.1175.8-61.5166.6000113.2L5 K10 L13 V86 L87 F91L5-L89 HydrophobicContact CD1-CD1 3.64Å; L5-L89 HydrophobicContact CD1-CD2 3.72Å; L5-L89 HydrophobicContact CD1-CG 4.1Å; K10-L89 HydrophobicContact CB-CD2 4.29Å; K10-L89 HydrophobicContact CG-CD2 3.82Å; L13-L89 HydrophobicContact CD1-CD1 3.76Å; L13-L89 HydrophobicContact CD1-CD2 4.49Å; V86-L89 VanDerWaalsContact O-CB 3.3Å; V86-L89 WeakPolarHBondContact O-CB 3.41Å; V86-L89 PolarHBondContact O-N 2.87Å; L87-L89 PolarHBondContact O-N 3.41Å; L87-L89 VanDerWaalsContact O-N 3.12Å; L89-F91 HydrophobicContact CB-CD2 3.67Å; L89-F91 HydrophobicContact CB-CE2 3.63Å; L89-F91 HydrophobicContact CD1-CD2 4.32Å; L89-F91 HydrophobicContact CD1-CE2 3.82Å; L89-F91 HydrophobicContact CG-CE2 4.39Å
90G80.8Confident85.4Confident53 Ų5353.5 Ų53.555%0.54632%0.317SS..THydrogen-bonded Turntrans82.723.5177.600000115L87L87-G90 PolarHBondContact O-N 3.35Å
91F81.9Confident85.5Confident11 Ų1155.1 Ų55.15%0.04832%0.318CS..  trans-72.7149171-71.4-81.9000111.6L13 L16 T17 V86 L89 L95 I96L13-F91 HydrophobicContact CB-CZ 4.3Å; L16-F91 HydrophobicContact CB-CE1 3.54Å; L16-F91 HydrophobicContact CB-CZ 3.88Å; L16-F91 HydrophobicContact CD1-CZ 4.36Å; T17-F91 HydrophobicContact CG2-CD1 4.29Å; T17-F91 HydrophobicContact CG2-CE1 4.28Å; T17-F91 HydrophobicContact CG2-CG 4.46Å; T17-F91 HydrophobicContact CG2-CZ 4.43Å; V86-F91 HydrophobicContact CG1-CB 4.14Å; V86-F91 HydrophobicContact CG1-CD2 3.48Å; V86-F91 VanDerWaalsContact CG1-CD2 3.48Å; V86-F91 HydrophobicContact CG1-CE2 4.18Å; V86-F91 HydrophobicContact CG1-CG 4.02Å; L89-F91 HydrophobicContact CB-CD2 3.67Å; L89-F91 HydrophobicContact CB-CE2 3.63Å; L89-F91 HydrophobicContact CD1-CD2 4.32Å; L89-F91 HydrophobicContact CD1-CE2 3.82Å; L89-F91 HydrophobicContact CG-CE2 4.39Å; F91-L95 HydrophobicContact CD1-CD1 4.34Å; F91-I96 HydrophobicContact CB-CD1 4.29Å; F91-I96 HydrophobicContact CB-CG1 3.83Å
92G81.2Confident85.6Confident43 Ų4353.7 Ų53.744%0.44331%0.31SS..  trans-68.5155.5171.300000112.4D94 L95 I96G92-D94 VanDerWaalsContact C-N 3.34Å; G92-D94 PolarHBondContact O-N 2.96Å; G92-L95 WeakPolarHBondContact O-CB 3.18Å; G92-L95 PolarHBondContact O-N 3.46Å; G92-I96 WeakPolarHBondContact O-CG1 3.28Å; G92-I96 PolarHBondContact O-N 2.88Å
93E82.1Confident85.6Confident150 Ų15053.6 Ų53.670%0.70131%0.31SS*.Hα-helixtrans-59.5-40.8-176.1-65.3-174.817500113.1L95 I96 Q97E93-L95 VanDerWaalsContact C-N 3.33Å; E93-L95 PolarHBondContact O-N 3.29Å; E93-I96 PolarHBondContact O-N 3.22Å; E93-Q97 PolarHBondContact O-N 3.07Å; E93-Q97 VanDerWaalsContact O-N 3.08Å
94D83.9Confident85.8Confident131 Ų13152.5 Ų52.570%0.70131%0.307SS*.Hα-helixtrans-61-43.1178.2-61.3-29.7000111.7G92 Q97 S98G92-D94 VanDerWaalsContact C-N 3.34Å; G92-D94 PolarHBondContact O-N 2.96Å; D94-Q97 PolarHBondContact O-N 3.38Å; D94-S98 PolarHBondContact O-N 3.42Å; D94-S98 VanDerWaalsContact O-N 3.13Å; D94-S98 PolarHBondContact O-OG 3.04Å
95L83.3Confident86.1Confident22 Ų2254.7 Ų54.712%0.11531%0.314CS..Hα-helixtrans-65.4-41.2177.6-85.1170.5000112.1V24 F91 G92 E93 Q97 S98 L99V24-L95 HydrophobicContact CB-CD2 3.58Å; V24-L95 HydrophobicContact CG1-CD2 3.85Å; V24-L95 HydrophobicContact CG2-CD2 3.91Å; F91-L95 HydrophobicContact CD1-CD1 4.34Å; G92-L95 WeakPolarHBondContact O-CB 3.18Å; G92-L95 PolarHBondContact O-N 3.46Å; E93-L95 VanDerWaalsContact C-N 3.33Å; E93-L95 PolarHBondContact O-N 3.29Å; L95-Q97 VanDerWaalsContact C-N 3.29Å; L95-Q97 PolarHBondContact O-N 3.46Å; L95-S98 PolarHBondContact O-N 2.96Å; L95-L99 WeakPolarHBondContact O-CG 3.3Å; L95-L99 PolarHBondContact O-N 2.67Å
96I87.4Confident86.3Confident5 Ų555.3 Ų55.33%0.02632%0.316CS..Hα-helixtrans-60.3-43.1177-67.5166.6000109.9M83 V86 L87 F91 G92 E93 L99 L100M83-I96 HydrophobicContact CB-CG2 4.23Å; M83-I96 HydrophobicContact CE-CG2 4.33Å; M83-I96 HydrophobicContact CG-CG2 3.93Å; V86-I96 HydrophobicContact CB-CG1 4.46Å; V86-I96 HydrophobicContact CG1-CG1 3.88Å; L87-I96 HydrophobicContact CB-CD1 4Å; L87-I96 HydrophobicContact CD1-CD1 4.22Å; L87-I96 HydrophobicContact CG-CD1 4.36Å; F91-I96 HydrophobicContact CB-CD1 4.29Å; F91-I96 HydrophobicContact CB-CG1 3.83Å; G92-I96 WeakPolarHBondContact O-CG1 3.28Å; G92-I96 PolarHBondContact O-N 2.88Å; E93-I96 PolarHBondContact O-N 3.22Å; I96-L99 PolarHBondContact O-N 3.38Å; I96-L100 VanDerWaalsContact O-CB 3.3Å; I96-L100 WeakPolarHBondContact O-CB 3.23Å; I96-L100 PolarHBondContact O-N 3.27Å
97Q87.9Confident86.4Confident111 Ų11157 Ų5752%0.51932%0.323SS..Hα-helixtrans-63.5-43.9177.2-70.1-170.64.700112.3E93 D94 L95 L100 Q101E93-Q97 PolarHBondContact O-N 3.07Å; E93-Q97 VanDerWaalsContact O-N 3.08Å; D94-Q97 PolarHBondContact O-N 3.38Å; L95-Q97 VanDerWaalsContact C-N 3.29Å; L95-Q97 PolarHBondContact O-N 3.46Å; Q97-L100 PolarHBondContact O-N 3.41Å; Q97-Q101 WeakPolarHBondContact O-CG 3.4Å; Q97-Q101 PolarHBondContact O-N 3.08Å
98S87.3Confident86.5Confident39 Ų3958.2 Ų58.227%0.27333%0.326SS..Hα-helixtrans-61.7-44.1176.2-60.40000112.3D94 L95 Q101 L102D94-S98 PolarHBondContact O-N 3.42Å; D94-S98 VanDerWaalsContact O-N 3.13Å; D94-S98 PolarHBondContact O-OG 3.04Å; L95-S98 PolarHBondContact O-N 2.96Å; S98-Q101 PolarHBondContact O-N 3.47Å; S98-L102 WeakPolarHBondContact O-CG 3.21Å; S98-L102 PolarHBondContact O-N 3.43Å; S98-L102 VanDerWaalsContact O-N 3.09Å
99L87.9Confident86.6Confident2 Ų258.4 Ų58.41%0.0131%0.312CS..Hα-helixtrans-66.1-37.7177-72.1174.1000112.2V24 L65 M69 F82 V86 L95 I96 L102 Y103V24-L99 HydrophobicContact CG1-CD2 4.35Å; L65-L99 HydrophobicContact CD2-CD1 4.49Å; L65-L99 HydrophobicContact CD2-CD2 3.94Å; M69-L99 HydrophobicContact CE-CB 4.49Å; M69-L99 HydrophobicContact CE-CD2 3.95Å; F82-L99 HydrophobicContact CE1-CB 4.4Å; V86-L99 HydrophobicContact CG1-CD1 4.22Å; L95-L99 WeakPolarHBondContact O-CG 3.3Å; L95-L99 PolarHBondContact O-N 2.67Å; I96-L99 PolarHBondContact O-N 3.38Å; L99-L102 HydrophobicContact CD2-CD1 4.49Å; L99-L102 PolarHBondContact O-N 3.19Å; L99-Y103 PolarHBondContact O-N 3.18Å
100L90.8Very high87Confident24 Ų2457.5 Ų57.513%0.12631%0.307CS..Hα-helixtrans-62.4-44.5174.8-179.469.7000111.1E79 F82 M83 I96 Q97 L102 Y103 V104E79-L100 HydrophobicContact CB-CD1 3.95Å; E79-L100 HydrophobicContact CG-CD1 4.12Å; F82-L100 HydrophobicContact CB-CD1 4.4Å; F82-L100 HydrophobicContact CD1-CB 4.35Å; F82-L100 HydrophobicContact CD1-CD1 3.66Å; F82-L100 HydrophobicContact CE1-CB 4.32Å; F82-L100 HydrophobicContact CE1-CD1 4.34Å; F82-L100 HydrophobicContact CG-CD1 4.31Å; M83-L100 HydrophobicContact CG-CD1 4.41Å; M83-L100 HydrophobicContact CG-CD2 3.99Å; M83-L100 HydrophobicContact SD-CD2 3.84Å; I96-L100 VanDerWaalsContact O-CB 3.3Å; I96-L100 WeakPolarHBondContact O-CB 3.23Å; I96-L100 PolarHBondContact O-N 3.27Å; Q97-L100 PolarHBondContact O-N 3.41Å; L100-L102 VanDerWaalsContact C-N 3.35Å; L100-L102 PolarHBondContact O-N 3.41Å; L100-Y103 HydrophobicContact CD1-CD1 4.37Å; L100-Y103 PolarHBondContact O-N 3.01Å; L100-V104 HydrophobicContact CD1-CG2 4.31Å; L100-V104 HydrophobicContact CG-CG2 4.42Å; L100-V104 WeakPolarHBondContact O-CG2 3.29Å; L100-V104 PolarHBondContact O-N 2.97Å
