A0A087YJC5_POEFO Loading...

Telomere repeat binding bouquet formation protein 1

AlphaFold DB , UniProt , Accession A0A087YJC5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 730 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
1M44.7Very low57.2Low209 Ų209118.9 Ų118.9100%1.0362%0.616SS**  023.30-86.4166158.700112.4
2D54.2Low59.4Low135 Ų135116.3 Ų116.372%0.72260%0.603SS**Hα-helixtrans-99.3-22.7-144.7-45-70.8000113.8A4 G5 S6D2-A4 PolarHBondContact O-N 2.57Å; D2-G5 PolarHBondContact O-N 2.61Å; D2-S6 WeakPolarHBondContact O-CB 3.48Å; D2-S6 PolarHBondContact O-N 3.3Å
3R43.7Very low61.7Low225 Ų225112.8 Ų112.885%0.84959%0.591SS**Hα-helixtrans-61-41.9170.3-89.7-174.1174.3-179-1.2112.2S6 C7R3-S6 PolarHBondContact O-N 3.48Å; R3-C7 WeakPolarHBondContact O-CB 3.24Å; R3-C7 PolarHBondContact O-N 3.24Å; R3-C7 PolarHBondContact O-SG 2.9Å
4A47.4Very low63.8Low76 Ų76106.1 Ų106.163%0.62856%0.557SS**Hα-helixtrans-66.6-40.8-179.800000112.2D2 R8D2-A4 PolarHBondContact O-N 2.57Å; A4-R8 WeakPolarHBondContact O-CB 3.28Å; A4-R8 PolarHBondContact O-N 3.43Å
5G49.3Very low65.7Low36 Ų36103.5 Ų103.537%0.37154%0.539SS..Hα-helixtrans-64.5-45.8174.400000112.6D2 R8 N9D2-G5 PolarHBondContact O-N 2.61Å; G5-R8 PolarHBondContact O-N 3.18Å; G5-N9 PolarHBondContact O-N 3.33Å
6S54.7Low67.4Low81 Ų81102.1 Ų102.157%0.56654%0.536SS*.Hα-helixtrans-62-47.2177.5-1740000112.3D2 R3 R8 N9 N10D2-S6 WeakPolarHBondContact O-CB 3.48Å; D2-S6 PolarHBondContact O-N 3.3Å; R3-S6 PolarHBondContact O-N 3.48Å; S6-R8 VanDerWaalsContact C-N 3.34Å; S6-R8 PolarHBondContact O-N 3.36Å; S6-N9 PolarHBondContact O-N 3.32Å; S6-N10 WeakPolarHBondContact O-CB 3.29Å; S6-N10 PolarHBondContact O-N 3.38Å
7C56.8Low69Low81 Ų81100.6 Ų100.655%0.54753%0.529SS..Hα-helixtrans-61.5-39176.2-71.60000112.8R3 N10 R11R3-C7 WeakPolarHBondContact O-CB 3.24Å; R3-C7 PolarHBondContact O-N 3.24Å; R3-C7 PolarHBondContact O-SG 2.9Å; C7-N10 PolarHBondContact O-N 3.03Å; C7-R11 PolarHBondContact O-N 2.91Å
8R60.7Low70.4Confident186 Ų18695 Ų9570%0.70250%0.499SS*.Hα-helixtrans-68.6-40.3178.4-169175.6-175.3-178.60.9112.1A4 G5 S6 R11 N12A4-R8 WeakPolarHBondContact O-CB 3.28Å; A4-R8 PolarHBondContact O-N 3.43Å; G5-R8 PolarHBondContact O-N 3.18Å; S6-R8 VanDerWaalsContact C-N 3.34Å; S6-R8 PolarHBondContact O-N 3.36Å; R8-R11 PolarHBondContact O-N 2.88Å; R8-N12 VanDerWaalsContact O-CG 3.28Å; R8-N12 PolarHBondContact O-N 2.75Å; R8-N12 VanDerWaalsContact O-N 3.1Å
9N66.5Low71.7Confident110 Ų11091.9 Ų91.959%0.58849%0.486SS*.Hα-helixtrans-64.4-43.2174.5-75.1-6.4000111.4G5 S6 N12 T13G5-N9 PolarHBondContact O-N 3.33Å; S6-N9 PolarHBondContact O-N 3.32Å; N9-N12 PolarHBondContact O-N 3.03Å; N9-T13 PolarHBondContact O-N 2.88Å; N9-T13 PolarHBondContact O-OG1 3.44Å
10N71.7Confident72.9Confident83 Ų8392.2 Ų92.244%0.44449%0.487SS..Hα-helixtrans-65-39.4177.9-163.213.9000112.5S6 C7 N12 T13 T14S6-N10 WeakPolarHBondContact O-CB 3.29Å; S6-N10 PolarHBondContact O-N 3.38Å; C7-N10 PolarHBondContact O-N 3.03Å; N10-N12 VanDerWaalsContact C-N 3.3Å; N10-N12 PolarHBondContact O-N 3.04Å; N10-T13 WeakPolarHBondContact CA-OG1 3.38Å; N10-T13 PolarHBondContact O-N 3.1Å; N10-T13 PolarHBondContact O-OG1 3.05Å; N10-T14 PolarHBondContact O-N 3.33Å; N10-T14 PolarHBondContact O-OG1 3.18Å; N10-T14 VanDerWaalsContact O-OG1 3.05Å
11R79.4Confident74Confident86 Ų8689.2 Ų89.233%0.32547%0.472SS..Hα-helixtrans-62.6-37.9173.2-167179.9172.4103.9-2.2111.6C7 R8 K15 D51 L55 E58C7-R11 PolarHBondContact O-N 2.91Å; R8-R11 PolarHBondContact O-N 2.88Å; R11-K15 WeakPolarHBondContact O-CB 3.41Å; R11-K15 PolarHBondContact O-N 3.34Å; R11-D51 IonicContact NH1-OD1 3.16Å; R11-D51 PolarHBondContact NH1-OD1 2.8Å; R11-L55 HydrophobicContact CG-CD1 3.89Å; R11-L55 HydrophobicContact CG-CD2 4.18Å; R11-L55 HydrophobicContact CG-CG 4.41Å; R11-E58 IonicContact NH2-OE1 3.08Å; R11-E58 PolarHBondContact NH2-OE1 3.1Å; R11-E58 VanDerWaalsContact NH2-OE1 3.08Å
12N83.6Confident76.4Confident87 Ų8780.2 Ų80.247%0.46543%0.428SS..Hα-helixtrans-69.4-42.7177.6-72-11.9000112.5R8 N9 N10 K15 T16R8-N12 VanDerWaalsContact O-CG 3.28Å; R8-N12 PolarHBondContact O-N 2.75Å; R8-N12 VanDerWaalsContact O-N 3.1Å; N9-N12 PolarHBondContact O-N 3.03Å; N10-N12 VanDerWaalsContact C-N 3.3Å; N10-N12 PolarHBondContact O-N 3.04Å; N12-K15 PolarHBondContact O-N 2.86Å; N12-T16 PolarHBondContact O-N 3.13Å; N12-T16 PolarHBondContact O-OG1 2.99Å
13T88.8Confident78.3Confident72 Ų7278.8 Ų78.844%0.44242%0.417SS..Hα-helixtrans-61.9-48.5176470000110.9N9 N10 K15 T16 D17N9-T13 PolarHBondContact O-N 2.88Å; N9-T13 PolarHBondContact O-OG1 3.44Å; N10-T13 WeakPolarHBondContact CA-OG1 3.38Å; N10-T13 PolarHBondContact O-N 3.1Å; N10-T13 PolarHBondContact O-OG1 3.05Å; T13-K15 VanDerWaalsContact C-N 3.28Å; T13-K15 PolarHBondContact O-N 3.41Å; T13-T16 WeakPolarHBondContact O-CA 3.47Å; T13-T16 WeakPolarHBondContact O-CB 3.4Å; T13-T16 PolarHBondContact O-N 3.22Å; T13-D17 VanDerWaalsContact O-CG 3.25Å; T13-D17 PolarHBondContact O-N 3.09Å
14T91.5Very high80.6Confident19 Ų1969.6 Ų69.612%0.11739%0.386CS..Hα-helixtrans-60.7-35.9177.3-530000112.5N10 D17 L18 I45 L55N10-T14 PolarHBondContact O-N 3.33Å; N10-T14 PolarHBondContact O-OG1 3.18Å; N10-T14 VanDerWaalsContact O-OG1 3.05Å; T14-D17 PolarHBondContact O-N 3.2Å; T14-L18 HydrophobicContact CG2-CD1 4.15Å; T14-L18 HydrophobicContact CG2-CG 4.39Å; T14-L18 WeakPolarHBondContact O-CB 3.26Å; T14-L18 VanDerWaalsContact O-CG 3.3Å; T14-L18 WeakPolarHBondContact O-CG 3.46Å; T14-L18 PolarHBondContact O-N 3.44Å; T14-I45 HydrophobicContact CG2-CG2 3.67Å; T14-L55 HydrophobicContact CG2-CD1 4.48Å
15K92.3Very high82.7Confident67 Ų6766 Ų6629%0.29136%0.357SS..Hα-helixtrans-64.2-39.6174-169.7170.8-170.2152.20112.3R11 N12 T13 S19 L55 E58 L59R11-K15 WeakPolarHBondContact O-CB 3.41Å; R11-K15 PolarHBondContact O-N 3.34Å; N12-K15 PolarHBondContact O-N 2.86Å; T13-K15 VanDerWaalsContact C-N 3.28Å; T13-K15 PolarHBondContact O-N 3.41Å; K15-S19 WeakPolarHBondContact O-CB 3.48Å; K15-S19 PolarHBondContact O-N 2.63Å; K15-S19 VanDerWaalsContact O-N 3.08Å; K15-S19 PolarHBondContact O-OG 3.38Å; K15-L55 HydrophobicContact CB-CD1 4.33Å; K15-L55 HydrophobicContact CB-CD2 4.21Å; K15-L55 HydrophobicContact CD-CD2 3.94Å; K15-L55 HydrophobicContact CG-CD2 4.2Å; K15-E58 IonicContact NZ-OE2 2.78Å; K15-E58 PolarHBondContact NZ-OE2 3.36Å; K15-L59 HydrophobicContact CG-CD1 4.2Å; K15-L59 HydrophobicContact CG-CD2 4.24Å; K15-L59 HydrophobicContact CG-CG 4.45Å
16T93.1Very high84.7Confident80 Ų8070 Ų7049%0.49136%0.364SS..Hα-helixtrans-65.5-46.7173.7-59.80000111.3N12 T13 L18 S19 L20N12-T16 PolarHBondContact O-N 3.13Å; N12-T16 PolarHBondContact O-OG1 2.99Å; T13-T16 WeakPolarHBondContact O-CA 3.47Å; T13-T16 WeakPolarHBondContact O-CB 3.4Å; T13-T16 PolarHBondContact O-N 3.22Å; T16-L18 PolarHBondContact O-N 3.29Å; T16-S19 WeakPolarHBondContact O-CB 3.25Å; T16-S19 PolarHBondContact O-N 2.86Å; T16-S19 VanDerWaalsContact O-N 3.14Å; T16-L20 HydrophobicContact CG2-CD1 4.06Å; T16-L20 HydrophobicContact CG2-CG 4.44Å; T16-L20 WeakPolarHBondContact O-CG 3.49Å; T16-L20 PolarHBondContact O-N 3.33Å
17D94.1Very high86.3Confident77 Ų7773 Ų7341%0.41237%0.367SS..Hα-helixtrans-60-46.2179.7-60.3-30000111.5T13 T14 S19 L20 L21T13-D17 VanDerWaalsContact O-CG 3.25Å; T13-D17 PolarHBondContact O-N 3.09Å; T14-D17 PolarHBondContact O-N 3.2Å; D17-S19 VanDerWaalsContact C-N 3.33Å; D17-S19 PolarHBondContact O-N 3.22Å; D17-L20 PolarHBondContact O-N 3.47Å; D17-L21 VanDerWaalsContact O-CG 3.29Å; D17-L21 WeakPolarHBondContact O-CG 3.19Å; D17-L21 PolarHBondContact O-N 3.09Å
18L95.1Very high87.5Confident0 Ų072.9 Ų72.90%036%0.358CS..Hα-helixtrans-62.8-37.4175.4-71.1173.3000112.4T14 T16 L21 L22 I42 I45 L55 L56 L59T14-L18 HydrophobicContact CG2-CD1 4.15Å; T14-L18 HydrophobicContact CG2-CG 4.39Å; T14-L18 WeakPolarHBondContact O-CB 3.26Å; T14-L18 VanDerWaalsContact O-CG 3.3Å; T14-L18 WeakPolarHBondContact O-CG 3.46Å; T14-L18 PolarHBondContact O-N 3.44Å; T16-L18 PolarHBondContact O-N 3.29Å; L18-L21 PolarHBondContact O-N 3.48Å; L18-L22 WeakPolarHBondContact O-CG 3.21Å; L18-L22 PolarHBondContact O-N 3.43Å; L18-I42 HydrophobicContact CD2-CG1 4.39Å; L18-I42 HydrophobicContact CD2-CG2 4.27Å; L18-I45 HydrophobicContact CD1-CG2 4.42Å; L18-I45 HydrophobicContact CD2-CB 4.17Å; L18-I45 HydrophobicContact CD2-CD1 4.25Å; L18-I45 HydrophobicContact CD2-CG2 3.8Å; L18-I45 HydrophobicContact CG-CG2 4.16Å; L18-L55 HydrophobicContact CD1-CB 4.13Å; L18-L56 HydrophobicContact CD1-CB 4.41Å; L18-L56 HydrophobicContact CD2-CD1 4.41Å; L18-L59 HydrophobicContact CB-CD1 3.99Å
19S95.1Very high88.3Confident36 Ų3667.7 Ų67.725%0.25234%0.343SS..Hα-helixtrans-65.3-45.7175.8-57.30000111.5K15 T16 D17 L21 L22 E23 L59K15-S19 WeakPolarHBondContact O-CB 3.48Å; K15-S19 PolarHBondContact O-N 2.63Å; K15-S19 VanDerWaalsContact O-N 3.08Å; K15-S19 PolarHBondContact O-OG 3.38Å; T16-S19 WeakPolarHBondContact O-CB 3.25Å; T16-S19 PolarHBondContact O-N 2.86Å; T16-S19 VanDerWaalsContact O-N 3.14Å; D17-S19 VanDerWaalsContact C-N 3.33Å; D17-S19 PolarHBondContact O-N 3.22Å; S19-L21 VanDerWaalsContact C-N 3.32Å; S19-L21 PolarHBondContact O-N 2.99Å; S19-L22 PolarHBondContact O-N 3.38Å; S19-E23 WeakPolarHBondContact O-CG 3.46Å; S19-E23 PolarHBondContact O-N 2.82Å; S19-L59 WeakPolarHBondContact OG-CD1 3.22Å; S19-L59 WeakPolarHBondContact OG-CD2 3.46Å
20L95Very high89Confident97 Ų9772.4 Ų72.451%0.50836%0.358SS..Hα-helixtrans-63.4-36.8176.9-70.3171.8000112.1T16 D17 E23 C24T16-L20 HydrophobicContact CG2-CD1 4.06Å; T16-L20 HydrophobicContact CG2-CG 4.44Å; T16-L20 WeakPolarHBondContact O-CG 3.49Å; T16-L20 PolarHBondContact O-N 3.33Å; D17-L20 PolarHBondContact O-N 3.47Å; L20-E23 PolarHBondContact O-N 2.84Å; L20-C24 VanDerWaalsContact O-CB 3.31Å; L20-C24 WeakPolarHBondContact O-CB 3.3Å; L20-C24 PolarHBondContact O-N 3.03Å
21L95.8Very high89.9Confident31 Ų3170.7 Ų70.716%0.16235%0.352CS..Hα-helixtrans-68.4-39.8174.8-70.7165.6000112.1D17 L18 S19 C24 V25 A38 T41 I42 I45D17-L21 VanDerWaalsContact O-CG 3.29Å; D17-L21 WeakPolarHBondContact O-CG 3.19Å; D17-L21 PolarHBondContact O-N 3.09Å; L18-L21 PolarHBondContact O-N 3.48Å; S19-L21 VanDerWaalsContact C-N 3.32Å; S19-L21 PolarHBondContact O-N 2.99Å; L21-C24 WeakPolarHBondContact O-CB 3.41Å; L21-C24 PolarHBondContact O-N 2.99Å; L21-V25 WeakPolarHBondContact O-CG2 3.32Å; L21-V25 PolarHBondContact O-N 2.93Å; L21-A38 HydrophobicContact CD2-CB 4.11Å; L21-T41 HydrophobicContact CD1-CG2 3.8Å; L21-T41 HydrophobicContact CD2-CG2 4.01Å; L21-I42 HydrophobicContact CB-CD1 3.89Å; L21-I42 HydrophobicContact CB-CG1 3.64Å; L21-I42 HydrophobicContact CD1-CG1 3.94Å; L21-I42 HydrophobicContact CG-CG1 4.37Å; L21-I45 HydrophobicContact CD1-CD1 3.5Å
22L95.2Very high90.4Very high20 Ų2068.4 Ų68.411%0.10535%0.349CS..Hα-helixtrans-63.6-41.4172.7-74.7173.5000112L18 S19 V25 K26 I42 L56 L59 F64L18-L22 WeakPolarHBondContact O-CG 3.21Å; L18-L22 PolarHBondContact O-N 3.43Å; S19-L22 PolarHBondContact O-N 3.38Å; L22-V25 PolarHBondContact O-N 3.12Å; L22-K26 VanDerWaalsContact O-CB 3.31Å; L22-K26 WeakPolarHBondContact O-CB 3.19Å; L22-K26 PolarHBondContact O-N 3.23Å; L22-I42 HydrophobicContact CD2-CD1 4.2Å; L22-I42 HydrophobicContact CG-CD1 4.49Å; L22-L56 HydrophobicContact CD1-CD1 3.86Å; L22-L56 HydrophobicContact CD2-CD1 4.17Å; L22-L56 HydrophobicContact CG-CD1 4.11Å; L22-L59 HydrophobicContact CD1-CB 4.08Å; L22-F64 HydrophobicContact CD2-CD1 3.66Å; L22-F64 HydrophobicContact CD2-CE1 4.13Å
23E93.8Very high90.8Very high105 Ų10569 Ų6949%0.49135%0.352SS..Hα-helixtrans-63.7-41.4173.6-73.6-175.4169.800111.9S19 L20 V25 K26 F27S19-E23 WeakPolarHBondContact O-CG 3.46Å; S19-E23 PolarHBondContact O-N 2.82Å; L20-E23 PolarHBondContact O-N 2.84Å; E23-V25 PolarHBondContact O-N 3.04Å; E23-K26 PolarHBondContact O-N 3.06Å; E23-K26 VanDerWaalsContact O-N 3.16Å; E23-F27 HydrophobicContact CB-CD2 4.06Å; E23-F27 HydrophobicContact CB-CE2 4.12Å; E23-F27 HydrophobicContact CG-CE2 4.16Å; E23-F27 WeakPolarHBondContact O-CD2 3.49Å; E23-F27 PolarHBondContact O-N 2.96Å
24C92.6Very high91Very high31 Ų3167.8 Ų67.821%0.20935%0.346CS..Hα-helixtrans-54.9-53.1173.5-175.90000111.2L20 L21 K26 F27 Q28 A38L20-C24 VanDerWaalsContact O-CB 3.31Å; L20-C24 WeakPolarHBondContact O-CB 3.3Å; L20-C24 PolarHBondContact O-N 3.03Å; L21-C24 WeakPolarHBondContact O-CB 3.41Å; L21-C24 PolarHBondContact O-N 2.99Å; C24-K26 VanDerWaalsContact C-N 3.3Å; C24-K26 PolarHBondContact O-N 3.23Å; C24-F27 PolarHBondContact O-N 3.26Å; C24-Q28 VanDerWaalsContact O-CB 3.25Å; C24-Q28 WeakPolarHBondContact O-CB 3.39Å; C24-Q28 WeakPolarHBondContact O-CG 3.49Å; C24-Q28 PolarHBondContact O-N 3.26Å; C24-Q28 PolarHBondContact SG-NE2 2.95Å; C24-Q28 VanDerWaalsContact SG-NE2 3.42Å; C24-Q28 PolarHBondContact SG-OE1 3.29Å; C24-A38 HydrophobicContact CB-CB 4.29Å
25V92.6Very high91.1Very high0 Ų067 Ų670%034%0.341CS..Hα-helixtrans-60.1-39.6176.7179.80000111.5L21 L22 E23 Q35 A38 L39 F64 L68L21-V25 WeakPolarHBondContact O-CG2 3.32Å; L21-V25 PolarHBondContact O-N 2.93Å; L22-V25 PolarHBondContact O-N 3.12Å; E23-V25 PolarHBondContact O-N 3.04Å; V25-Q35 PolarHBondContact O-NE2 2.88Å; V25-A38 HydrophobicContact CG2-CB 3.59Å; V25-L39 HydrophobicContact CG1-CD2 4.32Å; V25-L39 HydrophobicContact CG2-CD2 4.03Å; V25-L39 HydrophobicContact CG2-CG 4.06Å; V25-F64 HydrophobicContact CB-CE1 4.01Å; V25-F64 HydrophobicContact CB-CZ 4.26Å; V25-F64 HydrophobicContact CG1-CE1 3.7Å; V25-F64 HydrophobicContact CG1-CZ 3.88Å; V25-L68 HydrophobicContact CG1-CD1 4.34Å; V25-L68 HydrophobicContact CG1-CD2 3.44Å; V25-L68 VanDerWaalsContact CG1-CD2 3.44Å
26K90.4Very high91.2Very high120 Ų12065 Ų6552%0.52233%0.333SS..Hα-helixtrans-70-38.9-178-176.2178.1178.2-178.50114.1L22 E23 C24 M29 F64L22-K26 VanDerWaalsContact O-CB 3.31Å; L22-K26 WeakPolarHBondContact O-CB 3.19Å; L22-K26 PolarHBondContact O-N 3.23Å; E23-K26 PolarHBondContact O-N 3.06Å; E23-K26 VanDerWaalsContact O-N 3.16Å; C24-K26 VanDerWaalsContact C-N 3.3Å; C24-K26 PolarHBondContact O-N 3.23Å; K26-M29 WeakPolarHBondContact O-CG 3.31Å; K26-F64 HydrophobicContact CB-CE2 4.05Å; K26-F64 HydrophobicContact CB-CZ 3.91Å; K26-F64 HydrophobicContact CG-CE2 4.23Å
27F88.3Confident91.2Very high146 Ų14666.8 Ų66.864%0.6434%0.335SS*.Hα-helixtrans-97.2-21.9-173.4-65.8-62.7000113.8E23 C24 M29E23-F27 HydrophobicContact CB-CD2 4.06Å; E23-F27 HydrophobicContact CB-CE2 4.12Å; E23-F27 HydrophobicContact CG-CE2 4.16Å; E23-F27 WeakPolarHBondContact O-CD2 3.49Å; E23-F27 PolarHBondContact O-N 2.96Å; C24-F27 PolarHBondContact O-N 3.26Å; F27-M29 VanDerWaalsContact C-N 3.26Å; F27-M29 PolarHBondContact O-N 3.04Å
28Q82.1Confident91.3Very high77 Ų7763.3 Ų63.336%0.3632%0.318SS..  trans-89.935.7-178.7-59.4-172.15.300114C24 K30 C31 Q35C24-Q28 VanDerWaalsContact O-CB 3.25Å; C24-Q28 WeakPolarHBondContact O-CB 3.39Å; C24-Q28 WeakPolarHBondContact O-CG 3.49Å; C24-Q28 PolarHBondContact O-N 3.26Å; C24-Q28 PolarHBondContact SG-NE2 2.95Å; C24-Q28 VanDerWaalsContact SG-NE2 3.42Å; C24-Q28 PolarHBondContact SG-OE1 3.29Å; Q28-K30 PolarHBondContact O-N 3.03Å; Q28-C31 PolarHBondContact O-N 3.06Å; Q28-Q35 HydrophobicContact CB-CG 4.37Å; Q28-Q35 WeakPolarHBondContact O-CG 3.48Å
29M77.5Confident91.4Very high78 Ų7863.3 Ų63.338%0.38432%0.318SS..THydrogen-bonded Turntrans-57.8-9179.9-65.1-73.2-65.600115.3K26 F27 Q35 V74K26-M29 WeakPolarHBondContact O-CG 3.31Å; F27-M29 VanDerWaalsContact C-N 3.26Å; F27-M29 PolarHBondContact O-N 3.04Å; M29-Q35 PolarHBondContact SD-NE2 2.98Å; M29-V74 HydrophobicContact CE-CG2 3.57Å; M29-V74 HydrophobicContact SD-CG2 4.26Å
30K81.6Confident91.4Very high209 Ų20963.6 Ų63.691%0.90932%0.316SS*.THydrogen-bonded Turntrans-99.4-2.4175.6-62.8-173.9178.4-1760114Q28Q28-K30 PolarHBondContact O-N 3.03Å
31C89.4Confident91.4Very high47 Ų4761.3 Ų61.332%0.31831%0.306SS..  trans-132.986.1-179.7-174.70000110.1Q28 D33 S34 Q35Q28-C31 PolarHBondContact O-N 3.06Å; C31-D33 PolarHBondContact O-N 3.09Å; C31-S34 PolarHBondContact O-N 3.44Å; C31-S34 PolarHBondContact SG-OG 3.14Å; C31-Q35 PolarHBondContact O-N 3.36Å
32P91.4Very high91.4Very high38 Ų3859.8 Ų59.825%0.24730%0.298CS..Hα-helixtrans-54-38.4-178.2-28.337.1000113.6S34 Q35 K36 H75 V78P32-S34 PolarHBondContact O-N 3.07Å; P32-Q35 WeakPolarHBondContact O-CB 3.43Å; P32-Q35 PolarHBondContact O-N 3.31Å; P32-K36 VanDerWaalsContact O-CB 3.3Å; P32-K36 WeakPolarHBondContact O-CB 3.24Å; P32-K36 PolarHBondContact O-N 3.14Å; P32-H75 HydrophobicContact CB-CB 3.88Å; P32-H75 HydrophobicContact CG-CB 3.8Å; P32-V78 HydrophobicContact CB-CG2 3.85Å; P32-V78 WeakPolarHBondContact O-CG2 3.42Å
33D91.9Very high91.3Very high98 Ų9860.6 Ų60.652%0.52430%0.301SS..Hα-helixtrans-63.6-39.8-178.9-51.9-51.4000112.6C31 K36 Q37C31-D33 PolarHBondContact O-N 3.09Å; D33-K36 PolarHBondContact O-N 2.83Å; D33-Q37 WeakPolarHBondContact O-CB 3.48Å; D33-Q37 PolarHBondContact O-N 3.37Å
34S91.8Very high91.3Very high47 Ų4757.7 Ų57.733%0.32929%0.292SS..Hα-helixtrans-74.6-32.5178.4-60.50000111.6C31 P32 A38C31-S34 PolarHBondContact O-N 3.44Å; C31-S34 PolarHBondContact SG-OG 3.14Å; P32-S34 PolarHBondContact O-N 3.07Å; S34-A38 VanDerWaalsContact O-CB 3.31Å; S34-A38 WeakPolarHBondContact O-CB 3.1Å; S34-A38 PolarHBondContact O-N 3.13Å
35Q93.8Very high91.3Very high2 Ų257.6 Ų57.61%0.00929%0.29CS..Hα-helixtrans-63.4-48.4168.9-62.4-175.8-64.600111.1V25 Q28 M29 C31 P32 Q37 A38 L39 V78V25-Q35 PolarHBondContact O-NE2 2.88Å; Q28-Q35 HydrophobicContact CB-CG 4.37Å; Q28-Q35 WeakPolarHBondContact O-CG 3.48Å; M29-Q35 PolarHBondContact SD-NE2 2.98Å; C31-Q35 PolarHBondContact O-N 3.36Å; P32-Q35 WeakPolarHBondContact O-CB 3.43Å; P32-Q35 PolarHBondContact O-N 3.31Å; Q35-Q37 PolarHBondContact O-N 3.1Å; Q35-A38 PolarHBondContact O-N 3.28Å; Q35-L39 VanDerWaalsContact O-CG 3.29Å; Q35-L39 WeakPolarHBondContact O-CG 3.47Å; Q35-L39 PolarHBondContact O-N 3.23Å; Q35-V78 HydrophobicContact CB-CG1 3.95Å; Q35-V78 HydrophobicContact CB-CG2 4.04Å
36K94.2Very high91.4Very high27 Ų2757.8 Ų57.812%0.11729%0.291CS..Hα-helixtrans-57-48176.4-177.6177.9179.8-177.50111.1P32 D33 A38 L39 L40 T81 E532 L536P32-K36 VanDerWaalsContact O-CB 3.3Å; P32-K36 WeakPolarHBondContact O-CB 3.24Å; P32-K36 PolarHBondContact O-N 3.14Å; D33-K36 PolarHBondContact O-N 2.83Å; K36-A38 PolarHBondContact O-N 3.33Å; K36-L39 PolarHBondContact O-N 2.83Å; K36-L40 HydrophobicContact CG-CD1 4.41Å; K36-L40 WeakPolarHBondContact O-CG 3.49Å; K36-L40 PolarHBondContact O-N 3.49Å; K36-T81 HydrophobicContact CG-CG2 4.43Å; K36-E532 IonicContact NZ-OE2 3.45Å; K36-L536 VanDerWaalsContact CE-CD1 3.43Å
37Q94.3Very high91.3Very high116 Ų11658 Ų5854%0.54229%0.294SS..Hα-helixtrans-64.3-38.8177.1-174.456.737.300112.6D33 Q35 L40 T41D33-Q37 WeakPolarHBondContact O-CB 3.48Å; D33-Q37 PolarHBondContact O-N 3.37Å; Q35-Q37 PolarHBondContact O-N 3.1Å; Q37-L40 PolarHBondContact O-N 3.36Å; Q37-T41 WeakPolarHBondContact O-CB 3.43Å; Q37-T41 PolarHBondContact O-N 2.96Å; Q37-T41 PolarHBondContact O-OG1 3.48Å
38A96.3Very high91.2Very high5 Ų558.1 Ų58.14%0.04129%0.294CS..Hα-helixtrans-65.3-41.5174.900000112L21 C24 V25 S34 Q35 K36 T41 I42L21-A38 HydrophobicContact CD2-CB 4.11Å; C24-A38 HydrophobicContact CB-CB 4.29Å; V25-A38 HydrophobicContact CG2-CB 3.59Å; S34-A38 VanDerWaalsContact O-CB 3.31Å; S34-A38 WeakPolarHBondContact O-CB 3.1Å; S34-A38 PolarHBondContact O-N 3.13Å; Q35-A38 PolarHBondContact O-N 3.28Å; K36-A38 PolarHBondContact O-N 3.33Å; A38-T41 PolarHBondContact O-N 3.27Å; A38-I42 WeakPolarHBondContact O-CG1 3.42Å; A38-I42 PolarHBondContact O-N 3.4Å
39L96.3Very high91.4Very high0 Ų060 Ų600%030%0.298CS..Hα-helixtrans-61.8-45.6174.4-68.6172.6000112.6V25 Q35 K36 T41 I42 H43 L65 L68 V78 T81 A82V25-L39 HydrophobicContact CG1-CD2 4.32Å; V25-L39 HydrophobicContact CG2-CD2 4.03Å; V25-L39 HydrophobicContact CG2-CG 4.06Å; Q35-L39 VanDerWaalsContact O-CG 3.29Å; Q35-L39 WeakPolarHBondContact O-CG 3.47Å; Q35-L39 PolarHBondContact O-N 3.23Å; K36-L39 PolarHBondContact O-N 2.83Å; L39-T41 VanDerWaalsContact C-N 3.27Å; L39-T41 PolarHBondContact O-N 3.12Å; L39-I42 PolarHBondContact O-N 3.11Å; L39-H43 PolarHBondContact O-N 3.22Å; L39-L65 HydrophobicContact CD2-CD2 3.19Å; L39-L68 HydrophobicContact CD1-CD2 4.33Å; L39-L68 HydrophobicContact CD2-CD2 4.4Å; L39-V78 HydrophobicContact CD1-CG1 4.05Å; L39-T81 HydrophobicContact CB-CG2 3.66Å; L39-T81 HydrophobicContact CD1-CG2 3.84Å; L39-T81 HydrophobicContact CG-CG2 4.41Å; L39-A82 HydrophobicContact CD1-CB 4.23Å
40L94.5Very high91.9Very high42 Ų4261 Ų6122%0.2230%0.301CS..Hα-helixtrans-64.1-32.8175-67.2173.5000112.1K36 Q37 H43 S44 T81 L536K36-L40 HydrophobicContact CG-CD1 4.41Å; K36-L40 WeakPolarHBondContact O-CG 3.49Å; K36-L40 PolarHBondContact O-N 3.49Å; Q37-L40 PolarHBondContact O-N 3.36Å; L40-H43 PolarHBondContact O-N 2.93Å; L40-S44 PolarHBondContact O-N 3.24Å; L40-T81 HydrophobicContact CD2-CG2 4.25Å; L40-T81 HydrophobicContact CG-CG2 4.26Å; L40-L536 HydrophobicContact CD1-CD2 4.01Å; L40-L536 HydrophobicContact CD2-CD2 4.48Å
41T95.2Very high92.3Very high48 Ų4854 Ų5429%0.29427%0.274SS..Hα-helixtrans-70.6-41.1174.7-53.90000111.6L21 Q37 A38 L39 H43 S44 I45L21-T41 HydrophobicContact CD1-CG2 3.8Å; L21-T41 HydrophobicContact CD2-CG2 4.01Å; Q37-T41 WeakPolarHBondContact O-CB 3.43Å; Q37-T41 PolarHBondContact O-N 2.96Å; Q37-T41 PolarHBondContact O-OG1 3.48Å; A38-T41 PolarHBondContact O-N 3.27Å; L39-T41 VanDerWaalsContact C-N 3.27Å; L39-T41 PolarHBondContact O-N 3.12Å; T41-H43 VanDerWaalsContact C-N 3.35Å; T41-S44 PolarHBondContact O-N 2.86Å; T41-I45 HydrophobicContact CG2-CD1 4.19Å; T41-I45 WeakPolarHBondContact O-CG1 3.35Å; T41-I45 PolarHBondContact O-N 2.77Å
42I95.6Very high92.5Very high0 Ų052.3 Ų52.30%026%0.262CS..Hα-helixtrans-57.6-49.2171.6-70.1166.8000109.9L18 L21 L22 A38 L39 S44 I45 C46 L56 T85L18-I42 HydrophobicContact CD2-CG1 4.39Å; L18-I42 HydrophobicContact CD2-CG2 4.27Å; L21-I42 HydrophobicContact CB-CD1 3.89Å; L21-I42 HydrophobicContact CB-CG1 3.64Å; L21-I42 HydrophobicContact CD1-CG1 3.94Å; L21-I42 HydrophobicContact CG-CG1 4.37Å; L22-I42 HydrophobicContact CD2-CD1 4.2Å; L22-I42 HydrophobicContact CG-CD1 4.49Å; A38-I42 WeakPolarHBondContact O-CG1 3.42Å; A38-I42 PolarHBondContact O-N 3.4Å; L39-I42 PolarHBondContact O-N 3.11Å; I42-S44 PolarHBondContact O-N 3.19Å; I42-I45 PolarHBondContact O-N 3.23Å; I42-C46 WeakPolarHBondContact O-CB 3.38Å; I42-C46 PolarHBondContact O-N 3.28Å; I42-L56 HydrophobicContact CG2-CD1 4.16Å; I42-L56 HydrophobicContact CG2-CD2 3.56Å; I42-T85 HydrophobicContact CG2-CG2 4.44Å
43H93.9Very high92.5Very high37 Ų3750.5 Ų50.517%0.17125%0.25CC..Hα-helixtrans-53.8-51.8175.516468.9000111.9L39 L40 T41 I45 C46 E47 T85 T88L39-H43 PolarHBondContact O-N 3.22Å; L40-H43 PolarHBondContact O-N 2.93Å; T41-H43 VanDerWaalsContact C-N 3.35Å; H43-I45 VanDerWaalsContact C-N 3.27Å; H43-I45 PolarHBondContact O-N 3.17Å; H43-C46 PolarHBondContact O-N 3.24Å; H43-C46 VanDerWaalsContact O-N 3.08Å; H43-E47 WeakPolarHBondContact O-CB 3.4Å; H43-E47 PolarHBondContact O-N 3.3Å; H43-T85 HydrophobicContact CB-CG2 4.4Å; H43-T88 WeakPolarHBondContact ND1-CB 3.49Å; H43-T88 PolarHBondContact ND1-OG1 3.4Å
44S94.2Very high92.5Very high43 Ų4347.4 Ų47.430%0.30123%0.233SC..Hα-helixtrans-66.5-21.9179.8-172.10000114.7L40 T41 I42 K48L40-S44 PolarHBondContact O-N 3.24Å; T41-S44 PolarHBondContact O-N 2.86Å; I42-S44 PolarHBondContact O-N 3.19Å; S44-K48 VanDerWaalsContact O-CD 3.29Å; S44-K48 WeakPolarHBondContact O-CD 3.44Å; S44-K48 WeakPolarHBondContact O-CE 3.45Å; S44-K48 WeakPolarHBondContact O-CG 3.43Å; S44-K48 PolarHBondContact O-NZ 3.41Å
45I93.3Very high92.6Very high30 Ų3045.2 Ų45.215%0.15422%0.218CC..Hα-helixtrans-76.7-42.6170.7-69.6166.5000110.2T14 L18 L21 T41 I42 H43 N52T14-I45 HydrophobicContact CG2-CG2 3.67Å; L18-I45 HydrophobicContact CD1-CG2 4.42Å; L18-I45 HydrophobicContact CD2-CB 4.17Å; L18-I45 HydrophobicContact CD2-CD1 4.25Å; L18-I45 HydrophobicContact CD2-CG2 3.8Å; L18-I45 HydrophobicContact CG-CG2 4.16Å; L21-I45 HydrophobicContact CD1-CD1 3.5Å; T41-I45 HydrophobicContact CG2-CD1 4.19Å; T41-I45 WeakPolarHBondContact O-CG1 3.35Å; T41-I45 PolarHBondContact O-N 2.77Å; I42-I45 PolarHBondContact O-N 3.23Å; H43-I45 VanDerWaalsContact C-N 3.27Å; H43-I45 PolarHBondContact O-N 3.17Å; I45-N52 HydrophobicContact CG2-CB 4.31Å; I45-N52 PolarHBondContact O-ND2 2.99Å
46C93Very high92.6Very high3 Ų345.1 Ų45.12%0.0222%0.217CC..Hα-helixtrans-72.5-39.3-178.3-750000113.6I42 H43 K48 R49 V53 L89I42-C46 WeakPolarHBondContact O-CB 3.38Å; I42-C46 PolarHBondContact O-N 3.28Å; H43-C46 PolarHBondContact O-N 3.24Å; H43-C46 VanDerWaalsContact O-N 3.08Å; C46-K48 PolarHBondContact O-N 2.92Å; C46-K48 VanDerWaalsContact O-N 3.16Å; C46-R49 CarbonylContact O-C 3.44Å; C46-R49 PolarHBondContact O-N 3.33Å; C46-R49 VanDerWaalsContact O-O 3.07Å; C46-V53 HydrophobicContact CB-CG2 3.87Å; C46-L89 HydrophobicContact CB-CD2 3.55Å; C46-L89 VanDerWaalsContact SG-CD2 3.55Å
47E89.6Confident92.6Very high125 Ų12547.2 Ų47.258%0.58423%0.225SC*.THydrogen-bonded Turntrans-52.7-36.3176.8-177.1-170.6-152.200112.6H43 R49H43-E47 WeakPolarHBondContact O-CB 3.4Å; H43-E47 PolarHBondContact O-N 3.3Å; E47-R49 PolarHBondContact O-N 3.22Å
48K84.9Confident92.5Very high148 Ų14846.8 Ų46.864%0.64322%0.223SC*.THydrogen-bonded Turntrans-70.9-27.6-175.6-69.3166.8-173.21520114.1S44 C46S44-K48 VanDerWaalsContact O-CD 3.29Å; S44-K48 WeakPolarHBondContact O-CD 3.44Å; S44-K48 WeakPolarHBondContact O-CE 3.45Å; S44-K48 WeakPolarHBondContact O-CG 3.43Å; S44-K48 PolarHBondContact O-NZ 3.41Å; C46-K48 PolarHBondContact O-N 2.92Å; C46-K48 VanDerWaalsContact O-N 3.16Å