101Q91.2Very high87.2Confident134 Ų13460.5 Ų60.563%0.62630%0.302SS*.Hα-helixtrans-59.1-46.2176.1-74.2-179.74.600111.5Q97 S98 Y103 V104 Q105Q97-Q101 WeakPolarHBondContact O-CG 3.4Å; Q97-Q101 PolarHBondContact O-N 3.08Å; S98-Q101 PolarHBondContact O-N 3.47Å; Q101-Y103 VanDerWaalsContact C-N 3.34Å; Q101-Y103 PolarHBondContact O-N 3.21Å; Q101-V104 PolarHBondContact O-N 2.99Å; Q101-Q105 VanDerWaalsContact O-CB 3.28Å; Q101-Q105 WeakPolarHBondContact O-CB 3.38Å; Q101-Q105 PolarHBondContact O-N 3.29Å
102L88.7Confident87.2Confident13 Ų1361.5 Ų61.57%0.06831%0.311CS..Hα-helixtrans-59.4-43.5175.6-72.8173.2000111.9R29 L32 M69 S98 L99 L100 H106R29-L102 HydrophobicContact CG-CD2 4.48Å; L32-L102 HydrophobicContact CD1-CB 4.4Å; L32-L102 HydrophobicContact CD1-CD2 4.03Å; M69-L102 HydrophobicContact CE-CB 4.25Å; S98-L102 WeakPolarHBondContact O-CG 3.21Å; S98-L102 PolarHBondContact O-N 3.43Å; S98-L102 VanDerWaalsContact O-N 3.09Å; L99-L102 HydrophobicContact CD2-CD1 4.49Å; L99-L102 PolarHBondContact O-N 3.19Å; L100-L102 VanDerWaalsContact C-N 3.35Å; L100-L102 PolarHBondContact O-N 3.41Å; L102-H106 WeakPolarHBondContact O-CB 3.33Å; L102-H106 PolarHBondContact O-CD2 3.06Å; L102-H106 PolarHBondContact O-N 3.15Å; L102-H106 VanDerWaalsContact O-N 3.13Å
103Y89.9Confident87.3Confident1 Ų161.6 Ų61.60%0.00430%0.303CS..Hα-helixtrans-61.5-53.1176.4167.8-115.3000111.7S72 I77 F82 L99 L100 Q101 Q105 H106 K107S72-Y103 PolarHBondContact O-OH 3.06Å; I77-Y103 PolarHBondContact N-OH 2.93Å; I77-Y103 PolarHBondContact O-OH 2.9Å; F82-Y103 HydrophobicContact CD2-CD1 4.2Å; F82-Y103 HydrophobicContact CD2-CG 4.29Å; F82-Y103 HydrophobicContact CE2-CG 4.19Å; F82-Y103 HydrophobicContact CG-CD1 4.25Å; F82-Y103 HydrophobicContact CZ-CG 4.5Å; L99-Y103 PolarHBondContact O-N 3.18Å; L100-Y103 HydrophobicContact CD1-CD1 4.37Å; L100-Y103 PolarHBondContact O-N 3.01Å; Q101-Y103 VanDerWaalsContact C-N 3.34Å; Q101-Y103 PolarHBondContact O-N 3.21Å; Y103-Q105 VanDerWaalsContact C-N 3.28Å; Y103-Q105 PolarHBondContact O-N 3.42Å; Y103-H106 PolarHBondContact O-N 2.85Å; Y103-K107 HydrophobicContact CD2-CB 3.99Å; Y103-K107 HydrophobicContact CE1-CD 4.21Å; Y103-K107 HydrophobicContact CE2-CB 3.62Å; Y103-K107 HydrophobicContact CE2-CD 4.36Å; Y103-K107 VanDerWaalsContact O-CB 3.25Å; Y103-K107 WeakPolarHBondContact O-CB 3.43Å; Y103-K107 PolarHBondContact O-N 2.99Å
104V91.2Very high87.2Confident50 Ų5056.3 Ų56.330%0.30328%0.279SS..Hα-helixtrans-60.3-40.5-177.3172.50000111.3E79 L100 Q101E79-V104 HydrophobicContact CG-CG2 3.95Å; L100-V104 HydrophobicContact CD1-CG2 4.31Å; L100-V104 HydrophobicContact CG-CG2 4.42Å; L100-V104 WeakPolarHBondContact O-CG2 3.29Å; L100-V104 PolarHBondContact O-N 2.97Å; Q101-V104 PolarHBondContact O-N 2.99Å
105Q92.3Very high86.7Confident131 Ų13152.2 Ų52.261%0.61226%0.261SS*.Hα-helixtrans-66.7-35.9179.6-171.61764.200112.7Q101 Y103Q101-Q105 VanDerWaalsContact O-CB 3.28Å; Q101-Q105 WeakPolarHBondContact O-CB 3.38Å; Q101-Q105 PolarHBondContact O-N 3.29Å; Y103-Q105 VanDerWaalsContact C-N 3.28Å; Y103-Q105 PolarHBondContact O-N 3.42Å
106H89.5Confident86.2Confident25 Ų2558 Ų5812%0.11629%0.287CS..Hα-helixtrans-112.3-7.4-169.9-64.9-61.3000115.8L32 R36 L102 Y103 H108 Q109 I110L32-H106 HydrophobicContact CD1-CB 4.33Å; L32-H106 WeakPolarHBondContact CD1-CD2 3.5Å; L32-H106 HydrophobicContact CD2-CB 3.74Å; R36-H106 PolarHBondContact NH2-CE1 3.19Å; R36-H106 PolarHBondContact NH2-ND1 3.22Å; L102-H106 WeakPolarHBondContact O-CB 3.33Å; L102-H106 PolarHBondContact O-CD2 3.06Å; L102-H106 PolarHBondContact O-N 3.15Å; L102-H106 VanDerWaalsContact O-N 3.13Å; Y103-H106 PolarHBondContact O-N 2.85Å; H106-H108 VanDerWaalsContact C-N 3.29Å; H106-H108 PolarHBondContact O-N 3.24Å; H106-Q109 PolarHBondContact ND1-OE1 3.43Å; H106-Q109 WeakPolarHBondContact O-CB 3.47Å; H106-Q109 PolarHBondContact O-N 3.25Å; H106-I110 PolarHBondContact O-N 3.37Å
107K88.1Confident85.3Confident35 Ų3564.1 Ų64.115%0.15232%0.319CS..Hα-helixtrans-53.4-41-177.665.7-172.7178.8-172.40114.1Y103 R111Y103-K107 HydrophobicContact CD2-CB 3.99Å; Y103-K107 HydrophobicContact CE1-CD 4.21Å; Y103-K107 HydrophobicContact CE2-CB 3.62Å; Y103-K107 HydrophobicContact CE2-CD 4.36Å; Y103-K107 VanDerWaalsContact O-CB 3.25Å; Y103-K107 WeakPolarHBondContact O-CB 3.43Å; Y103-K107 PolarHBondContact O-N 2.99Å; K107-R111 VanDerWaalsContact O-CB 3.3Å; K107-R111 WeakPolarHBondContact O-CB 3.36Å; K107-R111 PolarHBondContact O-N 3.47Å
108H86.4Confident84.1Confident125 Ų12563.1 Ų63.158%0.57932%0.317SS*.Hα-helixtrans-67.8-37179-64.284.4000112H106 R111 S112H106-H108 VanDerWaalsContact C-N 3.29Å; H106-H108 PolarHBondContact O-N 3.24Å; H108-R111 PolarHBondContact O-N 3Å; H108-S112 PolarHBondContact O-N 3.46Å
109Q86.7Confident82.7Confident91 Ų9165.9 Ų65.943%0.42534%0.335SS..Hα-helixtrans-71.4-45.6179.3-65.4173.5-10.200111H106 R111 S112 V113H106-Q109 PolarHBondContact ND1-OE1 3.43Å; H106-Q109 WeakPolarHBondContact O-CB 3.47Å; H106-Q109 PolarHBondContact O-N 3.25Å; Q109-R111 PolarHBondContact O-N 2.84Å; Q109-S112 PolarHBondContact O-N 2.82Å; Q109-S112 VanDerWaalsContact O-N 3.15Å; Q109-V113 WeakPolarHBondContact O-CG2 3.38Å; Q109-V113 PolarHBondContact O-N 3.18Å
110I87.7Confident81.4Confident11 Ų1168.5 Ų68.56%0.05635%0.349CS..Hα-helixtrans-57.8-43.1174.6-63.3171.4000109.6L32 L35 M69 H106 S112 V113 L114L32-I110 HydrophobicContact CD2-CD1 3.73Å; L32-I110 HydrophobicContact CD2-CG1 4.3Å; L35-I110 HydrophobicContact CD1-CD1 4.05Å; L35-I110 HydrophobicContact CD1-CG1 4.21Å; M69-I110 HydrophobicContact CB-CD1 3.88Å; H106-I110 PolarHBondContact O-N 3.37Å; I110-S112 PolarHBondContact O-N 2.86Å; I110-V113 PolarHBondContact O-N 3.33Å; I110-L114 HydrophobicContact CG2-CD1 4.04Å; I110-L114 HydrophobicContact CG2-CG 4.36Å; I110-L114 WeakPolarHBondContact O-CB 3.34Å; I110-L114 WeakPolarHBondContact O-CG 3.32Å; I110-L114 PolarHBondContact O-N 3.31Å
111R85Confident80.4Confident116 Ų11674.1 Ų74.144%0.43838%0.375SS..Hα-helixtrans-63.5-38.8177.3-167.9177.4-179843.1113.1S73 K74 K107 H108 Q109 L114 S115S73-R111 PolarHBondContact O-NH1 3.48Å; K74-R111 PolarHBondContact O-NH1 2.99Å; K107-R111 VanDerWaalsContact O-CB 3.3Å; K107-R111 WeakPolarHBondContact O-CB 3.36Å; K107-R111 PolarHBondContact O-N 3.47Å; H108-R111 PolarHBondContact O-N 3Å; Q109-R111 PolarHBondContact O-N 2.84Å; R111-L114 PolarHBondContact O-N 3Å; R111-S115 WeakPolarHBondContact O-CB 3.45Å; R111-S115 PolarHBondContact O-N 3.09Å; R111-S115 PolarHBondContact O-OG 3.46Å
112S82.7Confident79.8Confident33 Ų3371.1 Ų71.123%0.23137%0.367CS..Hα-helixtrans-67.2-37.8174.9-172.20000111.9H108 Q109 I110 S115 Q116 D159H108-S112 PolarHBondContact O-N 3.46Å; Q109-S112 PolarHBondContact O-N 2.82Å; Q109-S112 VanDerWaalsContact O-N 3.15Å; I110-S112 PolarHBondContact O-N 2.86Å; S112-S115 WeakPolarHBondContact CA-OG 3.33Å; S112-S115 PolarHBondContact O-N 2.97Å; S112-S115 PolarHBondContact O-OG 2.79Å; S112-Q116 VanDerWaalsContact O-CG 3.24Å; S112-Q116 WeakPolarHBondContact O-CG 3.47Å; S112-Q116 PolarHBondContact O-N 3.37Å; S112-D159 PolarHBondContact OG-OD2 2.97Å
113V83.1Confident79.5Confident45 Ų4572.9 Ų72.927%0.27338%0.383SS..Hα-helixtrans-63.8-45.6172.2174.90000110.6Q109 I110 S115 Q116 L117Q109-V113 WeakPolarHBondContact O-CG2 3.38Å; Q109-V113 PolarHBondContact O-N 3.18Å; I110-V113 PolarHBondContact O-N 3.33Å; V113-S115 VanDerWaalsContact C-N 3.33Å; V113-S115 PolarHBondContact O-N 3.13Å; V113-Q116 PolarHBondContact O-N 3.18Å; V113-L117 HydrophobicContact CG1-CD1 4.13Å; V113-L117 WeakPolarHBondContact O-CG 3.22Å; V113-L117 PolarHBondContact O-N 3.44Å
114L79.9Confident79.5Confident38 Ų3879.7 Ų79.720%0.19941%0.41CS..Hα-helixtrans-62.1-38.9176-71.1173.4000112.1T70 K74 I110 R111 Q116 L117 L118T70-L114 HydrophobicContact CG2-CD1 4.06Å; T70-L114 HydrophobicContact CG2-CD2 3.97Å; K74-L114 HydrophobicContact CB-CD1 4.24Å; I110-L114 HydrophobicContact CG2-CD1 4.04Å; I110-L114 HydrophobicContact CG2-CG 4.36Å; I110-L114 WeakPolarHBondContact O-CB 3.34Å; I110-L114 WeakPolarHBondContact O-CG 3.32Å; I110-L114 PolarHBondContact O-N 3.31Å; R111-L114 PolarHBondContact O-N 3Å; L114-Q116 VanDerWaalsContact C-N 3.31Å; L114-Q116 PolarHBondContact O-N 3.39Å; L114-L117 PolarHBondContact O-N 3.09Å; L114-L118 WeakPolarHBondContact O-CB 3.36Å; L114-L118 WeakPolarHBondContact O-CG 3.33Å; L114-L118 PolarHBondContact O-N 3.45Å
115S74.1Confident79.4Confident46 Ų4682.4 Ų82.432%0.32242%0.419SS..Hα-helixtrans-69.5-28.2177.470.90000112.8R111 S112 V113R111-S115 WeakPolarHBondContact O-CB 3.45Å; R111-S115 PolarHBondContact O-N 3.09Å; R111-S115 PolarHBondContact O-OG 3.46Å; S112-S115 WeakPolarHBondContact CA-OG 3.33Å; S112-S115 PolarHBondContact O-N 2.97Å; S112-S115 PolarHBondContact O-OG 2.79Å; V113-S115 VanDerWaalsContact C-N 3.33Å; V113-S115 PolarHBondContact O-N 3.13Å
116Q72.4Confident79.5Confident143 Ų14379.3 Ų79.367%0.66841%0.407SS*.Hα-helixtrans-72.6-34.5171.7-70.3168.921.100112.2S112 V113 L114S112-Q116 VanDerWaalsContact O-CG 3.24Å; S112-Q116 WeakPolarHBondContact O-CG 3.47Å; S112-Q116 PolarHBondContact O-N 3.37Å; V113-Q116 PolarHBondContact O-N 3.18Å; L114-Q116 VanDerWaalsContact C-N 3.31Å; L114-Q116 PolarHBondContact O-N 3.39Å
117L69Low79.8Confident133 Ų13381.3 Ų81.370%0.69642%0.418SS*.Hα-helixtrans-75.8-37.7176.6-67.7170.3000112.2V113 L114 C119V113-L117 HydrophobicContact CG1-CD1 4.13Å; V113-L117 WeakPolarHBondContact O-CG 3.22Å; V113-L117 PolarHBondContact O-N 3.44Å; L114-L117 PolarHBondContact O-N 3.09Å; L117-C119 PolarHBondContact O-N 3.17Å
118L63.3Low80.2Confident90 Ų9083.9 Ų83.947%0.47143%0.431SS..SBendtrans-68.9116.3173.1-70.5165.2000107.7L114 N120L114-L118 WeakPolarHBondContact O-CB 3.36Å; L114-L118 WeakPolarHBondContact O-CG 3.33Å; L114-L118 PolarHBondContact O-N 3.45Å; L118-N120 PolarHBondContact O-N 3.5Å
119C56.5Low80.6Confident98 Ų9886.4 Ų86.466%0.66244%0.435SS*.  trans-40.9108-172.9-151.60000111.4L117 Q121L117-C119 PolarHBondContact O-N 3.17Å; C119-Q121 HydrophobicContact CB-CG 3.87Å; C119-Q121 PolarHBondContact O-N 3.28Å; C119-Q121 WeakPolarHBondContact SG-CG 3.5Å
120N60.9Low81Confident57 Ų5789.3 Ų89.331%0.30544%0.442SS..  trans-74.263.8173.8-171.2-5.2000109L118 R156 S157L118-N120 PolarHBondContact O-N 3.5Å; N120-R156 VanDerWaalsContact CG-NE 3.3Å; N120-R156 PolarHBondContact ND2-NE 2.74Å; N120-R156 VanDerWaalsContact ND2-NE 3.13Å; N120-R156 WeakPolarHBondContact OD1-CG 3.44Å; N120-R156 PolarHBondContact OD1-NE 3.21Å; N120-S157 PolarHBondContact ND2-O 2.88Å; N120-S157 PolarHBondContact OD1-O 3.3Å
121Q69.6Low81.4Confident141 Ų14193.1 Ų93.166%0.65946%0.462SS*.PPolyproline II helixtrans-72.3133.7177.7-65-150-26.100108.7C119 A123C119-Q121 HydrophobicContact CB-CG 3.87Å; C119-Q121 PolarHBondContact O-N 3.28Å; C119-Q121 WeakPolarHBondContact SG-CG 3.5Å; Q121-A123 PolarHBondContact O-N 3.41Å
122P78.9Confident81.8Confident71 Ų7190.1 Ų90.146%0.46146%0.455SS..PPolyproline II helixtrans-59.1127.1171.621.6-28.2000109.6L154P122-L154 HydrophobicContact CB-CB 3.87Å; P122-L154 HydrophobicContact CB-CD1 3.94Å; P122-L154 HydrophobicContact CB-CG 4.35Å; P122-L154 HydrophobicContact CG-CD1 4.12Å
123A83.4Confident82.4Confident51 Ų5192 Ų9242%0.42147%0.465SS..EExtended strand (participates in β ladder)trans-80.1138172.800000109.5Q121 H125 L154 T155Q121-A123 PolarHBondContact O-N 3.41Å; A123-H125 PolarHBondContact O-N 2.89Å; A123-L154 CarbonylContact O-C 3.51Å; A123-L154 VanDerWaalsContact O-CA 3.27Å; A123-L154 WeakPolarHBondContact O-CA 3.44Å; A123-T155 PolarHBondContact N-O 3.47Å; A123-T155 PolarHBondContact O-N 3.22Å; A123-T155 PolarHBondContact O-OG1 3.36Å
124Y88.9Confident82.8Confident143 Ų14394.3 Ų94.356%0.56147%0.473SS*.EExtended strand (participates in β ladder)trans-64.4131.1172.5171.6-96.8000110.5N126 L127 L152Y124-N126 VanDerWaalsContact CE2-C 3.5Å; Y124-N126 WeakPolarHBondContact CE2-O 3.28Å; Y124-L127 HydrophobicContact CE2-CB 3.91Å; Y124-L127 WeakPolarHBondContact OH-CB 3.41Å; Y124-L127 PolarHBondContact OH-N 3.22Å; Y124-L127 VanDerWaalsContact OH-N 3.07Å; Y124-L152 HydrophobicContact CE2-CD2 4.22Å
125H89.9Confident83.5Confident108 Ų10898.2 Ų98.250%0.549%0.493SS..EExtended strand (participates in β ladder)trans-113.7-51.3176.4-178.260.8000112.3A123 L153 T155A123-H125 PolarHBondContact O-N 2.89Å; H125-L153 WeakPolarHBondContact CA-O 3.5Å; H125-L153 WeakPolarHBondContact CB-O 3.48Å; H125-L153 PolarHBondContact N-O 3.15Å; H125-T155 HydrophobicContact CB-CG2 3.93Å
126N94Very high84.4Confident65 Ų6598.5 Ų98.535%0.34850%0.498SS..EExtended strand (participates in β ladder)trans-155.6159.6-178.4-172.431.2000111.7Y124 L153Y124-N126 VanDerWaalsContact CE2-C 3.5Å; Y124-N126 WeakPolarHBondContact CE2-O 3.28Å; N126-L153 HydrophobicContact CB-CB 4.06Å; N126-L153 HydrophobicContact CB-CD1 3.91Å; N126-L153 HydrophobicContact CB-CG 4.44Å; N126-L153 PolarHBondContact N-O 3.36Å; N126-L153 VanDerWaalsContact N-O 3.14Å; N126-L153 PolarHBondContact O-N 3.02Å
127L94.4Very high85.2Confident68 Ų6893.5 Ų93.536%0.35648%0.479SS..EExtended strand (participates in β ladder)trans-129.9120.7175.5-175.5155.3000108.8Y124 W129 I150 R151 L152Y124-L127 HydrophobicContact CE2-CB 3.91Å; Y124-L127 WeakPolarHBondContact OH-CB 3.41Å; Y124-L127 PolarHBondContact OH-N 3.22Å; Y124-L127 VanDerWaalsContact OH-N 3.07Å; L127-W129 HydrophobicContact CD2-CB 4.06Å; L127-W129 HydrophobicContact CD2-CG 4.39Å; L127-I150 HydrophobicContact CD1-CG2 3.85Å; L127-I150 HydrophobicContact CD2-CG2 4.07Å; L127-I150 HydrophobicContact CG-CG2 3.74Å; L127-R151 WeakPolarHBondContact CA-O 3.43Å; L127-L152 HydrophobicContact CB-CD2 4.25Å; L127-L152 HydrophobicContact CD1-CD2 3.7Å; L127-L152 HydrophobicContact CG-CD2 3.98Å