49R86.1Confident92.4Very high117 Ų11749.3 Ų49.344%0.44224%0.235SC..  trans-158125.7-174.8-67.5-175.865.4171.21.2111.4C46 E47 D51 N52C46-R49 CarbonylContact O-C 3.44Å; C46-R49 PolarHBondContact O-N 3.33Å; C46-R49 VanDerWaalsContact O-O 3.07Å; E47-R49 PolarHBondContact O-N 3.22Å; R49-D51 HydrophobicContact CB-CB 4.44Å; R49-D51 IonicContact CZ-OD2 3.88Å; R49-D51 IonicContact NE-OD2 3.59Å; R49-D51 PolarHBondContact NE-OD2 2.92Å; R49-D51 IonicContact NH2-OD2 2.78Å; R49-D51 PolarHBondContact NH2-OD2 3.49Å; R49-D51 PolarHBondContact O-N 3.31Å; R49-N52 VanDerWaalsContact O-CB 3.32Å; R49-N52 WeakPolarHBondContact O-CB 3.49Å; R49-N52 PolarHBondContact O-N 3.22Å
50E88.6Confident92.3Very high99 Ų9951 Ų5146%0.46325%0.253SS..Hα-helixtrans-54.4-37172.8-174.9173.2-170.200113N52 V53 D54 A92 N93E50-N52 PolarHBondContact O-N 3.18Å; E50-V53 WeakPolarHBondContact O-CA 3.4Å; E50-V53 WeakPolarHBondContact O-CB 3.36Å; E50-V53 PolarHBondContact O-N 3.39Å; E50-D54 PolarHBondContact O-N 2.94Å; E50-A92 WeakPolarHBondContact CG-O 3.3Å; E50-N93 HydrophobicContact CG-CB 3.99Å; E50-N93 WeakPolarHBondContact CG-ND2 3.28Å; E50-N93 WeakPolarHBondContact OE1-CA 3.37Å; E50-N93 PolarHBondContact OE1-ND2 3.12Å
51D90Very high92.3Very high61 Ų6149 Ų4933%0.32624%0.242SC..Hα-helixtrans-48.3-32.8172.5-74.5-67.2000114.1R11 R49 D54 L55R11-D51 IonicContact NH1-OD1 3.16Å; R11-D51 PolarHBondContact NH1-OD1 2.8Å; R49-D51 HydrophobicContact CB-CB 4.44Å; R49-D51 IonicContact CZ-OD2 3.88Å; R49-D51 IonicContact NE-OD2 3.59Å; R49-D51 PolarHBondContact NE-OD2 2.92Å; R49-D51 IonicContact NH2-OD2 2.78Å; R49-D51 PolarHBondContact NH2-OD2 3.49Å; R49-D51 PolarHBondContact O-N 3.31Å; D51-D54 PolarHBondContact O-N 3.49Å; D51-L55 WeakPolarHBondContact O-CG 3.37Å; D51-L55 PolarHBondContact O-N 2.94Å
52N93.1Very high92.3Very high12 Ų1247 Ų476%0.06423%0.23CC..Hα-helixtrans-77.4-27.8-178.4-64.6-11.2000111.3I45 R49 E50 L56I45-N52 HydrophobicContact CG2-CB 4.31Å; I45-N52 PolarHBondContact O-ND2 2.99Å; R49-N52 VanDerWaalsContact O-CB 3.32Å; R49-N52 WeakPolarHBondContact O-CB 3.49Å; R49-N52 PolarHBondContact O-N 3.22Å; E50-N52 PolarHBondContact O-N 3.18Å; N52-L56 WeakPolarHBondContact O-CB 3.48Å; N52-L56 PolarHBondContact O-N 3.23Å
53V92.4Very high92.3Very high0 Ų050.4 Ų50.40%025%0.254CS..Hα-helixtrans-69-40.9170.9-173.80000110.2C46 E50 L56 R57 L89 A92 N93 C96C46-V53 HydrophobicContact CB-CG2 3.87Å; E50-V53 WeakPolarHBondContact O-CA 3.4Å; E50-V53 WeakPolarHBondContact O-CB 3.36Å; E50-V53 PolarHBondContact O-N 3.39Å; V53-L56 PolarHBondContact O-N 2.79Å; V53-R57 WeakPolarHBondContact O-CB 3.47Å; V53-R57 PolarHBondContact O-N 3.46Å; V53-L89 HydrophobicContact CB-CD2 4.46Å; V53-L89 HydrophobicContact CG1-CB 4.17Å; V53-L89 HydrophobicContact CG1-CD2 4.02Å; V53-L89 HydrophobicContact CG2-CD2 3.97Å; V53-A92 HydrophobicContact CG2-CB 4.2Å; V53-N93 HydrophobicContact CB-CB 3.86Å; V53-N93 HydrophobicContact CG1-CB 3.54Å; V53-N93 HydrophobicContact CG2-CB 4.32Å; V53-C96 HydrophobicContact CG1-CB 3.93Å
54D91.9Very high92.3Very high33 Ų3351.3 Ų51.318%0.17626%0.257CS..Hα-helixtrans-60.3-46.1172.9-73.1-21.5000111.6E50 D51 L56 R57 E58 N93E50-D54 PolarHBondContact O-N 2.94Å; D51-D54 PolarHBondContact O-N 3.49Å; D54-L56 PolarHBondContact O-N 3.12Å; D54-R57 PolarHBondContact O-N 3.14Å; D54-R57 IonicContact OD1-CZ 2.69Å; D54-R57 IonicContact OD1-NH1 3.42Å; D54-R57 PolarHBondContact OD1-NH1 3.13Å; D54-R57 IonicContact OD1-NH2 2.67Å; D54-R57 PolarHBondContact OD1-NH2 3.14Å; D54-E58 WeakPolarHBondContact O-CG 3.49Å; D54-E58 PolarHBondContact O-N 2.88Å; D54-N93 PolarHBondContact OD1-ND2 2.96Å; D54-N93 VanDerWaalsContact OD1-ND2 3.09Å
55L93.4Very high92.4Very high1 Ų149.2 Ų49.21%0.00524%0.243CC..Hα-helixtrans-57.9-45.1173.3-76.8177.4000112.6R11 T14 K15 L18 D51 R57 E58 L59R11-L55 HydrophobicContact CG-CD1 3.89Å; R11-L55 HydrophobicContact CG-CD2 4.18Å; R11-L55 HydrophobicContact CG-CG 4.41Å; T14-L55 HydrophobicContact CG2-CD1 4.48Å; K15-L55 HydrophobicContact CB-CD1 4.33Å; K15-L55 HydrophobicContact CB-CD2 4.21Å; K15-L55 HydrophobicContact CD-CD2 3.94Å; K15-L55 HydrophobicContact CG-CD2 4.2Å; L18-L55 HydrophobicContact CD1-CB 4.13Å; D51-L55 WeakPolarHBondContact O-CG 3.37Å; D51-L55 PolarHBondContact O-N 2.94Å; L55-R57 VanDerWaalsContact C-N 3.3Å; L55-R57 PolarHBondContact O-N 3.07Å; L55-E58 WeakPolarHBondContact O-CB 3.37Å; L55-E58 PolarHBondContact O-N 2.9Å; L55-L59 VanDerWaalsContact O-CG 3.3Å; L55-L59 WeakPolarHBondContact O-CG 3.31Å; L55-L59 PolarHBondContact O-N 3.4Å
56L94.8Very high92.5Very high0 Ų048.7 Ų48.70%024%0.239CC..Hα-helixtrans-64.3-36.3178.3-173.768.1000111.7L18 L22 I42 N52 V53 D54 L59 G61 L89L18-L56 HydrophobicContact CD1-CB 4.41Å; L18-L56 HydrophobicContact CD2-CD1 4.41Å; L22-L56 HydrophobicContact CD1-CD1 3.86Å; L22-L56 HydrophobicContact CD2-CD1 4.17Å; L22-L56 HydrophobicContact CG-CD1 4.11Å; I42-L56 HydrophobicContact CG2-CD1 4.16Å; I42-L56 HydrophobicContact CG2-CD2 3.56Å; N52-L56 WeakPolarHBondContact O-CB 3.48Å; N52-L56 PolarHBondContact O-N 3.23Å; V53-L56 PolarHBondContact O-N 2.79Å; D54-L56 PolarHBondContact O-N 3.12Å; L56-L59 PolarHBondContact O-N 3.25Å; L56-G61 WeakPolarHBondContact O-CA 3.34Å; L56-G61 PolarHBondContact O-N 2.79Å; L56-L89 HydrophobicContact CD2-CD1 3.51Å; L56-L89 HydrophobicContact CD2-CD2 3.74Å; L56-L89 HydrophobicContact CD2-CG 4.29Å
57R93.8Very high92.6Very high72 Ų7252.9 Ų52.927%0.27226%0.261SS..Hα-helixtrans-68-43.8173.9-171.9-18065-102-2.7111.9V53 D54 L55 L59 G60 V62 N93V53-R57 WeakPolarHBondContact O-CB 3.47Å; V53-R57 PolarHBondContact O-N 3.46Å; D54-R57 PolarHBondContact O-N 3.14Å; D54-R57 IonicContact OD1-CZ 2.69Å; D54-R57 IonicContact OD1-NH1 3.42Å; D54-R57 PolarHBondContact OD1-NH1 3.13Å; D54-R57 IonicContact OD1-NH2 2.67Å; D54-R57 PolarHBondContact OD1-NH2 3.14Å; L55-R57 VanDerWaalsContact C-N 3.3Å; L55-R57 PolarHBondContact O-N 3.07Å; R57-L59 PolarHBondContact O-N 2.84Å; R57-G60 PolarHBondContact O-N 3.29Å; R57-V62 HydrophobicContact CB-CG2 4.12Å; R57-V62 HydrophobicContact CG-CG2 4.37Å; R57-N93 PolarHBondContact NH1-OD1 3.43Å
58E91.9Very high92.8Very high107 Ų10747.4 Ų47.450%0.524%0.236SC..Hα-helixtrans-56.5-36.9173.1-74.6174.3-153.900112.2R11 K15 D54 L55 G60R11-E58 IonicContact NH2-OE1 3.08Å; R11-E58 PolarHBondContact NH2-OE1 3.1Å; R11-E58 VanDerWaalsContact NH2-OE1 3.08Å; K15-E58 IonicContact NZ-OE2 2.78Å; K15-E58 PolarHBondContact NZ-OE2 3.36Å; D54-E58 WeakPolarHBondContact O-CG 3.49Å; D54-E58 PolarHBondContact O-N 2.88Å; L55-E58 WeakPolarHBondContact O-CB 3.37Å; L55-E58 PolarHBondContact O-N 2.9Å; E58-G60 PolarHBondContact O-N 3.25Å
59L93.9Very high93.2Very high57 Ų5740.6 Ų40.630%0.29821%0.207SC..THydrogen-bonded Turntrans-75.6-0.7176.9-68.8171000113.6K15 L18 S19 L22 L55 L56 R57 G61K15-L59 HydrophobicContact CG-CD1 4.2Å; K15-L59 HydrophobicContact CG-CD2 4.24Å; K15-L59 HydrophobicContact CG-CG 4.45Å; L18-L59 HydrophobicContact CB-CD1 3.99Å; S19-L59 WeakPolarHBondContact OG-CD1 3.22Å; S19-L59 WeakPolarHBondContact OG-CD2 3.46Å; L22-L59 HydrophobicContact CD1-CB 4.08Å; L55-L59 VanDerWaalsContact O-CG 3.3Å; L55-L59 WeakPolarHBondContact O-CG 3.31Å; L55-L59 PolarHBondContact O-N 3.4Å; L56-L59 PolarHBondContact O-N 3.25Å; R57-L59 PolarHBondContact O-N 2.84Å; L59-G61 PolarHBondContact O-N 2.69Å
60G94.2Very high93.4Very high36 Ų3639.4 Ų39.437%0.37121%0.205SC..THydrogen-bonded Turntrans74.27.5-173.800000114.2R57 E58 V62 S63 F64R57-G60 PolarHBondContact O-N 3.29Å; E58-G60 PolarHBondContact O-N 3.25Å; G60-V62 PolarHBondContact O-N 2.87Å; G60-S63 PolarHBondContact O-N 2.95Å; G60-S63 VanDerWaalsContact O-N 3.16Å; G60-F64 PolarHBondContact O-N 3.05Å
61G95.5Very high93.5Very high0 Ų036.4 Ų36.40%020%0.195CC..Hα-helixtrans-57.2-42.2-174.600000113.3L56 L59 S63 F64 L65L56-G61 WeakPolarHBondContact O-CA 3.34Å; L56-G61 PolarHBondContact O-N 2.79Å; L59-G61 PolarHBondContact O-N 2.69Å; G61-S63 VanDerWaalsContact C-N 3.35Å; G61-S63 PolarHBondContact O-N 3.38Å; G61-F64 WeakPolarHBondContact O-CB 3.46Å; G61-F64 PolarHBondContact O-N 3.16Å; G61-F64 VanDerWaalsContact O-N 3.17Å; G61-L65 VanDerWaalsContact O-CG 3.29Å; G61-L65 WeakPolarHBondContact O-CG 3.11Å; G61-L65 PolarHBondContact O-N 3.12Å
62V94.8Very high93.3Very high7 Ų738.3 Ų38.34%0.04221%0.213CC..Hα-helixtrans-58.8-44.6177.9-179.30000111.7R57 G60 L65 Y66 L86 L100R57-V62 HydrophobicContact CB-CG2 4.12Å; R57-V62 HydrophobicContact CG-CG2 4.37Å; G60-V62 PolarHBondContact O-N 2.87Å; V62-L65 PolarHBondContact O-N 2.85Å; V62-Y66 PolarHBondContact O-N 2.68Å; V62-Y66 VanDerWaalsContact O-N 3.16Å; V62-L86 HydrophobicContact CG1-CD2 3.97Å; V62-L100 HydrophobicContact CG1-CD1 4.09Å; V62-L100 HydrophobicContact CG1-CD2 3.85Å; V62-L100 HydrophobicContact CG1-CG 3.95Å
63S94.1Very high92.9Very high71 Ų7144 Ų4450%0.49724%0.243SC..Hα-helixtrans-67.5-40.9176.5-176.90000111.4G60 G61 Y66 N67G60-S63 PolarHBondContact O-N 2.95Å; G60-S63 VanDerWaalsContact O-N 3.16Å; G61-S63 VanDerWaalsContact C-N 3.35Å; G61-S63 PolarHBondContact O-N 3.38Å; S63-Y66 PolarHBondContact O-N 3.27Å; S63-N67 PolarHBondContact O-N 3.29Å; S63-N67 PolarHBondContact O-ND2 2.97Å; S63-N67 PolarHBondContact OG-ND2 2.82Å
64F95.7Very high92.7Very high55 Ų5544.5 Ų44.524%0.24125%0.247CC..Hα-helixtrans-59.7-47.1175170.2-99.9000112.3L22 V25 K26 G60 G61 Y66 N67 L68L22-F64 HydrophobicContact CD2-CD1 3.66Å; L22-F64 HydrophobicContact CD2-CE1 4.13Å; V25-F64 HydrophobicContact CB-CE1 4.01Å; V25-F64 HydrophobicContact CB-CZ 4.26Å; V25-F64 HydrophobicContact CG1-CE1 3.7Å; V25-F64 HydrophobicContact CG1-CZ 3.88Å; K26-F64 HydrophobicContact CB-CE2 4.05Å; K26-F64 HydrophobicContact CB-CZ 3.91Å; K26-F64 HydrophobicContact CG-CE2 4.23Å; G60-F64 PolarHBondContact O-N 3.05Å; G61-F64 WeakPolarHBondContact O-CB 3.46Å; G61-F64 PolarHBondContact O-N 3.16Å; G61-F64 VanDerWaalsContact O-N 3.17Å; F64-Y66 VanDerWaalsContact C-N 3.34Å; F64-Y66 PolarHBondContact O-N 3Å; F64-N67 PolarHBondContact O-N 2.79Å; F64-L68 HydrophobicContact CE1-CD2 4.43Å; F64-L68 HydrophobicContact CZ-CD1 4.44Å; F64-L68 WeakPolarHBondContact O-CB 3.38Å; F64-L68 PolarHBondContact O-N 3.05Å
65L95.9Very high92.6Very high0 Ų047.5 Ų47.50%026%0.259CS..Hα-helixtrans-63.1-37.3179.4-68.4-178.2000112.7L39 G61 V62 L68 S69 T85 L86 L89L39-L65 HydrophobicContact CD2-CD2 3.19Å; G61-L65 VanDerWaalsContact O-CG 3.29Å; G61-L65 WeakPolarHBondContact O-CG 3.11Å; G61-L65 PolarHBondContact O-N 3.12Å; V62-L65 PolarHBondContact O-N 2.85Å; L65-L68 HydrophobicContact CD2-CD2 4.43Å; L65-L68 WeakPolarHBondContact O-CB 3.36Å; L65-L68 PolarHBondContact O-N 2.97Å; L65-S69 PolarHBondContact O-N 3.46Å; L65-T85 HydrophobicContact CD1-CG2 3.79Å; L65-L86 HydrophobicContact CB-CD1 4.35Å; L65-L86 HydrophobicContact CB-CD2 3.81Å; L65-L86 HydrophobicContact CB-CG 3.97Å; L65-L89 HydrophobicContact CD1-CD1 3.81Å
66Y95.5Very high92.5Very high18 Ų1849.9 Ų49.97%0.07128%0.276CS..Hα-helixtrans-68.3-41.7174.3168.2-111.2000112.5V62 S63 F64 L68 S69 K70 D104 I105 D108V62-Y66 PolarHBondContact O-N 2.68Å; V62-Y66 VanDerWaalsContact O-N 3.16Å; S63-Y66 PolarHBondContact O-N 3.27Å; F64-Y66 VanDerWaalsContact C-N 3.34Å; F64-Y66 PolarHBondContact O-N 3Å; Y66-L68 VanDerWaalsContact C-N 3.28Å; Y66-L68 PolarHBondContact O-N 2.99Å; Y66-S69 PolarHBondContact O-N 2.66Å; Y66-S69 PolarHBondContact O-OG 2.87Å; Y66-K70 HydrophobicContact CD2-CD 4.36Å; Y66-K70 HydrophobicContact CE1-CD 4.11Å; Y66-K70 HydrophobicContact CE2-CD 3.62Å; Y66-K70 HydrophobicContact CE2-CG 4.19Å; Y66-K70 PolarHBondContact O-N 2.73Å; Y66-D104 PolarHBondContact OH-OD2 3.34Å; Y66-I105 HydrophobicContact CD2-CG1 4.14Å; Y66-I105 HydrophobicContact CE1-CG1 4.16Å; Y66-I105 HydrophobicContact CE2-CB 4.24Å; Y66-I105 HydrophobicContact CE2-CD1 4.44Å; Y66-I105 HydrophobicContact CE2-CG1 3.53Å; Y66-I105 HydrophobicContact CE2-CG2 4.38Å; Y66-I105 VanDerWaalsContact CZ-CG1 3.49Å; Y66-I105 WeakPolarHBondContact OH-CG1 3.38Å; Y66-D108 PolarHBondContact OH-OD2 3.31Å
67N94.5Very high92.3Very high92 Ų9252.4 Ų52.449%0.49229%0.289SS..Hα-helixtrans-66.5-32.7173.7-71.3-60.9000112S63 F64 K70 S71S63-N67 PolarHBondContact O-N 3.29Å; S63-N67 PolarHBondContact O-ND2 2.97Å; S63-N67 PolarHBondContact OG-ND2 2.82Å; F64-N67 PolarHBondContact O-N 2.79Å; N67-K70 PolarHBondContact O-N 3.19Å; N67-S71 PolarHBondContact O-N 3.22Å; N67-S71 VanDerWaalsContact O-N 3.13Å
68L93.9Very high92.3Very high10 Ų1049 Ų495%0.05228%0.276CS..Hα-helixtrans-64.6-44.5175.4-171.774.6000111.7V25 L39 F64 L65 Y66 K70 S71 V74 V78 A82V25-L68 HydrophobicContact CG1-CD1 4.34Å; V25-L68 HydrophobicContact CG1-CD2 3.44Å; V25-L68 VanDerWaalsContact CG1-CD2 3.44Å; L39-L68 HydrophobicContact CD1-CD2 4.33Å; L39-L68 HydrophobicContact CD2-CD2 4.4Å; F64-L68 HydrophobicContact CE1-CD2 4.43Å; F64-L68 HydrophobicContact CZ-CD1 4.44Å; F64-L68 WeakPolarHBondContact O-CB 3.38Å; F64-L68 PolarHBondContact O-N 3.05Å; L65-L68 HydrophobicContact CD2-CD2 4.43Å; L65-L68 WeakPolarHBondContact O-CB 3.36Å; L65-L68 PolarHBondContact O-N 2.97Å; Y66-L68 VanDerWaalsContact C-N 3.28Å; Y66-L68 PolarHBondContact O-N 2.99Å; L68-K70 VanDerWaalsContact C-N 3.27Å; L68-K70 PolarHBondContact O-N 3.43Å; L68-S71 WeakPolarHBondContact O-CB 3.36Å; L68-S71 PolarHBondContact O-N 2.91Å; L68-V74 HydrophobicContact CD1-CG1 4.35Å; L68-V74 HydrophobicContact CD1-CG2 3.76Å; L68-V74 HydrophobicContact CG-CG1 4.5Å; L68-V78 HydrophobicContact CD2-CG1 4.13Å; L68-A82 HydrophobicContact CD2-CB 4.11Å
69S93.6Very high92.4Very high5 Ų546.1 Ų46.14%0.03526%0.262CS..Hα-helixtrans-67.8-25.617965.50000113.9L65 Y66 K79L65-S69 PolarHBondContact O-N 3.46Å; Y66-S69 PolarHBondContact O-N 2.66Å; Y66-S69 PolarHBondContact O-OG 2.87Å; S69-K79 WeakPolarHBondContact O-CD 3.22Å
70K90.6Very high92.4Very high92 Ų9244 Ų4440%0.425%0.251SS..Hα-helixtrans-85.4-17.4174.1-66.4-17168.2161.60114.7Y66 N67 L68 S72 D108Y66-K70 HydrophobicContact CD2-CD 4.36Å; Y66-K70 HydrophobicContact CE1-CD 4.11Å; Y66-K70 HydrophobicContact CE2-CD 3.62Å; Y66-K70 HydrophobicContact CE2-CG 4.19Å; Y66-K70 PolarHBondContact O-N 2.73Å; N67-K70 PolarHBondContact O-N 3.19Å; L68-K70 VanDerWaalsContact C-N 3.27Å; L68-K70 PolarHBondContact O-N 3.43Å; K70-S72 PolarHBondContact O-N 3.46Å; K70-D108 WeakPolarHBondContact CD-OD2 3.44Å; K70-D108 VanDerWaalsContact CE-CG 3.44Å; K70-D108 WeakPolarHBondContact CE-OD1 3.45Å; K70-D108 VanDerWaalsContact CE-OD2 3.23Å; K70-D108 WeakPolarHBondContact CE-OD2 3.41Å; K70-D108 IonicContact NZ-OD1 3.31Å; K70-D108 PolarHBondContact NZ-OD1 3.17Å; K70-D108 IonicContact NZ-OD2 3.37Å; K70-D108 PolarHBondContact NZ-OD2 3.11Å
71S89.9Confident92.5Very high35 Ų3542.7 Ų42.725%0.24524%0.236CC..  trans-61.8131.6-171.4-178.20000112.4N67 L68 N73 K79N67-S71 PolarHBondContact O-N 3.22Å; N67-S71 VanDerWaalsContact O-N 3.13Å; L68-S71 WeakPolarHBondContact O-CB 3.36Å; L68-S71 PolarHBondContact O-N 2.91Å; S71-N73 VanDerWaalsContact C-N 3.25Å; S71-N73 PolarHBondContact O-N 2.83Å; S71-N73 PolarHBondContact OG-N 3.42Å; S71-K79 WeakPolarHBondContact O-CE 3.47Å; S71-K79 PolarHBondContact O-NZ 3.31Å
72S85.9Confident92.6Very high101 Ų10142.7 Ų42.771%0.70624%0.236SC*.THydrogen-bonded Turntrans-63.1-32.2173.342.90000112.5K70 V74K70-S72 PolarHBondContact O-N 3.46Å; S72-V74 PolarHBondContact O-N 3.01Å
73N84.5Confident92.6Very high132 Ų13242.7 Ų42.771%0.70624%0.235SC*.THydrogen-bonded Turntrans-95.612.1-166.8-61.744.9000113.9S71S71-N73 VanDerWaalsContact C-N 3.25Å; S71-N73 PolarHBondContact O-N 2.83Å; S71-N73 PolarHBondContact OG-N 3.42Å
74V88.4Confident92.7Very high11 Ų1140.9 Ų40.97%0.06722%0.219CC..SBendtrans-106.8148.5-179174.30000109.8M29 L68 S72 V78 K79M29-V74 HydrophobicContact CE-CG2 3.57Å; M29-V74 HydrophobicContact SD-CG2 4.26Å; L68-V74 HydrophobicContact CD1-CG1 4.35Å; L68-V74 HydrophobicContact CD1-CG2 3.76Å; L68-V74 HydrophobicContact CG-CG1 4.5Å; S72-V74 PolarHBondContact O-N 3.01Å; V74-V78 HydrophobicContact CG1-CB 3.64Å; V74-V78 HydrophobicContact CG1-CG1 3.58Å; V74-K79 HydrophobicContact CB-CG 4.17Å; V74-K79 HydrophobicContact CG1-CG 3.9Å; V74-K79 WeakPolarHBondContact O-CE 3.24Å; V74-K79 PolarHBondContact O-NZ 2.89Å
75H90.4Very high92.8Very high96 Ų9638.3 Ų38.344%0.44421%0.207SC..  trans-64.5147.8175.6-161.8-104.9000111.9P32 D77 V78 K79P32-H75 HydrophobicContact CB-CB 3.88Å; P32-H75 HydrophobicContact CG-CB 3.8Å; H75-D77 IonicContact CE1-OD1 2.76Å; H75-D77 IonicContact CE1-OD2 2.87Å; H75-D77 PolarHBondContact CE1-OD2 2.96Å; H75-D77 IonicContact ND1-OD1 2.9Å; H75-D77 IonicContact ND1-OD2 3.95Å; H75-D77 PolarHBondContact ND1-OD2 3.45Å; H75-D77 PolarHBondContact O-N 3.11Å; H75-V78 HydrophobicContact CB-CG2 4.25Å; H75-V78 PolarHBondContact O-N 3.47Å; H75-V78 VanDerWaalsContact O-N 3.16Å; H75-K79 PolarHBondContact O-N 2.82Å
76S90.4Very high92.9Very high51 Ų5138.3 Ų38.336%0.35721%0.207SC..Hα-helixtrans-55.8-50.1-174.2-161.70000111.9V78 K79 E80S76-V78 PolarHBondContact O-N 2.86Å; S76-K79 WeakPolarHBondContact O-CA 3.18Å; S76-K79 WeakPolarHBondContact O-CB 3.43Å; S76-K79 PolarHBondContact O-N 3.25Å; S76-E80 WeakPolarHBondContact O-CG 3.47Å; S76-E80 PolarHBondContact O-N 3.15Å
77D90.2Very high92.9Very high52 Ų5237.5 Ų37.528%0.27820%0.204SC..Hα-helixtrans-64-27.7-176-26-35.5000112.5H75 T81H75-D77 IonicContact CE1-OD1 2.76Å; H75-D77 IonicContact CE1-OD2 2.87Å; H75-D77 PolarHBondContact CE1-OD2 2.96Å; H75-D77 IonicContact ND1-OD1 2.9Å; H75-D77 IonicContact ND1-OD2 3.95Å; H75-D77 PolarHBondContact ND1-OD2 3.45Å; H75-D77 PolarHBondContact O-N 3.11Å; D77-T81 VanDerWaalsContact O-CB 3.24Å; D77-T81 WeakPolarHBondContact O-CB 3.28Å; D77-T81 PolarHBondContact O-N 3.2Å; D77-T81 PolarHBondContact O-OG1 3.25Å
78V94.1Very high93Very high0 Ų033.9 Ų33.90%019%0.185CC..Hα-helixtrans-73.2-36.2174.5177.90000110.3P32 Q35 L39 L68 V74 H75 S76 A82P32-V78 HydrophobicContact CB-CG2 3.85Å; P32-V78 WeakPolarHBondContact O-CG2 3.42Å; Q35-V78 HydrophobicContact CB-CG1 3.95Å; Q35-V78 HydrophobicContact CB-CG2 4.04Å; L39-V78 HydrophobicContact CD1-CG1 4.05Å; L68-V78 HydrophobicContact CD2-CG1 4.13Å; V74-V78 HydrophobicContact CG1-CB 3.64Å; V74-V78 HydrophobicContact CG1-CG1 3.58Å; H75-V78 HydrophobicContact CB-CG2 4.25Å; H75-V78 PolarHBondContact O-N 3.47Å; H75-V78 VanDerWaalsContact O-N 3.16Å; S76-V78 PolarHBondContact O-N 2.86Å; V78-A82 VanDerWaalsContact O-CB 3.27Å; V78-A82 WeakPolarHBondContact O-CB 3.36Å; V78-A82 PolarHBondContact O-N 3.15Å
79K94.4Very high93.1Very high47 Ų4733.4 Ų33.420%0.20418%0.183CC..Hα-helixtrans-65.6-43.8171.7-55.6180-151-166.90111.2S69 S71 V74 H75 S76 A82 L83S69-K79 WeakPolarHBondContact O-CD 3.22Å; S71-K79 WeakPolarHBondContact O-CE 3.47Å; S71-K79 PolarHBondContact O-NZ 3.31Å; V74-K79 HydrophobicContact CB-CG 4.17Å; V74-K79 HydrophobicContact CG1-CG 3.9Å; V74-K79 WeakPolarHBondContact O-CE 3.24Å; V74-K79 PolarHBondContact O-NZ 2.89Å; H75-K79 PolarHBondContact O-N 2.82Å; S76-K79 WeakPolarHBondContact O-CA 3.18Å; S76-K79 WeakPolarHBondContact O-CB 3.43Å; S76-K79 PolarHBondContact O-N 3.25Å; K79-A82 PolarHBondContact O-N 2.99Å; K79-L83 WeakPolarHBondContact O-CG 3.3Å; K79-L83 PolarHBondContact O-N 2.95Å
80E94.6Very high93.2Very high14 Ų1433.2 Ų33.27%0.06518%0.181CC..Hα-helixtrans-65.8-43178.7-67174.8170.600111.5S76 A82 L83 F84 N120 K121 V124S76-E80 WeakPolarHBondContact O-CG 3.47Å; S76-E80 PolarHBondContact O-N 3.15Å; E80-A82 VanDerWaalsContact C-N 3.33Å; E80-A82 PolarHBondContact O-N 3.24Å; E80-L83 PolarHBondContact O-N 3.46Å; E80-F84 WeakPolarHBondContact O-CB 3.43Å; E80-F84 PolarHBondContact O-N 3.28Å; E80-N120 PolarHBondContact OE2-ND2 2.87Å; E80-K121 HydrophobicContact CG-CB 4.33Å; E80-K121 WeakPolarHBondContact OE1-CB 3.41Å; E80-K121 PolarHBondContact OE1-N 3.26Å; E80-V124 HydrophobicContact CB-CG2 4.26Å; E80-V124 HydrophobicContact CG-CG2 4.43Å
81T95.8Very high93.3Very high7 Ų733.8 Ų33.84%0.04319%0.186CC..Hα-helixtrans-62.4-40.3173.1-54.30000110.8K36 L39 L40 D77 F84 T85K36-T81 HydrophobicContact CG-CG2 4.43Å; L39-T81 HydrophobicContact CB-CG2 3.66Å; L39-T81 HydrophobicContact CD1-CG2 3.84Å; L39-T81 HydrophobicContact CG-CG2 4.41Å; L40-T81 HydrophobicContact CD2-CG2 4.25Å; L40-T81 HydrophobicContact CG-CG2 4.26Å; D77-T81 VanDerWaalsContact O-CB 3.24Å; D77-T81 WeakPolarHBondContact O-CB 3.28Å; D77-T81 PolarHBondContact O-N 3.2Å; D77-T81 PolarHBondContact O-OG1 3.25Å; T81-F84 PolarHBondContact O-N 3.34Å; T81-T85 PolarHBondContact O-N 2.97Å; T81-T85 PolarHBondContact O-OG1 3.36Å
82A96.6Very high93.5Very high0 Ų034.1 Ų34.10%019%0.191CC..Hα-helixtrans-65.2-40.5176.200000112.8L39 L68 V78 K79 E80 T85 L86L39-A82 HydrophobicContact CD1-CB 4.23Å; L68-A82 HydrophobicContact CD2-CB 4.11Å; V78-A82 VanDerWaalsContact O-CB 3.27Å; V78-A82 WeakPolarHBondContact O-CB 3.36Å; V78-A82 PolarHBondContact O-N 3.15Å; K79-A82 PolarHBondContact O-N 2.99Å; E80-A82 VanDerWaalsContact C-N 3.33Å; E80-A82 PolarHBondContact O-N 3.24Å; A82-T85 PolarHBondContact O-N 3.27Å; A82-L86 WeakPolarHBondContact O-CB 3.34Å; A82-L86 VanDerWaalsContact O-CG 3.25Å; A82-L86 WeakPolarHBondContact O-CG 3.35Å; A82-L86 PolarHBondContact O-N 3.23Å
83L96.3Very high93.8Very high7 Ų729.4 Ų29.44%0.03716%0.158CC..Hα-helixtrans-62.3-43.8172.4-70.6171000111.8K79 E80 L86 G87 V124 L128K79-L83 WeakPolarHBondContact O-CG 3.3Å; K79-L83 PolarHBondContact O-N 2.95Å; E80-L83 PolarHBondContact O-N 3.46Å; L83-L86 PolarHBondContact O-N 3.35Å; L83-G87 PolarHBondContact O-N 3.46Å; L83-V124 HydrophobicContact CB-CB 4.28Å; L83-V124 HydrophobicContact CB-CG2 3.86Å; L83-V124 HydrophobicContact CD1-CG2 3.9Å; L83-L128 HydrophobicContact CD2-CD2 3.94Å
84F96.3Very high94.2Very high34 Ų3427.5 Ų27.515%0.14915%0.151CC..Hα-helixtrans-60.6-49.5174.7173.5-101.1000111.6E80 T81 L86 G87 T88 V124 Y127 F537E80-F84 WeakPolarHBondContact O-CB 3.43Å; E80-F84 PolarHBondContact O-N 3.28Å; T81-F84 PolarHBondContact O-N 3.34Å; F84-L86 VanDerWaalsContact C-N 3.33Å; F84-L86 PolarHBondContact O-N 2.82Å; F84-G87 PolarHBondContact O-N 3.22Å; F84-G87 VanDerWaalsContact O-N 3.09Å; F84-T88 HydrophobicContact CD1-CG2 4.42Å; F84-T88 HydrophobicContact CD2-CG2 4.47Å; F84-T88 HydrophobicContact CE1-CG2 3.91Å; F84-T88 HydrophobicContact CE2-CG2 3.96Å; F84-T88 HydrophobicContact CZ-CG2 3.65Å; F84-T88 WeakPolarHBondContact O-CG2 3.39Å; F84-T88 PolarHBondContact O-N 2.86Å; F84-V124 HydrophobicContact CB-CG1 4.2Å; F84-Y127 HydrophobicContact CD2-CD1 4.13Å; F84-Y127 HydrophobicContact CD2-CE1 4Å; F84-Y127 HydrophobicContact CE2-CE1 4.16Å; F84-F537 HydrophobicContact CB-CE1 4.42Å; F84-F537 HydrophobicContact CD2-CE1 4.42Å; F84-F537 HydrophobicContact CG-CE1 4.42Å
85T96.8Very high94.4Very high0 Ų034.3 Ų34.30%018%0.176CC..Hα-helixtrans-56.9-46.4176.2-56.90000110.9I42 H43 L65 T81 A82 G87 T88 L89I42-T85 HydrophobicContact CG2-CG2 4.44Å; H43-T85 HydrophobicContact CB-CG2 4.4Å; L65-T85 HydrophobicContact CD1-CG2 3.79Å; T81-T85 PolarHBondContact O-N 2.97Å; T81-T85 PolarHBondContact O-OG1 3.36Å; A82-T85 PolarHBondContact O-N 3.27Å; T85-G87 VanDerWaalsContact C-N 3.32Å; T85-G87 PolarHBondContact O-N 3.07Å; T85-T88 PolarHBondContact O-N 2.9Å; T85-T88 PolarHBondContact O-OG1 3.09Å; T85-L89 HydrophobicContact CG2-CD1 3.93Å; T85-L89 HydrophobicContact CG2-CG 4.25Å; T85-L89 VanDerWaalsContact O-CG 3.23Å; T85-L89 WeakPolarHBondContact O-CG 3.25Å; T85-L89 PolarHBondContact O-N 3.01Å
86L97.3Very high94.5Very high1 Ų129.7 Ų29.71%0.00516%0.155CC..Hα-helixtrans-56.4-42.6174.9-74.2167.5000112.9V62 L65 A82 L83 F84 L89 A90 L100 L128V62-L86 HydrophobicContact CG1-CD2 3.97Å; L65-L86 HydrophobicContact CB-CD1 4.35Å; L65-L86 HydrophobicContact CB-CD2 3.81Å; L65-L86 HydrophobicContact CB-CG 3.97Å; A82-L86 WeakPolarHBondContact O-CB 3.34Å; A82-L86 VanDerWaalsContact O-CG 3.25Å; A82-L86 WeakPolarHBondContact O-CG 3.35Å; A82-L86 PolarHBondContact O-N 3.23Å; L83-L86 PolarHBondContact O-N 3.35Å; F84-L86 VanDerWaalsContact C-N 3.33Å; F84-L86 PolarHBondContact O-N 2.82Å; L86-L89 PolarHBondContact O-N 3.42Å; L86-A90 WeakPolarHBondContact O-CB 3.29Å; L86-A90 PolarHBondContact O-N 3.1Å; L86-L100 HydrophobicContact CB-CD1 4.49Å; L86-L100 HydrophobicContact CD2-CD1 4.16Å; L86-L100 HydrophobicContact CD2-CD2 4.12Å; L86-L128 HydrophobicContact CB-CD1 4.32Å
87G96.6Very high94.8Very high0 Ų028.7 Ų28.70%014%0.144CC..Hα-helixtrans-57.7-51.417400000111.6L83 F84 T85 L89 A90 E91L83-G87 PolarHBondContact O-N 3.46Å; F84-G87 PolarHBondContact O-N 3.22Å; F84-G87 VanDerWaalsContact O-N 3.09Å; T85-G87 VanDerWaalsContact C-N 3.32Å; T85-G87 PolarHBondContact O-N 3.07Å; G87-L89 VanDerWaalsContact C-N 3.31Å; G87-L89 PolarHBondContact O-N 2.94Å; G87-A90 PolarHBondContact O-N 3.43Å; G87-A90 VanDerWaalsContact O-N 3.13Å; G87-E91 WeakPolarHBondContact O-CB 3.48Å; G87-E91 PolarHBondContact O-N 3.45Å
88T95.8Very high94.9Very high16 Ų1629.8 Ų29.810%0.09815%0.15CC..Hα-helixtrans-63.7-34.4-179.966.50000113H43 F84 T85 E91 A92 Y127H43-T88 WeakPolarHBondContact ND1-CB 3.49Å; H43-T88 PolarHBondContact ND1-OG1 3.4Å; F84-T88 HydrophobicContact CD1-CG2 4.42Å; F84-T88 HydrophobicContact CD2-CG2 4.47Å; F84-T88 HydrophobicContact CE1-CG2 3.91Å; F84-T88 HydrophobicContact CE2-CG2 3.96Å; F84-T88 HydrophobicContact CZ-CG2 3.65Å; F84-T88 WeakPolarHBondContact O-CG2 3.39Å; F84-T88 PolarHBondContact O-N 2.86Å; T85-T88 PolarHBondContact O-N 2.9Å; T85-T88 PolarHBondContact O-OG1 3.09Å; T88-E91 PolarHBondContact O-N 3.13Å; T88-A92 WeakPolarHBondContact O-CB 3Å; T88-A92 PolarHBondContact O-N 3.21Å; T88-Y127 WeakPolarHBondContact CA-OH 3.46Å; T88-Y127 HydrophobicContact CG2-CE1 4.16Å; T88-Y127 WeakPolarHBondContact CG2-OH 3.5Å; T88-Y127 PolarHBondContact N-OH 3.01Å