128E96.5Very high86.3Confident89 Ų8999.2 Ų99.242%0.41649%0.492SS..EExtended strand (participates in β ladder)trans-106.8146.3169.1-59.5175.7173.400108.7I150 R151E128-I150 CarbonylContact O-C 3.06Å; E128-I150 WeakPolarHBondContact O-CA 3.4Å; E128-R151 HydrophobicContact CB-CB 4.19Å; E128-R151 PolarHBondContact N-O 3.09Å; E128-R151 PolarHBondContact O-N 3.25Å; E128-R151 IonicContact OE2-NH1 3.96Å
129W95.8Very high87.6Confident177 Ų177100.5 Ų100.567%0.6751%0.508SS*.EExtended strand (participates in β ladder)trans-143.1154.8179.967.5-87000111.8L127 L131 T149L127-W129 HydrophobicContact CD2-CB 4.06Å; L127-W129 HydrophobicContact CD2-CG 4.39Å; W129-L131 HydrophobicContact CE3-CB 4.43Å; W129-L131 HydrophobicContact CZ3-CB 3.91Å; W129-T149 CarbonylContact C-O 3.48Å; W129-T149 VanDerWaalsContact CA-O 3.22Å; W129-T149 WeakPolarHBondContact CA-O 3.5Å
130R95.8Very high89.2Confident152 Ų15299 Ų9957%0.57450%0.496SS*.EExtended strand (participates in β ladder)trans-141.1130.9173.6-168.9177.374.7-171.20.8109.7D132 V148 T149R130-D132 IonicContact CZ-OD1 3.63Å; R130-D132 IonicContact CZ-OD2 2.77Å; R130-D132 VanDerWaalsContact CZ-OD2 3.24Å; R130-D132 VanDerWaalsContact NE-CG 3.32Å; R130-D132 IonicContact NE-OD1 2.96Å; R130-D132 PolarHBondContact NE-OD1 3.03Å; R130-D132 IonicContact NE-OD2 3.79Å; R130-D132 PolarHBondContact NE-OD2 3.35Å; R130-D132 IonicContact NH2-OD1 3.54Å; R130-D132 IonicContact NH2-OD2 3.45Å; R130-D132 PolarHBondContact NH2-OD2 2.92Å; R130-V148 CarbonylContact O-C 3.58Å; R130-V148 WeakPolarHBondContact O-CA 3.24Å; R130-T149 PolarHBondContact N-O 2.96Å; R130-T149 PolarHBondContact O-N 3.37Å
131L94.8Very high90.5Very high91 Ų91106.2 Ų106.248%0.47652%0.519SS..EExtended strand (participates in β ladder)trans-98.4118.1170173.266.1000108.8W129 V133 P146 V148W129-L131 HydrophobicContact CE3-CB 4.43Å; W129-L131 HydrophobicContact CZ3-CB 3.91Å; L131-V133 HydrophobicContact CG-CG2 4.42Å; L131-P146 HydrophobicContact CD1-CB 4.2Å; L131-V148 HydrophobicContact CD1-CG2 3.74Å
132D94.7Very high91.5Very high54 Ų54108.1 Ų108.129%0.28953%0.527SS..EExtended strand (participates in β ladder)trans-107.6144.8173.2-62.5-42.6000109R130 P146 M147R130-D132 IonicContact CZ-OD1 3.63Å; R130-D132 IonicContact CZ-OD2 2.77Å; R130-D132 VanDerWaalsContact CZ-OD2 3.24Å; R130-D132 VanDerWaalsContact NE-CG 3.32Å; R130-D132 IonicContact NE-OD1 2.96Å; R130-D132 PolarHBondContact NE-OD1 3.03Å; R130-D132 IonicContact NE-OD2 3.79Å; R130-D132 PolarHBondContact NE-OD2 3.35Å; R130-D132 IonicContact NH2-OD1 3.54Å; R130-D132 IonicContact NH2-OD2 3.45Å; R130-D132 PolarHBondContact NH2-OD2 2.92Å; D132-P146 CarbonylContact O-C 3.57Å; D132-P146 WeakPolarHBondContact O-CA 3.44Å; D132-M147 HydrophobicContact CB-CB 4.44Å; D132-M147 PolarHBondContact N-O 2.88Å; D132-M147 PolarHBondContact O-N 3.47Å
133V94.3Very high92Very high73 Ų73106.7 Ų106.744%0.44251%0.514SS..EExtended strand (participates in β ladder)trans-129.1118.3176.6-176.10000109.4L131 L135 I144 P146L131-V133 HydrophobicContact CG-CG2 4.42Å; V133-L135 HydrophobicContact CG1-CD2 3.88Å; V133-L135 PolarHBondContact O-N 3.17Å; V133-I144 HydrophobicContact CG1-CG2 3.81Å; V133-P146 HydrophobicContact CG2-CB 4.46Å
134Q92.4Very high92.3Very high92 Ų92110.5 Ų110.543%0.4353%0.526SS..EExtended strand (participates in β ladder)trans-87.1109.2174.6-165.8-176.74.600110.1A136 Q143 I144 V145Q134-A136 WeakPolarHBondContact CG-O 3.45Å; Q134-A136 PolarHBondContact NE2-O 3.35Å; Q134-Q143 VanDerWaalsContact CG-NE2 3.34Å; Q134-Q143 VanDerWaalsContact NE2-NE2 3.14Å; Q134-I144 WeakPolarHBondContact O-CA 3.45Å; Q134-V145 HydrophobicContact CB-CB 4.19Å; Q134-V145 PolarHBondContact N-O 3.03Å; Q134-V145 PolarHBondContact O-N 2.93Å
135L93.4Very high92.5Very high120 Ų120106.5 Ų106.563%0.62852%0.517SS*.  trans-83.8-22.8-179.2-59.7177.7000113.8V133 Q143 I144V133-L135 HydrophobicContact CG1-CD2 3.88Å; V133-L135 PolarHBondContact O-N 3.17Å; L135-Q143 CarbonylContact C-O 3.58Å; L135-Q143 WeakPolarHBondContact CA-O 3.39Å; L135-Q143 PolarHBondContact O-N 2.69Å; L135-Q143 VanDerWaalsContact O-N 3.11Å; L135-I144 HydrophobicContact CD2-CG1 4.48Å
136A92.4Very high92.7Very high52 Ų52103.4 Ų103.443%0.4351%0.506SS..  trans-158.3157.5-17900000111.4Q134 V140Q134-A136 WeakPolarHBondContact CG-O 3.45Å; Q134-A136 PolarHBondContact NE2-O 3.35Å; A136-V140 CarbonylContact C-O 3.56Å; A136-V140 WeakPolarHBondContact CA-O 3.25Å
137S89.8Confident92.7Very high38 Ų38103.6 Ų103.627%0.26651%0.506SS..  trans-128.9169.7164.871.70000109.6S139 V140S137-S139 PolarHBondContact O-N 2.77Å; S137-V140 PolarHBondContact N-O 2.9Å; S137-V140 CarbonylContact O-C 3.39Å; S137-V140 PolarHBondContact O-N 3.31Å; S137-V140 VanDerWaalsContact O-O 3.12Å; S137-V140 WeakPolarHBondContact OG-CB 3.46Å; S137-V140 PolarHBondContact OG-N 3.34Å
138R91.7Very high92.8Very high254 Ų254101 Ų10196%0.95849%0.492SS*.SBendtrans-57.5-35.4177.2-72-177.3179.5-110.11.2112.3
139S90.9Very high92.8Very high116 Ų11698.5 Ų98.581%0.81148%0.484SS*.SBendtrans-91.1-23.5-178.5-50.40000113.2S137S137-S139 PolarHBondContact O-N 2.77Å
140V90.9Very high92.7Very high68 Ų6890.8 Ų90.841%0.41246%0.455SS..  trans-132.8101.5-176.4-175.90000109.8A136 S137 H142 Q143A136-V140 CarbonylContact C-O 3.56Å; A136-V140 WeakPolarHBondContact CA-O 3.25Å; S137-V140 PolarHBondContact N-O 2.9Å; S137-V140 CarbonylContact O-C 3.39Å; S137-V140 PolarHBondContact O-N 3.31Å; S137-V140 VanDerWaalsContact O-O 3.12Å; S137-V140 WeakPolarHBondContact OG-CB 3.46Å; S137-V140 PolarHBondContact OG-N 3.34Å; V140-H142 VanDerWaalsContact C-N 3.34Å; V140-H142 PolarHBondContact O-N 3.32Å; V140-Q143 HydrophobicContact CG1-CB 3.96Å; V140-Q143 HydrophobicContact CG1-CG 4.31Å
141R88.9Confident92.7Very high207 Ų20788.5 Ų88.578%0.78145%0.447SS*.SBendtrans-77.2-16.1-174-64.1-172.6-179.21780.7114.8
142H88.7Confident92.7Very high181 Ų18185.9 Ų85.984%0.83843%0.433SS*.SBendtrans-130.297.6178.2-61.896.7000109V140V140-H142 VanDerWaalsContact C-N 3.34Å; V140-H142 PolarHBondContact O-N 3.32Å
143Q90.3Very high92.6Very high41 Ų4185.4 Ų85.419%0.19243%0.43CS..  trans-144.2157.9173.457.4178.728.400109.4Q134 L135 V140 V145Q134-Q143 VanDerWaalsContact CG-NE2 3.34Å; Q134-Q143 VanDerWaalsContact NE2-NE2 3.14Å; L135-Q143 CarbonylContact C-O 3.58Å; L135-Q143 WeakPolarHBondContact CA-O 3.39Å; L135-Q143 PolarHBondContact O-N 2.69Å; L135-Q143 VanDerWaalsContact O-N 3.11Å; V140-Q143 HydrophobicContact CG1-CB 3.96Å; V140-Q143 HydrophobicContact CG1-CG 4.31Å; Q143-V145 HydrophobicContact CB-CG2 4.32Å; Q143-V145 HydrophobicContact CG-CG2 4.45Å
144I89.9Confident92.4Very high132 Ų13283.3 Ų83.368%0.67742%0.416SS*.  trans-133.795.9171.2-59.9174.7000105.5V133 Q134 L135 P146V133-I144 HydrophobicContact CG1-CG2 3.81Å; Q134-I144 WeakPolarHBondContact O-CA 3.45Å; L135-I144 HydrophobicContact CD2-CG1 4.48Å; I144-P146 VanDerWaalsContact O-CD 3.29Å; I144-P146 WeakPolarHBondContact O-CD 3.32Å
145V92.6Very high92.1Very high59 Ų5980.5 Ų80.536%0.35841%0.406SS..EExtended strand (participates in β ladder)trans-111.295.8-180-172.80000108.3Q134 Q143 M147Q134-V145 HydrophobicContact CB-CB 4.19Å; Q134-V145 PolarHBondContact N-O 3.03Å; Q134-V145 PolarHBondContact O-N 2.93Å; Q143-V145 HydrophobicContact CB-CG2 4.32Å; Q143-V145 HydrophobicContact CG-CG2 4.45Å; V145-M147 HydrophobicContact CG1-CG 4.44Å
146P94.3Very high91.3Very high43 Ų4380.6 Ų80.628%0.27940%0.398SS..EExtended strand (participates in β ladder)trans-73.4138.3173.930.3-34.1000110.7L131 D132 V133 I144 P173L131-P146 HydrophobicContact CD1-CB 4.2Å; D132-P146 CarbonylContact O-C 3.57Å; D132-P146 WeakPolarHBondContact O-CA 3.44Å; V133-P146 HydrophobicContact CG2-CB 4.46Å; I144-P146 VanDerWaalsContact O-CD 3.29Å; I144-P146 WeakPolarHBondContact O-CD 3.32Å; P146-P173 HydrophobicContact CB-CG 3.74Å; P146-P173 HydrophobicContact CG-CG 3.53Å
147M94.3Very high89.9Confident69 Ų6982.8 Ų82.834%0.3441%0.41SS..EExtended strand (participates in β ladder)trans-136.9122.3-177.2-73.8-91.6-97.400108.3D132 V145 Q170D132-M147 HydrophobicContact CB-CB 4.44Å; D132-M147 PolarHBondContact N-O 2.88Å; D132-M147 PolarHBondContact O-N 3.47Å; V145-M147 HydrophobicContact CG1-CG 4.44Å; M147-Q170 HydrophobicContact CE-CG 4.32Å; M147-Q170 HydrophobicContact SD-CG 4.31Å
148V95.8Very high88.5Confident12 Ų1283 Ų837%0.07341%0.412CS..EExtended strand (participates in β ladder)trans-103.6121.1176.3-177.10000108.4R130 L131 I150 Q170 T171 L176R130-V148 CarbonylContact O-C 3.58Å; R130-V148 WeakPolarHBondContact O-CA 3.24Å; L131-V148 HydrophobicContact CD1-CG2 3.74Å; V148-I150 HydrophobicContact CG1-CD1 4.37Å; V148-I150 HydrophobicContact CG1-CG1 3.92Å; V148-Q170 CarbonylContact O-C 3.54Å; V148-Q170 WeakPolarHBondContact O-CA 3.29Å; V148-T171 HydrophobicContact CB-CG2 3.95Å; V148-T171 HydrophobicContact CG1-CG2 4.41Å; V148-T171 PolarHBondContact N-O 3.44Å; V148-T171 PolarHBondContact O-N 2.9Å; V148-L176 HydrophobicContact CG1-CD2 4.3Å; V148-L176 HydrophobicContact CG2-CD2 4.18Å
149T96.1Very high86.7Confident38 Ų3876.7 Ų76.723%0.23340%0.396CS..EExtended strand (participates in β ladder)trans-99.7131.2170.7-51.70000108.2W129 R130 L169W129-T149 CarbonylContact C-O 3.48Å; W129-T149 VanDerWaalsContact CA-O 3.22Å; W129-T149 WeakPolarHBondContact CA-O 3.5Å; R130-T149 PolarHBondContact N-O 2.96Å; R130-T149 PolarHBondContact O-N 3.37Å; T149-L169 CarbonylContact C-O 3.58Å; T149-L169 WeakPolarHBondContact CA-O 3.45Å
150I95.4Very high84.9Confident15 Ų1578 Ų788%0.07740%0.4CS..EExtended strand (participates in β ladder)trans-123.9132.7-178.7-55.4173.4000107.7L127 E128 V148 L152 D168 L169 T171 L176 M179L127-I150 HydrophobicContact CD1-CG2 3.85Å; L127-I150 HydrophobicContact CD2-CG2 4.07Å; L127-I150 HydrophobicContact CG-CG2 3.74Å; E128-I150 CarbonylContact O-C 3.06Å; E128-I150 WeakPolarHBondContact O-CA 3.4Å; V148-I150 HydrophobicContact CG1-CD1 4.37Å; V148-I150 HydrophobicContact CG1-CG1 3.92Å; I150-L152 HydrophobicContact CG2-CD2 4.2Å; I150-L152 HydrophobicContact CG2-CG 4.32Å; I150-D168 CarbonylContact O-C 3.6Å; I150-D168 WeakPolarHBondContact O-CA 3.11Å; I150-L169 HydrophobicContact CB-CB 4.31Å; I150-L169 PolarHBondContact N-O 3.26Å; I150-L169 PolarHBondContact O-N 2.63Å; I150-T171 HydrophobicContact CD1-CG2 4.07Å; I150-L176 HydrophobicContact CD1-CD1 4.12Å; I150-M179 HydrophobicContact CD1-CE 4.32Å
151R95.6Very high83.4Confident103 Ų10376.6 Ų76.639%0.38940%0.399SS..EExtended strand (participates in β ladder)trans-115.8116173167.8171.3-63.4152.90.9109.1L127 E128 L153 C166 D168L127-R151 WeakPolarHBondContact CA-O 3.43Å; E128-R151 HydrophobicContact CB-CB 4.19Å; E128-R151 PolarHBondContact N-O 3.09Å; E128-R151 PolarHBondContact O-N 3.25Å; E128-R151 IonicContact OE2-NH1 3.96Å; R151-L153 HydrophobicContact CG-CD2 4.35Å; R151-C166 VanDerWaalsContact CD-SG 3.54Å; R151-C166 WeakPolarHBondContact CG-SG 3.42Å; R151-D168 WeakPolarHBondContact CB-OD1 3.35Å; R151-D168 VanDerWaalsContact CG-OD1 3.25Å; R151-D168 WeakPolarHBondContact CG-OD1 3.45Å; R151-D168 IonicContact CZ-OD1 3.73Å; R151-D168 IonicContact CZ-OD2 3.24Å; R151-D168 IonicContact NE-OD1 3.53Å; R151-D168 PolarHBondContact NE-OD1 3.24Å; R151-D168 IonicContact NE-OD2 3.81Å; R151-D168 IonicContact NH2-OD1 3Å; R151-D168 IonicContact NH2-OD2 2.91Å; R151-D168 PolarHBondContact NH2-OD2 3.49Å
152L93.8Very high82.2Confident36 Ų3671.3 Ų71.319%0.18839%0.394CS..EExtended strand (participates in β ladder)trans-96.7117176.4-63.2173.7000109.5Y124 L127 I150 L154 C166 M167 L169Y124-L152 HydrophobicContact CE2-CD2 4.22Å; L127-L152 HydrophobicContact CB-CD2 4.25Å; L127-L152 HydrophobicContact CD1-CD2 3.7Å; L127-L152 HydrophobicContact CG-CD2 3.98Å; I150-L152 HydrophobicContact CG2-CD2 4.2Å; I150-L152 HydrophobicContact CG2-CG 4.32Å; L152-L154 HydrophobicContact CB-CD2 4.5Å; L152-C166 CarbonylContact O-C 3.59Å; L152-C166 WeakPolarHBondContact O-CA 3.3Å; L152-M167 HydrophobicContact CB-CB 4.32Å; L152-M167 PolarHBondContact N-O 2.89Å; L152-M167 PolarHBondContact O-N 2.94Å; L152-L169 HydrophobicContact CD1-CD1 3.64Å; L152-L169 HydrophobicContact CG-CD1 4.3Å
153L93Very high81.4Confident45 Ų4566.4 Ų66.424%0.23638%0.376CS..EExtended strand (participates in β ladder)trans-92123.2171.2-61.8173.9000108.3H125 N126 R151 C166H125-L153 WeakPolarHBondContact CA-O 3.5Å; H125-L153 WeakPolarHBondContact CB-O 3.48Å; H125-L153 PolarHBondContact N-O 3.15Å; N126-L153 HydrophobicContact CB-CB 4.06Å; N126-L153 HydrophobicContact CB-CD1 3.91Å; N126-L153 HydrophobicContact CB-CG 4.44Å; N126-L153 PolarHBondContact N-O 3.36Å; N126-L153 VanDerWaalsContact N-O 3.14Å; N126-L153 PolarHBondContact O-N 3.02Å; R151-L153 HydrophobicContact CG-CD2 4.35Å; L153-C166 HydrophobicContact CD2-CB 4.15Å
154L90.5Very high80.9Confident28 Ų2871.5 Ų71.515%0.14740%0.4CS..EExtended strand (participates in β ladder)trans-122.8140.6-173.4-59.2177.9000109.9P122 A123 L152 Q164 S165P122-L154 HydrophobicContact CB-CB 3.87Å; P122-L154 HydrophobicContact CB-CD1 3.94Å; P122-L154 HydrophobicContact CB-CG 4.35Å; P122-L154 HydrophobicContact CG-CD1 4.12Å; A123-L154 CarbonylContact O-C 3.51Å; A123-L154 VanDerWaalsContact O-CA 3.27Å; A123-L154 WeakPolarHBondContact O-CA 3.44Å; L152-L154 HydrophobicContact CB-CD2 4.5Å; L154-Q164 CarbonylContact O-C 3.56Å; L154-Q164 WeakPolarHBondContact O-CA 3.49Å; L154-S165 PolarHBondContact N-O 3.19Å; L154-S165 PolarHBondContact O-N 2.88Å
155T86.4Confident80.7Confident34 Ų3468.4 Ų68.421%0.20939%0.39CS..EExtended strand (participates in β ladder)trans-109.512917448.10000109.9A123 H125 Q164A123-T155 PolarHBondContact N-O 3.47Å; A123-T155 PolarHBondContact O-N 3.22Å; A123-T155 PolarHBondContact O-OG1 3.36Å; H125-T155 HydrophobicContact CB-CG2 3.93Å; T155-Q164 HydrophobicContact CG2-CG 4.24Å