89L95.8Very high94.9Very high1 Ų132 Ų321%0.00517%0.166CC..Hα-helixtrans-70.6-36.7175.3-64.4169.9000112C46 V53 L56 L65 T85 L86 G87 N93 C96C46-L89 HydrophobicContact CB-CD2 3.55Å; C46-L89 VanDerWaalsContact SG-CD2 3.55Å; V53-L89 HydrophobicContact CB-CD2 4.46Å; V53-L89 HydrophobicContact CG1-CB 4.17Å; V53-L89 HydrophobicContact CG1-CD2 4.02Å; V53-L89 HydrophobicContact CG2-CD2 3.97Å; L56-L89 HydrophobicContact CD2-CD1 3.51Å; L56-L89 HydrophobicContact CD2-CD2 3.74Å; L56-L89 HydrophobicContact CD2-CG 4.29Å; L65-L89 HydrophobicContact CD1-CD1 3.81Å; T85-L89 HydrophobicContact CG2-CD1 3.93Å; T85-L89 HydrophobicContact CG2-CG 4.25Å; T85-L89 VanDerWaalsContact O-CG 3.23Å; T85-L89 WeakPolarHBondContact O-CG 3.25Å; T85-L89 PolarHBondContact O-N 3.01Å; L86-L89 PolarHBondContact O-N 3.42Å; G87-L89 VanDerWaalsContact C-N 3.31Å; G87-L89 PolarHBondContact O-N 2.94Å; L89-N93 PolarHBondContact O-N 2.82Å; L89-C96 WeakPolarHBondContact O-CB 3.38Å
90A95.9Very high95Very high0 Ų030.1 Ų30.10%016%0.157CC..Hα-helixtrans-73.6-29175.800000112.5L86 G87 K97 L100 V131 L132L86-A90 WeakPolarHBondContact O-CB 3.29Å; L86-A90 PolarHBondContact O-N 3.1Å; G87-A90 PolarHBondContact O-N 3.43Å; G87-A90 VanDerWaalsContact O-N 3.13Å; A90-K97 HydrophobicContact CB-CB 4.33Å; A90-K97 WeakPolarHBondContact O-CB 3.31Å; A90-K97 VanDerWaalsContact O-CE 3.24Å; A90-K97 WeakPolarHBondContact O-CE 3.38Å; A90-L100 HydrophobicContact CB-CD1 3.98Å; A90-V131 VanDerWaalsContact C-CG1 3.49Å; A90-V131 HydrophobicContact CB-CG1 3.6Å; A90-L132 HydrophobicContact CB-CD2 4.42Å
91E94.3Very high95.1Very high104 Ų10430 Ų3049%0.48616%0.158SC..Hα-helixtrans-72.5-44.1175.2-173.7165.5-156.200110.8G87 T88 N93 Y127 V131G87-E91 WeakPolarHBondContact O-CB 3.48Å; G87-E91 PolarHBondContact O-N 3.45Å; T88-E91 PolarHBondContact O-N 3.13Å; E91-N93 PolarHBondContact O-N 3.38Å; E91-Y127 PolarHBondContact OE2-OH 2.91Å; E91-V131 HydrophobicContact CB-CG1 3.85Å; E91-V131 HydrophobicContact CB-CG2 4.06Å; E91-V131 HydrophobicContact CG-CG2 4.48Å; E91-V131 VanDerWaalsContact N-CG1 3.31Å
92A92.5Very high95.2Very high43 Ų4334.4 Ų34.436%0.35517%0.174SC..Hα-helixtrans-75.9-16.2-178.200000115.4E50 V53 T88E50-A92 WeakPolarHBondContact CG-O 3.3Å; V53-A92 HydrophobicContact CG2-CB 4.2Å; T88-A92 WeakPolarHBondContact O-CB 3Å; T88-A92 PolarHBondContact O-N 3.21Å
93N93.4Very high95.2Very high2 Ų240.2 Ų40.21%0.01120%0.199CC..  trans-149.9121.6-172.9178.9-108000113.4E50 V53 D54 R57 L89 E91 Y95 C96 K97E50-N93 HydrophobicContact CG-CB 3.99Å; E50-N93 WeakPolarHBondContact CG-ND2 3.28Å; E50-N93 WeakPolarHBondContact OE1-CA 3.37Å; E50-N93 PolarHBondContact OE1-ND2 3.12Å; V53-N93 HydrophobicContact CB-CB 3.86Å; V53-N93 HydrophobicContact CG1-CB 3.54Å; V53-N93 HydrophobicContact CG2-CB 4.32Å; D54-N93 PolarHBondContact OD1-ND2 2.96Å; D54-N93 VanDerWaalsContact OD1-ND2 3.09Å; R57-N93 PolarHBondContact NH1-OD1 3.43Å; L89-N93 PolarHBondContact O-N 2.82Å; E91-N93 PolarHBondContact O-N 3.38Å; N93-Y95 VanDerWaalsContact C-N 3.33Å; N93-Y95 PolarHBondContact O-N 2.98Å; N93-Y95 PolarHBondContact OD1-N 3.38Å; N93-C96 HydrophobicContact CB-CB 4.03Å; N93-C96 WeakPolarHBondContact O-CB 3.44Å; N93-C96 PolarHBondContact O-N 3.33Å; N93-C96 VanDerWaalsContact O-N 3.15Å; N93-C96 WeakPolarHBondContact OD1-CB 3.42Å; N93-C96 PolarHBondContact OD1-N 3.02Å; N93-K97 PolarHBondContact O-N 3.28Å
94V92.4Very high95.2Very high92 Ų9242.6 Ų42.656%0.55821%0.212SC*.Hα-helixtrans-64.6-35.2-176.2178.90000112.4K97 N98V94-K97 PolarHBondContact O-N 3.09Å; V94-N98 WeakPolarHBondContact O-CB 3.39Å; V94-N98 VanDerWaalsContact O-CG 3.28Å; V94-N98 PolarHBondContact O-N 3.19Å; V94-N98 PolarHBondContact O-ND2 3.24Å
95Y91.8Very high95.2Very high153 Ų15341.2 Ų41.260%0.621%0.206SC*.Hα-helixtrans-67-36176.5-62.3-74.2000112.4N93 S99N93-Y95 VanDerWaalsContact C-N 3.33Å; N93-Y95 PolarHBondContact O-N 2.98Å; N93-Y95 PolarHBondContact OD1-N 3.38Å; Y95-S99 WeakPolarHBondContact O-CB 3.46Å; Y95-S99 PolarHBondContact O-N 3.47Å; Y95-S99 PolarHBondContact O-OG 2.84Å
96C94.1Very high95.2Very high0 Ų041.2 Ų41.20%021%0.206CC..Hα-helixtrans-67-46171.9-169.10000111.4V53 L89 N93 N98 S99 L100V53-C96 HydrophobicContact CG1-CB 3.93Å; L89-C96 WeakPolarHBondContact O-CB 3.38Å; N93-C96 HydrophobicContact CB-CB 4.03Å; N93-C96 WeakPolarHBondContact O-CB 3.44Å; N93-C96 PolarHBondContact O-N 3.33Å; N93-C96 VanDerWaalsContact O-N 3.15Å; N93-C96 WeakPolarHBondContact OD1-CB 3.42Å; N93-C96 PolarHBondContact OD1-N 3.02Å; C96-N98 VanDerWaalsContact C-N 3.32Å; C96-N98 PolarHBondContact O-N 3.27Å; C96-S99 PolarHBondContact O-N 3.42Å; C96-S99 PolarHBondContact O-OG 2.96Å; C96-L100 WeakPolarHBondContact O-CG 3.42Å; C96-L100 PolarHBondContact O-N 3.13Å; C96-L100 VanDerWaalsContact O-N 3.13Å
97K95.2Very high95.2Very high30 Ų3045.4 Ų45.413%0.1323%0.228CC..Hα-helixtrans-53.4-50174.3-165.4-178.6-66.2-1450111.4A90 N93 V94 L100 C101 V131 L132 A134 N136A90-K97 HydrophobicContact CB-CB 4.33Å; A90-K97 WeakPolarHBondContact O-CB 3.31Å; A90-K97 VanDerWaalsContact O-CE 3.24Å; A90-K97 WeakPolarHBondContact O-CE 3.38Å; N93-K97 PolarHBondContact O-N 3.28Å; V94-K97 PolarHBondContact O-N 3.09Å; K97-L100 PolarHBondContact O-N 3.4Å; K97-C101 PolarHBondContact O-N 3.28Å; K97-C101 PolarHBondContact O-SG 3.47Å; K97-V131 WeakPolarHBondContact CD-O 3.42Å; K97-V131 WeakPolarHBondContact CE-O 3.27Å; K97-V131 PolarHBondContact NZ-O 2.89Å; K97-L132 HydrophobicContact CG-CD2 4.19Å; K97-A134 PolarHBondContact NZ-O 3.41Å; K97-N136 HydrophobicContact CD-CB 4.19Å
98N93.3Very high95.1Very high74 Ų7447.1 Ų47.140%0.39624%0.237SC..Hα-helixtrans-67.2-36.4-178.9-70.4-18.1000112.8V94 C96 L100 C101V94-N98 WeakPolarHBondContact O-CB 3.39Å; V94-N98 VanDerWaalsContact O-CG 3.28Å; V94-N98 PolarHBondContact O-N 3.19Å; V94-N98 PolarHBondContact O-ND2 3.24Å; C96-N98 VanDerWaalsContact C-N 3.32Å; C96-N98 PolarHBondContact O-N 3.27Å; N98-L100 PolarHBondContact O-N 2.72Å; N98-C101 WeakPolarHBondContact O-CB 3.38Å; N98-C101 PolarHBondContact O-N 3.17Å; N98-C101 VanDerWaalsContact O-N 3.13Å
99S94Very high95.2Very high48 Ų4846.5 Ų46.534%0.33623%0.233SC..Hα-helixtrans-68.7-23.3176.473.10000113.3Y95 C96 R102Y95-S99 WeakPolarHBondContact O-CB 3.46Å; Y95-S99 PolarHBondContact O-N 3.47Å; Y95-S99 PolarHBondContact O-OG 2.84Å; C96-S99 PolarHBondContact O-N 3.42Å; C96-S99 PolarHBondContact O-OG 2.96Å; S99-R102 WeakPolarHBondContact O-CD 3.38Å
100L96.3Very high95.1Very high6 Ų646.9 Ų46.93%0.03124%0.236CC..THydrogen-bonded Turntrans-89.5-4.8173.4-67.7166.9000113.4V62 L86 A90 C96 K97 N98 R102 I105 L132V62-L100 HydrophobicContact CG1-CD1 4.09Å; V62-L100 HydrophobicContact CG1-CD2 3.85Å; V62-L100 HydrophobicContact CG1-CG 3.95Å; L86-L100 HydrophobicContact CB-CD1 4.49Å; L86-L100 HydrophobicContact CD2-CD1 4.16Å; L86-L100 HydrophobicContact CD2-CD2 4.12Å; A90-L100 HydrophobicContact CB-CD1 3.98Å; C96-L100 WeakPolarHBondContact O-CG 3.42Å; C96-L100 PolarHBondContact O-N 3.13Å; C96-L100 VanDerWaalsContact O-N 3.13Å; K97-L100 PolarHBondContact O-N 3.4Å; N98-L100 PolarHBondContact O-N 2.72Å; L100-R102 VanDerWaalsContact C-N 3.29Å; L100-R102 PolarHBondContact O-N 3.2Å; L100-I105 HydrophobicContact CB-CD1 4.17Å; L100-I105 HydrophobicContact CD2-CD1 3.84Å; L100-I105 WeakPolarHBondContact O-CD1 3.39Å; L100-L132 HydrophobicContact CB-CD2 3.6Å
101C97.1Very high95Very high12 Ų1248.7 Ų48.78%0.08126%0.255CS..  trans-83.271.3174-70.40000111.7K97 N98 N136 L138 L142K97-C101 PolarHBondContact O-N 3.28Å; K97-C101 PolarHBondContact O-SG 3.47Å; N98-C101 WeakPolarHBondContact O-CB 3.38Å; N98-C101 PolarHBondContact O-N 3.17Å; N98-C101 VanDerWaalsContact O-N 3.13Å; C101-N136 PolarHBondContact SG-ND2 3.39Å; C101-L138 HydrophobicContact CB-CD2 3.72Å; C101-L138 HydrophobicContact CB-CG 4.01Å; C101-L142 HydrophobicContact CB-CD1 3.93Å; C101-L142 WeakPolarHBondContact O-CD1 3.22Å
102R96.7Very high94.9Very high100 Ų10044.8 Ų44.838%0.37724%0.236SC..  trans-127.6143.5179.6-51.8-174-59.8105.213.4110.6S99 L100 D104 I105 F106S99-R102 WeakPolarHBondContact O-CD 3.38Å; L100-R102 VanDerWaalsContact C-N 3.29Å; L100-R102 PolarHBondContact O-N 3.2Å; R102-D104 VanDerWaalsContact C-N 3.27Å; R102-D104 WeakPolarHBondContact CB-OD1 3.49Å; R102-D104 IonicContact CZ-OD1 3.36Å; R102-D104 IonicContact CZ-OD2 3.32Å; R102-D104 IonicContact NE-OD1 2.62Å; R102-D104 IonicContact NH1-OD1 2.73Å; R102-D104 PolarHBondContact NH1-OD1 3.19Å; R102-D104 IonicContact NH1-OD2 3.17Å; R102-D104 PolarHBondContact NH1-OD2 2.86Å; R102-D104 IonicContact NH2-OD1 3.91Å; R102-D104 PolarHBondContact NH2-OD1 3.2Å; R102-D104 IonicContact NH2-OD2 2.74Å; R102-D104 PolarHBondContact NH2-OD2 3.45Å; R102-D104 PolarHBondContact O-N 2.86Å; R102-I105 HydrophobicContact CB-CD1 4.04Å; R102-I105 HydrophobicContact CB-CG1 4.31Å; R102-I105 HydrophobicContact CG-CD1 4.23Å; R102-I105 WeakPolarHBondContact O-CB 3.28Å; R102-I105 PolarHBondContact O-N 3.26Å; R102-I105 VanDerWaalsContact O-N 3.09Å; R102-F106 WeakPolarHBondContact O-CD2 3.34Å; R102-F106 PolarHBondContact O-N 2.95Å
103K97.3Very high94.9Very high121 Ų12142.9 Ų42.953%0.52622%0.22SC..Hα-helixtrans-59.1-34.7-173.4-168.9177.3-178.6175.70113.4F106 I107 L142 T146K103-F106 PolarHBondContact O-N 3.46Å; K103-I107 HydrophobicContact CG-CD1 4.08Å; K103-I107 WeakPolarHBondContact O-CG1 3.4Å; K103-I107 PolarHBondContact O-N 3.43Å; K103-I107 VanDerWaalsContact O-N 3.12Å; K103-L142 HydrophobicContact CB-CD2 4.16Å; K103-T146 HydrophobicContact CG-CG2 3.71Å
104D95.9Very high94.7Very high58 Ų5847.4 Ų47.431%0.3124%0.241SC..Hα-helixtrans-62.5-45.3175.560.7-49.3000112Y66 R102 F106 I107 D108Y66-D104 PolarHBondContact OH-OD2 3.34Å; R102-D104 VanDerWaalsContact C-N 3.27Å; R102-D104 WeakPolarHBondContact CB-OD1 3.49Å; R102-D104 IonicContact CZ-OD1 3.36Å; R102-D104 IonicContact CZ-OD2 3.32Å; R102-D104 IonicContact NE-OD1 2.62Å; R102-D104 IonicContact NH1-OD1 2.73Å; R102-D104 PolarHBondContact NH1-OD1 3.19Å; R102-D104 IonicContact NH1-OD2 3.17Å; R102-D104 PolarHBondContact NH1-OD2 2.86Å; R102-D104 IonicContact NH2-OD1 3.91Å; R102-D104 PolarHBondContact NH2-OD1 3.2Å; R102-D104 IonicContact NH2-OD2 2.74Å; R102-D104 PolarHBondContact NH2-OD2 3.45Å; R102-D104 PolarHBondContact O-N 2.86Å; D104-F106 VanDerWaalsContact C-N 3.3Å; D104-F106 PolarHBondContact O-N 3.16Å; D104-I107 PolarHBondContact O-N 3.36Å; D104-I107 VanDerWaalsContact O-N 3.15Å; D104-D108 PolarHBondContact O-N 2.97Å; D104-D108 VanDerWaalsContact O-OD2 3.05Å
105I96.4Very high93.8Very high4 Ų451.3 Ų51.32%0.02125%0.253CS..Hα-helixtrans-58.7-43.9179.6-63.7171.7000110.7Y66 L100 R102 D108 I109 L132Y66-I105 HydrophobicContact CD2-CG1 4.14Å; Y66-I105 HydrophobicContact CE1-CG1 4.16Å; Y66-I105 HydrophobicContact CE2-CB 4.24Å; Y66-I105 HydrophobicContact CE2-CD1 4.44Å; Y66-I105 HydrophobicContact CE2-CG1 3.53Å; Y66-I105 HydrophobicContact CE2-CG2 4.38Å; Y66-I105 VanDerWaalsContact CZ-CG1 3.49Å; Y66-I105 WeakPolarHBondContact OH-CG1 3.38Å; L100-I105 HydrophobicContact CB-CD1 4.17Å; L100-I105 HydrophobicContact CD2-CD1 3.84Å; L100-I105 WeakPolarHBondContact O-CD1 3.39Å; R102-I105 HydrophobicContact CB-CD1 4.04Å; R102-I105 HydrophobicContact CB-CG1 4.31Å; R102-I105 HydrophobicContact CG-CD1 4.23Å; R102-I105 WeakPolarHBondContact O-CB 3.28Å; R102-I105 PolarHBondContact O-N 3.26Å; R102-I105 VanDerWaalsContact O-N 3.09Å; I105-D108 PolarHBondContact O-N 3.14Å; I105-I109 HydrophobicContact CG2-CD1 4.01Å; I105-I109 VanDerWaalsContact O-CG1 3.31Å; I105-I109 WeakPolarHBondContact O-CG1 3.16Å; I105-I109 PolarHBondContact O-N 3.45Å; I105-L132 HydrophobicContact CG2-CD1 4.3Å
106F97.9Very high93.4Very high0 Ų051.8 Ų51.80%027%0.266CS..Hα-helixtrans-68-37.5179-82.5-102.8000112.5R102 K103 D104 D108 I109 A110 L129 L132 V133 G139 L142 A143 T146 C148R102-F106 WeakPolarHBondContact O-CD2 3.34Å; R102-F106 PolarHBondContact O-N 2.95Å; K103-F106 PolarHBondContact O-N 3.46Å; D104-F106 VanDerWaalsContact C-N 3.3Å; D104-F106 PolarHBondContact O-N 3.16Å; F106-D108 VanDerWaalsContact C-N 3.35Å; F106-D108 PolarHBondContact O-N 3Å; F106-I109 PolarHBondContact O-N 3.5Å; F106-A110 PolarHBondContact O-N 3.21Å; F106-L129 HydrophobicContact CD1-CD1 3.79Å; F106-L129 HydrophobicContact CE1-CD1 3.46Å; F106-L129 VanDerWaalsContact CE1-CD1 3.46Å; F106-L129 HydrophobicContact CZ-CD1 4.39Å; F106-L132 HydrophobicContact CE2-CB 4.33Å; F106-L132 HydrophobicContact CE2-CD1 4Å; F106-L132 HydrophobicContact CZ-CB 3.81Å; F106-L132 HydrophobicContact CZ-CD1 4.18Å; F106-V133 HydrophobicContact CE1-CG1 4.26Å; F106-G139 WeakPolarHBondContact CE1-O 3.17Å; F106-L142 HydrophobicContact CD1-CB 3.98Å; F106-L142 HydrophobicContact CD2-CB 3.81Å; F106-L142 HydrophobicContact CD2-CD1 4.02Å; F106-L142 HydrophobicContact CE1-CB 3.98Å; F106-L142 HydrophobicContact CE2-CB 3.82Å; F106-L142 HydrophobicContact CE2-CD1 3.82Å; F106-L142 HydrophobicContact CG-CB 3.88Å; F106-L142 HydrophobicContact CZ-CB 3.9Å; F106-A143 HydrophobicContact CD1-CB 4.19Å; F106-A143 HydrophobicContact CE1-CB 3.87Å; F106-T146 HydrophobicContact CB-CG2 3.87Å; F106-T146 WeakPolarHBondContact CB-OG1 3.39Å; F106-C148 PolarHBondContact O-SG 3.03Å
107I96.7Very high93Very high89 Ų8952.7 Ų52.746%0.45627%0.273SS..Hα-helixtrans-63.5-40173.2-69165.6000111.2K103 D104 A110 G111 T146K103-I107 HydrophobicContact CG-CD1 4.08Å; K103-I107 WeakPolarHBondContact O-CG1 3.4Å; K103-I107 PolarHBondContact O-N 3.43Å; K103-I107 VanDerWaalsContact O-N 3.12Å; D104-I107 PolarHBondContact O-N 3.36Å; D104-I107 VanDerWaalsContact O-N 3.15Å; I107-A110 WeakPolarHBondContact O-CB 3.4Å; I107-A110 PolarHBondContact O-N 3.39Å; I107-G111 PolarHBondContact O-N 3.13Å; I107-T146 HydrophobicContact CG1-CG2 3.94Å
108D95.1Very high92.7Very high36 Ų3654.7 Ų54.719%0.19329%0.289CS..Hα-helixtrans-66.2-40.7175.3-59.8-54.5000112Y66 K70 D104 I105 F106 G111 H112Y66-D108 PolarHBondContact OH-OD2 3.31Å; K70-D108 WeakPolarHBondContact CD-OD2 3.44Å; K70-D108 VanDerWaalsContact CE-CG 3.44Å; K70-D108 WeakPolarHBondContact CE-OD1 3.45Å; K70-D108 VanDerWaalsContact CE-OD2 3.23Å; K70-D108 WeakPolarHBondContact CE-OD2 3.41Å; K70-D108 IonicContact NZ-OD1 3.31Å; K70-D108 PolarHBondContact NZ-OD1 3.17Å; K70-D108 IonicContact NZ-OD2 3.37Å; K70-D108 PolarHBondContact NZ-OD2 3.11Å; D104-D108 PolarHBondContact O-N 2.97Å; D104-D108 VanDerWaalsContact O-OD2 3.05Å; I105-D108 PolarHBondContact O-N 3.14Å; F106-D108 VanDerWaalsContact C-N 3.35Å; F106-D108 PolarHBondContact O-N 3Å; D108-G111 CarbonylContact O-C 3.08Å; D108-G111 WeakPolarHBondContact O-CA 3.18Å; D108-G111 PolarHBondContact O-N 3.02Å; D108-G111 VanDerWaalsContact O-N 3.15Å; D108-H112 PolarHBondContact O-CD2 3Å; D108-H112 PolarHBondContact O-N 3.11Å
109I96.3Very high92.5Very high3 Ų353.7 Ų53.72%0.01528%0.283CS..Hα-helixtrans-58.6-47.9173.1-71.7169.2000110I105 F106 G111 H112 L113 L128 L129 L132I105-I109 HydrophobicContact CG2-CD1 4.01Å; I105-I109 VanDerWaalsContact O-CG1 3.31Å; I105-I109 WeakPolarHBondContact O-CG1 3.16Å; I105-I109 PolarHBondContact O-N 3.45Å; F106-I109 PolarHBondContact O-N 3.5Å; I109-G111 VanDerWaalsContact C-N 3.26Å; I109-G111 PolarHBondContact O-N 3.39Å; I109-H112 WeakPolarHBondContact O-CA 3.46Å; I109-H112 WeakPolarHBondContact O-CB 3.43Å; I109-H112 PolarHBondContact O-N 3.33Å; I109-L113 HydrophobicContact CG2-CD1 4.01Å; I109-L113 HydrophobicContact CG2-CG 4.46Å; I109-L113 WeakPolarHBondContact O-CG 3.49Å; I109-L113 PolarHBondContact O-N 3Å; I109-L113 VanDerWaalsContact O-N 3.16Å; I109-L128 HydrophobicContact CD1-CD2 4.02Å; I109-L128 HydrophobicContact CD1-CG 4.09Å; I109-L128 HydrophobicContact CG1-CD2 4.42Å; I109-L129 HydrophobicContact CG2-CB 4.01Å; I109-L129 HydrophobicContact CG2-CD1 4.33Å; I109-L129 HydrophobicContact CG2-CD2 3.99Å; I109-L129 HydrophobicContact CG2-CG 4.34Å; I109-L132 HydrophobicContact CD1-CD1 3.95Å
110A95.3Very high92.3Very high10 Ų1052.9 Ų52.98%0.08328%0.275CS..Hα-helixtrans-56.2-39.7174.600000112.3F106 I107 H112 L113 Q114 I151F106-A110 PolarHBondContact O-N 3.21Å; I107-A110 WeakPolarHBondContact O-CB 3.4Å; I107-A110 PolarHBondContact O-N 3.39Å; A110-H112 VanDerWaalsContact C-N 3.33Å; A110-H112 PolarHBondContact O-N 2.98Å; A110-L113 PolarHBondContact O-N 2.65Å; A110-Q114 PolarHBondContact O-NE2 3.25Å; A110-I151 HydrophobicContact CB-CD1 3.59Å
111G93.4Very high92Very high37 Ų3755 Ų5538%0.38128%0.284SS..Hα-helixtrans-66.1-30172.800000114.2I107 D108 I109 L113 Q114I107-G111 PolarHBondContact O-N 3.13Å; D108-G111 CarbonylContact O-C 3.08Å; D108-G111 WeakPolarHBondContact O-CA 3.18Å; D108-G111 PolarHBondContact O-N 3.02Å; D108-G111 VanDerWaalsContact O-N 3.15Å; I109-G111 VanDerWaalsContact C-N 3.26Å; I109-G111 PolarHBondContact O-N 3.39Å; G111-L113 VanDerWaalsContact C-N 3.32Å; G111-Q114 WeakPolarHBondContact O-CG 3.41Å
112H92.4Very high91.9Very high22 Ų2255.7 Ų55.710%0.10229%0.286CS..Hα-helixtrans-79.9-11.8176.8-65.4-174.2000114.2D108 I109 A110 S117 K121 S125D108-H112 PolarHBondContact O-CD2 3Å; D108-H112 PolarHBondContact O-N 3.11Å; I109-H112 WeakPolarHBondContact O-CA 3.46Å; I109-H112 WeakPolarHBondContact O-CB 3.43Å; I109-H112 PolarHBondContact O-N 3.33Å; A110-H112 VanDerWaalsContact C-N 3.33Å; A110-H112 PolarHBondContact O-N 2.98Å; H112-S117 WeakPolarHBondContact O-CB 3.25Å; H112-S117 PolarHBondContact O-OG 2.8Å; H112-K121 HydrophobicContact CB-CG 4.48Å; H112-K121 WeakPolarHBondContact CD2-CE 3.34Å; H112-K121 PolarHBondContact CD2-NZ 3.45Å; H112-K121 VanDerWaalsContact CG-CE 3.42Å; H112-K121 WeakPolarHBondContact NE2-CE 3.28Å; H112-K121 PolarHBondContact NE2-NZ 2.99Å; H112-S125 VanDerWaalsContact CB-OG 3.29Å; H112-S125 WeakPolarHBondContact CB-OG 3.35Å; H112-S125 PolarHBondContact ND1-OG 3.49Å
113L92.6Very high91.7Very high3 Ų352.9 Ų52.92%0.01628%0.275CS..THydrogen-bonded Turntrans-100.4-3.4-178.7-65.9179.7000113.5I109 A110 G111 K122 V126 L129 I151 L155I109-L113 HydrophobicContact CG2-CD1 4.01Å; I109-L113 HydrophobicContact CG2-CG 4.46Å; I109-L113 WeakPolarHBondContact O-CG 3.49Å; I109-L113 PolarHBondContact O-N 3Å; I109-L113 VanDerWaalsContact O-N 3.16Å; A110-L113 PolarHBondContact O-N 2.65Å; G111-L113 VanDerWaalsContact C-N 3.32Å; L113-K122 HydrophobicContact CD2-CB 4.41Å; L113-V126 HydrophobicContact CD2-CG2 3.48Å; L113-V126 VanDerWaalsContact CD2-CG2 3.48Å; L113-L129 HydrophobicContact CD1-CD2 4.06Å; L113-I151 HydrophobicContact CB-CG2 3.51Å; L113-I151 HydrophobicContact CD1-CG2 4.21Å; L113-L155 HydrophobicContact CB-CD1 4.14Å; L113-L155 HydrophobicContact CD2-CD1 4.13Å; L113-L155 HydrophobicContact CG-CD1 4.49Å
114Q87.4Confident91.5Very high98 Ų9847.2 Ų47.246%0.45825%0.251SS..SBendtrans-59.2157.1176.1-61.3-57.5-49.600113A110 G111 D116 S117 K122A110-Q114 PolarHBondContact O-NE2 3.25Å; G111-Q114 WeakPolarHBondContact O-CG 3.41Å; Q114-D116 PolarHBondContact O-N 2.9Å; Q114-S117 WeakPolarHBondContact O-CB 3.46Å; Q114-S117 PolarHBondContact O-N 2.92Å; Q114-K122 WeakPolarHBondContact O-CE 3.34Å; Q114-K122 PolarHBondContact O-NZ 3.49Å
115E75.1Confident91.6Very high173 Ų17344.5 Ų44.581%0.80824%0.236SC*.THydrogen-bonded Turntrans-53.5-46.2-170.1-166.6167.5-172.900113.4S117 K122E115-S117 PolarHBondContact O-N 3.42Å; E115-K122 PolarHBondContact O-NZ 3.31Å
116D83.3Confident91.6Very high163 Ų16344.3 Ų44.387%0.87224%0.235SC*.THydrogen-bonded Turntrans-70.2-8.4-180-58.9-48000115.2Q114Q114-D116 PolarHBondContact O-N 2.9Å
117S85.8Confident91.6Very high19 Ų1945.9 Ų45.913%0.13324%0.241CC..SBendtrans-70.9136.1-175.4-74.70000112.3H112 Q114 E115 K122H112-S117 WeakPolarHBondContact O-CB 3.25Å; H112-S117 PolarHBondContact O-OG 2.8Å; Q114-S117 WeakPolarHBondContact O-CB 3.46Å; Q114-S117 PolarHBondContact O-N 2.92Å; E115-S117 PolarHBondContact O-N 3.42Å; S117-K122 WeakPolarHBondContact O-CE 3.47Å; S117-K122 PolarHBondContact O-NZ 2.77Å
118P88.9Confident91.6Very high72 Ų7241.9 Ų41.947%0.46822%0.221SC..  trans-53142.7176.5-27.934.8000112.7N120 K121 K122P118-N120 VanDerWaalsContact C-N 3.26Å; P118-N120 PolarHBondContact O-N 3.46Å; P118-K121 HydrophobicContact CB-CB 4.28Å; P118-K121 WeakPolarHBondContact O-CB 3.36Å; P118-K121 PolarHBondContact O-N 3.02Å; P118-K121 VanDerWaalsContact O-N 3.13Å; P118-K122 PolarHBondContact O-N 3.25Å
119L88Confident91.8Very high53 Ų5340.2 Ų40.228%0.27721%0.212SC..Hα-helixtrans-53-43.1-176.9178.167.6000112.5K122 R123 Q173 L177L119-K122 WeakPolarHBondContact O-CB 3.41Å; L119-K122 PolarHBondContact O-N 3.27Å; L119-R123 HydrophobicContact CD1-CG 4.49Å; L119-R123 WeakPolarHBondContact O-CG 3.4Å; L119-R123 PolarHBondContact O-N 3.02Å; L119-Q173 HydrophobicContact CD2-CB 3.78Å; L119-Q173 HydrophobicContact CD2-CG 4.21Å; L119-L177 HydrophobicContact CD1-CB 4.2Å; L119-L177 HydrophobicContact CD1-CD2 3.79Å
120N89.4Confident91.8Very high32 Ų3241 Ų4117%0.17122%0.215CC..Hα-helixtrans-67.1-44.6-178.2-16248.7000112E80 P118 K122 R123 V124 F537E80-N120 PolarHBondContact OE2-ND2 2.87Å; P118-N120 VanDerWaalsContact C-N 3.26Å; P118-N120 PolarHBondContact O-N 3.46Å; N120-K122 VanDerWaalsContact C-N 3.3Å; N120-K122 PolarHBondContact O-N 3.49Å; N120-R123 WeakPolarHBondContact O-CB 3.35Å; N120-R123 PolarHBondContact O-N 2.9Å; N120-R123 VanDerWaalsContact O-N 3.11Å; N120-V124 PolarHBondContact O-N 3.45Å; N120-F537 WeakPolarHBondContact ND2-CE2 3.48Å; N120-F537 VanDerWaalsContact ND2-CZ 3.26Å; N120-F537 WeakPolarHBondContact ND2-CZ 3.48Å; N120-F537 WeakPolarHBondContact OD1-CD2 3.42Å; N120-F537 VanDerWaalsContact OD1-CE2 3.22Å; N120-F537 WeakPolarHBondContact OD1-CE2 3.43Å
121K91.2Very high91.9Very high50 Ų5040.6 Ų40.622%0.21721%0.212CC..Hα-helixtrans-54.2-43.5171-162.8-175.2-177.2-164.60112.5E80 H112 P118 V124 S125E80-K121 HydrophobicContact CG-CB 4.33Å; E80-K121 WeakPolarHBondContact OE1-CB 3.41Å; E80-K121 PolarHBondContact OE1-N 3.26Å; H112-K121 HydrophobicContact CB-CG 4.48Å; H112-K121 WeakPolarHBondContact CD2-CE 3.34Å; H112-K121 PolarHBondContact CD2-NZ 3.45Å; H112-K121 VanDerWaalsContact CG-CE 3.42Å; H112-K121 WeakPolarHBondContact NE2-CE 3.28Å; H112-K121 PolarHBondContact NE2-NZ 2.99Å; P118-K121 HydrophobicContact CB-CB 4.28Å; P118-K121 WeakPolarHBondContact O-CB 3.36Å; P118-K121 PolarHBondContact O-N 3.02Å; P118-K121 VanDerWaalsContact O-N 3.13Å; K121-V124 WeakPolarHBondContact O-CG2 3.41Å; K121-S125 VanDerWaalsContact O-CB 3.26Å; K121-S125 WeakPolarHBondContact O-CB 3.32Å; K121-S125 PolarHBondContact O-N 3.46Å; K121-S125 VanDerWaalsContact O-N 3.11Å; K121-S125 PolarHBondContact O-OG 3.16Å
122K93.6Very high92.1Very high27 Ų2738.9 Ų38.912%0.11719%0.194CC..Hα-helixtrans-59.8-52.5173.2-72178.1176.5164.80110.6L113 Q114 E115 S117 P118 L119 N120 V124 S125 V126 L177L113-K122 HydrophobicContact CD2-CB 4.41Å; Q114-K122 WeakPolarHBondContact O-CE 3.34Å; Q114-K122 PolarHBondContact O-NZ 3.49Å; E115-K122 PolarHBondContact O-NZ 3.31Å; S117-K122 WeakPolarHBondContact O-CE 3.47Å; S117-K122 PolarHBondContact O-NZ 2.77Å; P118-K122 PolarHBondContact O-N 3.25Å; L119-K122 WeakPolarHBondContact O-CB 3.41Å; L119-K122 PolarHBondContact O-N 3.27Å; N120-K122 VanDerWaalsContact C-N 3.3Å; N120-K122 PolarHBondContact O-N 3.49Å; K122-V124 PolarHBondContact O-N 2.9Å; K122-S125 PolarHBondContact O-N 2.9Å; K122-S125 VanDerWaalsContact O-N 3.16Å; K122-V126 WeakPolarHBondContact O-CG2 3.45Å; K122-V126 PolarHBondContact O-N 3.24Å; K122-L177 HydrophobicContact CB-CD1 4.21Å; K122-L177 HydrophobicContact CD-CD2 4.49Å
123R93Very high92.3Very high40 Ų4037.8 Ų37.815%0.15119%0.189CC..Hα-helixtrans-55.9-50.3-179.2-72.5-179.163.7179.81.5113.4L119 N120 S125 V126 Y127 Q176 L177 F537L119-R123 HydrophobicContact CD1-CG 4.49Å; L119-R123 WeakPolarHBondContact O-CG 3.4Å; L119-R123 PolarHBondContact O-N 3.02Å; N120-R123 WeakPolarHBondContact O-CB 3.35Å; N120-R123 PolarHBondContact O-N 2.9Å; N120-R123 VanDerWaalsContact O-N 3.11Å; R123-S125 VanDerWaalsContact C-N 3.29Å; R123-S125 PolarHBondContact O-N 3.47Å; R123-V126 PolarHBondContact O-N 3.22Å; R123-Y127 PolarHBondContact O-N 3.42Å; R123-Q176 VanDerWaalsContact NH2-OE1 3.14Å; R123-L177 HydrophobicContact CG-CB 4.28Å; R123-L177 HydrophobicContact CG-CD1 4.02Å; R123-F537 PolarHBondContact NH2-O 3.08Å
124V94.4Very high92.5Very high3 Ų337.9 Ų37.92%0.01819%0.19CC..Hα-helixtrans-67.6-30.6179.5-59.10000112.4E80 L83 F84 N120 K121 K122 L128 F537E80-V124 HydrophobicContact CB-CG2 4.26Å; E80-V124 HydrophobicContact CG-CG2 4.43Å; L83-V124 HydrophobicContact CB-CB 4.28Å; L83-V124 HydrophobicContact CB-CG2 3.86Å; L83-V124 HydrophobicContact CD1-CG2 3.9Å; F84-V124 HydrophobicContact CB-CG1 4.2Å; N120-V124 PolarHBondContact O-N 3.45Å; K121-V124 WeakPolarHBondContact O-CG2 3.41Å; K122-V124 PolarHBondContact O-N 2.9Å; V124-L128 WeakPolarHBondContact O-CB 3.49Å; V124-L128 PolarHBondContact O-N 2.81Å; V124-F537 HydrophobicContact CG1-CD1 4Å; V124-F537 HydrophobicContact CG1-CE1 3.46Å; V124-F537 VanDerWaalsContact CG1-CE1 3.46Å; V124-F537 HydrophobicContact CG1-CZ 4.13Å
125S96.7Very high92.7Very high0 Ų038.6 Ų38.60%019%0.193CC..Hα-helixtrans-74.1-38.4176.3-55.50000112.1H112 K121 K122 R123 L128 L129H112-S125 VanDerWaalsContact CB-OG 3.29Å; H112-S125 WeakPolarHBondContact CB-OG 3.35Å; H112-S125 PolarHBondContact ND1-OG 3.49Å; K121-S125 VanDerWaalsContact O-CB 3.26Å; K121-S125 WeakPolarHBondContact O-CB 3.32Å; K121-S125 PolarHBondContact O-N 3.46Å; K121-S125 VanDerWaalsContact O-N 3.11Å; K121-S125 PolarHBondContact O-OG 3.16Å; K122-S125 PolarHBondContact O-N 2.9Å; K122-S125 VanDerWaalsContact O-N 3.16Å; R123-S125 VanDerWaalsContact C-N 3.29Å; R123-S125 PolarHBondContact O-N 3.47Å; S125-L128 PolarHBondContact O-N 3.26Å; S125-L129 VanDerWaalsContact O-CB 3.29Å; S125-L129 WeakPolarHBondContact O-CB 3.3Å; S125-L129 PolarHBondContact O-N 2.84Å
126V97.2Very high93.7Very high0 Ų031.1 Ų31.10%016%0.159CC..Hα-helixtrans-64.2-42.1171.4174.30000111L113 K122 R123 L129 F130 L152 L177 S180 V181 A184L113-V126 HydrophobicContact CD2-CG2 3.48Å; L113-V126 VanDerWaalsContact CD2-CG2 3.48Å; K122-V126 WeakPolarHBondContact O-CG2 3.45Å; K122-V126 PolarHBondContact O-N 3.24Å; R123-V126 PolarHBondContact O-N 3.22Å; V126-L129 PolarHBondContact O-N 3.33Å; V126-F130 WeakPolarHBondContact O-CB 3.45Å; V126-F130 PolarHBondContact O-N 3.4Å; V126-L152 HydrophobicContact CG1-CD2 4.39Å; V126-L152 HydrophobicContact CG2-CD2 4.34Å; V126-L177 HydrophobicContact CG2-CD1 4.02Å; V126-S180 VanDerWaalsContact CG1-C 3.46Å; V126-S180 WeakPolarHBondContact CG1-O 3.48Å; V126-V181 HydrophobicContact CG1-CG2 4.03Å; V126-V181 HydrophobicContact CG2-CG2 3.86Å; V126-A184 HydrophobicContact CG1-CB 4.01Å
127Y97.1Very high94.3Very high34 Ų3427.6 Ų27.613%0.13314%0.136CC..Hα-helixtrans-61.8-48.3175.2167.3-115.2000111.9F84 T88 E91 R123 L129 F130 V131F84-Y127 HydrophobicContact CD2-CD1 4.13Å; F84-Y127 HydrophobicContact CD2-CE1 4Å; F84-Y127 HydrophobicContact CE2-CE1 4.16Å; T88-Y127 WeakPolarHBondContact CA-OH 3.46Å; T88-Y127 HydrophobicContact CG2-CE1 4.16Å; T88-Y127 WeakPolarHBondContact CG2-OH 3.5Å; T88-Y127 PolarHBondContact N-OH 3.01Å; E91-Y127 PolarHBondContact OE2-OH 2.91Å; R123-Y127 PolarHBondContact O-N 3.42Å; Y127-L129 VanDerWaalsContact C-N 3.33Å; Y127-L129 PolarHBondContact O-N 2.98Å; Y127-F130 PolarHBondContact O-N 3.1Å; Y127-V131 HydrophobicContact CD2-CG2 4.03Å; Y127-V131 HydrophobicContact CE2-CG2 3.55Å; Y127-V131 WeakPolarHBondContact O-CG2 3.38Å; Y127-V131 PolarHBondContact O-N 3.31Å
128L97.6Very high94.8Very high5 Ų530.9 Ų30.93%0.02615%0.151CC..Hα-helixtrans-58.6-45.1174.7176.860.8000111.3L83 L86 I109 V124 S125 V131 L132L83-L128 HydrophobicContact CD2-CD2 3.94Å; L86-L128 HydrophobicContact CB-CD1 4.32Å; I109-L128 HydrophobicContact CD1-CD2 4.02Å; I109-L128 HydrophobicContact CD1-CG 4.09Å; I109-L128 HydrophobicContact CG1-CD2 4.42Å; V124-L128 WeakPolarHBondContact O-CB 3.49Å; V124-L128 PolarHBondContact O-N 2.81Å; S125-L128 PolarHBondContact O-N 3.26Å; L128-V131 PolarHBondContact O-N 3.38Å; L128-L132 HydrophobicContact CD1-CD1 4.01Å; L128-L132 HydrophobicContact CD1-CG 4.11Å; L128-L132 HydrophobicContact CG-CD1 3.99Å; L128-L132 HydrophobicContact CG-CG 4.47Å; L128-L132 VanDerWaalsContact O-CG 3.25Å; L128-L132 WeakPolarHBondContact O-CG 3.27Å; L128-L132 PolarHBondContact O-N 3.46Å
129L98.2Very high95.2Very high0 Ų027.4 Ų27.40%013%0.129CC..Hα-helixtrans-60.4-48.7177.5-176.755.8000111.9F106 I109 L113 S125 V126 Y127 V131 L132 V133 A143 C148 L152F106-L129 HydrophobicContact CD1-CD1 3.79Å; F106-L129 HydrophobicContact CE1-CD1 3.46Å; F106-L129 VanDerWaalsContact CE1-CD1 3.46Å; F106-L129 HydrophobicContact CZ-CD1 4.39Å; I109-L129 HydrophobicContact CG2-CB 4.01Å; I109-L129 HydrophobicContact CG2-CD1 4.33Å; I109-L129 HydrophobicContact CG2-CD2 3.99Å; I109-L129 HydrophobicContact CG2-CG 4.34Å; L113-L129 HydrophobicContact CD1-CD2 4.06Å; S125-L129 VanDerWaalsContact O-CB 3.29Å; S125-L129 WeakPolarHBondContact O-CB 3.3Å; S125-L129 PolarHBondContact O-N 2.84Å; V126-L129 PolarHBondContact O-N 3.33Å; Y127-L129 VanDerWaalsContact C-N 3.33Å; Y127-L129 PolarHBondContact O-N 2.98Å; L129-V131 VanDerWaalsContact C-N 3.34Å; L129-V131 PolarHBondContact O-N 3.04Å; L129-L132 PolarHBondContact O-N 3.22Å; L129-L132 VanDerWaalsContact O-N 3.11Å; L129-V133 HydrophobicContact CD1-CG1 4.05Å; L129-V133 WeakPolarHBondContact O-CG2 3.41Å; L129-V133 PolarHBondContact O-N 3.45Å; L129-A143 HydrophobicContact CD1-CB 4.36Å; L129-C148 HydrophobicContact CD1-CB 4.28Å; L129-C148 HydrophobicContact CD2-CB 3.95Å; L129-L152 HydrophobicContact CD2-CD1 3.64Å; L129-L152 HydrophobicContact CD2-CD2 4.1Å; L129-L152 HydrophobicContact CD2-CG 3.86Å; L129-L152 HydrophobicContact CG-CD1 4.36Å
130F97.6Very high95.6Very high19 Ų1925 Ų258%0.08312%0.116CC..Hα-helixtrans-52.4-50.9174.4164.2-108.6000111.2V126 Y127 L132 V133 A134 S183 A184 W544V126-F130 WeakPolarHBondContact O-CB 3.45Å; V126-F130 PolarHBondContact O-N 3.4Å; Y127-F130 PolarHBondContact O-N 3.1Å; F130-L132 VanDerWaalsContact C-N 3.3Å; F130-L132 PolarHBondContact O-N 2.93Å; F130-V133 WeakPolarHBondContact O-CG2 2.99Å; F130-V133 PolarHBondContact O-N 3.42Å; F130-A134 HydrophobicContact CD2-CB 4.32Å; F130-A134 HydrophobicContact CE2-CB 4Å; F130-A134 HydrophobicContact CZ-CB 4.28Å; F130-A134 WeakPolarHBondContact O-CB 3.42Å; F130-A134 PolarHBondContact O-N 2.94Å; F130-S183 WeakPolarHBondContact CD2-O 3.39Å; F130-A184 HydrophobicContact CB-CB 3.98Å; F130-W544 HydrophobicContact CZ-CE3 4.39Å
131V97.4Very high96Very high3 Ų326.2 Ų26.22%0.01813%0.125CC..Hα-helixtrans-60.9-39.6178.8171.20000111.5A90 E91 K97 Y127 L128 L129A90-V131 VanDerWaalsContact C-CG1 3.49Å; A90-V131 HydrophobicContact CB-CG1 3.6Å; E91-V131 HydrophobicContact CB-CG1 3.85Å; E91-V131 HydrophobicContact CB-CG2 4.06Å; E91-V131 HydrophobicContact CG-CG2 4.48Å; E91-V131 VanDerWaalsContact N-CG1 3.31Å; K97-V131 WeakPolarHBondContact CD-O 3.42Å; K97-V131 WeakPolarHBondContact CE-O 3.27Å; K97-V131 PolarHBondContact NZ-O 2.89Å; Y127-V131 HydrophobicContact CD2-CG2 4.03Å; Y127-V131 HydrophobicContact CE2-CG2 3.55Å; Y127-V131 WeakPolarHBondContact O-CG2 3.38Å; Y127-V131 PolarHBondContact O-N 3.31Å; L128-V131 PolarHBondContact O-N 3.38Å; L129-V131 VanDerWaalsContact C-N 3.34Å; L129-V131 PolarHBondContact O-N 3.04Å
132L97.7Very high96.3Very high0 Ų024.8 Ų24.80%012%0.119CC..Hα-helixtrans-70.7-34.5-180-67.9173.3000113.2A90 K97 L100 I105 F106 I109 L128 L129 F130 N136A90-L132 HydrophobicContact CB-CD2 4.42Å; K97-L132 HydrophobicContact CG-CD2 4.19Å; L100-L132 HydrophobicContact CB-CD2 3.6Å; I105-L132 HydrophobicContact CG2-CD1 4.3Å; F106-L132 HydrophobicContact CE2-CB 4.33Å; F106-L132 HydrophobicContact CE2-CD1 4Å; F106-L132 HydrophobicContact CZ-CB 3.81Å; F106-L132 HydrophobicContact CZ-CD1 4.18Å; I109-L132 HydrophobicContact CD1-CD1 3.95Å; L128-L132 HydrophobicContact CD1-CD1 4.01Å; L128-L132 HydrophobicContact CD1-CG 4.11Å; L128-L132 HydrophobicContact CG-CD1 3.99Å; L128-L132 HydrophobicContact CG-CG 4.47Å; L128-L132 VanDerWaalsContact O-CG 3.25Å; L128-L132 WeakPolarHBondContact O-CG 3.27Å; L128-L132 PolarHBondContact O-N 3.46Å; L129-L132 PolarHBondContact O-N 3.22Å; L129-L132 VanDerWaalsContact O-N 3.11Å; F130-L132 VanDerWaalsContact C-N 3.3Å; F130-L132 PolarHBondContact O-N 2.93Å; L132-N136 WeakPolarHBondContact O-CB 3.36Å; L132-N136 PolarHBondContact O-ND2 2.94Å
133V97.1Very high96.5Very high0 Ų023.5 Ų23.50%011%0.114CC..Hα-helixtrans-84.6-35.8178.3-57.70000113.3F106 L129 F130 H135 N136 Q140 A143F106-V133 HydrophobicContact CE1-CG1 4.26Å; L129-V133 HydrophobicContact CD1-CG1 4.05Å; L129-V133 WeakPolarHBondContact O-CG2 3.41Å; L129-V133 PolarHBondContact O-N 3.45Å; F130-V133 WeakPolarHBondContact O-CG2 2.99Å; F130-V133 PolarHBondContact O-N 3.42Å; V133-H135 PolarHBondContact O-N 3.33Å; V133-N136 PolarHBondContact O-N 3.18Å; V133-N136 VanDerWaalsContact O-N 3.07Å; V133-Q140 HydrophobicContact CB-CG 4.27Å; V133-A143 HydrophobicContact CG1-CB 3.75Å
134A95.1Very high96.6Very high5 Ų523.9 Ų23.94%0.04112%0.117CC..THydrogen-bonded Turntrans-62.7124.8-174.800000111.7K97 F130 N136 W544K97-A134 PolarHBondContact NZ-O 3.41Å; F130-A134 HydrophobicContact CD2-CB 4.32Å; F130-A134 HydrophobicContact CE2-CB 4Å; F130-A134 HydrophobicContact CZ-CB 4.28Å; F130-A134 WeakPolarHBondContact O-CB 3.42Å; F130-A134 PolarHBondContact O-N 2.94Å; A134-N136 PolarHBondContact O-N 3.4Å; A134-W544 HydrophobicContact CB-CH2 4.32Å
135H92.8Very high96.7Very high112 Ų11227.6 Ų27.652%0.51914%0.14SC..THydrogen-bonded Turntrans59.927-176.5-61.7-20.7000114.4V133 N191 W544V133-H135 PolarHBondContact O-N 3.33Å; H135-N191 WeakPolarHBondContact CA-O 3.5Å; H135-N191 PolarHBondContact N-O 3.33Å; H135-N191 PolarHBondContact ND1-O 3.4Å; H135-W544 AromaticContact CD2-CH2 3.73Å; H135-W544 AromaticContact CD2-CZ2 3.85Å; H135-W544 AromaticContact CE1-CH2 3.39Å; H135-W544 WeakPolarHBondContact CE1-CH2 3.36Å; H135-W544 AromaticContact ND1-CH2 3.94Å; H135-W544 AromaticContact NE2-CH2 3.25Å; H135-W544 WeakPolarHBondContact NE2-CH2 3.31Å; H135-W544 AromaticContact NE2-CZ2 3.45Å; H135-W544 WeakPolarHBondContact NE2-CZ2 3.29Å
136N95.2Very high96.6Very high16 Ų1628.8 Ų28.89%0.08615%0.147CC..  trans-144.3100.6-172.7-178.112.5000113.5K97 C101 L132 V133 A134 L138 G139 Q140K97-N136 HydrophobicContact CD-CB 4.19Å; C101-N136 PolarHBondContact SG-ND2 3.39Å; L132-N136 WeakPolarHBondContact O-CB 3.36Å; L132-N136 PolarHBondContact O-ND2 2.94Å; V133-N136 PolarHBondContact O-N 3.18Å; V133-N136 VanDerWaalsContact O-N 3.07Å; A134-N136 PolarHBondContact O-N 3.4Å; N136-L138 VanDerWaalsContact C-N 3.26Å; N136-L138 PolarHBondContact O-N 2.87Å; N136-L138 PolarHBondContact OD1-N 3.46Å; N136-G139 PolarHBondContact ND2-N 3.03Å; N136-G139 PolarHBondContact O-N 2.63Å; N136-G139 VanDerWaalsContact O-N 3.1Å; N136-G139 PolarHBondContact OD1-N 3.46Å; N136-Q140 WeakPolarHBondContact O-CG 3.5Å; N136-Q140 PolarHBondContact O-N 3.33Å
137K95.8Very high96.5Very high90 Ų9030 Ų3039%0.39116%0.16SC..Hα-helixtrans-59.1-34.9179.5-168.259.2172.71790113.1T141 P192 Q193 N194K137-T141 PolarHBondContact O-N 2.89Å; K137-T141 PolarHBondContact O-OG1 3.03Å; K137-T141 VanDerWaalsContact O-OG1 3.08Å; K137-P192 HydrophobicContact CB-CG 3.84Å; K137-P192 HydrophobicContact CD-CG 4.17Å; K137-Q193 PolarHBondContact NZ-O 3.02Å; K137-N194 PolarHBondContact NZ-OD1 3.4Å
138L96.4Very high96.5Very high87 Ų8728.3 Ų28.346%0.45515%0.153SC..Hα-helixtrans-66.2-44.3176.817762.1000110.9C101 N136 T141 L142C101-L138 HydrophobicContact CB-CD2 3.72Å; C101-L138 HydrophobicContact CB-CG 4.01Å; N136-L138 VanDerWaalsContact C-N 3.26Å; N136-L138 PolarHBondContact O-N 2.87Å; N136-L138 PolarHBondContact OD1-N 3.46Å; L138-T141 PolarHBondContact O-N 3.14Å; L138-L142 HydrophobicContact CD1-CD1 4.21Å; L138-L142 HydrophobicContact CD1-CG 4.32Å; L138-L142 HydrophobicContact CG-CD1 4.1Å; L138-L142 WeakPolarHBondContact O-CB 3.4Å; L138-L142 VanDerWaalsContact O-CG 3.31Å; L138-L142 WeakPolarHBondContact O-CG 3.48Å; L138-L142 PolarHBondContact O-N 3.17Å
139G97.7Very high96.4Very high0 Ų028.1 Ų28.10%015%0.152CC..Hα-helixtrans-60.9-44.8175.800000112.5F106 N136 L142 A143F106-G139 WeakPolarHBondContact CE1-O 3.17Å; N136-G139 PolarHBondContact ND2-N 3.03Å; N136-G139 PolarHBondContact O-N 2.63Å; N136-G139 VanDerWaalsContact O-N 3.1Å; N136-G139 PolarHBondContact OD1-N 3.46Å; G139-L142 PolarHBondContact O-N 2.94Å; G139-A143 PolarHBondContact O-N 3.25Å
140Q97.5Very high96.3Very high1 Ų131.6 Ų31.61%0.00517%0.168CC..Hα-helixtrans-58.1-49.5175.1-67.2175.8-21.900112.3V133 N136 L142 A143 Q144 G187 S188 N190 P192V133-Q140 HydrophobicContact CB-CG 4.27Å; N136-Q140 WeakPolarHBondContact O-CG 3.5Å; N136-Q140 PolarHBondContact O-N 3.33Å; Q140-L142 VanDerWaalsContact C-N 3.3Å; Q140-L142 PolarHBondContact O-N 2.86Å; Q140-A143 PolarHBondContact O-N 2.89Å; Q140-Q144 PolarHBondContact O-N 3.3Å; Q140-Q144 VanDerWaalsContact O-N 3.1Å; Q140-G187 WeakPolarHBondContact CG-O 3.37Å; Q140-G187 PolarHBondContact NE2-O 3.29Å; Q140-S188 WeakPolarHBondContact CG-O 3.49Å; Q140-N190 PolarHBondContact NE2-O 2.72Å; Q140-P192 PolarHBondContact NE2-O 3.35Å; Q140-P192 PolarHBondContact OE1-O 2.7Å
141T96.8Very high96.2Very high59 Ų5932.2 Ų32.236%0.36217%0.172SC..Hα-helixtrans-62.4-37.4177.4-590000111.9K137 L138 T145K137-T141 PolarHBondContact O-N 2.89Å; K137-T141 PolarHBondContact O-OG1 3.03Å; K137-T141 VanDerWaalsContact O-OG1 3.08Å; L138-T141 PolarHBondContact O-N 3.14Å; T141-T145 HydrophobicContact CG2-CG2 4.29Å; T141-T145 WeakPolarHBondContact O-CB 3.39Å; T141-T145 VanDerWaalsContact O-CG2 3.32Å; T141-T145 WeakPolarHBondContact O-CG2 3.43Å; T141-T145 PolarHBondContact O-N 2.74Å; T141-T145 PolarHBondContact O-OG1 3.29Å
142L97.9Very high96.2Very high19 Ų1932 Ų3210%0.09917%0.171CC..Hα-helixtrans-68.1-42.8175.3-73172.2000111.9C101 K103 F106 L138 G139 Q140 Q144 T145 T146C101-L142 HydrophobicContact CB-CD1 3.93Å; C101-L142 WeakPolarHBondContact O-CD1 3.22Å; K103-L142 HydrophobicContact CB-CD2 4.16Å; F106-L142 HydrophobicContact CD1-CB 3.98Å; F106-L142 HydrophobicContact CD2-CB 3.81Å; F106-L142 HydrophobicContact CD2-CD1 4.02Å; F106-L142 HydrophobicContact CE1-CB 3.98Å; F106-L142 HydrophobicContact CE2-CB 3.82Å; F106-L142 HydrophobicContact CE2-CD1 3.82Å; F106-L142 HydrophobicContact CG-CB 3.88Å; F106-L142 HydrophobicContact CZ-CB 3.9Å; L138-L142 HydrophobicContact CD1-CD1 4.21Å; L138-L142 HydrophobicContact CD1-CG 4.32Å; L138-L142 HydrophobicContact CG-CD1 4.1Å; L138-L142 WeakPolarHBondContact O-CB 3.4Å; L138-L142 VanDerWaalsContact O-CG 3.31Å; L138-L142 WeakPolarHBondContact O-CG 3.48Å; L138-L142 PolarHBondContact O-N 3.17Å; G139-L142 PolarHBondContact O-N 2.94Å; Q140-L142 VanDerWaalsContact C-N 3.3Å; Q140-L142 PolarHBondContact O-N 2.86Å; L142-Q144 VanDerWaalsContact C-N 3.3Å; L142-Q144 PolarHBondContact O-N 2.8Å; L142-T145 PolarHBondContact O-N 3.45Å; L142-T146 WeakPolarHBondContact O-CB 3.43Å; L142-T146 WeakPolarHBondContact O-CG2 3.48Å; L142-T146 PolarHBondContact O-N 3.22Å; L142-T146 PolarHBondContact O-OG1 2.99Å
143A97.3Very high96.1Very high0 Ų032.2 Ų32.20%017%0.172CC..Hα-helixtrans-56.2-45.9176.100000111.7F106 L129 V133 G139 Q140 T146 G147 C148 L149F106-A143 HydrophobicContact CD1-CB 4.19Å; F106-A143 HydrophobicContact CE1-CB 3.87Å; L129-A143 HydrophobicContact CD1-CB 4.36Å; V133-A143 HydrophobicContact CG1-CB 3.75Å; G139-A143 PolarHBondContact O-N 3.25Å; Q140-A143 PolarHBondContact O-N 2.89Å; A143-T146 PolarHBondContact O-OG1 3.42Å; A143-G147 PolarHBondContact O-N 3.49Å; A143-C148 HydrophobicContact CB-CB 4.15Å; A143-C148 WeakPolarHBondContact O-CB 3.27Å; A143-C148 PolarHBondContact O-N 3.45Å; A143-L149 PolarHBondContact O-N 2.79Å
144Q95.3Very high95.9Very high48 Ų4836.5 Ų36.522%0.22420%0.195CC..Hα-helixtrans-67.2-51.1177.5-169.8-165.1-21.400112.1Q140 L142 T146 G147 L149 I200Q140-Q144 PolarHBondContact O-N 3.3Å; Q140-Q144 VanDerWaalsContact O-N 3.1Å; L142-Q144 VanDerWaalsContact C-N 3.3Å; L142-Q144 PolarHBondContact O-N 2.8Å; Q144-T146 PolarHBondContact O-N 3.25Å; Q144-G147 PolarHBondContact O-N 3.38Å; Q144-L149 HydrophobicContact CG-CD2 4.48Å; Q144-I200 HydrophobicContact CG-CD1 3.98Å
145T95.8Very high95.8Very high81 Ų8137 Ų3750%0.49720%0.197SC..Hα-helixtrans-73.52.8-175.256.70000115.1T141 L142T141-T145 HydrophobicContact CG2-CG2 4.29Å; T141-T145 WeakPolarHBondContact O-CB 3.39Å; T141-T145 VanDerWaalsContact O-CG2 3.32Å; T141-T145 WeakPolarHBondContact O-CG2 3.43Å; T141-T145 PolarHBondContact O-N 2.74Å; T141-T145 PolarHBondContact O-OG1 3.29Å; L142-T145 PolarHBondContact O-N 3.45Å
146T96.4Very high95.9Very high25 Ų2531.6 Ų31.615%0.15317%0.172CC..THydrogen-bonded Turntrans-1210176.9560000114.1K103 F106 I107 L142 A143 Q144 C148K103-T146 HydrophobicContact CG-CG2 3.71Å; F106-T146 HydrophobicContact CB-CG2 3.87Å; F106-T146 WeakPolarHBondContact CB-OG1 3.39Å; I107-T146 HydrophobicContact CG1-CG2 3.94Å; L142-T146 WeakPolarHBondContact O-CB 3.43Å; L142-T146 WeakPolarHBondContact O-CG2 3.48Å; L142-T146 PolarHBondContact O-N 3.22Å; L142-T146 PolarHBondContact O-OG1 2.99Å; A143-T146 PolarHBondContact O-OG1 3.42Å; Q144-T146 PolarHBondContact O-N 3.25Å; T146-C148 PolarHBondContact OG1-SG 3.46Å; T146-C148 VanDerWaalsContact OG1-SG 3.4Å
147G94.4Very high95.7Very high25 Ų2534.6 Ų34.626%0.25818%0.182SC..THydrogen-bonded Turntrans853.3-178.900000114.9A143 Q144 L149 E150 I151A143-G147 PolarHBondContact O-N 3.49Å; Q144-G147 PolarHBondContact O-N 3.38Å; G147-L149 VanDerWaalsContact C-N 3.32Å; G147-L149 PolarHBondContact O-N 2.9Å; G147-E150 VanDerWaalsContact C-OE2 3.26Å; G147-E150 WeakPolarHBondContact CA-OE2 3.49Å; G147-E150 PolarHBondContact O-N 3.28Å; G147-I151 WeakPolarHBondContact O-CD1 3.35Å; G147-I151 VanDerWaalsContact O-CG1 3.28Å; G147-I151 WeakPolarHBondContact O-CG1 3.4Å; G147-I151 PolarHBondContact O-N 2.75Å; G147-I151 VanDerWaalsContact O-N 3.1Å
148C96.9Very high95.3Very high0 Ų034.5 Ų34.50%019%0.193CC..Hα-helixtrans-67.5-32.7-179.2-660000112.5F106 L129 A143 T146 L152F106-C148 PolarHBondContact O-SG 3.03Å; L129-C148 HydrophobicContact CD1-CB 4.28Å; L129-C148 HydrophobicContact CD2-CB 3.95Å; A143-C148 HydrophobicContact CB-CB 4.15Å; A143-C148 WeakPolarHBondContact O-CB 3.27Å; A143-C148 PolarHBondContact O-N 3.45Å; T146-C148 PolarHBondContact OG1-SG 3.46Å; T146-C148 VanDerWaalsContact OG1-SG 3.4Å; C148-L152 WeakPolarHBondContact O-CB 3.44Å; C148-L152 VanDerWaalsContact O-CG 3.28Å; C148-L152 WeakPolarHBondContact O-CG 3.36Å; C148-L152 PolarHBondContact O-N 2.93Å
149L96Very high94.9Very high1 Ų131.2 Ų31.21%0.00518%0.176CC..Hα-helixtrans-67.4-42.3179.4178.357.9000110.9A143 Q144 G147 L152 M153 L185 V189 I200A143-L149 PolarHBondContact O-N 2.79Å; Q144-L149 HydrophobicContact CG-CD2 4.48Å; G147-L149 VanDerWaalsContact C-N 3.32Å; G147-L149 PolarHBondContact O-N 2.9Å; L149-L152 PolarHBondContact O-N 3.39Å; L149-M153 VanDerWaalsContact O-CG 3.29Å; L149-M153 WeakPolarHBondContact O-CG 3.4Å; L149-M153 PolarHBondContact O-N 3.34Å; L149-L185 HydrophobicContact CD1-CD2 3.63Å; L149-V189 HydrophobicContact CD1-CG1 4.48Å; L149-I200 HydrophobicContact CD2-CB 4.07Å; L149-I200 HydrophobicContact CD2-CD1 3.83Å; L149-I200 HydrophobicContact CD2-CG2 4Å; L149-I200 HydrophobicContact CG-CG2 4.13Å
150E95.1Very high94.3Very high72 Ų7232.4 Ų32.434%0.33618%0.181SC..Hα-helixtrans-62.9-47.2176.3-65.275-173.600110.6G147 L152 M153 D154G147-E150 VanDerWaalsContact C-OE2 3.26Å; G147-E150 WeakPolarHBondContact CA-OE2 3.49Å; G147-E150 PolarHBondContact O-N 3.28Å; E150-L152 PolarHBondContact O-N 2.7Å; E150-M153 WeakPolarHBondContact O-CB 3.38Å; E150-M153 PolarHBondContact O-N 3.01Å; E150-M153 VanDerWaalsContact O-N 3.1Å; E150-D154 PolarHBondContact O-N 3.4Å
151I95.8Very high93.2Very high32 Ų3233.3 Ų33.316%0.16419%0.188CC..Hα-helixtrans-63-39.8175.8-65.2162.3000111.6A110 L113 G147 M153 D154 L155A110-I151 HydrophobicContact CB-CD1 3.59Å; L113-I151 HydrophobicContact CB-CG2 3.51Å; L113-I151 HydrophobicContact CD1-CG2 4.21Å; G147-I151 WeakPolarHBondContact O-CD1 3.35Å; G147-I151 VanDerWaalsContact O-CG1 3.28Å; G147-I151 WeakPolarHBondContact O-CG1 3.4Å; G147-I151 PolarHBondContact O-N 2.75Å; G147-I151 VanDerWaalsContact O-N 3.1Å; I151-M153 VanDerWaalsContact C-N 3.32Å; I151-M153 PolarHBondContact O-N 2.73Å; I151-D154 PolarHBondContact O-N 3.13Å; I151-L155 HydrophobicContact CG2-CD1 4.18Å; I151-L155 HydrophobicContact CG2-CG 4.48Å; I151-L155 WeakPolarHBondContact O-CB 3.34Å; I151-L155 WeakPolarHBondContact O-CG 3.5Å; I151-L155 PolarHBondContact O-N 3.41Å
152L96.5Very high91.8Very high0 Ų035.3 Ų35.30%019%0.192CC..Hα-helixtrans-62.5-39.2173.2-76.9175.5000111.7V126 L129 C148 L149 E150 F156 V181 A184 L185V126-L152 HydrophobicContact CG1-CD2 4.39Å; V126-L152 HydrophobicContact CG2-CD2 4.34Å; L129-L152 HydrophobicContact CD2-CD1 3.64Å; L129-L152 HydrophobicContact CD2-CD2 4.1Å; L129-L152 HydrophobicContact CD2-CG 3.86Å; L129-L152 HydrophobicContact CG-CD1 4.36Å; C148-L152 WeakPolarHBondContact O-CB 3.44Å; C148-L152 VanDerWaalsContact O-CG 3.28Å; C148-L152 WeakPolarHBondContact O-CG 3.36Å; C148-L152 PolarHBondContact O-N 2.93Å; L149-L152 PolarHBondContact O-N 3.39Å; E150-L152 PolarHBondContact O-N 2.7Å; L152-F156 VanDerWaalsContact O-CB 3.26Å; L152-F156 WeakPolarHBondContact O-CB 3.18Å; L152-F156 PolarHBondContact O-N 3.36Å; L152-V181 HydrophobicContact CB-CG1 4.42Å; L152-V181 HydrophobicContact CD2-CB 4.43Å; L152-V181 HydrophobicContact CD2-CG1 4.03Å; L152-V181 HydrophobicContact CD2-CG2 4.28Å; L152-V181 WeakPolarHBondContact O-CG1 3.34Å; L152-A184 HydrophobicContact CD1-CB 3.69Å; L152-A184 HydrophobicContact CD2-CB 3.83Å; L152-A184 HydrophobicContact CG-CB 4.44Å; L152-L185 HydrophobicContact CB-CD2 3.48Å; L152-L185 VanDerWaalsContact CB-CD2 3.48Å; L152-L185 HydrophobicContact CB-CG 3.95Å; L152-L185 HydrophobicContact CD1-CD2 4.27Å
153M95.8Very high89.7Confident4 Ų436.7 Ų36.72%0.0220%0.203CC..Hα-helixtrans-64.8-39.7176.4-74.8-71.5-70.300112L149 E150 I151 F156 R157 L185 C201 A204 F229L149-M153 VanDerWaalsContact O-CG 3.29Å; L149-M153 WeakPolarHBondContact O-CG 3.4Å; L149-M153 PolarHBondContact O-N 3.34Å; E150-M153 WeakPolarHBondContact O-CB 3.38Å; E150-M153 PolarHBondContact O-N 3.01Å; E150-M153 VanDerWaalsContact O-N 3.1Å; I151-M153 VanDerWaalsContact C-N 3.32Å; I151-M153 PolarHBondContact O-N 2.73Å; M153-F156 PolarHBondContact O-N 3.5Å; M153-R157 WeakPolarHBondContact O-CG 3.37Å; M153-R157 PolarHBondContact O-N 3.37Å; M153-R157 VanDerWaalsContact O-N 3.12Å; M153-L185 HydrophobicContact CG-CD2 3.83Å; M153-L185 HydrophobicContact SD-CD1 3.94Å; M153-L185 HydrophobicContact SD-CD2 3.87Å; M153-C201 HydrophobicContact CE-CB 4.44Å; M153-C201 HydrophobicContact SD-CB 4.25Å; M153-A204 HydrophobicContact CE-CB 3.48Å; M153-A204 VanDerWaalsContact CE-CB 3.48Å; M153-A204 HydrophobicContact SD-CB 4.34Å; M153-F229 HydrophobicContact SD-CE2 4.34Å; M153-F229 HydrophobicContact SD-CZ 4.25Å
154D93.6Very high87.4Confident90 Ų9043.9 Ų43.948%0.48125%0.247SC..Hα-helixtrans-72.4-38.4177.8-68.4-23.3000112.4E150 I151 F156 R157 S158E150-D154 PolarHBondContact O-N 3.4Å; I151-D154 PolarHBondContact O-N 3.13Å; D154-F156 VanDerWaalsContact C-N 3.34Å; D154-F156 PolarHBondContact O-N 2.94Å; D154-R157 PolarHBondContact O-N 3.24Å; D154-R157 IonicContact OD1-CZ 3.21Å; D154-R157 IonicContact OD1-NH1 2.91Å; D154-R157 PolarHBondContact OD1-NH1 3.12Å; D154-S158 WeakPolarHBondContact O-CB 3.45Å; D154-S158 PolarHBondContact O-N 2.89Å; D154-S158 PolarHBondContact O-OG 3.5Å
155L93.8Very high85.3Confident14 Ų1447.6 Ų47.67%0.07327%0.272CS..Hα-helixtrans-61.2-41.4168.8-73.1173.6000111.7L113 I151 R157 S158 T159 V181L113-L155 HydrophobicContact CB-CD1 4.14Å; L113-L155 HydrophobicContact CD2-CD1 4.13Å; L113-L155 HydrophobicContact CG-CD1 4.49Å; I151-L155 HydrophobicContact CG2-CD1 4.18Å; I151-L155 HydrophobicContact CG2-CG 4.48Å; I151-L155 WeakPolarHBondContact O-CB 3.34Å; I151-L155 WeakPolarHBondContact O-CG 3.5Å; I151-L155 PolarHBondContact O-N 3.41Å; L155-R157 VanDerWaalsContact C-N 3.32Å; L155-R157 PolarHBondContact O-N 2.87Å; L155-S158 WeakPolarHBondContact CA-OG 3.38Å; L155-S158 PolarHBondContact O-N 3.49Å; L155-S158 PolarHBondContact O-OG 3.3Å; L155-T159 HydrophobicContact CD2-CG2 4.32Å; L155-T159 WeakPolarHBondContact O-CB 3.47Å; L155-T159 WeakPolarHBondContact O-CG2 3.44Å; L155-T159 PolarHBondContact O-N 3.32Å; L155-T159 PolarHBondContact O-OG1 3.16Å; L155-V181 HydrophobicContact CB-CG1 4.06Å; L155-V181 HydrophobicContact CB-CG2 4.08Å; L155-V181 HydrophobicContact CD1-CG2 4.31Å
156F93.8Very high83.2Confident0 Ų047.1 Ų47.10%027%0.267CS..Hα-helixtrans-62.7-37.9179.8-177.8-116.7000112.4L152 M153 D154 W178 V181 L185 A204 V208 W211 F229L152-F156 VanDerWaalsContact O-CB 3.26Å; L152-F156 WeakPolarHBondContact O-CB 3.18Å; L152-F156 PolarHBondContact O-N 3.36Å; M153-F156 PolarHBondContact O-N 3.5Å; D154-F156 VanDerWaalsContact C-N 3.34Å; D154-F156 PolarHBondContact O-N 2.94Å; F156-W178 AromaticContact CD2-CE2 3.8Å; F156-W178 HydrophobicContact CD2-CZ2 4.16Å; F156-W178 AromaticContact CD2-NE1 3.3Å; F156-W178 VanDerWaalsContact CD2-NE1 3.3Å; F156-W178 AromaticContact CE2-CE2 3.58Å; F156-W178 HydrophobicContact CE2-CH2 4.43Å; F156-W178 AromaticContact CE2-CZ2 3.44Å; F156-W178 HydrophobicContact CE2-CZ2 3.44Å; F156-W178 VanDerWaalsContact CE2-CZ2 3.44Å; F156-W178 AromaticContact CE2-NE1 3.54Å; F156-W178 HydrophobicContact CZ-CZ2 4.07Å; F156-W178 VanDerWaalsContact O-CD1 3.3Å; F156-W178 PolarHBondContact O-NE1 3.37Å; F156-V181 HydrophobicContact CB-CG1 3.82Å; F156-L185 HydrophobicContact CB-CD1 3.59Å; F156-L185 HydrophobicContact CD1-CD1 3.96Å; F156-L185 HydrophobicContact CD2-CD1 4.02Å; F156-L185 HydrophobicContact CG-CD1 3.61Å; F156-A204 HydrophobicContact CD1-CB 4.3Å; F156-A204 HydrophobicContact CE1-CB 4.21Å; F156-V208 HydrophobicContact CE1-CG2 3.96Å; F156-V208 HydrophobicContact CZ-CG2 4.35Å; F156-W211 HydrophobicContact CD1-CH2 4.16Å; F156-W211 HydrophobicContact CD1-CZ3 4.23Å; F156-W211 HydrophobicContact CE1-CH2 4.03Å; F156-W211 AromaticContact CE1-CZ3 3.63Å; F156-W211 HydrophobicContact CE1-CZ3 3.63Å; F156-W211 HydrophobicContact CE2-CZ3 4.28Å; F156-W211 HydrophobicContact CZ-CH2 4.33Å; F156-W211 AromaticContact CZ-CZ3 3.67Å; F156-W211 HydrophobicContact CZ-CZ3 3.67Å; F156-W211 WeakPolarHBondContact O-CH2 3.41Å; F156-F229 AromaticContact CE1-CD1 3.94Å; F156-F229 HydrophobicContact CE1-CD1 3.94Å; F156-F229 HydrophobicContact CE1-CD2 4.31Å; F156-F229 AromaticContact CE1-CE1 3.93Å; F156-F229 HydrophobicContact CE1-CE1 3.93Å; F156-F229 HydrophobicContact CE1-CE2 4.3Å; F156-F229 HydrophobicContact CE1-CG 4.14Å; F156-F229 HydrophobicContact CE1-CZ 4.11Å; F156-F229 HydrophobicContact CZ-CB 4.23Å; F156-F229 AromaticContact CZ-CD1 3.93Å; F156-F229 HydrophobicContact CZ-CD1 3.93Å; F156-F229 HydrophobicContact CZ-CD2 4.21Å; F156-F229 HydrophobicContact CZ-CE1 4.39Å; F156-F229 AromaticContact CZ-CG 3.83Å; F156-F229 HydrophobicContact CZ-CG 3.83Å
157R91.5Very high81.5Confident78 Ų7852 Ų5229%0.29429%0.292SS..Hα-helixtrans-71.2-44.2174.8-66.7174-173.7115-1.4112.7M153 D154 L155 A203 I207M153-R157 WeakPolarHBondContact O-CG 3.37Å; M153-R157 PolarHBondContact O-N 3.37Å; M153-R157 VanDerWaalsContact O-N 3.12Å; D154-R157 PolarHBondContact O-N 3.24Å; D154-R157 IonicContact OD1-CZ 3.21Å; D154-R157 IonicContact OD1-NH1 2.91Å; D154-R157 PolarHBondContact OD1-NH1 3.12Å; L155-R157 VanDerWaalsContact C-N 3.32Å; L155-R157 PolarHBondContact O-N 2.87Å; R157-A203 VanDerWaalsContact NH2-C 3.31Å; R157-A203 VanDerWaalsContact NH2-CB 3.32Å; R157-A203 PolarHBondContact NH2-O 3.17Å; R157-I207 HydrophobicContact CB-CD1 4.42Å; R157-I207 HydrophobicContact CG-CG2 4.3Å
158S88.3Confident80Confident89 Ų8958.2 Ų58.262%0.62232%0.319SS*.Hα-helixtrans-84.2-24.9-170.5550000114.9D154 L155D154-S158 WeakPolarHBondContact O-CB 3.45Å; D154-S158 PolarHBondContact O-N 2.89Å; D154-S158 PolarHBondContact O-OG 3.5Å; L155-S158 WeakPolarHBondContact CA-OG 3.38Å; L155-S158 PolarHBondContact O-N 3.49Å; L155-S158 PolarHBondContact O-OG 3.3Å