156R76.8Confident80.5Confident122 Ų12268.8 Ų68.846%0.4639%0.394SS..EExtended strand (participates in β ladder)trans-106.8118.1172.3-162.6174.4-174.5176.50.6108.6N120 S158 T163N120-R156 VanDerWaalsContact CG-NE 3.3Å; N120-R156 PolarHBondContact ND2-NE 2.74Å; N120-R156 VanDerWaalsContact ND2-NE 3.13Å; N120-R156 WeakPolarHBondContact OD1-CG 3.44Å; N120-R156 PolarHBondContact OD1-NE 3.21Å; R156-S158 PolarHBondContact O-N 3.29Å; R156-T163 PolarHBondContact N-O 2.99Å; R156-T163 PolarHBondContact O-N 2.98Å; R156-T163 VanDerWaalsContact O-N 3.13Å; R156-T163 PolarHBondContact O-OG1 3.49Å
157S62.9Low80.3Confident98 Ų9871.2 Ų71.269%0.68540%0.403SS*.EExtended strand (participates in β ladder)trans-73.9115.2172.3-1710000107.7N120N120-S157 PolarHBondContact ND2-O 2.88Å; N120-S157 PolarHBondContact OD1-O 3.3Å
158S60.2Low80.3Confident43 Ų4372.2 Ų72.230%0.30141%0.41SS..EExtended strand (participates in β ladder)trans-120.8150.1167.871.50000108.2R156 V160 G161R156-S158 PolarHBondContact O-N 3.29Å; S158-V160 PolarHBondContact O-N 2.75Å; S158-G161 PolarHBondContact N-O 2.81Å; S158-G161 PolarHBondContact O-N 3.44Å; S158-G161 PolarHBondContact OG-O 2.94Å
159D52.7Low80.2Confident120 Ų12074.8 Ų74.864%0.64242%0.423SS*.THydrogen-bonded Turntrans-56.5-9.9180-73-17.1000113.3S112S112-D159 PolarHBondContact OG-OD2 2.97Å
160V54.7Low80.1Confident145 Ų14578.7 Ų78.788%0.87944%0.438SS*.THydrogen-bonded Turntrans-112.73.9-176.4-161.20000112.9S158S158-V160 PolarHBondContact O-N 2.75Å
161G58.8Low80Confident38 Ų3878.8 Ų78.839%0.39244%0.44SS..EExtended strand (participates in β ladder)trans138.5166178.100000113.7S158 T163S158-G161 PolarHBondContact N-O 2.81Å; S158-G161 PolarHBondContact O-N 3.44Å; S158-G161 PolarHBondContact OG-O 2.94Å; G161-T163 PolarHBondContact O-N 3.41Å
162S64.2Low79.9Confident96 Ų9676.7 Ų76.767%0.67144%0.437SS*.EExtended strand (participates in β ladder)trans-77.9111.9173.249.30000109.7
163T70.6Confident79.8Confident77 Ų7777.3 Ų77.347%0.47244%0.443SS..EExtended strand (participates in β ladder)trans-89.7121.4170.243.50000108.5R156 G161R156-T163 PolarHBondContact N-O 2.99Å; R156-T163 PolarHBondContact O-N 2.98Å; R156-T163 VanDerWaalsContact O-N 3.13Å; R156-T163 PolarHBondContact O-OG1 3.49Å; G161-T163 PolarHBondContact O-N 3.41Å
164Q80.3Confident79.8Confident149 Ų14979.2 Ų79.270%0.69646%0.46SS*.EExtended strand (participates in β ladder)trans-83.8129.1172.5-70.7-177.2-17.100108.9L154 T155L154-Q164 CarbonylContact O-C 3.56Å; L154-Q164 WeakPolarHBondContact O-CA 3.49Å; T155-Q164 HydrophobicContact CG2-CG 4.24Å
165S85.9Confident79.9Confident66 Ų6680.3 Ų80.346%0.46247%0.469SS..EExtended strand (participates in β ladder)trans-118.8148174.7-175.90000109L154L154-S165 PolarHBondContact N-O 3.19Å; L154-S165 PolarHBondContact O-N 2.88Å
166C88.3Confident80.2Confident67 Ų6781 Ų8145%0.45347%0.472SS..EExtended strand (participates in β ladder)trans-124.6134.6-178-174.40000109R151 L152 L153 D168R151-C166 VanDerWaalsContact CD-SG 3.54Å; R151-C166 WeakPolarHBondContact CG-SG 3.42Å; L152-C166 CarbonylContact O-C 3.59Å; L152-C166 WeakPolarHBondContact O-CA 3.3Å; L153-C166 HydrophobicContact CD2-CB 4.15Å; C166-D168 PolarHBondContact SG-OD1 3.32Å
167M90.6Very high81.1Confident95 Ų9581 Ų8147%0.46848%0.48SS..EExtended strand (participates in β ladder)trans-126.2116.4175.7-175.8-179-169.100109.8L152 L169L152-M167 HydrophobicContact CB-CB 4.32Å; L152-M167 PolarHBondContact N-O 2.89Å; L152-M167 PolarHBondContact O-N 2.94Å; M167-L169 HydrophobicContact CE-CD2 3.84Å; M167-L169 HydrophobicContact CG-CG 4.43Å
168D93Very high82.7Confident89 Ų8982.5 Ų82.548%0.47648%0.476SS..EExtended strand (participates in β ladder)trans-97.6131.9178.6-70.2-5.6000109.7I150 R151 C166I150-D168 CarbonylContact O-C 3.6Å; I150-D168 WeakPolarHBondContact O-CA 3.11Å; R151-D168 WeakPolarHBondContact CB-OD1 3.35Å; R151-D168 VanDerWaalsContact CG-OD1 3.25Å; R151-D168 WeakPolarHBondContact CG-OD1 3.45Å; R151-D168 IonicContact CZ-OD1 3.73Å; R151-D168 IonicContact CZ-OD2 3.24Å; R151-D168 IonicContact NE-OD1 3.53Å; R151-D168 PolarHBondContact NE-OD1 3.24Å; R151-D168 IonicContact NE-OD2 3.81Å; R151-D168 IonicContact NH2-OD1 3Å; R151-D168 IonicContact NH2-OD2 2.91Å; R151-D168 PolarHBondContact NH2-OD2 3.49Å; C166-D168 PolarHBondContact SG-OD1 3.32Å
169L93.3Very high84.3Confident66 Ų6683.9 Ų83.935%0.34648%0.479SS..EExtended strand (participates in β ladder)trans-130.2146.6-175.2-67.7166.1000109.2T149 I150 L152 M167T149-L169 CarbonylContact C-O 3.58Å; T149-L169 WeakPolarHBondContact CA-O 3.45Å; I150-L169 HydrophobicContact CB-CB 4.31Å; I150-L169 PolarHBondContact N-O 3.26Å; I150-L169 PolarHBondContact O-N 2.63Å; L152-L169 HydrophobicContact CD1-CD1 3.64Å; L152-L169 HydrophobicContact CG-CD1 4.3Å; M167-L169 HydrophobicContact CE-CD2 3.84Å; M167-L169 HydrophobicContact CG-CG 4.43Å
170Q94.9Very high86.3Confident120 Ų12081.6 Ų81.656%0.56147%0.466SS*.EExtended strand (participates in β ladder)trans-130.9134.6173-170.2169.530.500109.8M147 V148M147-Q170 HydrophobicContact CE-CG 4.32Å; M147-Q170 HydrophobicContact SD-CG 4.31Å; V148-Q170 CarbonylContact O-C 3.54Å; V148-Q170 WeakPolarHBondContact O-CA 3.29Å
171T94.3Very high88.3Confident17 Ų1777.9 Ų77.910%0.10445%0.446CS..EExtended strand (participates in β ladder)trans-145.2150.3-173.8179.70000110.7V148 I150 S175 L176 M179V148-T171 HydrophobicContact CB-CG2 3.95Å; V148-T171 HydrophobicContact CG1-CG2 4.41Å; V148-T171 PolarHBondContact N-O 3.44Å; V148-T171 PolarHBondContact O-N 2.9Å; I150-T171 HydrophobicContact CD1-CG2 4.07Å; T171-S175 WeakPolarHBondContact OG1-CB 3.37Å; T171-L176 HydrophobicContact CG2-CB 4.2Å; T171-L176 PolarHBondContact OG1-N 2.96Å; T171-M179 HydrophobicContact CG2-CE 3.75Å
172D93.7Very high90.1Very high60 Ų6079.4 Ų79.432%0.32145%0.448SS..  trans-79164.1164.370-83.8000110.5S174 S175 L176D172-S174 VanDerWaalsContact C-N 3.31Å; D172-S174 PolarHBondContact O-N 3.24Å; D172-S174 WeakPolarHBondContact OD2-CA 3.36Å; D172-S174 VanDerWaalsContact OD2-CB 3.32Å; D172-S174 WeakPolarHBondContact OD2-CB 3.32Å; D172-S174 PolarHBondContact OD2-N 3.29Å; D172-S174 PolarHBondContact OD2-OG 3.48Å; D172-S175 PolarHBondContact O-N 3.42Å; D172-S175 WeakPolarHBondContact OD1-CB 3.19Å; D172-S175 PolarHBondContact OD1-OG 3.39Å; D172-S175 PolarHBondContact OD2-N 3.13Å; D172-L176 PolarHBondContact O-N 3.21Å
173P91.1Very high91.6Very high49 Ų4980.8 Ų80.832%0.31845%0.447SS..Hα-helixtrans-62.8-30.8-179-26.236.1000114.9P146 L176 L177P146-P173 HydrophobicContact CB-CG 3.74Å; P146-P173 HydrophobicContact CG-CG 3.53Å; P173-L176 PolarHBondContact O-N 3.3Å; P173-L177 WeakPolarHBondContact O-CG 3.39Å; P173-L177 PolarHBondContact O-N 2.79Å
174S91.6Very high92.8Very high85 Ų8583.1 Ų83.159%0.59445%0.453SS*.Hα-helixtrans-72.2-41.5-179.273.30000111.1D172 L176 L177 H178D172-S174 VanDerWaalsContact C-N 3.31Å; D172-S174 PolarHBondContact O-N 3.24Å; D172-S174 WeakPolarHBondContact OD2-CA 3.36Å; D172-S174 VanDerWaalsContact OD2-CB 3.32Å; D172-S174 WeakPolarHBondContact OD2-CB 3.32Å; D172-S174 PolarHBondContact OD2-N 3.29Å; D172-S174 PolarHBondContact OD2-OG 3.48Å; S174-L176 VanDerWaalsContact C-N 3.31Å; S174-L176 PolarHBondContact O-N 2.89Å; S174-L177 PolarHBondContact O-N 3.33Å; S174-H178 PolarHBondContact O-N 3.34Å