159T86.7Confident78.3Confident18 Ų1867.6 Ų67.611%0.1135%0.354CS..SBendtrans-100.38.2-175.163.40000114.6L155 L177L155-T159 HydrophobicContact CD2-CG2 4.32Å; L155-T159 WeakPolarHBondContact O-CB 3.47Å; L155-T159 WeakPolarHBondContact O-CG2 3.44Å; L155-T159 PolarHBondContact O-N 3.32Å; L155-T159 PolarHBondContact O-OG1 3.16Å; T159-L177 HydrophobicContact CG2-CD2 4Å
160F85.6Confident76.9Confident24 Ų2469.8 Ų69.811%0.10537%0.367CS..  trans-59133.4-179.5-171.5-110.2000111.6F162 W178 W211 I226F160-F162 HydrophobicContact CD1-CB 3.84Å; F160-F162 AromaticContact CD1-CD2 3.64Å; F160-F162 HydrophobicContact CD1-CD2 3.64Å; F160-F162 HydrophobicContact CD1-CG 4.11Å; F160-F162 HydrophobicContact CE1-CB 3.82Å; F160-F162 AromaticContact CE1-CD2 3.01Å; F160-F162 HydrophobicContact CE1-CD2 3.01Å; F160-F162 AromaticContact CE1-CE2 3.64Å; F160-F162 HydrophobicContact CE1-CE2 3.64Å; F160-F162 AromaticContact CE1-CG 3.6Å; F160-F162 HydrophobicContact CE1-CG 3.6Å; F160-F162 HydrophobicContact CE2-CD2 4.42Å; F160-F162 AromaticContact CZ-CD2 3.46Å; F160-F162 HydrophobicContact CZ-CD2 3.46Å; F160-F162 VanDerWaalsContact CZ-CD2 3.46Å; F160-F162 AromaticContact CZ-CE2 3.6Å; F160-F162 HydrophobicContact CZ-CE2 3.6Å; F160-F162 HydrophobicContact CZ-CG 4.41Å; F160-F162 PolarHBondContact O-N 3.05Å; F160-W178 HydrophobicContact CD2-CD2 4.27Å; F160-W178 AromaticContact CD2-CE2 3.53Å; F160-W178 HydrophobicContact CD2-CH2 4.24Å; F160-W178 AromaticContact CD2-CZ2 3.52Å; F160-W178 HydrophobicContact CD2-CZ2 3.52Å; F160-W178 AromaticContact CD2-NE1 3.65Å; F160-W178 HydrophobicContact CE2-CH2 4Å; F160-W178 AromaticContact CE2-CZ2 3.66Å; F160-W178 HydrophobicContact CE2-CZ2 3.66Å; F160-W211 HydrophobicContact CB-CH2 4.18Å; F160-W211 HydrophobicContact CB-CZ2 3.57Å; F160-W211 AromaticContact CD1-CD1 3.54Å; F160-W211 AromaticContact CD1-CD2 3.97Å; F160-W211 HydrophobicContact CD1-CD2 3.97Å; F160-W211 AromaticContact CD1-CE2 3.46Å; F160-W211 VanDerWaalsContact CD1-CE2 3.46Å; F160-W211 HydrophobicContact CD1-CG 4Å; F160-W211 HydrophobicContact CD1-CZ2 4.03Å; F160-W211 AromaticContact CD1-NE1 3.18Å; F160-W211 AromaticContact CD2-CD2 3.63Å; F160-W211 HydrophobicContact CD2-CD2 3.63Å; F160-W211 AromaticContact CD2-CE2 3.55Å; F160-W211 AromaticContact CD2-CE3 3.77Å; F160-W211 HydrophobicContact CD2-CE3 3.77Å; F160-W211 HydrophobicContact CD2-CG 4.29Å; F160-W211 AromaticContact CD2-CH2 3.81Å; F160-W211 HydrophobicContact CD2-CH2 3.81Å; F160-W211 AromaticContact CD2-CZ2 3.65Å; F160-W211 HydrophobicContact CD2-CZ2 3.65Å; F160-W211 AromaticContact CD2-CZ3 3.87Å; F160-W211 HydrophobicContact CD2-CZ3 3.87Å; F160-W211 HydrophobicContact CE1-CB 4.03Å; F160-W211 AromaticContact CE1-CD1 3.16Å; F160-W211 AromaticContact CE1-CD2 3.76Å; F160-W211 HydrophobicContact CE1-CD2 3.76Å; F160-W211 AromaticContact CE1-CE2 3.74Å; F160-W211 AromaticContact CE1-CG 3.4Å; F160-W211 HydrophobicContact CE1-CG 3.4Å; F160-W211 AromaticContact CE1-NE1 3.37Å; F160-W211 HydrophobicContact CE2-CB 4.26Å; F160-W211 AromaticContact CE2-CD2 3.48Å; F160-W211 HydrophobicContact CE2-CD2 3.48Å; F160-W211 VanDerWaalsContact CE2-CD2 3.48Å; F160-W211 AromaticContact CE2-CE2 3.88Å; F160-W211 AromaticContact CE2-CE3 3.62Å; F160-W211 HydrophobicContact CE2-CE3 3.62Å; F160-W211 AromaticContact CE2-CG 3.8Å; F160-W211 HydrophobicContact CE2-CG 3.8Å; F160-W211 HydrophobicContact CE2-CH2 4.5Å; F160-W211 HydrophobicContact CE2-CZ2 4.38Å; F160-W211 HydrophobicContact CE2-CZ3 4.14Å; F160-W211 AromaticContact CG-CD2 3.91Å; F160-W211 HydrophobicContact CG-CD2 3.91Å; F160-W211 AromaticContact CG-CE2 3.36Å; F160-W211 HydrophobicContact CG-CE3 4.45Å; F160-W211 HydrophobicContact CG-CG 4.42Å; F160-W211 HydrophobicContact CG-CH2 4.09Å; F160-W211 AromaticContact CG-CZ2 3.47Å; F160-W211 HydrophobicContact CG-CZ2 3.47Å; F160-W211 VanDerWaalsContact CG-CZ2 3.47Å; F160-W211 AromaticContact CG-NE1 3.62Å; F160-W211 HydrophobicContact CZ-CB 3.62Å; F160-W211 AromaticContact CZ-CD1 3.64Å; F160-W211 AromaticContact CZ-CD2 3.55Å; F160-W211 HydrophobicContact CZ-CD2 3.55Å; F160-W211 AromaticContact CZ-CE2 3.98Å; F160-W211 HydrophobicContact CZ-CE3 4.12Å; F160-W211 AromaticContact CZ-CG 3.32Å; F160-W211 HydrophobicContact CZ-CG 3.32Å; F160-W211 AromaticContact CZ-NE1 4Å; F160-I226 HydrophobicContact CE2-CD1 4.11Å; F160-I226 HydrophobicContact CZ-CD1 4.31Å
161P75.1Confident75.6Confident21 Ų2168.4 Ų68.414%0.13636%0.364CS..SBendtrans-75.622.4-165.632.9-40.5000115.9V171 Y175 T222P161-V171 HydrophobicContact CB-CG1 4.33Å; P161-Y175 HydrophobicContact CB-CD2 4.49Å; P161-Y175 HydrophobicContact CG-CD2 4.06Å; P161-T222 HydrophobicContact CG-CG2 3.98Å
162F65.8Low74.6Confident101 Ų10169.7 Ų69.744%0.44338%0.375SS..  trans-108.169.1178.5-75-107.7000110.9F160 I215 T222F160-F162 HydrophobicContact CD1-CB 3.84Å; F160-F162 AromaticContact CD1-CD2 3.64Å; F160-F162 HydrophobicContact CD1-CD2 3.64Å; F160-F162 HydrophobicContact CD1-CG 4.11Å; F160-F162 HydrophobicContact CE1-CB 3.82Å; F160-F162 AromaticContact CE1-CD2 3.01Å; F160-F162 HydrophobicContact CE1-CD2 3.01Å; F160-F162 AromaticContact CE1-CE2 3.64Å; F160-F162 HydrophobicContact CE1-CE2 3.64Å; F160-F162 AromaticContact CE1-CG 3.6Å; F160-F162 HydrophobicContact CE1-CG 3.6Å; F160-F162 HydrophobicContact CE2-CD2 4.42Å; F160-F162 AromaticContact CZ-CD2 3.46Å; F160-F162 HydrophobicContact CZ-CD2 3.46Å; F160-F162 VanDerWaalsContact CZ-CD2 3.46Å; F160-F162 AromaticContact CZ-CE2 3.6Å; F160-F162 HydrophobicContact CZ-CE2 3.6Å; F160-F162 HydrophobicContact CZ-CG 4.41Å; F160-F162 PolarHBondContact O-N 3.05Å; F162-I215 HydrophobicContact CE2-CG1 4.23Å; F162-I215 HydrophobicContact CZ-CG1 3.78Å; F162-T222 HydrophobicContact CE2-CG2 4.31Å
163S55.5Low73.7Confident48 Ų4873 Ų7334%0.33639%0.391SS..  trans-106.5124.5168.2169.40000108.9V165 D166S163-V165 PolarHBondContact O-N 3.29Å; S163-V165 PolarHBondContact OG-N 2.61Å; S163-D166 WeakPolarHBondContact CB-OD2 3.29Å; S163-D166 PolarHBondContact OG-N 3.28Å; S163-D166 PolarHBondContact OG-OD2 3.07Å
164T48.7Very low73Confident150 Ų15074.9 Ų74.992%0.9240%0.401SS*.SBendtrans-75.9-1.3178.246.50000113.6
165V50Low72.6Confident126 Ų12673 Ų7376%0.76439%0.388SS*.SBendtrans-121.4-9.4-168-166.60000112.3S163S163-V165 PolarHBondContact O-N 3.29Å; S163-V165 PolarHBondContact OG-N 2.61Å
166D51.9Low72.3Confident71 Ų7175.6 Ų75.638%0.3840%0.399SS..  trans-89.7140.4-172.7-83.6-55.4000115S163 T170 V171S163-D166 WeakPolarHBondContact CB-OD2 3.29Å; S163-D166 PolarHBondContact OG-N 3.28Å; S163-D166 PolarHBondContact OG-OD2 3.07Å; D166-T170 HydrophobicContact CB-CG2 4.43Å; D166-V171 HydrophobicContact CB-CG2 3.74Å
167N60.5Low72.2Confident127 Ų12775.8 Ų75.868%0.67940%0.4SS*.  trans-63.5145.7172.1-71.4-38.5000111.4R169 T170 V171N167-R169 PolarHBondContact O-N 2.87Å; N167-T170 WeakPolarHBondContact O-CA 3.33Å; N167-T170 VanDerWaalsContact O-CB 3.3Å; N167-T170 WeakPolarHBondContact O-CB 3.27Å; N167-T170 PolarHBondContact O-N 2.81Å; N167-V171 PolarHBondContact O-N 2.85Å
168L62.9Low72.2Confident157 Ų15772 Ų7282%0.82239%0.386SS*.Hα-helixtrans-54.4-33.2-174.9-169.1132.6000114.5S172L168-S172 WeakPolarHBondContact O-CB 3.33Å; L168-S172 PolarHBondContact O-N 3.07Å
169R62.6Low72.4Confident197 Ų19769 Ų6974%0.74336%0.364SS*.Hα-helixtrans-66-42.8172.8-177.4-179.9-75.2-174-3112.2N167 S172 Q173N167-R169 PolarHBondContact O-N 2.87Å; R169-S172 PolarHBondContact O-N 3.08Å; R169-Q173 WeakPolarHBondContact O-CB 3.44Å; R169-Q173 WeakPolarHBondContact O-CG 3.37Å; R169-Q173 PolarHBondContact O-N 2.89Å
170T65.6Low72.8Confident46 Ų4669.1 Ų69.128%0.28237%0.365SS..Hα-helixtrans-65.2-43.8176.5-48.30000110.6D166 N167 S172 Q173 N174D166-T170 HydrophobicContact CB-CG2 4.43Å; N167-T170 WeakPolarHBondContact O-CA 3.33Å; N167-T170 VanDerWaalsContact O-CB 3.3Å; N167-T170 WeakPolarHBondContact O-CB 3.27Å; N167-T170 PolarHBondContact O-N 2.81Å; T170-S172 PolarHBondContact O-N 2.85Å; T170-Q173 PolarHBondContact O-N 3.33Å; T170-N174 WeakPolarHBondContact O-CB 3.35Å; T170-N174 PolarHBondContact O-N 3.04Å
171V67.4Low73.3Confident43 Ų4368 Ų6826%0.26136%0.36SS..Hα-helixtrans-58.7-47.4175.2178.50000111.2P161 D166 N167 Q173 N174 Y175P161-V171 HydrophobicContact CB-CG1 4.33Å; D166-V171 HydrophobicContact CB-CG2 3.74Å; N167-V171 PolarHBondContact O-N 2.85Å; V171-Q173 PolarHBondContact O-N 2.96Å; V171-N174 PolarHBondContact O-N 2.99Å; V171-Y175 VanDerWaalsContact O-CB 3.27Å; V171-Y175 WeakPolarHBondContact O-CB 3.26Å; V171-Y175 PolarHBondContact O-N 3.01Å
172S74.4Confident74.3Confident59 Ų5967 Ų6741%0.41336%0.355SS..Hα-helixtrans-62.3-40.3177.5-173.90000112.9L168 R169 T170 Q176L168-S172 WeakPolarHBondContact O-CB 3.33Å; L168-S172 PolarHBondContact O-N 3.07Å; R169-S172 PolarHBondContact O-N 3.08Å; T170-S172 PolarHBondContact O-N 2.85Å; S172-Q176 WeakPolarHBondContact O-CG 3.31Å; S172-Q176 PolarHBondContact O-N 2.85Å; S172-Q176 VanDerWaalsContact O-N 3.12Å
173Q77.9Confident75.7Confident70 Ų7063.8 Ų63.833%0.32734%0.344SS..Hα-helixtrans-69.7-43.4178.3-81.1-177.7-6.600112.9L119 R169 T170 V171 Q176 L177L119-Q173 HydrophobicContact CD2-CB 3.78Å; L119-Q173 HydrophobicContact CD2-CG 4.21Å; R169-Q173 WeakPolarHBondContact O-CB 3.44Å; R169-Q173 WeakPolarHBondContact O-CG 3.37Å; R169-Q173 PolarHBondContact O-N 2.89Å; T170-Q173 PolarHBondContact O-N 3.33Å; V171-Q173 PolarHBondContact O-N 2.96Å; Q173-Q176 PolarHBondContact O-N 3.42Å; Q173-L177 PolarHBondContact O-N 3.33Å
174N80.8Confident77.7Confident44 Ų4461.5 Ų61.524%0.23533%0.328CS..Hα-helixtrans-64.9-41.4175.2-72.8-8000110.8T170 V171 Q176 L177 W178T170-N174 WeakPolarHBondContact O-CB 3.35Å; T170-N174 PolarHBondContact O-N 3.04Å; V171-N174 PolarHBondContact O-N 2.99Å; N174-Q176 PolarHBondContact O-N 3.39Å; N174-L177 PolarHBondContact O-N 3.42Å; N174-W178 VanDerWaalsContact O-CB 3.27Å; N174-W178 WeakPolarHBondContact O-CB 3.47Å; N174-W178 PolarHBondContact O-N 2.99Å
175Y85.5Confident80.1Confident49 Ų4954.3 Ų54.319%0.19228%0.284CS..Hα-helixtrans-58.2-43.8173.9175.2-116.7000112.9P161 V171 L177 W178 T179 E221 T222P161-Y175 HydrophobicContact CB-CD2 4.49Å; P161-Y175 HydrophobicContact CG-CD2 4.06Å; V171-Y175 VanDerWaalsContact O-CB 3.27Å; V171-Y175 WeakPolarHBondContact O-CB 3.26Å; V171-Y175 PolarHBondContact O-N 3.01Å; Y175-L177 PolarHBondContact O-N 2.92Å; Y175-W178 HydrophobicContact CD2-CE3 4.15Å; Y175-W178 HydrophobicContact CE2-CE3 4.25Å; Y175-W178 HydrophobicContact CE2-CZ3 4.3Å; Y175-W178 PolarHBondContact O-N 3.11Å; Y175-T179 WeakPolarHBondContact CE2-OG1 3.2Å; Y175-T179 WeakPolarHBondContact O-CB 3.46Å; Y175-T179 PolarHBondContact O-N 2.9Å; Y175-T179 PolarHBondContact O-OG1 3.05Å; Y175-E221 WeakPolarHBondContact OH-CB 3.31Å; Y175-E221 PolarHBondContact OH-O 3.25Å; Y175-T222 HydrophobicContact CD2-CG2 4.42Å; Y175-T222 HydrophobicContact CE2-CG2 4.14Å
176Q88.3Confident82.3Confident69 Ų6949 Ų4932%0.32225%0.252SS..Hα-helixtrans-62-41.1176.2-73.8176.511.100112.6R123 S172 Q173 N174 S180R123-Q176 VanDerWaalsContact NH2-OE1 3.14Å; S172-Q176 WeakPolarHBondContact O-CG 3.31Å; S172-Q176 PolarHBondContact O-N 2.85Å; S172-Q176 VanDerWaalsContact O-N 3.12Å; Q173-Q176 PolarHBondContact O-N 3.42Å; N174-Q176 PolarHBondContact O-N 3.39Å; Q176-S180 PolarHBondContact O-N 3Å; Q176-S180 PolarHBondContact O-OG 2.94Å
177L90.9Very high84.4Confident4 Ų445.8 Ų45.82%0.02124%0.236CC..Hα-helixtrans-65.2-50.2173.9175.963.3000110.7L119 K122 R123 V126 T159 Q173 N174 Y175 T179 S180 V181L119-L177 HydrophobicContact CD1-CB 4.2Å; L119-L177 HydrophobicContact CD1-CD2 3.79Å; K122-L177 HydrophobicContact CB-CD1 4.21Å; K122-L177 HydrophobicContact CD-CD2 4.49Å; R123-L177 HydrophobicContact CG-CB 4.28Å; R123-L177 HydrophobicContact CG-CD1 4.02Å; V126-L177 HydrophobicContact CG2-CD1 4.02Å; T159-L177 HydrophobicContact CG2-CD2 4Å; Q173-L177 PolarHBondContact O-N 3.33Å; N174-L177 PolarHBondContact O-N 3.42Å; Y175-L177 PolarHBondContact O-N 2.92Å; L177-T179 PolarHBondContact O-N 3.27Å; L177-S180 CarbonylContact O-C 3.58Å; L177-S180 WeakPolarHBondContact O-CA 3.29Å; L177-S180 VanDerWaalsContact O-CB 3.31Å; L177-S180 WeakPolarHBondContact O-CB 3.45Å; L177-S180 PolarHBondContact O-N 3.47Å; L177-V181 HydrophobicContact CD1-CG2 4.08Å; L177-V181 HydrophobicContact CG-CG2 4.26Å; L177-V181 WeakPolarHBondContact O-CG2 3.47Å; L177-V181 PolarHBondContact O-N 3.02Å
178W92.8Very high86.2Confident0 Ų039.8 Ų39.80%020%0.204CC..Hα-helixtrans-60.2-43.6-176.1178.583.4000112.8F156 F160 N174 Y175 S180 V181 S182 W211 P225 I226F156-W178 AromaticContact CD2-CE2 3.8Å; F156-W178 HydrophobicContact CD2-CZ2 4.16Å; F156-W178 AromaticContact CD2-NE1 3.3Å; F156-W178 VanDerWaalsContact CD2-NE1 3.3Å; F156-W178 AromaticContact CE2-CE2 3.58Å; F156-W178 HydrophobicContact CE2-CH2 4.43Å; F156-W178 AromaticContact CE2-CZ2 3.44Å; F156-W178 HydrophobicContact CE2-CZ2 3.44Å; F156-W178 VanDerWaalsContact CE2-CZ2 3.44Å; F156-W178 AromaticContact CE2-NE1 3.54Å; F156-W178 HydrophobicContact CZ-CZ2 4.07Å; F156-W178 VanDerWaalsContact O-CD1 3.3Å; F156-W178 PolarHBondContact O-NE1 3.37Å; F160-W178 HydrophobicContact CD2-CD2 4.27Å; F160-W178 AromaticContact CD2-CE2 3.53Å; F160-W178 HydrophobicContact CD2-CH2 4.24Å; F160-W178 AromaticContact CD2-CZ2 3.52Å; F160-W178 HydrophobicContact CD2-CZ2 3.52Å; F160-W178 AromaticContact CD2-NE1 3.65Å; F160-W178 HydrophobicContact CE2-CH2 4Å; F160-W178 AromaticContact CE2-CZ2 3.66Å; F160-W178 HydrophobicContact CE2-CZ2 3.66Å; N174-W178 VanDerWaalsContact O-CB 3.27Å; N174-W178 WeakPolarHBondContact O-CB 3.47Å; N174-W178 PolarHBondContact O-N 2.99Å; Y175-W178 HydrophobicContact CD2-CE3 4.15Å; Y175-W178 HydrophobicContact CE2-CE3 4.25Å; Y175-W178 HydrophobicContact CE2-CZ3 4.3Å; Y175-W178 PolarHBondContact O-N 3.11Å; W178-S180 VanDerWaalsContact C-N 3.3Å; W178-S180 PolarHBondContact O-N 2.94Å; W178-V181 PolarHBondContact O-N 3.29Å; W178-S182 WeakPolarHBondContact O-CB 3.44Å; W178-S182 PolarHBondContact O-N 2.73Å; W178-W211 HydrophobicContact CZ2-CZ3 4.17Å; W178-P225 HydrophobicContact CH2-CB 3.79Å; W178-P225 HydrophobicContact CZ3-CB 3.67Å; W178-P225 HydrophobicContact CZ3-CG 3.99Å; W178-I226 HydrophobicContact CH2-CG1 3.86Å; W178-I226 HydrophobicContact CZ2-CG1 4.24Å
179T92.4Very high87.8Confident26 Ų2632.3 Ų32.316%0.1617%0.165CC..Hα-helixtrans-65-33.9174.6-64.20000112Y175 L177 S183 P225Y175-T179 WeakPolarHBondContact CE2-OG1 3.2Å; Y175-T179 WeakPolarHBondContact O-CB 3.46Å; Y175-T179 PolarHBondContact O-N 2.9Å; Y175-T179 PolarHBondContact O-OG1 3.05Å; L177-T179 PolarHBondContact O-N 3.27Å; T179-S183 WeakPolarHBondContact O-CB 3.39Å; T179-S183 PolarHBondContact O-N 3.34Å; T179-S183 PolarHBondContact O-OG 3.35Å; T179-P225 HydrophobicContact CG2-CG 4.03Å
180S93.9Very high89.3Confident19 Ų1923.3 Ų23.313%0.13313%0.132CC..Hα-helixtrans-68.3-41.4173.4-53.80000111.4V126 Q176 L177 W178 S183 A184V126-S180 VanDerWaalsContact CG1-C 3.46Å; V126-S180 WeakPolarHBondContact CG1-O 3.48Å; Q176-S180 PolarHBondContact O-N 3Å; Q176-S180 PolarHBondContact O-OG 2.94Å; L177-S180 CarbonylContact O-C 3.58Å; L177-S180 WeakPolarHBondContact O-CA 3.29Å; L177-S180 VanDerWaalsContact O-CB 3.31Å; L177-S180 WeakPolarHBondContact O-CB 3.45Å; L177-S180 PolarHBondContact O-N 3.47Å; W178-S180 VanDerWaalsContact C-N 3.3Å; W178-S180 PolarHBondContact O-N 2.94Å; S180-S183 WeakPolarHBondContact O-CB 3.41Å; S180-S183 PolarHBondContact O-N 3.27Å; S180-A184 PolarHBondContact O-N 3.33Å
181V96.4Very high90.4Very high0 Ų023.2 Ų23.20%013%0.13CC..Hα-helixtrans-64.5-45.6176.11690000110.8V126 L152 L155 F156 L177 W178 S183 A184 L185V126-V181 HydrophobicContact CG1-CG2 4.03Å; V126-V181 HydrophobicContact CG2-CG2 3.86Å; L152-V181 HydrophobicContact CB-CG1 4.42Å; L152-V181 HydrophobicContact CD2-CB 4.43Å; L152-V181 HydrophobicContact CD2-CG1 4.03Å; L152-V181 HydrophobicContact CD2-CG2 4.28Å; L152-V181 WeakPolarHBondContact O-CG1 3.34Å; L155-V181 HydrophobicContact CB-CG1 4.06Å; L155-V181 HydrophobicContact CB-CG2 4.08Å; L155-V181 HydrophobicContact CD1-CG2 4.31Å; F156-V181 HydrophobicContact CB-CG1 3.82Å; L177-V181 HydrophobicContact CD1-CG2 4.08Å; L177-V181 HydrophobicContact CG-CG2 4.26Å; L177-V181 WeakPolarHBondContact O-CG2 3.47Å; L177-V181 PolarHBondContact O-N 3.02Å; W178-V181 PolarHBondContact O-N 3.29Å; V181-S183 VanDerWaalsContact C-N 3.27Å; V181-S183 PolarHBondContact O-N 2.99Å; V181-A184 PolarHBondContact O-N 2.95Å; V181-L185 HydrophobicContact CG1-CD1 4.4Å; V181-L185 WeakPolarHBondContact O-CG 3.36Å; V181-L185 PolarHBondContact O-N 2.82Å
182S96.3Very high91.7Very high2 Ų223.6 Ų23.61%0.01413%0.133CC..Hα-helixtrans-55.4-43.31731800000111.5W178 L185 C186 P225W178-S182 WeakPolarHBondContact O-CB 3.44Å; W178-S182 PolarHBondContact O-N 2.73Å; S182-L185 PolarHBondContact O-N 2.73Å; S182-C186 PolarHBondContact O-N 3.29Å; S182-C186 PolarHBondContact O-SG 3.34Å; S182-P225 PolarHBondContact OG-O 3.05Å
183S96Very high92.7Very high32 Ų3223.6 Ų23.622%0.22413%0.126CC..Hα-helixtrans-66.4-41.3177.6-560000112.2F130 T179 S180 V181 C186 G187F130-S183 WeakPolarHBondContact CD2-O 3.39Å; T179-S183 WeakPolarHBondContact O-CB 3.39Å; T179-S183 PolarHBondContact O-N 3.34Å; T179-S183 PolarHBondContact O-OG 3.35Å; S180-S183 WeakPolarHBondContact O-CB 3.41Å; S180-S183 PolarHBondContact O-N 3.27Å; V181-S183 VanDerWaalsContact C-N 3.27Å; V181-S183 PolarHBondContact O-N 2.99Å; S183-C186 PolarHBondContact O-N 2.99Å; S183-G187 PolarHBondContact O-N 3.25Å
184A97.3Very high93.6Very high0 Ų020.6 Ų20.60%011%0.113CC..Hα-helixtrans-63.6-39174.700000112.5V126 F130 L152 S180 V181 G187 S188V126-A184 HydrophobicContact CG1-CB 4.01Å; F130-A184 HydrophobicContact CB-CB 3.98Å; L152-A184 HydrophobicContact CD1-CB 3.69Å; L152-A184 HydrophobicContact CD2-CB 3.83Å; L152-A184 HydrophobicContact CG-CB 4.44Å; S180-A184 PolarHBondContact O-N 3.33Å; V181-A184 PolarHBondContact O-N 2.95Å; A184-G187 PolarHBondContact O-N 3.04Å; A184-S188 WeakPolarHBondContact O-CB 3.37Å; A184-S188 PolarHBondContact O-N 2.93Å; A184-S188 PolarHBondContact O-OG 3.48Å
185L97.6Very high94.3Very high0 Ų023.8 Ų23.80%013%0.126CC..Hα-helixtrans-61.7-50.6172.3-73.8174.9000111.3L149 L152 M153 F156 V181 S182 G187 S188 V189 F229L149-L185 HydrophobicContact CD1-CD2 3.63Å; L152-L185 HydrophobicContact CB-CD2 3.48Å; L152-L185 VanDerWaalsContact CB-CD2 3.48Å; L152-L185 HydrophobicContact CB-CG 3.95Å; L152-L185 HydrophobicContact CD1-CD2 4.27Å; M153-L185 HydrophobicContact CG-CD2 3.83Å; M153-L185 HydrophobicContact SD-CD1 3.94Å; M153-L185 HydrophobicContact SD-CD2 3.87Å; F156-L185 HydrophobicContact CB-CD1 3.59Å; F156-L185 HydrophobicContact CD1-CD1 3.96Å; F156-L185 HydrophobicContact CD2-CD1 4.02Å; F156-L185 HydrophobicContact CG-CD1 3.61Å; V181-L185 HydrophobicContact CG1-CD1 4.4Å; V181-L185 WeakPolarHBondContact O-CG 3.36Å; V181-L185 PolarHBondContact O-N 2.82Å; S182-L185 PolarHBondContact O-N 2.73Å; L185-G187 VanDerWaalsContact C-N 3.32Å; L185-G187 PolarHBondContact O-N 2.74Å; L185-S188 WeakPolarHBondContact O-CB 3.45Å; L185-S188 PolarHBondContact O-N 3.42Å; L185-V189 PolarHBondContact O-N 3.43Å; L185-V189 VanDerWaalsContact O-N 3.16Å; L185-F229 HydrophobicContact CB-CD2 4.05Å; L185-F229 HydrophobicContact CB-CE2 4.06Å; L185-F229 HydrophobicContact CD1-CD2 4.19Å; L185-F229 HydrophobicContact CD1-CE2 3.85Å; L185-F229 HydrophobicContact CG-CE2 4.5Å
186C97.3Very high94.7Very high13 Ų1325 Ų259%0.08813%0.134CC..Hα-helixtrans-52.9-47.6176.5-69.10000112.3S182 S183 S188 V189 N190 M232S182-C186 PolarHBondContact O-N 3.29Å; S182-C186 PolarHBondContact O-SG 3.34Å; S183-C186 PolarHBondContact O-N 2.99Å; C186-S188 VanDerWaalsContact C-N 3.3Å; C186-S188 PolarHBondContact O-N 3.1Å; C186-V189 PolarHBondContact O-N 2.94Å; C186-N190 PolarHBondContact O-N 3.01Å; C186-N190 VanDerWaalsContact O-N 3.11Å; C186-M232 HydrophobicContact CB-CB 4.12Å; C186-M232 HydrophobicContact CB-CE 4.22Å; C186-M232 HydrophobicContact CB-CG 4Å
187G96.6Very high95Very high4 Ų421.8 Ų21.84%0.04112%0.118CC..Hα-helixtrans-69.2-22.9177.300000114.5Q140 S183 A184 L185Q140-G187 WeakPolarHBondContact CG-O 3.37Å; Q140-G187 PolarHBondContact NE2-O 3.29Å; S183-G187 PolarHBondContact O-N 3.25Å; A184-G187 PolarHBondContact O-N 3.04Å; L185-G187 VanDerWaalsContact C-N 3.32Å; L185-G187 PolarHBondContact O-N 2.74Å
188S96.9Very high95.4Very high1 Ų121.6 Ų21.61%0.00712%0.117CC..Hα-helixtrans-77.5-28177.1-61.60000113.1Q140 A184 L185 C186 N194Q140-S188 WeakPolarHBondContact CG-O 3.49Å; A184-S188 WeakPolarHBondContact O-CB 3.37Å; A184-S188 PolarHBondContact O-N 2.93Å; A184-S188 PolarHBondContact O-OG 3.48Å; L185-S188 WeakPolarHBondContact O-CB 3.45Å; L185-S188 PolarHBondContact O-N 3.42Å; C186-S188 VanDerWaalsContact C-N 3.3Å; C186-S188 PolarHBondContact O-N 3.1Å; S188-N194 PolarHBondContact O-ND2 2.89Å
189V96.5Very high95.5Very high0 Ų026 Ų260%013%0.134CC..Hα-helixtrans-105.3-22.9-173.9-55.20000114.5L149 L185 C186 N194 G197 Q198 C201 M232L149-V189 HydrophobicContact CD1-CG1 4.48Å; L185-V189 PolarHBondContact O-N 3.43Å; L185-V189 VanDerWaalsContact O-N 3.16Å; C186-V189 PolarHBondContact O-N 2.94Å; V189-N194 WeakPolarHBondContact O-CA 3.49Å; V189-N194 WeakPolarHBondContact O-CB 3.44Å; V189-N194 PolarHBondContact O-N 3.13Å; V189-G197 VanDerWaalsContact CG1-C 3.44Å; V189-G197 WeakPolarHBondContact CG1-O 3.42Å; V189-Q198 HydrophobicContact CB-CG 3.87Å; V189-Q198 HydrophobicContact CG2-CG 4.38Å; V189-C201 HydrophobicContact CG1-CB 4.44Å; V189-C201 VanDerWaalsContact CG1-SG 3.54Å; V189-M232 HydrophobicContact CG2-CB 4.41Å
190N94.1Very high95.7Very high9 Ų926.9 Ų26.95%0.04814%0.137CC..THydrogen-bonded Turntrans-148.4165.3-175.9-157.1-8.6000113.3Q140 C186 P192 M232 S235Q140-N190 PolarHBondContact NE2-O 2.72Å; C186-N190 PolarHBondContact O-N 3.01Å; C186-N190 VanDerWaalsContact O-N 3.11Å; N190-P192 CarbonylContact C-O 3.59Å; N190-P192 VanDerWaalsContact CA-O 3.25Å; N190-P192 WeakPolarHBondContact CA-O 3.35Å; N190-M232 HydrophobicContact CB-CB 4.24Å; N190-M232 HydrophobicContact CB-CE 3.78Å; N190-M232 WeakPolarHBondContact CB-O 3.49Å; N190-M232 HydrophobicContact CB-SD 4.13Å; N190-M232 PolarHBondContact ND2-O 3.44Å; N190-M232 VanDerWaalsContact ND2-O 3.12Å; N190-S235 VanDerWaalsContact ND2-CB 3.29Å; N190-S235 WeakPolarHBondContact ND2-CB 3.27Å; N190-S235 PolarHBondContact ND2-OG 3.38Å; N190-S235 VanDerWaalsContact ND2-OG 3.16Å
191N90.1Very high95.8Very high44 Ų4426 Ų2624%0.23513%0.131CC..THydrogen-bonded Turntrans49.471.8-171.1-70-42.4000113.8H135 M232H135-N191 WeakPolarHBondContact CA-O 3.5Å; H135-N191 PolarHBondContact N-O 3.33Å; H135-N191 PolarHBondContact ND1-O 3.4Å; N191-M232 HydrophobicContact CB-CE 4.36Å
192P94.7Very high95.9Very high51 Ų5127.4 Ų27.433%0.33114%0.14SC..THydrogen-bonded Turncis-79.7162.33.431.5-34.2000113.4K137 Q140 N190K137-P192 HydrophobicContact CB-CG 3.84Å; K137-P192 HydrophobicContact CD-CG 4.17Å; Q140-P192 PolarHBondContact NE2-O 3.35Å; Q140-P192 PolarHBondContact OE1-O 2.7Å; N190-P192 CarbonylContact C-O 3.59Å; N190-P192 VanDerWaalsContact CA-O 3.25Å; N190-P192 WeakPolarHBondContact CA-O 3.35Å
193Q94.9Very high95.9Very high58 Ų5830.2 Ų30.227%0.27116%0.163SC..THydrogen-bonded Turntrans-62.3137.4-178.3-168.9175.4-1.100112.2K137 E195 S235 N236K137-Q193 PolarHBondContact NZ-O 3.02Å; Q193-E195 HydrophobicContact CG-CG 4.48Å; Q193-S235 PolarHBondContact NE2-O 3.17Å; Q193-N236 PolarHBondContact NE2-O 2.9Å
194N95.4Very high95.9Very high8 Ų828.7 Ų28.74%0.04315%0.152CC..  trans-135.581.7177.6-173.925.5000110.8K137 S188 V189 E196 G197 Q198K137-N194 PolarHBondContact NZ-OD1 3.4Å; S188-N194 PolarHBondContact O-ND2 2.89Å; V189-N194 WeakPolarHBondContact O-CA 3.49Å; V189-N194 WeakPolarHBondContact O-CB 3.44Å; V189-N194 PolarHBondContact O-N 3.13Å; N194-E196 VanDerWaalsContact C-N 3.27Å; N194-E196 PolarHBondContact O-N 3.44Å; N194-G197 CarbonylContact O-C 3.56Å; N194-G197 WeakPolarHBondContact O-CA 3.29Å; N194-G197 PolarHBondContact O-N 3.36Å; N194-Q198 WeakPolarHBondContact O-CG 3.34Å; N194-Q198 PolarHBondContact O-N 3.09Å
195E95.6Very high95.9Very high111 Ų11128.8 Ų28.852%0.51915%0.153SC..Hα-helixtrans-52.7-37.6-175.7-65.5171.9-159.300114.5Q193 Q198 R199Q193-E195 HydrophobicContact CG-CG 4.48Å; E195-Q198 PolarHBondContact O-N 2.97Å; E195-R199 WeakPolarHBondContact O-CB 3.44Å; E195-R199 WeakPolarHBondContact O-CG 3.49Å; E195-R199 PolarHBondContact O-N 3.41Å
196E94.3Very high95.9Very high75 Ų7532.5 Ų32.535%0.3518%0.177SC..Hα-helixtrans-68.8-41.3177.6-167.464.9-115.500111N194 R199 I200N194-E196 VanDerWaalsContact C-N 3.27Å; N194-E196 PolarHBondContact O-N 3.44Å; E196-R199 PolarHBondContact O-N 3.28Å; E196-R199 IonicContact OE1-CZ 2.74Å; E196-R199 IonicContact OE1-NH1 3.22Å; E196-R199 PolarHBondContact OE1-NH1 2.95Å; E196-R199 IonicContact OE1-NH2 2.63Å; E196-R199 IonicContact OE2-CZ 2.75Å; E196-R199 IonicContact OE2-NH1 3.71Å; E196-R199 PolarHBondContact OE2-NH1 3.32Å; E196-R199 IonicContact OE2-NH2 3.73Å; E196-R199 PolarHBondContact OE2-NH2 3.04Å; E196-I200 WeakPolarHBondContact O-CG1 3.45Å; E196-I200 PolarHBondContact O-N 3.11Å
197G95.9Very high95.7Very high0 Ų034.4 Ų34.40%019%0.186CC..Hα-helixtrans-63.1-41.4171.600000112.6V189 N194 R199 I200 C201V189-G197 VanDerWaalsContact CG1-C 3.44Å; V189-G197 WeakPolarHBondContact CG1-O 3.42Å; N194-G197 CarbonylContact O-C 3.56Å; N194-G197 WeakPolarHBondContact O-CA 3.29Å; N194-G197 PolarHBondContact O-N 3.36Å; G197-R199 VanDerWaalsContact C-N 3.32Å; G197-R199 PolarHBondContact O-N 3.41Å; G197-I200 PolarHBondContact O-N 3.48Å; G197-C201 PolarHBondContact O-N 3.44Å
198Q97.6Very high95.6Very high0 Ų034.2 Ų34.20%018%0.184CC..Hα-helixtrans-59.6-42.4173.4-68178.2-46.700111.3V189 N194 E195 C201 V202 M232 T233 S235 N237 V240V189-Q198 HydrophobicContact CB-CG 3.87Å; V189-Q198 HydrophobicContact CG2-CG 4.38Å; N194-Q198 WeakPolarHBondContact O-CG 3.34Å; N194-Q198 PolarHBondContact O-N 3.09Å; E195-Q198 PolarHBondContact O-N 2.97Å; Q198-C201 PolarHBondContact O-N 3.09Å; Q198-V202 PolarHBondContact O-N 3.12Å; Q198-M232 PolarHBondContact NE2-O 2.98Å; Q198-T233 WeakPolarHBondContact CB-O 2.96Å; Q198-T233 VanDerWaalsContact CD-O 3.27Å; Q198-T233 WeakPolarHBondContact CG-O 3.34Å; Q198-T233 PolarHBondContact NE2-O 3.38Å; Q198-T233 VanDerWaalsContact NE2-O 3.15Å; Q198-S235 PolarHBondContact NE2-O 2.69Å; Q198-N237 PolarHBondContact OE1-ND2 2.64Å; Q198-V240 HydrophobicContact CB-CG2 4.15Å
199R96.3Very high95.4Very high93 Ų9336.6 Ų36.635%0.35119%0.194SC..Hα-helixtrans-64.8-39.3176.1-77.1-171.6-83.5109.60.1112.9E195 E196 G197 C201 V202 Y239 V240E195-R199 WeakPolarHBondContact O-CB 3.44Å; E195-R199 WeakPolarHBondContact O-CG 3.49Å; E195-R199 PolarHBondContact O-N 3.41Å; E196-R199 PolarHBondContact O-N 3.28Å; E196-R199 IonicContact OE1-CZ 2.74Å; E196-R199 IonicContact OE1-NH1 3.22Å; E196-R199 PolarHBondContact OE1-NH1 2.95Å; E196-R199 IonicContact OE1-NH2 2.63Å; E196-R199 IonicContact OE2-CZ 2.75Å; E196-R199 IonicContact OE2-NH1 3.71Å; E196-R199 PolarHBondContact OE2-NH1 3.32Å; E196-R199 IonicContact OE2-NH2 3.73Å; E196-R199 PolarHBondContact OE2-NH2 3.04Å; G197-R199 VanDerWaalsContact C-N 3.32Å; G197-R199 PolarHBondContact O-N 3.41Å; R199-C201 VanDerWaalsContact C-N 3.31Å; R199-C201 PolarHBondContact O-N 2.97Å; R199-V202 WeakPolarHBondContact O-CB 3.31Å; R199-V202 WeakPolarHBondContact O-CG2 3.33Å; R199-V202 PolarHBondContact O-N 3.39Å; R199-Y239 HydrophobicContact CG-CD1 3.72Å; R199-Y239 HydrophobicContact CG-CE1 3.77Å; R199-V240 HydrophobicContact CG-CG2 3.98Å
200I95.6Very high95.2Very high44 Ų4439.3 Ų39.323%0.22621%0.211CC..Hα-helixtrans-62.1-40172.5-68.6162.7000110.9Q144 L149 E196 G197 V202 A203Q144-I200 HydrophobicContact CG-CD1 3.98Å; L149-I200 HydrophobicContact CD2-CB 4.07Å; L149-I200 HydrophobicContact CD2-CD1 3.83Å; L149-I200 HydrophobicContact CD2-CG2 4Å; L149-I200 HydrophobicContact CG-CG2 4.13Å; E196-I200 WeakPolarHBondContact O-CG1 3.45Å; E196-I200 PolarHBondContact O-N 3.11Å; G197-I200 PolarHBondContact O-N 3.48Å; I200-V202 VanDerWaalsContact C-N 3.26Å; I200-V202 PolarHBondContact O-N 3.18Å; I200-A203 PolarHBondContact O-N 2.82Å
201C97.1Very high95Very high0 Ų039.4 Ų39.40%021%0.21CC..Hα-helixtrans-68.3-15.8180-76.90000115.2M153 V189 G197 Q198 R199 A203 A204 F229 T233M153-C201 HydrophobicContact CE-CB 4.44Å; M153-C201 HydrophobicContact SD-CB 4.25Å; V189-C201 HydrophobicContact CG1-CB 4.44Å; V189-C201 VanDerWaalsContact CG1-SG 3.54Å; G197-C201 PolarHBondContact O-N 3.44Å; Q198-C201 PolarHBondContact O-N 3.09Å; R199-C201 VanDerWaalsContact C-N 3.31Å; R199-C201 PolarHBondContact O-N 2.97Å; C201-A203 PolarHBondContact O-N 3.27Å; C201-A203 VanDerWaalsContact O-N 3.11Å; C201-A204 PolarHBondContact O-N 2.74Å; C201-F229 HydrophobicContact CB-CE2 4.19Å; C201-F229 HydrophobicContact CB-CZ 3.91Å; C201-T233 HydrophobicContact CB-CG2 3.5Å; C201-T233 VanDerWaalsContact CB-CG2 3.5Å
202V97.4Very high95Very high31 Ų3137.5 Ų37.519%0.18820%0.2CC..G310 helixtrans-52.9-33.2172.9173.80000111.7Q198 R199 I200 A204 F205 V240Q198-V202 PolarHBondContact O-N 3.12Å; R199-V202 WeakPolarHBondContact O-CB 3.31Å; R199-V202 WeakPolarHBondContact O-CG2 3.33Å; R199-V202 PolarHBondContact O-N 3.39Å; I200-V202 VanDerWaalsContact C-N 3.26Å; I200-V202 PolarHBondContact O-N 3.18Å; V202-A204 PolarHBondContact O-N 3.46Å; V202-F205 HydrophobicContact CB-CD2 4.27Å; V202-F205 HydrophobicContact CB-CE2 4.22Å; V202-F205 HydrophobicContact CG1-CD2 3.94Å; V202-F205 HydrophobicContact CG1-CE2 4.24Å; V202-F205 HydrophobicContact CG2-CD2 4.43Å; V202-F205 HydrophobicContact CG2-CE2 3.91Å; V202-F205 WeakPolarHBondContact O-CB 3.35Å; V202-F205 WeakPolarHBondContact O-CG 3.42Å; V202-F205 PolarHBondContact O-N 2.83Å; V202-V240 HydrophobicContact CG2-CB 4.4Å; V202-V240 HydrophobicContact CG2-CG1 3.97Å; V202-V240 HydrophobicContact CG2-CG2 3.96Å
203A96.4Very high94.6Very high61 Ų6139.8 Ų39.850%0.50421%0.206SC..G310 helixtrans-66.9-0.5178.400000114.8R157 I200 C201R157-A203 VanDerWaalsContact NH2-C 3.31Å; R157-A203 VanDerWaalsContact NH2-CB 3.32Å; R157-A203 PolarHBondContact NH2-O 3.17Å; I200-A203 PolarHBondContact O-N 2.82Å; C201-A203 PolarHBondContact O-N 3.27Å; C201-A203 VanDerWaalsContact O-N 3.11Å
204A96.9Very high93.9Very high0 Ų042.8 Ų42.80%022%0.22CC..G310 helixtrans-99.7-11.9167.600000113.7M153 F156 C201 V202 I207 V208 F229M153-A204 HydrophobicContact CE-CB 3.48Å; M153-A204 VanDerWaalsContact CE-CB 3.48Å; M153-A204 HydrophobicContact SD-CB 4.34Å; F156-A204 HydrophobicContact CD1-CB 4.3Å; F156-A204 HydrophobicContact CE1-CB 4.21Å; C201-A204 PolarHBondContact O-N 2.74Å; V202-A204 PolarHBondContact O-N 3.46Å; A204-I207 HydrophobicContact CB-CG2 4.5Å; A204-I207 WeakPolarHBondContact O-CG2 3.3Å; A204-I207 PolarHBondContact O-N 3.38Å; A204-V208 HydrophobicContact CB-CG2 4.36Å; A204-V208 WeakPolarHBondContact O-CB 3.49Å; A204-V208 WeakPolarHBondContact O-CG2 3.23Å; A204-V208 PolarHBondContact O-N 3.02Å; A204-F229 HydrophobicContact CB-CE1 3.85Å; A204-F229 HydrophobicContact CB-CZ 3.8Å
205F97.4Very high92.7Very high1 Ų143.1 Ų43.10%0.00422%0.222CC..Hα-helixtrans-59.6-39.4-175.3-64.8-20.1000115.1V202 I207 V208 K209 T233 V234 V240 F244V202-F205 HydrophobicContact CB-CD2 4.27Å; V202-F205 HydrophobicContact CB-CE2 4.22Å; V202-F205 HydrophobicContact CG1-CD2 3.94Å; V202-F205 HydrophobicContact CG1-CE2 4.24Å; V202-F205 HydrophobicContact CG2-CD2 4.43Å; V202-F205 HydrophobicContact CG2-CE2 3.91Å; V202-F205 WeakPolarHBondContact O-CB 3.35Å; V202-F205 WeakPolarHBondContact O-CG 3.42Å; V202-F205 PolarHBondContact O-N 2.83Å; F205-I207 PolarHBondContact O-N 3.29Å; F205-V208 PolarHBondContact O-N 3.26Å; F205-K209 WeakPolarHBondContact O-CB 3.41Å; F205-K209 PolarHBondContact O-N 3.37Å; F205-T233 HydrophobicContact CE1-CG2 3.79Å; F205-T233 HydrophobicContact CZ-CG2 3.68Å; F205-V234 HydrophobicContact CZ-CG1 3.97Å; F205-V240 HydrophobicContact CE2-CG1 3.83Å; F205-V240 WeakPolarHBondContact CE2-O 3.46Å; F205-V240 HydrophobicContact CZ-CG1 3.59Å; F205-F244 HydrophobicContact CB-CD2 4.11Å; F205-F244 AromaticContact CD1-CD2 3.79Å; F205-F244 HydrophobicContact CD1-CD2 3.79Å; F205-F244 HydrophobicContact CD1-CE2 4.4Å; F205-F244 HydrophobicContact CD2-CB 3.85Å; F205-F244 AromaticContact CD2-CD2 3.98Å; F205-F244 HydrophobicContact CD2-CD2 3.98Å; F205-F244 HydrophobicContact CD2-CG 4.43Å; F205-F244 HydrophobicContact CE1-CD2 4.09Å; F205-F244 HydrophobicContact CE2-CB 3.63Å; F205-F244 HydrophobicContact CE2-CD2 4.27Å; F205-F244 HydrophobicContact CE2-CG 4.41Å; F205-F244 HydrophobicContact CG-CB 4.46Å; F205-F244 AromaticContact CG-CD2 3.72Å; F205-F244 HydrophobicContact CG-CD2 3.72Å; F205-F244 HydrophobicContact CZ-CB 4.07Å; F205-F244 HydrophobicContact CZ-CD2 4.31Å
206P95.9Very high91.4Very high78 Ų7841.6 Ų41.651%0.50622%0.224SC..Hα-helixtrans-61.2-41.5177.3-25.335.9000113.3T210P206-T210 PolarHBondContact O-N 3.36Å; P206-T210 PolarHBondContact O-OG1 3.18Å; P206-T210 VanDerWaalsContact O-OG1 3.12Å
207I93.5Very high89.4Confident53 Ų5341.5 Ų41.527%0.27223%0.228SC..Hα-helixtrans-77.6-36.3180-166.6174000111.6R157 A204 F205 K209 T210 W211R157-I207 HydrophobicContact CB-CD1 4.42Å; R157-I207 HydrophobicContact CG-CG2 4.3Å; A204-I207 HydrophobicContact CB-CG2 4.5Å; A204-I207 WeakPolarHBondContact O-CG2 3.3Å; A204-I207 PolarHBondContact O-N 3.38Å; F205-I207 PolarHBondContact O-N 3.29Å; I207-K209 VanDerWaalsContact C-N 3.33Å; I207-K209 PolarHBondContact O-N 3.49Å; I207-T210 WeakPolarHBondContact O-CB 3.49Å; I207-T210 PolarHBondContact O-N 3.44Å; I207-T210 VanDerWaalsContact O-N 3.11Å; I207-W211 HydrophobicContact CD1-CH2 4.45Å; I207-W211 HydrophobicContact CD1-CZ2 3.56Å; I207-W211 HydrophobicContact CG1-CD2 4.37Å; I207-W211 HydrophobicContact CG1-CH2 4.46Å; I207-W211 HydrophobicContact CG1-CZ2 3.65Å; I207-W211 HydrophobicContact CG2-CH2 4.28Å; I207-W211 HydrophobicContact CG2-CZ2 4.28Å; I207-W211 VanDerWaalsContact O-CG 3.28Å; I207-W211 PolarHBondContact O-N 3.47Å
208V94.5Very high87.4Confident0 Ų046.1 Ų46.10%026%0.258CS..Hα-helixtrans-60-42.3171.8163.60000111.5F156 A204 F205 T210 W211 L212 I226 F229 I230F156-V208 HydrophobicContact CE1-CG2 3.96Å; F156-V208 HydrophobicContact CZ-CG2 4.35Å; A204-V208 HydrophobicContact CB-CG2 4.36Å; A204-V208 WeakPolarHBondContact O-CB 3.49Å; A204-V208 WeakPolarHBondContact O-CG2 3.23Å; A204-V208 PolarHBondContact O-N 3.02Å; F205-V208 PolarHBondContact O-N 3.26Å; V208-T210 PolarHBondContact O-N 2.94Å; V208-W211 HydrophobicContact CB-CE3 4.45Å; V208-W211 HydrophobicContact CG2-CE3 3.91Å; V208-W211 HydrophobicContact CG2-CZ3 3.83Å; V208-W211 PolarHBondContact O-N 3.36Å; V208-L212 HydrophobicContact CG1-CD1 4.35Å; V208-L212 WeakPolarHBondContact O-CG 3.49Å; V208-L212 PolarHBondContact O-N 2.92Å; V208-I226 HydrophobicContact CG1-CG2 3.8Å; V208-F229 HydrophobicContact CG2-CD1 4.08Å; V208-F229 HydrophobicContact CG2-CE1 4.06Å; V208-I230 HydrophobicContact CG1-CD1 3.72Å; V208-I230 HydrophobicContact CG1-CG1 3.8Å
209K94.1Very high85.8Confident52 Ų5247.6 Ų47.623%0.22627%0.268CS..Hα-helixtrans-57.2-47.6171.4169.8177.8171.7172.40111.3F205 I207 W211 L212 Q213 C247 T252F205-K209 WeakPolarHBondContact O-CB 3.41Å; F205-K209 PolarHBondContact O-N 3.37Å; I207-K209 VanDerWaalsContact C-N 3.33Å; I207-K209 PolarHBondContact O-N 3.49Å; K209-W211 VanDerWaalsContact C-N 3.3Å; K209-W211 PolarHBondContact O-N 2.73Å; K209-L212 PolarHBondContact O-N 3.33Å; K209-Q213 WeakPolarHBondContact O-CG 3.27Å; K209-Q213 PolarHBondContact O-N 3.2Å; K209-C247 WeakPolarHBondContact CD-O 3.21Å; K209-C247 PolarHBondContact NZ-O 3.07Å; K209-T252 HydrophobicContact CG-CG2 4.31Å
210T91.4Very high84.4Confident57 Ų5745.2 Ų45.235%0.3526%0.264SS..Hα-helixtrans-58.2-42.9177.5-57.80000111.7P206 I207 V208 Q213 Q214P206-T210 PolarHBondContact O-N 3.36Å; P206-T210 PolarHBondContact O-OG1 3.18Å; P206-T210 VanDerWaalsContact O-OG1 3.12Å; I207-T210 WeakPolarHBondContact O-CB 3.49Å; I207-T210 PolarHBondContact O-N 3.44Å; I207-T210 VanDerWaalsContact O-N 3.11Å; V208-T210 PolarHBondContact O-N 2.94Å; T210-Q213 PolarHBondContact O-N 2.62Å; T210-Q214 HydrophobicContact CG2-CG 4.4Å; T210-Q214 WeakPolarHBondContact O-CB 3.35Å; T210-Q214 VanDerWaalsContact O-CG 3.29Å; T210-Q214 WeakPolarHBondContact O-CG 3.37Å; T210-Q214 PolarHBondContact O-N 3.15Å
211W90.2Very high83.5Confident11 Ų1149.4 Ų49.44%0.04228%0.283CS..Hα-helixtrans-63.6-45.3175.9-58.7-24.5000112.8F156 F160 W178 I207 V208 K209 Q213 Q214 I215 I226F156-W211 HydrophobicContact CD1-CH2 4.16Å; F156-W211 HydrophobicContact CD1-CZ3 4.23Å; F156-W211 HydrophobicContact CE1-CH2 4.03Å; F156-W211 AromaticContact CE1-CZ3 3.63Å; F156-W211 HydrophobicContact CE1-CZ3 3.63Å; F156-W211 HydrophobicContact CE2-CZ3 4.28Å; F156-W211 HydrophobicContact CZ-CH2 4.33Å; F156-W211 AromaticContact CZ-CZ3 3.67Å; F156-W211 HydrophobicContact CZ-CZ3 3.67Å; F156-W211 WeakPolarHBondContact O-CH2 3.41Å; F160-W211 HydrophobicContact CB-CH2 4.18Å; F160-W211 HydrophobicContact CB-CZ2 3.57Å; F160-W211 AromaticContact CD1-CD1 3.54Å; F160-W211 AromaticContact CD1-CD2 3.97Å; F160-W211 HydrophobicContact CD1-CD2 3.97Å; F160-W211 AromaticContact CD1-CE2 3.46Å; F160-W211 VanDerWaalsContact CD1-CE2 3.46Å; F160-W211 HydrophobicContact CD1-CG 4Å; F160-W211 HydrophobicContact CD1-CZ2 4.03Å; F160-W211 AromaticContact CD1-NE1 3.18Å; F160-W211 AromaticContact CD2-CD2 3.63Å; F160-W211 HydrophobicContact CD2-CD2 3.63Å; F160-W211 AromaticContact CD2-CE2 3.55Å; F160-W211 AromaticContact CD2-CE3 3.77Å; F160-W211 HydrophobicContact CD2-CE3 3.77Å; F160-W211 HydrophobicContact CD2-CG 4.29Å; F160-W211 AromaticContact CD2-CH2 3.81Å; F160-W211 HydrophobicContact CD2-CH2 3.81Å; F160-W211 AromaticContact CD2-CZ2 3.65Å; F160-W211 HydrophobicContact CD2-CZ2 3.65Å; F160-W211 AromaticContact CD2-CZ3 3.87Å; F160-W211 HydrophobicContact CD2-CZ3 3.87Å; F160-W211 HydrophobicContact CE1-CB 4.03Å; F160-W211 AromaticContact CE1-CD1 3.16Å; F160-W211 AromaticContact CE1-CD2 3.76Å; F160-W211 HydrophobicContact CE1-CD2 3.76Å; F160-W211 AromaticContact CE1-CE2 3.74Å; F160-W211 AromaticContact CE1-CG 3.4Å; F160-W211 HydrophobicContact CE1-CG 3.4Å; F160-W211 AromaticContact CE1-NE1 3.37Å; F160-W211 HydrophobicContact CE2-CB 4.26Å; F160-W211 AromaticContact CE2-CD2 3.48Å; F160-W211 HydrophobicContact CE2-CD2 3.48Å; F160-W211 VanDerWaalsContact CE2-CD2 3.48Å; F160-W211 AromaticContact CE2-CE2 3.88Å; F160-W211 AromaticContact CE2-CE3 3.62Å; F160-W211 HydrophobicContact CE2-CE3 3.62Å; F160-W211 AromaticContact CE2-CG 3.8Å; F160-W211 HydrophobicContact CE2-CG 3.8Å; F160-W211 HydrophobicContact CE2-CH2 4.5Å; F160-W211 HydrophobicContact CE2-CZ2 4.38Å; F160-W211 HydrophobicContact CE2-CZ3 4.14Å; F160-W211 AromaticContact CG-CD2 3.91Å; F160-W211 HydrophobicContact CG-CD2 3.91Å; F160-W211 AromaticContact CG-CE2 3.36Å; F160-W211 HydrophobicContact CG-CE3 4.45Å; F160-W211 HydrophobicContact CG-CG 4.42Å; F160-W211 HydrophobicContact CG-CH2 4.09Å; F160-W211 AromaticContact CG-CZ2 3.47Å; F160-W211 HydrophobicContact CG-CZ2 3.47Å; F160-W211 VanDerWaalsContact CG-CZ2 3.47Å; F160-W211 AromaticContact CG-NE1 3.62Å; F160-W211 HydrophobicContact CZ-CB 3.62Å; F160-W211 AromaticContact CZ-CD1 3.64Å; F160-W211 AromaticContact CZ-CD2 3.55Å; F160-W211 HydrophobicContact CZ-CD2 3.55Å; F160-W211 AromaticContact CZ-CE2 3.98Å; F160-W211 HydrophobicContact CZ-CE3 4.12Å; F160-W211 AromaticContact CZ-CG 3.32Å; F160-W211 HydrophobicContact CZ-CG 3.32Å; F160-W211 AromaticContact CZ-NE1 4Å; W178-W211 HydrophobicContact CZ2-CZ3 4.17Å; I207-W211 HydrophobicContact CD1-CH2 4.45Å; I207-W211 HydrophobicContact CD1-CZ2 3.56Å; I207-W211 HydrophobicContact CG1-CD2 4.37Å; I207-W211 HydrophobicContact CG1-CH2 4.46Å; I207-W211 HydrophobicContact CG1-CZ2 3.65Å; I207-W211 HydrophobicContact CG2-CH2 4.28Å; I207-W211 HydrophobicContact CG2-CZ2 4.28Å; I207-W211 VanDerWaalsContact O-CG 3.28Å; I207-W211 PolarHBondContact O-N 3.47Å; V208-W211 HydrophobicContact CB-CE3 4.45Å; V208-W211 HydrophobicContact CG2-CE3 3.91Å; V208-W211 HydrophobicContact CG2-CZ3 3.83Å; V208-W211 PolarHBondContact O-N 3.36Å; K209-W211 VanDerWaalsContact C-N 3.3Å; K209-W211 PolarHBondContact O-N 2.73Å; W211-Q213 PolarHBondContact O-N 3.3Å; W211-Q214 PolarHBondContact O-N 3.34Å; W211-Q214 VanDerWaalsContact O-N 3.12Å; W211-I215 HydrophobicContact CB-CD1 4.45Å; W211-I215 WeakPolarHBondContact O-CB 3.47Å; W211-I215 WeakPolarHBondContact O-CD1 3.4Å; W211-I215 VanDerWaalsContact O-CG1 3.24Å; W211-I215 WeakPolarHBondContact O-CG1 3.45Å; W211-I215 PolarHBondContact O-N 3.43Å; W211-I226 HydrophobicContact CB-CD1 4.02Å; W211-I226 HydrophobicContact CE3-CD1 4.36Å; W211-I226 HydrophobicContact CE3-CG1 4.46Å
212L88.9Confident82.7Confident3 Ų350.1 Ų50.12%0.01629%0.287CS..Hα-helixtrans-59.2-29.9175-70.6173.1000112.9V208 K209 F223 I226 I230 F244 T252 L253V208-L212 HydrophobicContact CG1-CD1 4.35Å; V208-L212 WeakPolarHBondContact O-CG 3.49Å; V208-L212 PolarHBondContact O-N 2.92Å; K209-L212 PolarHBondContact O-N 3.33Å; L212-F223 HydrophobicContact CD2-CE1 3.92Å; L212-F223 HydrophobicContact CD2-CE2 3.89Å; L212-F223 HydrophobicContact CD2-CZ 3.46Å; L212-F223 VanDerWaalsContact CD2-CZ 3.46Å; L212-I226 HydrophobicContact CD2-CG2 3.82Å; L212-I226 HydrophobicContact CG-CG2 4.13Å; L212-I230 HydrophobicContact CD1-CD1 3.92Å; L212-F244 HydrophobicContact CD1-CZ 4.5Å; L212-T252 HydrophobicContact CB-CG2 3.61Å; L212-T252 HydrophobicContact CD1-CG2 4.36Å; L212-L253 HydrophobicContact CD1-CB 4.4Å; L212-L253 HydrophobicContact CD1-CD1 4.34Å; L212-L253 HydrophobicContact CD2-CD1 4.32Å
213Q87.1Confident82.2Confident100 Ų10049 Ų4947%0.46728%0.28SS..Hα-helixtrans-77.9-35.1175.3-68.8179.1-18.700113.1K209 T210 W211 T252K209-Q213 WeakPolarHBondContact O-CG 3.27Å; K209-Q213 PolarHBondContact O-N 3.2Å; T210-Q213 PolarHBondContact O-N 2.62Å; W211-Q213 PolarHBondContact O-N 3.3Å; Q213-T252 HydrophobicContact CG-CG2 3.5Å; Q213-T252 PolarHBondContact NE2-OG1 2.92Å
214Q80.1Confident81.8Confident120 Ų12049.1 Ų49.156%0.56127%0.27SS*.Hα-helixtrans-85.6-25.6-175.1-72.5173.2-14.700114T210 W211 S216T210-Q214 HydrophobicContact CG2-CG 4.4Å; T210-Q214 WeakPolarHBondContact O-CB 3.35Å; T210-Q214 VanDerWaalsContact O-CG 3.29Å; T210-Q214 WeakPolarHBondContact O-CG 3.37Å; T210-Q214 PolarHBondContact O-N 3.15Å; W211-Q214 PolarHBondContact O-N 3.34Å; W211-Q214 VanDerWaalsContact O-N 3.12Å; Q214-S216 PolarHBondContact O-N 3.36Å
215I71.2Confident81.6Confident15 Ų1549.8 Ų49.88%0.07727%0.274CS..SBendtrans-66.2126.9-179.2-75.1162.4000111F162 W211 S219 F223 I226F162-I215 HydrophobicContact CE2-CG1 4.23Å; F162-I215 HydrophobicContact CZ-CG1 3.78Å; W211-I215 HydrophobicContact CB-CD1 4.45Å; W211-I215 WeakPolarHBondContact O-CB 3.47Å; W211-I215 WeakPolarHBondContact O-CD1 3.4Å; W211-I215 VanDerWaalsContact O-CG1 3.24Å; W211-I215 WeakPolarHBondContact O-CG1 3.45Å; W211-I215 PolarHBondContact O-N 3.43Å; I215-S219 WeakPolarHBondContact CG2-OG 3.02Å; I215-F223 HydrophobicContact CD1-CD2 4.43Å; I215-F223 HydrophobicContact CG2-CD2 3.86Å; I215-F223 HydrophobicContact CG2-CE2 4.38Å; I215-I226 HydrophobicContact CD1-CD1 3.36Å
216S67.1Low81.5Confident80 Ų8049.7 Ų49.756%0.55927%0.274SS*.  trans-75.3154172.561.60000111.6Q214 P218 S219Q214-S216 PolarHBondContact O-N 3.36Å; S216-P218 VanDerWaalsContact C-N 3.26Å; S216-P218 WeakPolarHBondContact O-CD 3.43Å; S216-S219 PolarHBondContact O-N 3.5Å
217V53.7Low81.4Confident73 Ų7346 Ų4644%0.44225%0.25SC..THydrogen-bonded Turntrans-55.2-18.6-166.1163.60000116.9R259 V260 L273V217-R259 HydrophobicContact CG2-CB 4.29Å; V217-V260 HydrophobicContact CG1-CG1 4.24Å; V217-L273 WeakPolarHBondContact O-CD2 3.34Å
218P52.6Low81.5Confident97 Ų9745.4 Ų45.463%0.6325%0.25SS*.THydrogen-bonded Turntrans-123.752.8174.742.1-29.3000115.5S216S216-P218 VanDerWaalsContact C-N 3.26Å; S216-P218 WeakPolarHBondContact O-CD 3.43Å
219S64.4Low81.7Confident30 Ų3045.4 Ų45.421%0.2125%0.25CS..  trans-112.466.316275.80000112.6I215 S216 E221 T222 F223I215-S219 WeakPolarHBondContact CG2-OG 3.02Å; S216-S219 PolarHBondContact O-N 3.5Å; S219-E221 PolarHBondContact O-N 2.9Å; S219-E221 VanDerWaalsContact O-N 3.16Å; S219-T222 PolarHBondContact O-N 3.24Å; S219-T222 PolarHBondContact O-OG1 3.08Å; S219-T222 PolarHBondContact OG-OG1 2.93Å; S219-F223 PolarHBondContact O-N 2.95Å; S219-F223 VanDerWaalsContact O-N 3.11Å
220T67.1Low81.9Confident43 Ų4342.9 Ų42.926%0.26424%0.239SC..Hα-helixtrans-50.9-37.817745.10000112.9T222 F223 Q224 L269 L273T220-T222 PolarHBondContact O-N 3.42Å; T220-F223 PolarHBondContact O-N 3.46Å; T220-Q224 PolarHBondContact O-N 3.21Å; T220-Q224 VanDerWaalsContact O-N 3.1Å; T220-L269 HydrophobicContact CG2-CB 4.45Å; T220-L269 HydrophobicContact CG2-CD2 4.4Å; T220-L273 HydrophobicContact CG2-CB 4.27Å
221E76.2Confident82.2Confident133 Ų13341.2 Ų41.262%0.62123%0.231SC*.Hα-helixtrans-55.4-49.7178.6-63.6-168.5175.700112.9Y175 S219 P225Y175-E221 WeakPolarHBondContact OH-CB 3.31Å; Y175-E221 PolarHBondContact OH-O 3.25Å; S219-E221 PolarHBondContact O-N 2.9Å; S219-E221 VanDerWaalsContact O-N 3.16Å; E221-P225 WeakPolarHBondContact O-CD 3.28Å
222T81.5Confident82.5Confident14 Ų1442 Ų429%0.08624%0.236CC..Hα-helixtrans-80.1-27.9178.757.20000112.7P161 F162 Y175 S219 T220 P225 I226P161-T222 HydrophobicContact CG-CG2 3.98Å; F162-T222 HydrophobicContact CE2-CG2 4.31Å; Y175-T222 HydrophobicContact CD2-CG2 4.42Å; Y175-T222 HydrophobicContact CE2-CG2 4.14Å; S219-T222 PolarHBondContact O-N 3.24Å; S219-T222 PolarHBondContact O-OG1 3.08Å; S219-T222 PolarHBondContact OG-OG1 2.93Å; T220-T222 PolarHBondContact O-N 3.42Å; T222-P225 WeakPolarHBondContact O-CD 3.44Å; T222-I226 WeakPolarHBondContact O-CG1 3.39Å
223F85.9Confident82.9Confident9 Ų941.9 Ų41.94%0.03924%0.235CC..Hα-helixtrans-72.6-38.6-175.4-148.1-73.3000112.3L212 I215 S219 T220 I226 C227 L253 A256 L273 I277L212-F223 HydrophobicContact CD2-CE1 3.92Å; L212-F223 HydrophobicContact CD2-CE2 3.89Å; L212-F223 HydrophobicContact CD2-CZ 3.46Å; L212-F223 VanDerWaalsContact CD2-CZ 3.46Å; I215-F223 HydrophobicContact CD1-CD2 4.43Å; I215-F223 HydrophobicContact CG2-CD2 3.86Å; I215-F223 HydrophobicContact CG2-CE2 4.38Å; S219-F223 PolarHBondContact O-N 2.95Å; S219-F223 VanDerWaalsContact O-N 3.11Å; T220-F223 PolarHBondContact O-N 3.46Å; F223-I226 PolarHBondContact O-N 2.78Å; F223-C227 VanDerWaalsContact CD1-SG 3.59Å; F223-C227 WeakPolarHBondContact CE1-SG 3.38Å; F223-C227 WeakPolarHBondContact O-CB 3.5Å; F223-C227 PolarHBondContact O-N 3.41Å; F223-L253 HydrophobicContact CE1-CD1 4.41Å; F223-A256 HydrophobicContact CE2-CB 4.47Å; F223-A256 HydrophobicContact CZ-CB 4.01Å; F223-L273 HydrophobicContact CB-CD1 3.73Å; F223-L273 HydrophobicContact CD1-CD1 3.54Å; F223-L273 HydrophobicContact CD2-CD1 4.12Å; F223-L273 HydrophobicContact CE1-CD1 4.18Å; F223-L273 HydrophobicContact CG-CD1 3.52Å; F223-I277 HydrophobicContact CD1-CG1 4.23Å; F223-I277 HydrophobicContact CE1-CD1 3.86Å; F223-I277 HydrophobicContact CE1-CG1 3.4Å; F223-I277 HydrophobicContact CZ-CD1 3.86Å; F223-I277 HydrophobicContact CZ-CG1 3.86Å
224Q89.1Confident83.4Confident62 Ų6237.1 Ų37.129%0.2921%0.213SC..Hα-helixtrans-62-45.3-178.5175.3178.1-7.200113.5T220 C227 S228T220-Q224 PolarHBondContact O-N 3.21Å; T220-Q224 VanDerWaalsContact O-N 3.1Å; Q224-C227 PolarHBondContact O-N 2.91Å; Q224-S228 WeakPolarHBondContact O-CB 3.44Å; Q224-S228 PolarHBondContact O-N 2.85Å; Q224-S228 PolarHBondContact O-OG 3.41Å
225P92.4Very high84.1Confident14 Ų1432.6 Ų32.69%0.09119%0.194CC..Hα-helixtrans-61.7-39172.8-2635.6000113.4W178 T179 S182 E221 T222 S228 F229W178-P225 HydrophobicContact CH2-CB 3.79Å; W178-P225 HydrophobicContact CZ3-CB 3.67Å; W178-P225 HydrophobicContact CZ3-CG 3.99Å; T179-P225 HydrophobicContact CG2-CG 4.03Å; S182-P225 PolarHBondContact OG-O 3.05Å; E221-P225 WeakPolarHBondContact O-CD 3.28Å; T222-P225 WeakPolarHBondContact O-CD 3.44Å; P225-S228 PolarHBondContact O-N 3.42Å; P225-F229 WeakPolarHBondContact O-CB 3.31Å; P225-F229 PolarHBondContact O-N 2.82Å
226I94.1Very high85.2Confident0 Ų035.4 Ų35.40%021%0.209CC..Hα-helixtrans-61.2-51.3175.7-64.3173.3000110.7F160 W178 V208 W211 L212 I215 T222 F223 S228 F229 I230F160-I226 HydrophobicContact CE2-CD1 4.11Å; F160-I226 HydrophobicContact CZ-CD1 4.31Å; W178-I226 HydrophobicContact CH2-CG1 3.86Å; W178-I226 HydrophobicContact CZ2-CG1 4.24Å; V208-I226 HydrophobicContact CG1-CG2 3.8Å; W211-I226 HydrophobicContact CB-CD1 4.02Å; W211-I226 HydrophobicContact CE3-CD1 4.36Å; W211-I226 HydrophobicContact CE3-CG1 4.46Å; L212-I226 HydrophobicContact CD2-CG2 3.82Å; L212-I226 HydrophobicContact CG-CG2 4.13Å; I215-I226 HydrophobicContact CD1-CD1 3.36Å; T222-I226 WeakPolarHBondContact O-CG1 3.39Å; F223-I226 PolarHBondContact O-N 2.78Å; I226-S228 VanDerWaalsContact C-N 3.31Å; I226-S228 PolarHBondContact O-N 3.01Å; I226-F229 PolarHBondContact O-N 3.04Å; I226-I230 HydrophobicContact CG2-CD1 3.77Å; I226-I230 HydrophobicContact CG2-CG1 4.46Å; I226-I230 WeakPolarHBondContact O-CG1 3.19Å; I226-I230 PolarHBondContact O-N 3.26Å
227C95Very high86.6Confident1 Ų132.3 Ų32.31%0.00719%0.186CC..Hα-helixtrans-58.1-43.1176-91.10000112.5F223 Q224 F229 I230 A231 V276 T280F223-C227 VanDerWaalsContact CD1-SG 3.59Å; F223-C227 WeakPolarHBondContact CE1-SG 3.38Å; F223-C227 WeakPolarHBondContact O-CB 3.5Å; F223-C227 PolarHBondContact O-N 3.41Å; Q224-C227 PolarHBondContact O-N 2.91Å; C227-F229 PolarHBondContact O-N 3.21Å; C227-I230 PolarHBondContact O-N 2.91Å; C227-A231 VanDerWaalsContact O-CB 3.31Å; C227-A231 WeakPolarHBondContact O-CB 3.47Å; C227-A231 PolarHBondContact O-N 3.18Å; C227-V276 HydrophobicContact CB-CG1 3.52Å; C227-T280 HydrophobicContact CB-CG2 4.35Å; C227-T280 WeakPolarHBondContact CB-OG1 3.33Å; C227-T280 PolarHBondContact SG-OG1 2.92Å
228S95.6Very high88.6Confident39 Ų3932 Ų3227%0.27319%0.187SC..Hα-helixtrans-62.2-44177.4-56.20000111.3Q224 P225 I226 M232Q224-S228 WeakPolarHBondContact O-CB 3.44Å; Q224-S228 PolarHBondContact O-N 2.85Å; Q224-S228 PolarHBondContact O-OG 3.41Å; P225-S228 PolarHBondContact O-N 3.42Å; I226-S228 VanDerWaalsContact C-N 3.31Å; I226-S228 PolarHBondContact O-N 3.01Å; S228-M232 VanDerWaalsContact O-CB 3.27Å; S228-M232 WeakPolarHBondContact O-CB 3.37Å; S228-M232 WeakPolarHBondContact O-CG 3.31Å; S228-M232 PolarHBondContact O-N 3.46Å
229F97.4Very high90.7Very high0 Ų033.5 Ų33.50%018%0.182CC..Hα-helixtrans-61.6-47.6175.7174.5-98.9000112M153 F156 L185 C201 A204 V208 P225 I226 C227 T233M153-F229 HydrophobicContact SD-CE2 4.34Å; M153-F229 HydrophobicContact SD-CZ 4.25Å; F156-F229 AromaticContact CE1-CD1 3.94Å; F156-F229 HydrophobicContact CE1-CD1 3.94Å; F156-F229 HydrophobicContact CE1-CD2 4.31Å; F156-F229 AromaticContact CE1-CE1 3.93Å; F156-F229 HydrophobicContact CE1-CE1 3.93Å; F156-F229 HydrophobicContact CE1-CE2 4.3Å; F156-F229 HydrophobicContact CE1-CG 4.14Å; F156-F229 HydrophobicContact CE1-CZ 4.11Å; F156-F229 HydrophobicContact CZ-CB 4.23Å; F156-F229 AromaticContact CZ-CD1 3.93Å; F156-F229 HydrophobicContact CZ-CD1 3.93Å; F156-F229 HydrophobicContact CZ-CD2 4.21Å; F156-F229 HydrophobicContact CZ-CE1 4.39Å; F156-F229 AromaticContact CZ-CG 3.83Å; F156-F229 HydrophobicContact CZ-CG 3.83Å; L185-F229 HydrophobicContact CB-CD2 4.05Å; L185-F229 HydrophobicContact CB-CE2 4.06Å; L185-F229 HydrophobicContact CD1-CD2 4.19Å; L185-F229 HydrophobicContact CD1-CE2 3.85Å; L185-F229 HydrophobicContact CG-CE2 4.5Å; C201-F229 HydrophobicContact CB-CE2 4.19Å; C201-F229 HydrophobicContact CB-CZ 3.91Å; A204-F229 HydrophobicContact CB-CE1 3.85Å; A204-F229 HydrophobicContact CB-CZ 3.8Å; V208-F229 HydrophobicContact CG2-CD1 4.08Å; V208-F229 HydrophobicContact CG2-CE1 4.06Å; P225-F229 WeakPolarHBondContact O-CB 3.31Å; P225-F229 PolarHBondContact O-N 2.82Å; I226-F229 PolarHBondContact O-N 3.04Å; C227-F229 PolarHBondContact O-N 3.21Å; F229-T233 WeakPolarHBondContact O-CB 3.47Å; F229-T233 PolarHBondContact O-N 2.94Å; F229-T233 PolarHBondContact O-OG1 2.7Å