175S93.1Very high93.6Very high50 Ų5078.8 Ų78.835%0.3544%0.443SS..Hα-helixtrans-63.4-36.5171.1-64.70000111.9T171 D172 H178 M179T171-S175 WeakPolarHBondContact OG1-CB 3.37Å; D172-S175 PolarHBondContact O-N 3.42Å; D172-S175 WeakPolarHBondContact OD1-CB 3.19Å; D172-S175 PolarHBondContact OD1-OG 3.39Å; D172-S175 PolarHBondContact OD2-N 3.13Å; S175-H178 WeakPolarHBondContact O-CB 3.15Å; S175-H178 PolarHBondContact O-N 3.05Å; S175-M179 WeakPolarHBondContact O-CG 3.4Å; S175-M179 PolarHBondContact O-N 3.02Å
176L93.9Very high93.9Very high49 Ų4978.1 Ų78.126%0.25744%0.441SS..Hα-helixtrans-62.7-44.4174179.860.6000112.2V148 I150 T171 D172 P173 S174 H178 M179 I180V148-L176 HydrophobicContact CG1-CD2 4.3Å; V148-L176 HydrophobicContact CG2-CD2 4.18Å; I150-L176 HydrophobicContact CD1-CD1 4.12Å; T171-L176 HydrophobicContact CG2-CB 4.2Å; T171-L176 PolarHBondContact OG1-N 2.96Å; D172-L176 PolarHBondContact O-N 3.21Å; P173-L176 PolarHBondContact O-N 3.3Å; S174-L176 VanDerWaalsContact C-N 3.31Å; S174-L176 PolarHBondContact O-N 2.89Å; L176-H178 VanDerWaalsContact C-N 3.28Å; L176-H178 PolarHBondContact O-N 2.97Å; L176-M179 HydrophobicContact CB-CE 4.36Å; L176-M179 HydrophobicContact CD1-CE 3.78Å; L176-M179 PolarHBondContact O-N 3.49Å; L176-I180 HydrophobicContact CD1-CD1 4.48Å; L176-I180 HydrophobicContact CG-CD1 4.21Å; L176-I180 WeakPolarHBondContact O-CG1 3.27Å; L176-I180 PolarHBondContact O-N 3.25Å
177L94.8Very high94.1Very high122 Ų12280.1 Ų80.164%0.63945%0.446SS*.Hα-helixtrans-60.8-39.8174.8-71.4171.9000111.7P173 S174 I180 S181P173-L177 WeakPolarHBondContact O-CG 3.39Å; P173-L177 PolarHBondContact O-N 2.79Å; S174-L177 PolarHBondContact O-N 3.33Å; L177-I180 PolarHBondContact O-N 2.53Å; L177-S181 PolarHBondContact O-N 2.86Å
178H95.8Very high94.2Very high129 Ų12978.3 Ų78.360%0.59745%0.447SS*.Hα-helixtrans-63.7-42.8174.8-177.956.9000112.1S174 S175 L176 I180 S181 T182S174-H178 PolarHBondContact O-N 3.34Å; S175-H178 WeakPolarHBondContact O-CB 3.15Å; S175-H178 PolarHBondContact O-N 3.05Å; L176-H178 VanDerWaalsContact C-N 3.28Å; L176-H178 PolarHBondContact O-N 2.97Å; H178-I180 PolarHBondContact O-N 3.03Å; H178-S181 PolarHBondContact O-N 3.45Å; H178-T182 WeakPolarHBondContact O-CB 3.37Å; H178-T182 PolarHBondContact O-N 3.42Å; H178-T182 PolarHBondContact O-OG1 3.02Å
179M94.1Very high94.1Very high72 Ų7276.4 Ų76.436%0.35544%0.444SS..Hα-helixtrans-60.4-44.6175.3-73.4-169.1-66.700111.7I150 T171 S175 L176 S181 T182 L183I150-M179 HydrophobicContact CD1-CE 4.32Å; T171-M179 HydrophobicContact CG2-CE 3.75Å; S175-M179 WeakPolarHBondContact O-CG 3.4Å; S175-M179 PolarHBondContact O-N 3.02Å; L176-M179 HydrophobicContact CB-CE 4.36Å; L176-M179 HydrophobicContact CD1-CE 3.78Å; L176-M179 PolarHBondContact O-N 3.49Å; M179-S181 PolarHBondContact O-N 3.38Å; M179-T182 PolarHBondContact O-N 3.45Å; M179-L183 WeakPolarHBondContact O-CB 3.47Å; M179-L183 VanDerWaalsContact O-CG 3.29Å; M179-L183 WeakPolarHBondContact O-CG 3.29Å; M179-L183 PolarHBondContact O-N 3.47Å
180I95.1Very high93.9Very high73 Ų7377.1 Ų77.137%0.37445%0.451SS..Hα-helixtrans-57.8-51.2176.5-67.6165.5000110.1L176 L177 H178 T182 L183 E184L176-I180 HydrophobicContact CD1-CD1 4.48Å; L176-I180 HydrophobicContact CG-CD1 4.21Å; L176-I180 WeakPolarHBondContact O-CG1 3.27Å; L176-I180 PolarHBondContact O-N 3.25Å; L177-I180 PolarHBondContact O-N 2.53Å; H178-I180 PolarHBondContact O-N 3.03Å; I180-T182 VanDerWaalsContact C-N 3.27Å; I180-T182 PolarHBondContact O-N 2.85Å; I180-L183 PolarHBondContact O-N 3.44Å; I180-E184 HydrophobicContact CG2-CG 4.35Å; I180-E184 WeakPolarHBondContact O-CB 3.25Å; I180-E184 WeakPolarHBondContact O-CG 3.22Å; I180-E184 PolarHBondContact O-N 3.44Å
181S97.1Very high93.7Very high67 Ų6778.1 Ų78.147%0.46945%0.453SS..Hα-helixtrans-55.5-42.6177165.20000112.4L177 H178 M179 E184 A185L177-S181 PolarHBondContact O-N 2.86Å; H178-S181 PolarHBondContact O-N 3.45Å; M179-S181 PolarHBondContact O-N 3.38Å; S181-E184 PolarHBondContact O-N 2.79Å; S181-A185 WeakPolarHBondContact O-CB 3.36Å; S181-A185 PolarHBondContact O-N 3.36Å
182T96.8Very high93.6Very high70 Ų7080.5 Ų80.543%0.42947%0.467SS..Hα-helixtrans-68.4-41.1-179.1-49.30000111.5H178 M179 I180 A185 A186H178-T182 WeakPolarHBondContact O-CB 3.37Å; H178-T182 PolarHBondContact O-N 3.42Å; H178-T182 PolarHBondContact O-OG1 3.02Å; M179-T182 PolarHBondContact O-N 3.45Å; I180-T182 VanDerWaalsContact C-N 3.27Å; I180-T182 PolarHBondContact O-N 2.85Å; T182-A185 PolarHBondContact O-N 3.32Å; T182-A186 WeakPolarHBondContact O-CB 3.44Å; T182-A186 PolarHBondContact O-N 2.75Å
183L94.7Very high93.4Very high124 Ų12481.9 Ų81.965%0.64948%0.482SS*.Hα-helixtrans-68.5-38.4177.3-70.5173.8000112M179 I180 A186 L187M179-L183 WeakPolarHBondContact O-CB 3.47Å; M179-L183 VanDerWaalsContact O-CG 3.29Å; M179-L183 WeakPolarHBondContact O-CG 3.29Å; M179-L183 PolarHBondContact O-N 3.47Å; I180-L183 PolarHBondContact O-N 3.44Å; L183-A186 PolarHBondContact O-N 2.85Å; L183-L187 WeakPolarHBondContact O-CB 3.44Å; L183-L187 PolarHBondContact O-N 3.46Å
184E96.7Very high93.2Very high126 Ų12685.1 Ų85.159%0.58949%0.492SS*.Hα-helixtrans-63.3-43.1173.3-73.9177.7166.600111.7I180 S181 A186 L187 A188I180-E184 HydrophobicContact CG2-CG 4.35Å; I180-E184 WeakPolarHBondContact O-CB 3.25Å; I180-E184 WeakPolarHBondContact O-CG 3.22Å; I180-E184 PolarHBondContact O-N 3.44Å; S181-E184 PolarHBondContact O-N 2.79Å; E184-A186 VanDerWaalsContact C-N 3.34Å; E184-A186 PolarHBondContact O-N 2.82Å; E184-L187 PolarHBondContact O-N 2.87Å; E184-A188 PolarHBondContact O-N 2.81Å
185A95.8Very high92.8Very high59 Ų5982 Ų8249%0.48847%0.472SS..Hα-helixtrans-61.9-42.1174.400000111.6S181 T182 L187 A188 A189S181-A185 WeakPolarHBondContact O-CB 3.36Å; S181-A185 PolarHBondContact O-N 3.36Å; T182-A185 PolarHBondContact O-N 3.32Å; A185-L187 PolarHBondContact O-N 3.02Å; A185-A188 PolarHBondContact O-N 2.81Å; A185-A189 WeakPolarHBondContact O-CB 3.44Å; A185-A189 PolarHBondContact O-N 2.85Å
186A92.5Very high92.4Very high51 Ų5186.2 Ų86.242%0.42148%0.481SS..Hα-helixtrans-62.1-42174.500000111.8T182 L183 E184 A188 A189 V190T182-A186 WeakPolarHBondContact O-CB 3.44Å; T182-A186 PolarHBondContact O-N 2.75Å; L183-A186 PolarHBondContact O-N 2.85Å; E184-A186 VanDerWaalsContact C-N 3.34Å; E184-A186 PolarHBondContact O-N 2.82Å; A186-A188 VanDerWaalsContact C-N 3.33Å; A186-A188 PolarHBondContact O-N 2.78Å; A186-A189 WeakPolarHBondContact O-CB 3.17Å; A186-A189 PolarHBondContact O-N 2.76Å; A186-A189 VanDerWaalsContact O-N 3.17Å; A186-V190 WeakPolarHBondContact O-CG2 3.46Å; A186-V190 PolarHBondContact O-N 2.77Å; A186-V190 VanDerWaalsContact O-N 3.09Å
187L92.9Very high91.9Very high109 Ų10991.5 Ų91.557%0.57150%0.497SS*.Hα-helixtrans-64.3-38.5177.1-162.9151.6000111.6L183 E184 A185L183-L187 WeakPolarHBondContact O-CB 3.44Å; L183-L187 PolarHBondContact O-N 3.46Å; E184-L187 PolarHBondContact O-N 2.87Å; A185-L187 PolarHBondContact O-N 3.02Å