230I98.2Very high92.3Very high0 Ų032.1 Ų32.10%017%0.172CC..Hα-helixtrans-58.8-58.6176.9-64.8161.1000109.6V208 L212 I226 C227 M232 T233 V234 F244 T280V208-I230 HydrophobicContact CG1-CD1 3.72Å; V208-I230 HydrophobicContact CG1-CG1 3.8Å; L212-I230 HydrophobicContact CD1-CD1 3.92Å; I226-I230 HydrophobicContact CG2-CD1 3.77Å; I226-I230 HydrophobicContact CG2-CG1 4.46Å; I226-I230 WeakPolarHBondContact O-CG1 3.19Å; I226-I230 PolarHBondContact O-N 3.26Å; C227-I230 PolarHBondContact O-N 2.91Å; I230-M232 VanDerWaalsContact C-N 3.34Å; I230-M232 PolarHBondContact O-N 2.71Å; I230-T233 PolarHBondContact O-N 2.94Å; I230-V234 HydrophobicContact CG2-CG1 4.27Å; I230-V234 WeakPolarHBondContact O-CG2 3.15Å; I230-V234 PolarHBondContact O-N 3.25Å; I230-F244 HydrophobicContact CD1-CE2 4.25Å; I230-F244 HydrophobicContact CD1-CZ 3.89Å; I230-F244 HydrophobicContact CG1-CE2 4.19Å; I230-F244 HydrophobicContact CG1-CZ 4.19Å; I230-F244 HydrophobicContact CG2-CD1 4.32Å; I230-F244 HydrophobicContact CG2-CE1 3.89Å; I230-F244 HydrophobicContact CG2-CE2 4.24Å; I230-F244 HydrophobicContact CG2-CZ 3.86Å; I230-T280 HydrophobicContact CB-CG2 3.76Å; I230-T280 HydrophobicContact CD1-CG2 4.43Å; I230-T280 HydrophobicContact CG2-CG2 3.61Å
231A97.7Very high93.8Very high21 Ų2130.3 Ų30.317%0.17416%0.16CC..Hα-helixtrans-56.7-45-175.100000112.4C227 T233 S235 T280 A283C227-A231 VanDerWaalsContact O-CB 3.31Å; C227-A231 WeakPolarHBondContact O-CB 3.47Å; C227-A231 PolarHBondContact O-N 3.18Å; A231-T233 VanDerWaalsContact C-N 3.34Å; A231-T233 PolarHBondContact O-N 3Å; A231-S235 WeakPolarHBondContact O-CB 3.43Å; A231-S235 PolarHBondContact O-N 2.87Å; A231-T280 HydrophobicContact CB-CG2 4.31Å; A231-A283 HydrophobicContact CB-CB 4.02Å
232M97Very high94.9Very high29 Ų2928.5 Ų28.514%0.14315%0.152CC..Hα-helixtrans-68.4-34179-67.5-72.4-82.100112.2C186 V189 N190 N191 Q198 S228 I230C186-M232 HydrophobicContact CB-CB 4.12Å; C186-M232 HydrophobicContact CB-CE 4.22Å; C186-M232 HydrophobicContact CB-CG 4Å; V189-M232 HydrophobicContact CG2-CB 4.41Å; N190-M232 HydrophobicContact CB-CB 4.24Å; N190-M232 HydrophobicContact CB-CE 3.78Å; N190-M232 WeakPolarHBondContact CB-O 3.49Å; N190-M232 HydrophobicContact CB-SD 4.13Å; N190-M232 PolarHBondContact ND2-O 3.44Å; N190-M232 VanDerWaalsContact ND2-O 3.12Å; N191-M232 HydrophobicContact CB-CE 4.36Å; Q198-M232 PolarHBondContact NE2-O 2.98Å; S228-M232 VanDerWaalsContact O-CB 3.27Å; S228-M232 WeakPolarHBondContact O-CB 3.37Å; S228-M232 WeakPolarHBondContact O-CG 3.31Å; S228-M232 PolarHBondContact O-N 3.46Å; I230-M232 VanDerWaalsContact C-N 3.34Å; I230-M232 PolarHBondContact O-N 2.71Å
233T97.9Very high95.7Very high0 Ų029 Ų290%016%0.156CC..Hα-helixtrans-74-42.7179-58.80000112.4Q198 C201 F205 F229 I230 A231 V240Q198-T233 WeakPolarHBondContact CB-O 2.96Å; Q198-T233 VanDerWaalsContact CD-O 3.27Å; Q198-T233 WeakPolarHBondContact CG-O 3.34Å; Q198-T233 PolarHBondContact NE2-O 3.38Å; Q198-T233 VanDerWaalsContact NE2-O 3.15Å; C201-T233 HydrophobicContact CB-CG2 3.5Å; C201-T233 VanDerWaalsContact CB-CG2 3.5Å; F205-T233 HydrophobicContact CE1-CG2 3.79Å; F205-T233 HydrophobicContact CZ-CG2 3.68Å; F229-T233 WeakPolarHBondContact O-CB 3.47Å; F229-T233 PolarHBondContact O-N 2.94Å; F229-T233 PolarHBondContact O-OG1 2.7Å; I230-T233 PolarHBondContact O-N 2.94Å; A231-T233 VanDerWaalsContact C-N 3.34Å; A231-T233 PolarHBondContact O-N 3Å; T233-V240 HydrophobicContact CG2-CG1 3.83Å; T233-V240 WeakPolarHBondContact O-CG1 3.36Å
234V97.5Very high96.3Very high0 Ų028.5 Ų28.50%015%0.154CC..Hα-helixtrans-83.2-23.3-177.9-56.10000114.2F205 I230 N236 N237 V240 Q241 F244 A283F205-V234 HydrophobicContact CZ-CG1 3.97Å; I230-V234 HydrophobicContact CG2-CG1 4.27Å; I230-V234 WeakPolarHBondContact O-CG2 3.15Å; I230-V234 PolarHBondContact O-N 3.25Å; V234-N236 PolarHBondContact O-N 2.99Å; V234-N237 PolarHBondContact O-N 3.21Å; V234-V240 HydrophobicContact CG1-CG1 4.24Å; V234-Q241 HydrophobicContact CB-CG 3.91Å; V234-Q241 WeakPolarHBondContact O-CG 3.46Å; V234-F244 HydrophobicContact CG1-CB 4.15Å; V234-F244 HydrophobicContact CG1-CG 4.44Å; V234-A283 HydrophobicContact CG2-CB 4.1Å; V234-A283 WeakPolarHBondContact CG2-O 3.45Å
235S94.8Very high96.7Very high24 Ų2426.8 Ų26.817%0.16815%0.15CC..THydrogen-bonded Turntrans-53.8127.4-171.5158.10000112.8N190 Q193 Q198 A231 N237N190-S235 VanDerWaalsContact ND2-CB 3.29Å; N190-S235 WeakPolarHBondContact ND2-CB 3.27Å; N190-S235 PolarHBondContact ND2-OG 3.38Å; N190-S235 VanDerWaalsContact ND2-OG 3.16Å; Q193-S235 PolarHBondContact NE2-O 3.17Å; Q198-S235 PolarHBondContact NE2-O 2.69Å; A231-S235 WeakPolarHBondContact O-CB 3.43Å; A231-S235 PolarHBondContact O-N 2.87Å; S235-N237 PolarHBondContact O-N 3.03Å
236N93.1Very high97Very high74 Ų7430.5 Ų30.540%0.39618%0.182SC..THydrogen-bonded Turntrans55.630.9178.3-52.6-10.1000114Q193 V234Q193-N236 PolarHBondContact NE2-O 2.9Å; V234-N236 PolarHBondContact O-N 2.99Å
237N96.5Very high97.1Very high15 Ų1532.2 Ų32.28%0.0819%0.193CC..  trans-141.591.5-176.6-170.1-28.6000111.3Q198 V234 S235 Y239 V240 Q241Q198-N237 PolarHBondContact OE1-ND2 2.64Å; V234-N237 PolarHBondContact O-N 3.21Å; S235-N237 PolarHBondContact O-N 3.03Å; N237-Y239 VanDerWaalsContact C-N 3.34Å; N237-Y239 PolarHBondContact O-N 3.31Å; N237-V240 HydrophobicContact CB-CB 4.16Å; N237-V240 HydrophobicContact CB-CG2 4.35Å; N237-V240 VanDerWaalsContact CG-CG2 3.49Å; N237-V240 WeakPolarHBondContact ND2-CG2 3.33Å; N237-V240 PolarHBondContact O-N 2.94Å; N237-V240 WeakPolarHBondContact OD1-CG2 3.35Å; N237-V240 PolarHBondContact OD1-N 3.36Å; N237-Q241 WeakPolarHBondContact O-CG 3.32Å; N237-Q241 PolarHBondContact O-N 3.1Å
238S96.6Very high97.2Very high66 Ų6632.7 Ų32.746%0.46220%0.198SC..Hα-helixtrans-57-41.7-175.155.10000113.6V240 Q241 E242S238-V240 VanDerWaalsContact C-N 3.26Å; S238-V240 PolarHBondContact O-N 3.49Å; S238-Q241 PolarHBondContact O-N 2.96Å; S238-E242 WeakPolarHBondContact O-CB 3.18Å; S238-E242 VanDerWaalsContact O-CG 3.29Å; S238-E242 WeakPolarHBondContact O-CG 3.15Å; S238-E242 PolarHBondContact O-N 2.94Å
239Y97.4Very high97.3Very high130 Ų13030.8 Ų30.851%0.5119%0.185SC..Hα-helixtrans-57.6-39.2175.6172.3-94.6000112.5R199 N237 S243R199-Y239 HydrophobicContact CG-CD1 3.72Å; R199-Y239 HydrophobicContact CG-CE1 3.77Å; N237-Y239 VanDerWaalsContact C-N 3.34Å; N237-Y239 PolarHBondContact O-N 3.31Å; Y239-S243 WeakPolarHBondContact O-CB 3.38Å; Y239-S243 PolarHBondContact O-N 3.43Å; Y239-S243 PolarHBondContact O-OG 2.88Å
240V98.3Very high97.3Very high0 Ų031.4 Ų31.40%019%0.188CC..Hα-helixtrans-79.8-35.6-179.5178.50000111.5Q198 R199 V202 F205 T233 V234 N237 S238 S243 F244Q198-V240 HydrophobicContact CB-CG2 4.15Å; R199-V240 HydrophobicContact CG-CG2 3.98Å; V202-V240 HydrophobicContact CG2-CB 4.4Å; V202-V240 HydrophobicContact CG2-CG1 3.97Å; V202-V240 HydrophobicContact CG2-CG2 3.96Å; F205-V240 HydrophobicContact CE2-CG1 3.83Å; F205-V240 WeakPolarHBondContact CE2-O 3.46Å; F205-V240 HydrophobicContact CZ-CG1 3.59Å; T233-V240 HydrophobicContact CG2-CG1 3.83Å; T233-V240 WeakPolarHBondContact O-CG1 3.36Å; V234-V240 HydrophobicContact CG1-CG1 4.24Å; N237-V240 HydrophobicContact CB-CB 4.16Å; N237-V240 HydrophobicContact CB-CG2 4.35Å; N237-V240 VanDerWaalsContact CG-CG2 3.49Å; N237-V240 WeakPolarHBondContact ND2-CG2 3.33Å; N237-V240 PolarHBondContact O-N 2.94Å; N237-V240 WeakPolarHBondContact OD1-CG2 3.35Å; N237-V240 PolarHBondContact OD1-N 3.36Å; S238-V240 VanDerWaalsContact C-N 3.26Å; S238-V240 PolarHBondContact O-N 3.49Å; V240-S243 PolarHBondContact O-N 3.35Å; V240-F244 PolarHBondContact O-N 3.43Å
241Q98.4Very high97.2Very high5 Ų535.5 Ų35.52%0.02321%0.207CC..Hα-helixtrans-58.6-50168.4-68.4170.7-29.600111.3V234 N237 S238 S243 F244 A245 A283 C284 T286 N288 L291V234-Q241 HydrophobicContact CB-CG 3.91Å; V234-Q241 WeakPolarHBondContact O-CG 3.46Å; N237-Q241 WeakPolarHBondContact O-CG 3.32Å; N237-Q241 PolarHBondContact O-N 3.1Å; S238-Q241 PolarHBondContact O-N 2.96Å; Q241-S243 VanDerWaalsContact C-N 3.33Å; Q241-S243 PolarHBondContact O-N 2.94Å; Q241-F244 WeakPolarHBondContact O-CB 3.37Å; Q241-F244 PolarHBondContact O-N 3.26Å; Q241-F244 VanDerWaalsContact O-N 3.16Å; Q241-A245 PolarHBondContact O-N 3.15Å; Q241-A283 PolarHBondContact NE2-O 3.03Å; Q241-C284 WeakPolarHBondContact CG-O 3.28Å; Q241-T286 PolarHBondContact NE2-O 3.1Å; Q241-N288 PolarHBondContact OE1-ND2 3.43Å; Q241-L291 HydrophobicContact CB-CD1 3.71Å
242E98.3Very high97.1Very high95 Ų9534.9 Ų34.944%0.44420%0.202SC..Hα-helixtrans-60.9-40.4176.9-74.5169.1-155.400111.7S238 F244 A245 A246 L291S238-E242 WeakPolarHBondContact O-CB 3.18Å; S238-E242 VanDerWaalsContact O-CG 3.29Å; S238-E242 WeakPolarHBondContact O-CG 3.15Å; S238-E242 PolarHBondContact O-N 2.94Å; E242-F244 VanDerWaalsContact C-N 3.35Å; E242-F244 PolarHBondContact O-N 3.04Å; E242-A245 PolarHBondContact O-N 3.48Å; E242-A246 VanDerWaalsContact O-CB 3.28Å; E242-A246 WeakPolarHBondContact O-CB 3.29Å; E242-A246 PolarHBondContact O-N 3.19Å; E242-L291 HydrophobicContact CG-CD1 4.38Å
243S98.4Very high97.1Very high24 Ų2433.5 Ų33.517%0.16820%0.195CC..Hα-helixtrans-63.2-38.5174.8-62.70000112.6Y239 V240 Q241 C247Y239-S243 WeakPolarHBondContact O-CB 3.38Å; Y239-S243 PolarHBondContact O-N 3.43Å; Y239-S243 PolarHBondContact O-OG 2.88Å; V240-S243 PolarHBondContact O-N 3.35Å; Q241-S243 VanDerWaalsContact C-N 3.33Å; Q241-S243 PolarHBondContact O-N 2.94Å; S243-C247 PolarHBondContact O-N 3.12Å
244F98.6Very high97Very high0 Ų033.5 Ų33.50%020%0.195CC..Hα-helixtrans-68.3-38174.7-173.6-115.3000112F205 L212 I230 V234 V240 Q241 E242 C247 G249 L250 L253F205-F244 HydrophobicContact CB-CD2 4.11Å; F205-F244 AromaticContact CD1-CD2 3.79Å; F205-F244 HydrophobicContact CD1-CD2 3.79Å; F205-F244 HydrophobicContact CD1-CE2 4.4Å; F205-F244 HydrophobicContact CD2-CB 3.85Å; F205-F244 AromaticContact CD2-CD2 3.98Å; F205-F244 HydrophobicContact CD2-CD2 3.98Å; F205-F244 HydrophobicContact CD2-CG 4.43Å; F205-F244 HydrophobicContact CE1-CD2 4.09Å; F205-F244 HydrophobicContact CE2-CB 3.63Å; F205-F244 HydrophobicContact CE2-CD2 4.27Å; F205-F244 HydrophobicContact CE2-CG 4.41Å; F205-F244 HydrophobicContact CG-CB 4.46Å; F205-F244 AromaticContact CG-CD2 3.72Å; F205-F244 HydrophobicContact CG-CD2 3.72Å; F205-F244 HydrophobicContact CZ-CB 4.07Å; F205-F244 HydrophobicContact CZ-CD2 4.31Å; L212-F244 HydrophobicContact CD1-CZ 4.5Å; I230-F244 HydrophobicContact CD1-CE2 4.25Å; I230-F244 HydrophobicContact CD1-CZ 3.89Å; I230-F244 HydrophobicContact CG1-CE2 4.19Å; I230-F244 HydrophobicContact CG1-CZ 4.19Å; I230-F244 HydrophobicContact CG2-CD1 4.32Å; I230-F244 HydrophobicContact CG2-CE1 3.89Å; I230-F244 HydrophobicContact CG2-CE2 4.24Å; I230-F244 HydrophobicContact CG2-CZ 3.86Å; V234-F244 HydrophobicContact CG1-CB 4.15Å; V234-F244 HydrophobicContact CG1-CG 4.44Å; V240-F244 PolarHBondContact O-N 3.43Å; Q241-F244 WeakPolarHBondContact O-CB 3.37Å; Q241-F244 PolarHBondContact O-N 3.26Å; Q241-F244 VanDerWaalsContact O-N 3.16Å; E242-F244 VanDerWaalsContact C-N 3.35Å; E242-F244 PolarHBondContact O-N 3.04Å; F244-C247 PolarHBondContact O-SG 3.17Å; F244-G249 WeakPolarHBondContact CZ-O 3.08Å; F244-G249 WeakPolarHBondContact O-CA 3.36Å; F244-G249 PolarHBondContact O-N 3.03Å; F244-L250 HydrophobicContact CD1-CB 4.2Å; F244-L250 HydrophobicContact CE1-CB 4.38Å; F244-L250 PolarHBondContact O-N 3.3Å; F244-L253 HydrophobicContact CE1-CD2 4.3Å
245A98Very high96.8Very high26 Ų2636.2 Ų36.222%0.21521%0.209CC..Hα-helixtrans-66.3-45.9173.100000112.1Q241 E242 C247 G248 L250 L291Q241-A245 PolarHBondContact O-N 3.15Å; E242-A245 PolarHBondContact O-N 3.48Å; A245-C247 VanDerWaalsContact C-N 3.3Å; A245-C247 PolarHBondContact O-N 3.3Å; A245-G248 WeakPolarHBondContact O-CA 3.35Å; A245-G248 PolarHBondContact O-N 3.12Å; A245-L250 HydrophobicContact CB-CB 4.16Å; A245-L250 HydrophobicContact CB-CD2 4.08Å; A245-L291 HydrophobicContact CB-CD1 4.27Å; A245-L291 HydrophobicContact CB-CD2 3.47Å; A245-L291 VanDerWaalsContact CB-CD2 3.47Å; A245-L291 HydrophobicContact CB-CG 4.5Å
246A98Very high96.7Very high91 Ų9135.3 Ų35.375%0.75220%0.203SC*.Hα-helixtrans-62.5-31-177.900000113.6E242 G248E242-A246 VanDerWaalsContact O-CB 3.28Å; E242-A246 WeakPolarHBondContact O-CB 3.29Å; E242-A246 PolarHBondContact O-N 3.19Å; A246-G248 PolarHBondContact O-N 3.23Å
247C97.1Very high96.6Very high36 Ų3631.8 Ų31.824%0.24318%0.184CC..THydrogen-bonded Turntrans-77.4-4.7172.279.60000113.7K209 S243 F244 A245 G249K209-C247 WeakPolarHBondContact CD-O 3.21Å; K209-C247 PolarHBondContact NZ-O 3.07Å; S243-C247 PolarHBondContact O-N 3.12Å; F244-C247 PolarHBondContact O-SG 3.17Å; A245-C247 VanDerWaalsContact C-N 3.3Å; A245-C247 PolarHBondContact O-N 3.3Å; C247-G249 PolarHBondContact SG-N 2.98Å
248G97.1Very high96.4Very high11 Ų1133.1 Ų33.111%0.11319%0.191CC..THydrogen-bonded Turntrans75.622-172.300000113.8A245 A246 T252A245-G248 WeakPolarHBondContact O-CA 3.35Å; A245-G248 PolarHBondContact O-N 3.12Å; A246-G248 PolarHBondContact O-N 3.23Å; G248-T252 WeakPolarHBondContact O-CB 3.5Å; G248-T252 PolarHBondContact O-N 2.9Å; G248-T252 PolarHBondContact O-OG1 3.32Å
249G97.4Very high96Very high0 Ų036 Ų360%019%0.192CC..Hα-helixtrans-70.9-42.1176.900000112F244 C247 T252 L253F244-G249 WeakPolarHBondContact CZ-O 3.08Å; F244-G249 WeakPolarHBondContact O-CA 3.36Å; F244-G249 PolarHBondContact O-N 3.03Å; C247-G249 PolarHBondContact SG-N 2.98Å; G249-T252 WeakPolarHBondContact O-CB 3.47Å; G249-T252 PolarHBondContact O-N 2.88Å; G249-L253 WeakPolarHBondContact O-CB 3.29Å; G249-L253 PolarHBondContact O-N 2.78Å
250L97.4Very high95.7Very high12 Ų1230 Ų306%0.06317%0.169CC..Hα-helixtrans-60.6-50.4178.3-179.456.1000112.2F244 A245 T252 L253 T254 L281 C284 I285 L291 L295F244-L250 HydrophobicContact CD1-CB 4.2Å; F244-L250 HydrophobicContact CE1-CB 4.38Å; F244-L250 PolarHBondContact O-N 3.3Å; A245-L250 HydrophobicContact CB-CB 4.16Å; A245-L250 HydrophobicContact CB-CD2 4.08Å; L250-T252 VanDerWaalsContact C-N 3.32Å; L250-T252 PolarHBondContact O-N 3.4Å; L250-L253 PolarHBondContact O-N 2.82Å; L250-T254 PolarHBondContact O-N 3.43Å; L250-T254 PolarHBondContact O-OG1 3.31Å; L250-L281 HydrophobicContact CD1-CD2 3.73Å; L250-C284 HydrophobicContact CD1-CB 3.8Å; L250-I285 HydrophobicContact CD1-CG2 4.39Å; L250-I285 HydrophobicContact CD2-CG2 4.4Å; L250-L291 HydrophobicContact CD2-CB 4.07Å; L250-L291 HydrophobicContact CD2-CD2 4.45Å; L250-L295 HydrophobicContact CD1-CD1 4.31Å; L250-L295 HydrophobicContact CD1-CD2 4.29Å; L250-L295 HydrophobicContact CD2-CD2 4.3Å; L250-L295 HydrophobicContact CG-CD2 3.98Å
251E96.4Very high95.3Very high86 Ų8630 Ų3040%0.40217%0.169SC..Hα-helixtrans-54.7-47.6172.2165.5175.2-143.300111.7L253 T254 L255 Y298E251-L253 VanDerWaalsContact C-N 3.29Å; E251-L253 PolarHBondContact O-N 2.69Å; E251-T254 PolarHBondContact O-N 3.46Å; E251-L255 HydrophobicContact CG-CD1 3.91Å; E251-L255 HydrophobicContact CG-CG 4.35Å; E251-L255 WeakPolarHBondContact O-CG 3.48Å; E251-L255 PolarHBondContact O-N 3.25Å; E251-Y298 VanDerWaalsContact CD-OH 3.25Å; E251-Y298 HydrophobicContact CG-CE1 4.32Å; E251-Y298 VanDerWaalsContact CG-OH 3.25Å; E251-Y298 WeakPolarHBondContact CG-OH 3.48Å; E251-Y298 PolarHBondContact OE1-OH 2.88Å
252T95.9Very high94.8Very high9 Ų934 Ų346%0.05520%0.197CC..Hα-helixtrans-60.8-40-178.9-640000111.6K209 L212 Q213 G248 G249 L250 L255 A256K209-T252 HydrophobicContact CG-CG2 4.31Å; L212-T252 HydrophobicContact CB-CG2 3.61Å; L212-T252 HydrophobicContact CD1-CG2 4.36Å; Q213-T252 HydrophobicContact CG-CG2 3.5Å; Q213-T252 PolarHBondContact NE2-OG1 2.92Å; G248-T252 WeakPolarHBondContact O-CB 3.5Å; G248-T252 PolarHBondContact O-N 2.9Å; G248-T252 PolarHBondContact O-OG1 3.32Å; G249-T252 WeakPolarHBondContact O-CB 3.47Å; G249-T252 PolarHBondContact O-N 2.88Å; L250-T252 VanDerWaalsContact C-N 3.32Å; L250-T252 PolarHBondContact O-N 3.4Å; T252-L255 PolarHBondContact O-N 2.9Å; T252-A256 WeakPolarHBondContact O-CB 3.44Å; T252-A256 PolarHBondContact O-N 2.74Å
253L95.6Very high94.3Very high0 Ų031 Ų310%019%0.189CC..Hα-helixtrans-68-39.6177-174.863.5000111.8L212 F223 F244 G249 L250 E251 A256 L257 I277 T280 L281L212-L253 HydrophobicContact CD1-CB 4.4Å; L212-L253 HydrophobicContact CD1-CD1 4.34Å; L212-L253 HydrophobicContact CD2-CD1 4.32Å; F223-L253 HydrophobicContact CE1-CD1 4.41Å; F244-L253 HydrophobicContact CE1-CD2 4.3Å; G249-L253 WeakPolarHBondContact O-CB 3.29Å; G249-L253 PolarHBondContact O-N 2.78Å; L250-L253 PolarHBondContact O-N 2.82Å; E251-L253 VanDerWaalsContact C-N 3.29Å; E251-L253 PolarHBondContact O-N 2.69Å; L253-A256 WeakPolarHBondContact O-CB 3.43Å; L253-A256 PolarHBondContact O-N 2.98Å; L253-L257 PolarHBondContact O-N 3.28Å; L253-I277 HydrophobicContact CD1-CG1 4.4Å; L253-I277 HydrophobicContact CD1-CG2 3.81Å; L253-I277 HydrophobicContact CG-CG2 4.02Å; L253-T280 HydrophobicContact CD2-CG2 3.57Å; L253-L281 HydrophobicContact CB-CD2 4.1Å; L253-L281 HydrophobicContact CD2-CD2 3.76Å; L253-L281 HydrophobicContact CD2-CG 3.96Å; L253-L281 HydrophobicContact CG-CD2 3.79Å; L253-L281 HydrophobicContact CG-CG 3.99Å
254T95.9Very high93.7Very high0 Ų029.9 Ų29.90%018%0.181CC..Hα-helixtrans-62.7-47.4172.8-60.10000111.3L250 E251 A256 L257 L258 L281 L295 Y298L250-T254 PolarHBondContact O-N 3.43Å; L250-T254 PolarHBondContact O-OG1 3.31Å; E251-T254 PolarHBondContact O-N 3.46Å; T254-A256 PolarHBondContact O-N 3.03Å; T254-L257 WeakPolarHBondContact O-CB 3.41Å; T254-L257 PolarHBondContact O-N 3.09Å; T254-L258 HydrophobicContact CG2-CD1 4.15Å; T254-L258 WeakPolarHBondContact O-CD1 3.43Å; T254-L258 PolarHBondContact O-N 3.38Å; T254-L281 WeakPolarHBondContact OG1-CD2 3.39Å; T254-L295 HydrophobicContact CG2-CD2 4.41Å; T254-L295 VanDerWaalsContact OG1-CD2 3.31Å; T254-L295 WeakPolarHBondContact OG1-CD2 3.37Å; T254-Y298 HydrophobicContact CG2-CD2 3.97Å; T254-Y298 HydrophobicContact CG2-CG 3.83Å
255L93.4Very high93.1Very high56 Ų5631.6 Ų31.629%0.29320%0.199SC..Hα-helixtrans-62.6-30.3175.6-67.3175.4000112.4E251 T252 L258 R259 Y298E251-L255 HydrophobicContact CG-CD1 3.91Å; E251-L255 HydrophobicContact CG-CG 4.35Å; E251-L255 WeakPolarHBondContact O-CG 3.48Å; E251-L255 PolarHBondContact O-N 3.25Å; T252-L255 PolarHBondContact O-N 2.9Å; L255-L258 HydrophobicContact CD2-CD2 4.46Å; L255-R259 WeakPolarHBondContact O-CD 3.39Å; L255-R259 VanDerWaalsContact O-CG 3.28Å; L255-R259 WeakPolarHBondContact O-CG 3.45Å; L255-R259 PolarHBondContact O-N 3.03Å; L255-Y298 HydrophobicContact CD2-CD1 4.23Å; L255-Y298 HydrophobicContact CD2-CE1 4.29Å
256A92Very high92.5Very high6 Ų636.7 Ų36.75%0.0523%0.228CC..Hα-helixtrans-66.7-42.3171.200000112F223 T252 L253 T254 R259 V260 I277F223-A256 HydrophobicContact CE2-CB 4.47Å; F223-A256 HydrophobicContact CZ-CB 4.01Å; T252-A256 WeakPolarHBondContact O-CB 3.44Å; T252-A256 PolarHBondContact O-N 2.74Å; L253-A256 WeakPolarHBondContact O-CB 3.43Å; L253-A256 PolarHBondContact O-N 2.98Å; T254-A256 PolarHBondContact O-N 3.03Å; A256-R259 PolarHBondContact O-N 2.89Å; A256-V260 PolarHBondContact O-N 3.41Å; A256-I277 HydrophobicContact CB-CD1 4.45Å
257L92.9Very high92Very high0 Ų034.3 Ų34.30%021%0.206CC..Hα-helixtrans-57-51173.2-177.558.6000111.2L253 T254 R259 V260 V261 I277 V278 L281 L300 L304L253-L257 PolarHBondContact O-N 3.28Å; T254-L257 WeakPolarHBondContact O-CB 3.41Å; T254-L257 PolarHBondContact O-N 3.09Å; L257-R259 PolarHBondContact O-N 2.93Å; L257-V260 HydrophobicContact CD1-CG2 4.33Å; L257-V260 VanDerWaalsContact O-CG2 3.3Å; L257-V260 WeakPolarHBondContact O-CG2 3.47Å; L257-V260 PolarHBondContact O-N 3.01Å; L257-V261 HydrophobicContact CD1-CB 4.1Å; L257-V261 HydrophobicContact CD1-CG2 4.45Å; L257-V261 HydrophobicContact CG-CB 4.36Å; L257-V261 VanDerWaalsContact O-CB 3.31Å; L257-V261 WeakPolarHBondContact O-CB 3.23Å; L257-V261 WeakPolarHBondContact O-CG1 3.48Å; L257-V261 PolarHBondContact O-N 3.48Å; L257-I277 HydrophobicContact CB-CG2 3.67Å; L257-I277 HydrophobicContact CD1-CB 4.25Å; L257-I277 HydrophobicContact CD1-CG2 4.24Å; L257-I277 HydrophobicContact CG-CG2 4.39Å; L257-V278 HydrophobicContact CD1-CG2 3.92Å; L257-V278 HydrophobicContact CD2-CG2 3.76Å; L257-L281 HydrophobicContact CB-CD1 4.3Å; L257-L281 HydrophobicContact CD2-CD1 3.76Å; L257-L300 HydrophobicContact CD2-CD1 3.64Å; L257-L304 HydrophobicContact CD2-CD2 4.34Å
258L92.1Very high91.5Very high43 Ų4337.5 Ų37.523%0.22522%0.22CC..Hα-helixtrans-56.6-34.2-177.8-92.756.2000112.7T254 L255T254-L258 HydrophobicContact CG2-CD1 4.15Å; T254-L258 WeakPolarHBondContact O-CD1 3.43Å; T254-L258 PolarHBondContact O-N 3.38Å; L255-L258 HydrophobicContact CD2-CD2 4.46Å
259R88.4Confident91Very high126 Ų12641.4 Ų41.448%0.47524%0.237SC..Hα-helixtrans-71.3-35.7176.1-68.1165.7-167.51763.2113.5V217 L255 A256 L257V217-R259 HydrophobicContact CG2-CB 4.29Å; L255-R259 WeakPolarHBondContact O-CD 3.39Å; L255-R259 VanDerWaalsContact O-CG 3.28Å; L255-R259 WeakPolarHBondContact O-CG 3.45Å; L255-R259 PolarHBondContact O-N 3.03Å; A256-R259 PolarHBondContact O-N 2.89Å; L257-R259 PolarHBondContact O-N 2.93Å
260V89.1Confident90.6Very high4 Ų441.8 Ų41.82%0.02424%0.24CC..Hα-helixtrans-91.8-34.6-175.4-57.30000112.7V217 A256 L257 S262 A263 S270 L273 S274 I277V217-V260 HydrophobicContact CG1-CG1 4.24Å; A256-V260 PolarHBondContact O-N 3.41Å; L257-V260 HydrophobicContact CD1-CG2 4.33Å; L257-V260 VanDerWaalsContact O-CG2 3.3Å; L257-V260 WeakPolarHBondContact O-CG2 3.47Å; L257-V260 PolarHBondContact O-N 3.01Å; V260-S262 VanDerWaalsContact C-N 3.29Å; V260-S262 PolarHBondContact O-N 3.38Å; V260-A263 PolarHBondContact O-N 3.18Å; V260-A263 VanDerWaalsContact O-N 3.09Å; V260-S270 PolarHBondContact O-OG 2.81Å; V260-L273 HydrophobicContact CB-CD2 4.46Å; V260-L273 HydrophobicContact CG1-CD2 3.71Å; V260-L273 HydrophobicContact CG1-CG 4.2Å; V260-L273 HydrophobicContact CG2-CG 4.48Å; V260-S274 WeakPolarHBondContact CG2-OG 3.48Å; V260-I277 HydrophobicContact CG2-CD1 3.68Å
261V91.3Very high90.2Very high0 Ų041.9 Ų41.90%024%0.24CC..Hα-helixtrans-65.3-31.5-168.171.60000113L257 A263 A264 S274 H303 F306 L307L257-V261 HydrophobicContact CD1-CB 4.1Å; L257-V261 HydrophobicContact CD1-CG2 4.45Å; L257-V261 HydrophobicContact CG-CB 4.36Å; L257-V261 VanDerWaalsContact O-CB 3.31Å; L257-V261 WeakPolarHBondContact O-CB 3.23Å; L257-V261 WeakPolarHBondContact O-CG1 3.48Å; L257-V261 PolarHBondContact O-N 3.48Å; V261-A263 PolarHBondContact O-N 3.23Å; V261-A264 WeakPolarHBondContact O-CB 3.42Å; V261-A264 PolarHBondContact O-N 2.73Å; V261-S274 WeakPolarHBondContact CA-OG 3.38Å; V261-H303 HydrophobicContact CG1-CB 3.95Å; V261-H303 WeakPolarHBondContact CG1-ND1 3.43Å; V261-H303 HydrophobicContact CG2-CB 4.42Å; V261-H303 WeakPolarHBondContact CG2-O 3.43Å; V261-F306 HydrophobicContact CG2-CD1 4.29Å; V261-F306 WeakPolarHBondContact O-CE1 3.46Å; V261-L307 HydrophobicContact CG2-CB 4.14Å
262S88.1Confident89.9Confident88 Ų8842.2 Ų42.262%0.61524%0.241SC*.THydrogen-bonded Turntrans-59-29.3176.559.10000113.4V260V260-S262 VanDerWaalsContact C-N 3.29Å; V260-S262 PolarHBondContact O-N 3.38Å
263A87.3Confident89.6Confident33 Ų3342.2 Ų42.227%0.27324%0.24SC..THydrogen-bonded Turntrans-93.3-1.1176.800000113.6V260 V261 G265 T266 S267V260-A263 PolarHBondContact O-N 3.18Å; V260-A263 VanDerWaalsContact O-N 3.09Å; V261-A263 PolarHBondContact O-N 3.23Å; A263-G265 PolarHBondContact O-N 2.9Å; A263-T266 PolarHBondContact O-N 3.24Å; A263-T266 VanDerWaalsContact O-N 3.13Å; A263-T266 PolarHBondContact O-OG1 3.03Å; A263-S267 WeakPolarHBondContact O-CB 3.46Å; A263-S267 PolarHBondContact O-N 3.11Å
264A86.3Confident89.5Confident0 Ų042.2 Ų42.20%024%0.24CC..THydrogen-bonded Turntrans-66.4-19.2-178.900000113.8V261 R271 L307V261-A264 WeakPolarHBondContact O-CB 3.42Å; V261-A264 PolarHBondContact O-N 2.73Å; A264-R271 HydrophobicContact CB-CB 4.11Å; A264-R271 HydrophobicContact CB-CG 4.38Å; A264-R271 VanDerWaalsContact O-CZ 3.24Å; A264-R271 PolarHBondContact O-NE 2.81Å; A264-R271 PolarHBondContact O-NH2 2.76Å; A264-L307 HydrophobicContact CB-CD1 3.79Å
265G84.6Confident89.3Confident37 Ų3742.3 Ų42.338%0.38124%0.241SC..THydrogen-bonded Turntrans-66.3-41.7170.800000112.6A263 R271A263-G265 PolarHBondContact O-N 2.9Å; G265-R271 PolarHBondContact O-NH2 2.93Å
266T86.2Confident89.3Confident133 Ų13341.1 Ų41.182%0.81624%0.236SC*.THydrogen-bonded Turntrans-104.6-25.6-170.754.80000114.3A263A263-T266 PolarHBondContact O-N 3.24Å; A263-T266 VanDerWaalsContact O-N 3.13Å; A263-T266 PolarHBondContact O-OG1 3.03Å
267S87.9Confident89.4Confident41 Ų4140.8 Ų40.829%0.28723%0.234SC..  trans-114.6121.4-175.5175.80000112.4A263 S270 R271A263-S267 WeakPolarHBondContact O-CB 3.46Å; A263-S267 PolarHBondContact O-N 3.11Å; S267-S270 PolarHBondContact O-N 3.38Å; S267-S270 PolarHBondContact OG-N 3.02Å; S267-R271 PolarHBondContact O-N 2.97Å
268L86.9Confident89.6Confident103 Ų10340.9 Ų40.954%0.53923%0.234SC..Hα-helixtrans-60.5-44.9174.6177.162.4000111.9S270 R271 Q272L268-S270 VanDerWaalsContact C-N 3.3Å; L268-S270 PolarHBondContact O-N 3.35Å; L268-R271 WeakPolarHBondContact O-CB 3.32Å; L268-R271 PolarHBondContact O-N 3.15Å; L268-Q272 HydrophobicContact CD1-CG 4.28Å; L268-Q272 WeakPolarHBondContact O-CG 3.42Å; L268-Q272 PolarHBondContact O-N 3.22Å