188A93.3Very high91.3Very high57 Ų5789.1 Ų89.147%0.47148%0.484SS..Hα-helixtrans-65.3-41.4172.200000111.9E184 A185 A186 V190 K191E184-A188 PolarHBondContact O-N 2.81Å; A185-A188 PolarHBondContact O-N 2.81Å; A186-A188 VanDerWaalsContact C-N 3.33Å; A186-A188 PolarHBondContact O-N 2.78Å; A188-V190 VanDerWaalsContact C-N 3.31Å; A188-V190 PolarHBondContact O-N 2.79Å; A188-K191 WeakPolarHBondContact O-CB 3.4Å; A188-K191 PolarHBondContact O-N 2.86Å; A188-K191 VanDerWaalsContact O-N 3.09Å
189A91.7Very high90.3Very high50 Ų5088.5 Ų88.541%0.41349%0.485SS..Hα-helixtrans-61.8-36179.400000112.8A185 A186 K191 T192 A195A185-A189 WeakPolarHBondContact O-CB 3.44Å; A185-A189 PolarHBondContact O-N 2.85Å; A186-A189 WeakPolarHBondContact O-CB 3.17Å; A186-A189 PolarHBondContact O-N 2.76Å; A186-A189 VanDerWaalsContact O-N 3.17Å; A189-K191 PolarHBondContact O-N 2.79Å; A189-T192 VanDerWaalsContact O-CB 3.29Å; A189-T192 WeakPolarHBondContact O-CB 3.38Å; A189-T192 WeakPolarHBondContact O-CG2 3.44Å; A189-T192 PolarHBondContact O-N 2.88Å; A189-T192 VanDerWaalsContact O-N 3.07Å; A189-T192 PolarHBondContact O-OG1 3.13Å; A189-A195 WeakPolarHBondContact O-CB 3.11Å
190V88.9Confident89.3Confident81 Ų8194 Ų9449%0.49150%0.501SS..Hα-helixtrans-60.4-29175.9171.80000112.4A186 A188 T192A186-V190 WeakPolarHBondContact O-CG2 3.46Å; A186-V190 PolarHBondContact O-N 2.77Å; A186-V190 VanDerWaalsContact O-N 3.09Å; A188-V190 VanDerWaalsContact C-N 3.31Å; A188-V190 PolarHBondContact O-N 2.79Å; V190-T192 VanDerWaalsContact C-N 3.25Å; V190-T192 PolarHBondContact O-N 3.37Å
191K89Confident87.7Confident141 Ų14196.5 Ų96.561%0.61352%0.516SS*.THydrogen-bonded Turntrans-75.4-13.4178.9-60.6177.9-176.71750113.2A188 A189 R196A188-K191 WeakPolarHBondContact O-CB 3.4Å; A188-K191 PolarHBondContact O-N 2.86Å; A188-K191 VanDerWaalsContact O-N 3.09Å; A189-K191 PolarHBondContact O-N 2.79Å; K191-R196 PolarHBondContact O-NE 3Å; K191-R196 PolarHBondContact O-NH2 3Å
192T92.1Very high86.1Confident66 Ų6698.6 Ų98.641%0.40552%0.52SS..SBendtrans-62.5154.1-179.666.20000111.8A189 V190 H194 A195 R196A189-T192 VanDerWaalsContact O-CB 3.29Å; A189-T192 WeakPolarHBondContact O-CB 3.38Å; A189-T192 WeakPolarHBondContact O-CG2 3.44Å; A189-T192 PolarHBondContact O-N 2.88Å; A189-T192 VanDerWaalsContact O-N 3.07Å; A189-T192 PolarHBondContact O-OG1 3.13Å; V190-T192 VanDerWaalsContact C-N 3.25Å; V190-T192 PolarHBondContact O-N 3.37Å; T192-H194 VanDerWaalsContact C-N 3.26Å; T192-H194 PolarHBondContact O-N 2.81Å; T192-A195 PolarHBondContact O-N 3.14Å; T192-A195 WeakPolarHBondContact OG1-CB 3.49Å; T192-A195 PolarHBondContact OG1-N 2.86Å; T192-R196 WeakPolarHBondContact O-CB 3.42Å; T192-R196 WeakPolarHBondContact O-CG 3.33Å; T192-R196 PolarHBondContact O-N 3.07Å
193S89.6Confident83.7Confident90 Ų90105.4 Ų105.463%0.62954%0.544SS*.Hα-helixtrans-58.1-41.3176.8178.30000111.7R196 R197S193-R196 PolarHBondContact O-N 3.18Å; S193-R197 PolarHBondContact O-N 2.89Å
194H87.4Confident83.2Confident116 Ų116104.5 Ų104.554%0.53754%0.539SS..Hα-helixtrans-62.2-51179.9-175.778.7000112.1T192 R196 R197 I198T192-H194 VanDerWaalsContact C-N 3.26Å; T192-H194 PolarHBondContact O-N 2.81Å; H194-R196 PolarHBondContact O-N 3.11Å; H194-R197 WeakPolarHBondContact O-CB 3.45Å; H194-R197 PolarHBondContact O-N 2.8Å; H194-I198 VanDerWaalsContact NE2-CD1 3.35Å; H194-I198 WeakPolarHBondContact NE2-CD1 3.47Å; H194-I198 PolarHBondContact O-N 3.3Å; H194-I198 VanDerWaalsContact O-N 3.08Å
195A84Confident82.5Confident21 Ų21103.4 Ų103.417%0.17454%0.536CS..Hα-helixtrans-62.7-41.217800000111.9A189 T192 R197 I198 L199A189-A195 WeakPolarHBondContact O-CB 3.11Å; T192-A195 PolarHBondContact O-N 3.14Å; T192-A195 WeakPolarHBondContact OG1-CB 3.49Å; T192-A195 PolarHBondContact OG1-N 2.86Å; A195-R197 VanDerWaalsContact C-N 3.31Å; A195-R197 PolarHBondContact O-N 2.76Å; A195-I198 PolarHBondContact O-N 3.01Å; A195-L199 PolarHBondContact O-N 2.76Å
196R84.3Confident81.7Confident138 Ų138105.8 Ų105.852%0.52154%0.539SS..Hα-helixtrans-61.4-36.5174.6-76.2-172.1-77.7157.6-4.6113K191 T192 S193 H194 R200K191-R196 PolarHBondContact O-NE 3Å; K191-R196 PolarHBondContact O-NH2 3Å; T192-R196 WeakPolarHBondContact O-CB 3.42Å; T192-R196 WeakPolarHBondContact O-CG 3.33Å; T192-R196 PolarHBondContact O-N 3.07Å; S193-R196 PolarHBondContact O-N 3.18Å; H194-R196 PolarHBondContact O-N 3.11Å; R196-R200 WeakPolarHBondContact O-CG 3.44Å; R196-R200 PolarHBondContact O-N 2.9Å
197R83.6Confident81.1Confident159 Ų159109.1 Ų109.160%0.655%0.546SS*.Hα-helixtrans-65.9-43.2175.4-171.2176.969.8149.32.5111.3S193 H194 A195 R200 N201S193-R197 PolarHBondContact O-N 2.89Å; H194-R197 WeakPolarHBondContact O-CB 3.45Å; H194-R197 PolarHBondContact O-N 2.8Å; A195-R197 VanDerWaalsContact C-N 3.31Å; A195-R197 PolarHBondContact O-N 2.76Å; R197-R200 PolarHBondContact O-N 2.91Å; R197-N201 PolarHBondContact O-ND2 2.77Å
198I81.6Confident80.4Confident73 Ų73109.1 Ų109.137%0.37454%0.544SS..Hα-helixtrans-63-47.8176.3-68.9172.3000110.5H194 A195 R200 N201 I202H194-I198 VanDerWaalsContact NE2-CD1 3.35Å; H194-I198 WeakPolarHBondContact NE2-CD1 3.47Å; H194-I198 PolarHBondContact O-N 3.3Å; H194-I198 VanDerWaalsContact O-N 3.08Å; A195-I198 PolarHBondContact O-N 3.01Å; I198-R200 PolarHBondContact O-N 3.25Å; I198-N201 PolarHBondContact O-N 3.45Å; I198-I202 HydrophobicContact CG2-CD1 3.39Å; I198-I202 HydrophobicContact CG2-CG1 4.2Å; I198-I202 WeakPolarHBondContact O-CG1 3.36Å; I198-I202 PolarHBondContact O-N 2.96Å
199L74.8Confident79.5Confident115 Ų115112.5 Ų112.560%0.60255%0.549SS*.Hα-helixtrans-59.5-31.7-178.2-132.897.4000113.2A195 N201A195-L199 PolarHBondContact O-N 2.76Å; L199-N201 PolarHBondContact O-N 3.46Å
200R73.4Confident78.6Confident188 Ų188117 Ų11771%0.70956%0.559SS**Hα-helixtrans-65.3-28.7175.3-74.1173.3-173.6-176.10.6112.9R196 R197 I198R196-R200 WeakPolarHBondContact O-CG 3.44Å; R196-R200 PolarHBondContact O-N 2.9Å; R197-R200 PolarHBondContact O-N 2.91Å; I198-R200 PolarHBondContact O-N 3.25Å
201N61.9Low77.8Confident126 Ų126119.8 Ų119.867%0.67456%0.564SS**Hα-helixtrans-95.3-8.4-175.1-64.9-24000113.4R197 I198 L199R197-N201 PolarHBondContact O-ND2 2.77Å; I198-N201 PolarHBondContact O-N 3.45Å; L199-N201 PolarHBondContact O-N 3.46Å
202I64Low76.9Confident111 Ų111118 Ų11857%0.56956%0.56SS**  trans-93.19.8-177.7-66.4177.1000112.6I198I198-I202 HydrophobicContact CG2-CD1 3.39Å; I198-I202 HydrophobicContact CG2-CG1 4.2Å; I198-I202 WeakPolarHBondContact O-CG1 3.36Å; I198-I202 PolarHBondContact O-N 2.96Å
203K46.3Very low75.5Confident213 Ų213122.7 Ų122.793%0.92657%0.574SS**  trans-66.60175.6-81.8-171.5177-176.50113.6K74K74-K203 VanDerWaalsContact CE-O 3.24Å; K74-K203 WeakPolarHBondContact CE-O 3.37Å

Retrieved 203 of 203 residues in 302.5 ms (Link to these results)

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