269L85.9Confident89.8Confident92 Ų9242.6 Ų42.648%0.48224%0.24SC..Hα-helixtrans-61.7-40.8178.8-67.2173.5000111.2T220 Q272 L273T220-L269 HydrophobicContact CG2-CB 4.45Å; T220-L269 HydrophobicContact CG2-CD2 4.4Å; L269-Q272 PolarHBondContact O-N 2.87Å; L269-L273 VanDerWaalsContact O-CB 3.25Å; L269-L273 WeakPolarHBondContact O-CB 3.35Å; L269-L273 PolarHBondContact O-N 3.08Å
270S88.3Confident90.2Very high8 Ų836.8 Ų36.86%0.05622%0.218CC..Hα-helixtrans-69.7-35.4178.9-143.60000112.1V260 S267 L268 S274V260-S270 PolarHBondContact O-OG 2.81Å; S267-S270 PolarHBondContact O-N 3.38Å; S267-S270 PolarHBondContact OG-N 3.02Å; L268-S270 VanDerWaalsContact C-N 3.3Å; L268-S270 PolarHBondContact O-N 3.35Å; S270-S274 WeakPolarHBondContact O-CB 3.37Å; S270-S274 PolarHBondContact O-N 2.95Å; S270-S274 PolarHBondContact O-OG 3.01Å
271R90Very high90.6Very high15 Ų1536.8 Ų36.86%0.05722%0.218CC..Hα-helixtrans-63.7-49.7171.7-167.6-178-52.3111.510.8112.1A264 G265 S267 L268 L273 S274 V275 L307 H312 L313A264-R271 HydrophobicContact CB-CB 4.11Å; A264-R271 HydrophobicContact CB-CG 4.38Å; A264-R271 VanDerWaalsContact O-CZ 3.24Å; A264-R271 PolarHBondContact O-NE 2.81Å; A264-R271 PolarHBondContact O-NH2 2.76Å; G265-R271 PolarHBondContact O-NH2 2.93Å; S267-R271 PolarHBondContact O-N 2.97Å; L268-R271 WeakPolarHBondContact O-CB 3.32Å; L268-R271 PolarHBondContact O-N 3.15Å; R271-L273 VanDerWaalsContact C-N 3.34Å; R271-L273 PolarHBondContact O-N 2.84Å; R271-S274 WeakPolarHBondContact O-CB 3.49Å; R271-S274 PolarHBondContact O-N 3.29Å; R271-V275 WeakPolarHBondContact O-CG2 3.46Å; R271-V275 PolarHBondContact O-N 3.33Å; R271-L307 HydrophobicContact CG-CD1 3.87Å; R271-H312 WeakPolarHBondContact CD-O 3.22Å; R271-H312 VanDerWaalsContact NH1-CB 3.34Å; R271-L313 HydrophobicContact CG-CD1 4.28Å
272Q89.6Confident90.8Very high93 Ų9337.8 Ų37.844%0.43523%0.225SC..Hα-helixtrans-58.9-45.1176.8-72.9174.4-34.100111.5L268 L269 V275 V276L268-Q272 HydrophobicContact CD1-CG 4.28Å; L268-Q272 WeakPolarHBondContact O-CG 3.42Å; L268-Q272 PolarHBondContact O-N 3.22Å; L269-Q272 PolarHBondContact O-N 2.87Å; Q272-V275 PolarHBondContact O-N 3.45Å; Q272-V276 WeakPolarHBondContact O-CG2 3.42Å; Q272-V276 PolarHBondContact O-N 3.29Å
273L89.9Confident91.2Very high8 Ų834.4 Ų34.44%0.04220%0.202CC..Hα-helixtrans-63.3-42.7176.6-176.854.2000112.3V217 T220 F223 V260 L269 R271 V275 V276 I277V217-L273 WeakPolarHBondContact O-CD2 3.34Å; T220-L273 HydrophobicContact CG2-CB 4.27Å; F223-L273 HydrophobicContact CB-CD1 3.73Å; F223-L273 HydrophobicContact CD1-CD1 3.54Å; F223-L273 HydrophobicContact CD2-CD1 4.12Å; F223-L273 HydrophobicContact CE1-CD1 4.18Å; F223-L273 HydrophobicContact CG-CD1 3.52Å; V260-L273 HydrophobicContact CB-CD2 4.46Å; V260-L273 HydrophobicContact CG1-CD2 3.71Å; V260-L273 HydrophobicContact CG1-CG 4.2Å; V260-L273 HydrophobicContact CG2-CG 4.48Å; L269-L273 VanDerWaalsContact O-CB 3.25Å; L269-L273 WeakPolarHBondContact O-CB 3.35Å; L269-L273 PolarHBondContact O-N 3.08Å; R271-L273 VanDerWaalsContact C-N 3.34Å; R271-L273 PolarHBondContact O-N 2.84Å; L273-V275 VanDerWaalsContact C-N 3.34Å; L273-V275 PolarHBondContact O-N 3.47Å; L273-V276 PolarHBondContact O-N 3.18Å; L273-I277 HydrophobicContact CD1-CD1 4.24Å; L273-I277 HydrophobicContact CD1-CG1 4.49Å; L273-I277 HydrophobicContact CG-CD1 4.09Å; L273-I277 WeakPolarHBondContact O-CG1 3.12Å; L273-I277 PolarHBondContact O-N 2.8Å
274S92.5Very high91.8Very high0 Ų032.8 Ų32.80%019%0.189CC..Hα-helixtrans-57.7-47.1175.1-57.90000111V260 V261 S270 R271 V276 I277 V278V260-S274 WeakPolarHBondContact CG2-OG 3.48Å; V261-S274 WeakPolarHBondContact CA-OG 3.38Å; S270-S274 WeakPolarHBondContact O-CB 3.37Å; S270-S274 PolarHBondContact O-N 2.95Å; S270-S274 PolarHBondContact O-OG 3.01Å; R271-S274 WeakPolarHBondContact O-CB 3.49Å; R271-S274 PolarHBondContact O-N 3.29Å; S274-V276 PolarHBondContact O-N 2.88Å; S274-I277 PolarHBondContact O-N 2.96Å; S274-V278 VanDerWaalsContact O-CG2 3.29Å; S274-V278 WeakPolarHBondContact O-CG2 3.47Å; S274-V278 PolarHBondContact O-N 3.09Å
275V92.9Very high92.3Very high3 Ų333.1 Ų33.12%0.01819%0.191CC..Hα-helixtrans-61.2-43177170.50000112.1R271 Q272 L273 I277 V278 K279 L307 L313 D317R271-V275 WeakPolarHBondContact O-CG2 3.46Å; R271-V275 PolarHBondContact O-N 3.33Å; Q272-V275 PolarHBondContact O-N 3.45Å; L273-V275 VanDerWaalsContact C-N 3.34Å; L273-V275 PolarHBondContact O-N 3.47Å; V275-I277 VanDerWaalsContact C-N 3.31Å; V275-I277 PolarHBondContact O-N 3.44Å; V275-V278 PolarHBondContact O-N 3.37Å; V275-K279 HydrophobicContact CG1-CD 3.95Å; V275-K279 HydrophobicContact CG1-CG 4.43Å; V275-K279 WeakPolarHBondContact O-CG 3.39Å; V275-K279 PolarHBondContact O-N 3.41Å; V275-L307 HydrophobicContact CG2-CD2 4.12Å; V275-L313 HydrophobicContact CG2-CD1 3.63Å; V275-D317 HydrophobicContact CG1-CB 3.88Å; V275-D317 WeakPolarHBondContact CG1-OD1 3.37Å; V275-D317 HydrophobicContact CG2-CB 4.01Å
276V93.1Very high92.7Very high30 Ų3033 Ų3318%0.18218%0.182CC..Hα-helixtrans-61.4-41.4177.1168.60000110.9C227 Q272 L273 S274 T280C227-V276 HydrophobicContact CB-CG1 3.52Å; Q272-V276 WeakPolarHBondContact O-CG2 3.42Å; Q272-V276 PolarHBondContact O-N 3.29Å; L273-V276 PolarHBondContact O-N 3.18Å; S274-V276 PolarHBondContact O-N 2.88Å; V276-T280 PolarHBondContact O-N 2.94Å; V276-T280 VanDerWaalsContact O-N 3.17Å; V276-T280 PolarHBondContact O-OG1 3.28Å
277I94.8Very high93.1Very high0 Ų033.8 Ų33.80%018%0.182CC..Hα-helixtrans-65.3-45.4174.1-65.5159.2000111.1F223 L253 A256 L257 V260 L273 S274 V275 K279 T280 L281F223-I277 HydrophobicContact CD1-CG1 4.23Å; F223-I277 HydrophobicContact CE1-CD1 3.86Å; F223-I277 HydrophobicContact CE1-CG1 3.4Å; F223-I277 HydrophobicContact CZ-CD1 3.86Å; F223-I277 HydrophobicContact CZ-CG1 3.86Å; L253-I277 HydrophobicContact CD1-CG1 4.4Å; L253-I277 HydrophobicContact CD1-CG2 3.81Å; L253-I277 HydrophobicContact CG-CG2 4.02Å; A256-I277 HydrophobicContact CB-CD1 4.45Å; L257-I277 HydrophobicContact CB-CG2 3.67Å; L257-I277 HydrophobicContact CD1-CB 4.25Å; L257-I277 HydrophobicContact CD1-CG2 4.24Å; L257-I277 HydrophobicContact CG-CG2 4.39Å; V260-I277 HydrophobicContact CG2-CD1 3.68Å; L273-I277 HydrophobicContact CD1-CD1 4.24Å; L273-I277 HydrophobicContact CD1-CG1 4.49Å; L273-I277 HydrophobicContact CG-CD1 4.09Å; L273-I277 WeakPolarHBondContact O-CG1 3.12Å; L273-I277 PolarHBondContact O-N 2.8Å; S274-I277 PolarHBondContact O-N 2.96Å; V275-I277 VanDerWaalsContact C-N 3.31Å; V275-I277 PolarHBondContact O-N 3.44Å; I277-K279 PolarHBondContact O-N 3.24Å; I277-T280 CarbonylContact O-C 3.56Å; I277-T280 WeakPolarHBondContact O-CA 3.49Å; I277-T280 WeakPolarHBondContact O-CB 3.45Å; I277-T280 PolarHBondContact O-N 3.11Å; I277-L281 HydrophobicContact CG2-CD1 3.88Å; I277-L281 HydrophobicContact CG2-CG 4.16Å; I277-L281 PolarHBondContact O-N 2.96Å
278V96.1Very high93.5Very high1 Ų132.3 Ų32.31%0.00617%0.171CC..Hα-helixtrans-60.1-44.7178.9170.40000111.8L257 S274 V275 T280 L281 S282 L304 L307 V321 A324L257-V278 HydrophobicContact CD1-CG2 3.92Å; L257-V278 HydrophobicContact CD2-CG2 3.76Å; S274-V278 VanDerWaalsContact O-CG2 3.29Å; S274-V278 WeakPolarHBondContact O-CG2 3.47Å; S274-V278 PolarHBondContact O-N 3.09Å; V275-V278 PolarHBondContact O-N 3.37Å; V278-T280 PolarHBondContact O-N 3.16Å; V278-L281 PolarHBondContact O-N 3.36Å; V278-S282 WeakPolarHBondContact O-CB 3.47Å; V278-S282 PolarHBondContact O-N 3.13Å; V278-L304 HydrophobicContact CB-CD2 4.26Å; V278-L304 HydrophobicContact CG1-CD2 3.77Å; V278-L304 HydrophobicContact CG2-CD2 3.41Å; V278-L304 VanDerWaalsContact CG2-CD2 3.41Å; V278-L307 HydrophobicContact CG2-CD2 4.04Å; V278-V321 HydrophobicContact CG1-CG2 4.29Å; V278-A324 HydrophobicContact CG1-CB 3.63Å
279K95.9Very high93.8Very high79 Ų7931 Ų3134%0.34317%0.168SC..Hα-helixtrans-60.1-32.4173.8-73170.5179.5169.30112.4V275 I277 A283 D317 S320V275-K279 HydrophobicContact CG1-CD 3.95Å; V275-K279 HydrophobicContact CG1-CG 4.43Å; V275-K279 WeakPolarHBondContact O-CG 3.39Å; V275-K279 PolarHBondContact O-N 3.41Å; I277-K279 PolarHBondContact O-N 3.24Å; K279-A283 PolarHBondContact O-N 2.71Å; K279-D317 IonicContact NZ-OD1 2.91Å; K279-D317 PolarHBondContact NZ-OD1 3Å; K279-S320 VanDerWaalsContact CE-CB 3.49Å; K279-S320 WeakPolarHBondContact CE-OG 3.18Å
280T97.2Very high94.3Very high4 Ų432.9 Ų32.93%0.02518%0.179CC..Hα-helixtrans-77.2-43.4177.5-50.30000111.7C227 I230 A231 L253 V276 I277 V278 S282 A283 C284C227-T280 HydrophobicContact CB-CG2 4.35Å; C227-T280 WeakPolarHBondContact CB-OG1 3.33Å; C227-T280 PolarHBondContact SG-OG1 2.92Å; I230-T280 HydrophobicContact CB-CG2 3.76Å; I230-T280 HydrophobicContact CD1-CG2 4.43Å; I230-T280 HydrophobicContact CG2-CG2 3.61Å; A231-T280 HydrophobicContact CB-CG2 4.31Å; L253-T280 HydrophobicContact CD2-CG2 3.57Å; V276-T280 PolarHBondContact O-N 2.94Å; V276-T280 VanDerWaalsContact O-N 3.17Å; V276-T280 PolarHBondContact O-OG1 3.28Å; I277-T280 CarbonylContact O-C 3.56Å; I277-T280 WeakPolarHBondContact O-CA 3.49Å; I277-T280 WeakPolarHBondContact O-CB 3.45Å; I277-T280 PolarHBondContact O-N 3.11Å; V278-T280 PolarHBondContact O-N 3.16Å; T280-S282 VanDerWaalsContact C-N 3.35Å; T280-A283 PolarHBondContact O-N 3Å; T280-C284 PolarHBondContact O-N 3.43Å; T280-C284 PolarHBondContact O-SG 2.84Å
281L97.3Very high94.7Very high5 Ų533.7 Ų33.73%0.02618%0.183CC..Hα-helixtrans-59.6-45.3174.7-76.6170.2000111.3L250 L253 T254 L257 I277 V278 A283 C284 I285 L300L250-L281 HydrophobicContact CD1-CD2 3.73Å; L253-L281 HydrophobicContact CB-CD2 4.1Å; L253-L281 HydrophobicContact CD2-CD2 3.76Å; L253-L281 HydrophobicContact CD2-CG 3.96Å; L253-L281 HydrophobicContact CG-CD2 3.79Å; L253-L281 HydrophobicContact CG-CG 3.99Å; T254-L281 WeakPolarHBondContact OG1-CD2 3.39Å; L257-L281 HydrophobicContact CB-CD1 4.3Å; L257-L281 HydrophobicContact CD2-CD1 3.76Å; I277-L281 HydrophobicContact CG2-CD1 3.88Å; I277-L281 HydrophobicContact CG2-CG 4.16Å; I277-L281 PolarHBondContact O-N 2.96Å; V278-L281 PolarHBondContact O-N 3.36Å; L281-A283 PolarHBondContact O-N 3.5Å; L281-C284 WeakPolarHBondContact O-CA 3.39Å; L281-C284 WeakPolarHBondContact O-CB 3.49Å; L281-C284 PolarHBondContact O-N 3.35Å; L281-I285 WeakPolarHBondContact O-CG1 3.42Å; L281-I285 PolarHBondContact O-N 3.37Å; L281-I285 VanDerWaalsContact O-N 3.16Å; L281-L300 HydrophobicContact CD1-CD1 4.41Å
282S96.7Very high95Very high21 Ų2133.1 Ų33.115%0.14718%0.181CC..Hα-helixtrans-51.2-57.1172.7176.40000110.5V278 T280 C284 I285 T286 E327V278-S282 WeakPolarHBondContact O-CB 3.47Å; V278-S282 PolarHBondContact O-N 3.13Å; T280-S282 VanDerWaalsContact C-N 3.35Å; S282-C284 PolarHBondContact O-N 2.98Å; S282-C284 VanDerWaalsContact O-N 3.08Å; S282-I285 CarbonylContact O-C 3.55Å; S282-I285 WeakPolarHBondContact O-CG1 3.28Å; S282-I285 PolarHBondContact O-N 3.24Å; S282-T286 PolarHBondContact O-N 3.16Å; S282-T286 PolarHBondContact O-OG1 3.34Å; S282-E327 VanDerWaalsContact CA-OE2 3.29Å; S282-E327 WeakPolarHBondContact CA-OE2 3.39Å; S282-E327 WeakPolarHBondContact CB-OE2 3.35Å; S282-E327 VanDerWaalsContact OG-CD 3.3Å; S282-E327 PolarHBondContact OG-OE1 3.37Å; S282-E327 PolarHBondContact OG-OE2 3.05Å
283A97Very high95.3Very high16 Ų1630.3 Ų30.313%0.13217%0.174CC..Hα-helixtrans-56.8-30176.900000114.6A231 V234 Q241 K279 T280 L281 I285A231-A283 HydrophobicContact CB-CB 4.02Å; V234-A283 HydrophobicContact CG2-CB 4.1Å; V234-A283 WeakPolarHBondContact CG2-O 3.45Å; Q241-A283 PolarHBondContact NE2-O 3.03Å; K279-A283 PolarHBondContact O-N 2.71Å; T280-A283 PolarHBondContact O-N 3Å; L281-A283 PolarHBondContact O-N 3.5Å; A283-I285 VanDerWaalsContact C-N 3.34Å
284C97.9Very high95.6Very high0 Ų031.7 Ų31.70%019%0.19CC..Hα-helixtrans-73.1-20.7174.2-65.60000114.3Q241 L250 T280 L281 S282Q241-C284 WeakPolarHBondContact CG-O 3.28Å; L250-C284 HydrophobicContact CD1-CB 3.8Å; T280-C284 PolarHBondContact O-N 3.43Å; T280-C284 PolarHBondContact O-SG 2.84Å; L281-C284 WeakPolarHBondContact O-CA 3.39Å; L281-C284 WeakPolarHBondContact O-CB 3.49Å; L281-C284 PolarHBondContact O-N 3.35Å; S282-C284 PolarHBondContact O-N 2.98Å; S282-C284 VanDerWaalsContact O-N 3.08Å
285I96.7Very high95.8Very high6 Ų631.8 Ų31.83%0.03119%0.19CC..Hα-helixtrans-119.7-12.2-17571.9178.2000114.6L250 L281 S282 A283 D287 N288 L291 A292 L295 E327L250-I285 HydrophobicContact CD1-CG2 4.39Å; L250-I285 HydrophobicContact CD2-CG2 4.4Å; L281-I285 WeakPolarHBondContact O-CG1 3.42Å; L281-I285 PolarHBondContact O-N 3.37Å; L281-I285 VanDerWaalsContact O-N 3.16Å; S282-I285 CarbonylContact O-C 3.55Å; S282-I285 WeakPolarHBondContact O-CG1 3.28Å; S282-I285 PolarHBondContact O-N 3.24Å; A283-I285 VanDerWaalsContact C-N 3.34Å; I285-D287 PolarHBondContact O-N 3.32Å; I285-N288 WeakPolarHBondContact O-CA 3.43Å; I285-N288 PolarHBondContact O-N 3.11Å; I285-L291 HydrophobicContact CG2-CB 4.29Å; I285-A292 HydrophobicContact CB-CB 4.02Å; I285-A292 HydrophobicContact CD1-CB 4.15Å; I285-A292 HydrophobicContact CG1-CB 4.46Å; I285-L295 HydrophobicContact CD1-CD1 4.31Å; I285-L295 HydrophobicContact CG2-CD1 3.79Å; I285-E327 HydrophobicContact CD1-CB 4.12Å; I285-E327 HydrophobicContact CG1-CB 4.33Å
286T95.1Very high95.9Very high34 Ų3432 Ų3221%0.20919%0.192CC..THydrogen-bonded Turntrans-50.7129.9175.9-55.10000110.4Q241 S282 N288 E327Q241-T286 PolarHBondContact NE2-O 3.1Å; S282-T286 PolarHBondContact O-N 3.16Å; S282-T286 PolarHBondContact O-OG1 3.34Å; T286-N288 PolarHBondContact O-N 3.43Å; T286-N288 VanDerWaalsContact O-N 3.12Å; T286-E327 WeakPolarHBondContact CA-OE1 3.45Å; T286-E327 WeakPolarHBondContact CB-OE1 3.25Å; T286-E327 PolarHBondContact OG1-OE1 3.37Å
287D93.8Very high96Very high150 Ų15037.8 Ų37.880%0.80222%0.217SC*.THydrogen-bonded Turntrans55.618.2-176-60.1-37.9000115.2I285I285-D287 PolarHBondContact O-N 3.32Å
288N95.6Very high96Very high10 Ų1040.1 Ų40.15%0.05323%0.226CC..  trans-129.876.1-175.8-154.1-36.2000112.5Q241 I285 T286 N290 L291 A292Q241-N288 PolarHBondContact OE1-ND2 3.43Å; I285-N288 WeakPolarHBondContact O-CA 3.43Å; I285-N288 PolarHBondContact O-N 3.11Å; T286-N288 PolarHBondContact O-N 3.43Å; T286-N288 VanDerWaalsContact O-N 3.12Å; N288-N290 PolarHBondContact O-N 3.01Å; N288-N290 VanDerWaalsContact O-N 3.17Å; N288-L291 HydrophobicContact CB-CB 4.48Å; N288-L291 HydrophobicContact CB-CD1 4.37Å; N288-L291 PolarHBondContact O-N 3.49Å; N288-L291 VanDerWaalsContact O-N 3.14Å; N288-A292 PolarHBondContact O-N 2.98Å; N288-A292 VanDerWaalsContact O-N 3.09Å
289P94Very high96Very high75 Ų7540.7 Ų40.749%0.48723%0.232SC..Hα-helixtrans-63.7-26.4-170.125.1-34.9000113.7A293 A331P289-A293 VanDerWaalsContact O-CB 3.22Å; P289-A293 WeakPolarHBondContact O-CB 3.4Å; P289-A293 PolarHBondContact O-N 3.16Å; P289-A331 HydrophobicContact CB-CB 4.16Å
290N95.9Very high96Very high132 Ų13237 Ų3771%0.70622%0.217SC*.Hα-helixtrans-65.7-44.6176.5-66.2-30.3000111.5N288 G294N288-N290 PolarHBondContact O-N 3.01Å; N288-N290 VanDerWaalsContact O-N 3.17Å; N290-G294 PolarHBondContact O-N 2.85Å; N290-G294 VanDerWaalsContact O-N 3.13Å
291L96.9Very high95.9Very high26 Ų2636.9 Ų36.914%0.13622%0.215CC..Hα-helixtrans-70.7-40.9177.7-63.1-175.9000111.2Q241 E242 A245 L250 I285 N288 G294Q241-L291 HydrophobicContact CB-CD1 3.71Å; E242-L291 HydrophobicContact CG-CD1 4.38Å; A245-L291 HydrophobicContact CB-CD1 4.27Å; A245-L291 HydrophobicContact CB-CD2 3.47Å; A245-L291 VanDerWaalsContact CB-CD2 3.47Å; A245-L291 HydrophobicContact CB-CG 4.5Å; L250-L291 HydrophobicContact CD2-CB 4.07Å; L250-L291 HydrophobicContact CD2-CD2 4.45Å; I285-L291 HydrophobicContact CG2-CB 4.29Å; N288-L291 HydrophobicContact CB-CB 4.48Å; N288-L291 HydrophobicContact CB-CD1 4.37Å; N288-L291 PolarHBondContact O-N 3.49Å; N288-L291 VanDerWaalsContact O-N 3.14Å; L291-G294 PolarHBondContact O-N 3.06Å
292A96.8Very high95.8Very high2 Ų241.2 Ų41.22%0.01723%0.232CC..Hα-helixtrans-57.9-54.5173.200000111.4I285 N288 G294 L295 A331 H335I285-A292 HydrophobicContact CB-CB 4.02Å; I285-A292 HydrophobicContact CD1-CB 4.15Å; I285-A292 HydrophobicContact CG1-CB 4.46Å; N288-A292 PolarHBondContact O-N 2.98Å; N288-A292 VanDerWaalsContact O-N 3.09Å; A292-G294 PolarHBondContact O-N 3.16Å; A292-L295 WeakPolarHBondContact O-CB 3.43Å; A292-L295 PolarHBondContact O-N 2.92Å; A292-A331 HydrophobicContact CB-CB 3.36Å; A292-H335 PolarHBondContact O-CE1 3.36Å
293A96.3Very high95.8Very high35 Ų3542.9 Ų42.929%0.28924%0.237SC..Hα-helixtrans-58.6-35.218000000112.8P289 L295 A296P289-A293 VanDerWaalsContact O-CB 3.22Å; P289-A293 WeakPolarHBondContact O-CB 3.4Å; P289-A293 PolarHBondContact O-N 3.16Å; A293-L295 PolarHBondContact O-N 3.5Å; A293-A296 VanDerWaalsContact O-CB 3.28Å; A293-A296 WeakPolarHBondContact O-CB 3.45Å; A293-A296 PolarHBondContact O-N 3.49Å; A293-A296 VanDerWaalsContact O-N 3.12Å
294G95.7Very high95.7Very high36 Ų3642.2 Ų42.237%0.37123%0.232SC..THydrogen-bonded Turntrans-63-14.6173.900000115.2N290 L291 A292 Q297N290-G294 PolarHBondContact O-N 2.85Å; N290-G294 VanDerWaalsContact O-N 3.13Å; L291-G294 PolarHBondContact O-N 3.06Å; A292-G294 PolarHBondContact O-N 3.16Å; G294-Q297 PolarHBondContact O-NE2 3.29Å
295L96.6Very high95.6Very high3 Ų343.6 Ų43.62%0.01624%0.238CC..THydrogen-bonded Turntrans-83.2-13.4174.3-64.3-177.8000114L250 T254 I285 A292 A293 Q297 Y298 L300L250-L295 HydrophobicContact CD1-CD1 4.31Å; L250-L295 HydrophobicContact CD1-CD2 4.29Å; L250-L295 HydrophobicContact CD2-CD2 4.3Å; L250-L295 HydrophobicContact CG-CD2 3.98Å; T254-L295 HydrophobicContact CG2-CD2 4.41Å; T254-L295 VanDerWaalsContact OG1-CD2 3.31Å; T254-L295 WeakPolarHBondContact OG1-CD2 3.37Å; I285-L295 HydrophobicContact CD1-CD1 4.31Å; I285-L295 HydrophobicContact CG2-CD1 3.79Å; A292-L295 WeakPolarHBondContact O-CB 3.43Å; A292-L295 PolarHBondContact O-N 2.92Å; A293-L295 PolarHBondContact O-N 3.5Å; L295-Q297 VanDerWaalsContact C-N 3.26Å; L295-Q297 PolarHBondContact O-N 3.47Å; L295-Y298 HydrophobicContact CD2-CD2 4.2Å; L295-Y298 HydrophobicContact CD2-CE2 4.35Å; L295-Y298 PolarHBondContact O-N 3.33Å; L295-L300 HydrophobicContact CB-CD2 3.91Å; L295-L300 HydrophobicContact CD1-CD2 3.64Å; L295-L300 HydrophobicContact CG-CD2 4.37Å
296A94.9Very high95.5Very high6 Ų647.6 Ų47.65%0.0526%0.255CS..G310 helixtrans-62.3-33.3-174.200000113.2A293 Y298 G299 E334 H335 Q338A293-A296 VanDerWaalsContact O-CB 3.28Å; A293-A296 WeakPolarHBondContact O-CB 3.45Å; A293-A296 PolarHBondContact O-N 3.49Å; A293-A296 VanDerWaalsContact O-N 3.12Å; A296-Y298 PolarHBondContact O-N 2.98Å; A296-Y298 VanDerWaalsContact O-N 3.1Å; A296-G299 PolarHBondContact O-N 2.7Å; A296-E334 HydrophobicContact CB-CB 3.94Å; A296-E334 HydrophobicContact CB-CG 3.63Å; A296-H335 WeakPolarHBondContact CA-NE2 3.31Å; A296-H335 PolarHBondContact N-NE2 2.93Å; A296-Q338 PolarHBondContact O-NE2 3.04Å
297Q94.7Very high95.4Very high153 Ų15346 Ų4672%0.71525%0.245SC*.G310 helixtrans-59.6-18175.168.7-172.8-37.200114.7G294 L295G294-Q297 PolarHBondContact O-NE2 3.29Å; L295-Q297 VanDerWaalsContact C-N 3.26Å; L295-Q297 PolarHBondContact O-N 3.47Å
298Y95.8Very high95.4Very high48 Ų4839.1 Ų39.119%0.18821%0.209CC..G310 helixtrans-94.53.5177.6-57.1-77.5000113.2E251 T254 L255 L295 A296 L300E251-Y298 VanDerWaalsContact CD-OH 3.25Å; E251-Y298 HydrophobicContact CG-CE1 4.32Å; E251-Y298 VanDerWaalsContact CG-OH 3.25Å; E251-Y298 WeakPolarHBondContact CG-OH 3.48Å; E251-Y298 PolarHBondContact OE1-OH 2.88Å; T254-Y298 HydrophobicContact CG2-CD2 3.97Å; T254-Y298 HydrophobicContact CG2-CG 3.83Å; L255-Y298 HydrophobicContact CD2-CD1 4.23Å; L255-Y298 HydrophobicContact CD2-CE1 4.29Å; L295-Y298 HydrophobicContact CD2-CD2 4.2Å; L295-Y298 HydrophobicContact CD2-CE2 4.35Å; L295-Y298 PolarHBondContact O-N 3.33Å; A296-Y298 PolarHBondContact O-N 2.98Å; A296-Y298 VanDerWaalsContact O-N 3.1Å; Y298-L300 PolarHBondContact O-N 3.18Å
299G94.7Very high95.1Very high13 Ų1342 Ų4213%0.13423%0.227CC..THydrogen-bonded Turntrans62.630.3-177.400000113.3A296 V301 Y302 H303A296-G299 PolarHBondContact O-N 2.7Å; G299-V301 PolarHBondContact O-N 3.16Å; G299-V301 VanDerWaalsContact O-N 3.13Å; G299-Y302 WeakPolarHBondContact O-CB 3.48Å; G299-Y302 PolarHBondContact O-N 3.05Å; G299-H303 PolarHBondContact O-CD2 3.33Å
300L95.6Very high94.7Very high3 Ų339.3 Ų39.32%0.01621%0.21CC..Hα-helixtrans-54.4-38.2-168.3177.458.3000112.8L257 L281 L295 Y298 Y302 H303 L304L257-L300 HydrophobicContact CD2-CD1 3.64Å; L281-L300 HydrophobicContact CD1-CD1 4.41Å; L295-L300 HydrophobicContact CB-CD2 3.91Å; L295-L300 HydrophobicContact CD1-CD2 3.64Å; L295-L300 HydrophobicContact CG-CD2 4.37Å; Y298-L300 PolarHBondContact O-N 3.18Å; L300-Y302 VanDerWaalsContact C-N 3.32Å; L300-Y302 PolarHBondContact O-N 3.38Å; L300-H303 WeakPolarHBondContact O-CB 3.19Å; L300-H303 PolarHBondContact O-N 3.38Å; L300-H303 VanDerWaalsContact O-N 3.09Å; L300-L304 HydrophobicContact CD1-CD1 4.45Å; L300-L304 HydrophobicContact CD1-CD2 4.34Å; L300-L304 HydrophobicContact CD1-CG 4.11Å; L300-L304 HydrophobicContact CG-CD1 4.04Å; L300-L304 HydrophobicContact CG-CG 4.17Å; L300-L304 WeakPolarHBondContact O-CG 3.48Å; L300-L304 PolarHBondContact O-N 3.37Å
301V96.6Very high93.7Very high0 Ų037.8 Ų37.80%021%0.209CC..Hα-helixtrans-62-37.5-178.7174.60000112.2G299 H303 L304 F305 C328 H335 Q338 L339G299-V301 PolarHBondContact O-N 3.16Å; G299-V301 VanDerWaalsContact O-N 3.13Å; V301-H303 VanDerWaalsContact C-N 3.28Å; V301-H303 PolarHBondContact O-N 3.04Å; V301-L304 PolarHBondContact O-N 3.08Å; V301-F305 VanDerWaalsContact O-CB 3.3Å; V301-F305 WeakPolarHBondContact O-CB 3.35Å; V301-F305 PolarHBondContact O-N 3.23Å; V301-C328 HydrophobicContact CG2-CB 4.01Å; V301-H335 HydrophobicContact CG2-CB 3.87Å; V301-Q338 HydrophobicContact CB-CB 3.92Å; V301-Q338 HydrophobicContact CG1-CB 4.22Å; V301-L339 HydrophobicContact CG1-CB 3.83Å; V301-L339 HydrophobicContact CG1-CD1 3.9Å; V301-L339 HydrophobicContact CG1-CG 4.48Å
302Y95.3Very high92.7Very high96 Ų9642.7 Ų42.738%0.37623%0.231SC..Hα-helixtrans-58.6-41.6174.2-65.7-69.5000111.9G299 L300 F306 Q338 D341 C342G299-Y302 WeakPolarHBondContact O-CB 3.48Å; G299-Y302 PolarHBondContact O-N 3.05Å; L300-Y302 VanDerWaalsContact C-N 3.32Å; L300-Y302 PolarHBondContact O-N 3.38Å; Y302-F306 WeakPolarHBondContact O-CB 3.5Å; Y302-F306 PolarHBondContact O-N 3.34Å; Y302-Q338 HydrophobicContact CD2-CB 4.31Å; Y302-Q338 HydrophobicContact CD2-CG 4.23Å; Y302-Q338 HydrophobicContact CE2-CB 3.85Å; Y302-Q338 HydrophobicContact CE2-CG 3.55Å; Y302-D341 HydrophobicContact CE1-CB 4.18Å; Y302-D341 WeakPolarHBondContact OH-CB 3.25Å; Y302-D341 PolarHBondContact OH-OD2 3.34Å; Y302-C342 HydrophobicContact CD1-CB 3.64Å; Y302-C342 HydrophobicContact CE1-CB 3.85Å
303H95.3Very high92.1Very high56 Ų5643.1 Ų43.126%0.25923%0.233SC..Hα-helixtrans-73.1-39-179.8-67.4-65000112.5V261 G299 L300 V301 F306 L307V261-H303 HydrophobicContact CG1-CB 3.95Å; V261-H303 WeakPolarHBondContact CG1-ND1 3.43Å; V261-H303 HydrophobicContact CG2-CB 4.42Å; V261-H303 WeakPolarHBondContact CG2-O 3.43Å; G299-H303 PolarHBondContact O-CD2 3.33Å; L300-H303 WeakPolarHBondContact O-CB 3.19Å; L300-H303 PolarHBondContact O-N 3.38Å; L300-H303 VanDerWaalsContact O-N 3.09Å; V301-H303 VanDerWaalsContact C-N 3.28Å; V301-H303 PolarHBondContact O-N 3.04Å; H303-F306 PolarHBondContact O-N 3.19Å; H303-L307 PolarHBondContact O-N 3.02Å; H303-L307 VanDerWaalsContact O-N 3.09Å
304L96.3Very high91.6Very high2 Ų245.5 Ų45.51%0.0124%0.241CC..Hα-helixtrans-63.8-42.3172.6-63.8179.1000111.3L257 V278 L300 V301 L307 L308 V321 A324 I325L257-L304 HydrophobicContact CD2-CD2 4.34Å; V278-L304 HydrophobicContact CB-CD2 4.26Å; V278-L304 HydrophobicContact CG1-CD2 3.77Å; V278-L304 HydrophobicContact CG2-CD2 3.41Å; V278-L304 VanDerWaalsContact CG2-CD2 3.41Å; L300-L304 HydrophobicContact CD1-CD1 4.45Å; L300-L304 HydrophobicContact CD1-CD2 4.34Å; L300-L304 HydrophobicContact CD1-CG 4.11Å; L300-L304 HydrophobicContact CG-CD1 4.04Å; L300-L304 HydrophobicContact CG-CG 4.17Å; L300-L304 WeakPolarHBondContact O-CG 3.48Å; L300-L304 PolarHBondContact O-N 3.37Å; V301-L304 PolarHBondContact O-N 3.08Å; L304-L307 PolarHBondContact O-N 3.35Å; L304-L308 VanDerWaalsContact O-CB 3.31Å; L304-L308 WeakPolarHBondContact O-CB 3.43Å; L304-L308 PolarHBondContact O-N 3.2Å; L304-V321 HydrophobicContact CB-CG1 4.21Å; L304-V321 WeakPolarHBondContact O-CG1 3.27Å; L304-A324 HydrophobicContact CD1-CB 4.14Å; L304-I325 HydrophobicContact CB-CD1 3.94Å; L304-I325 HydrophobicContact CB-CG1 3.58Å; L304-I325 HydrophobicContact CD1-CG1 3.76Å; L304-I325 HydrophobicContact CG-CG1 4.31Å
305F95.2Very high91Very high30 Ų3047.5 Ų47.513%0.13225%0.248CC..Hα-helixtrans-64.4-41.3176.8-179.7-103.5000112.8V301 L307 L308 T309 C342 I347V301-F305 VanDerWaalsContact O-CB 3.3Å; V301-F305 WeakPolarHBondContact O-CB 3.35Å; V301-F305 PolarHBondContact O-N 3.23Å; F305-L307 VanDerWaalsContact C-N 3.33Å; F305-L307 PolarHBondContact O-N 3.05Å; F305-L308 PolarHBondContact O-N 2.94Å; F305-T309 HydrophobicContact CD1-CG2 4.49Å; F305-T309 HydrophobicContact CD2-CG2 4.32Å; F305-T309 HydrophobicContact CE1-CG2 4.04Å; F305-T309 HydrophobicContact CE2-CG2 3.84Å; F305-T309 HydrophobicContact CZ-CG2 3.71Å; F305-T309 WeakPolarHBondContact O-CG2 3.26Å; F305-T309 PolarHBondContact O-N 3.35Å; F305-T309 PolarHBondContact O-OG1 2.92Å; F305-C342 HydrophobicContact CD1-CB 3.9Å; F305-C342 VanDerWaalsContact CD1-SG 3.57Å; F305-C342 HydrophobicContact CE1-CB 4.29Å; F305-C342 WeakPolarHBondContact CE1-O 3.39Å; F305-C342 HydrophobicContact CG-CB 4.33Å; F305-C342 WeakPolarHBondContact CG-SG 3.43Å; F305-C342 WeakPolarHBondContact CZ-O 3.45Å; F305-I347 HydrophobicContact CE2-CB 4.03Å; F305-I347 HydrophobicContact CE2-CG1 3.8Å; F305-I347 HydrophobicContact CE2-CG2 4.29Å; F305-I347 HydrophobicContact CZ-CG1 3.95Å
306F94.1Very high90.3Very high89 Ų8951.5 Ų51.539%0.3927%0.269SS..Hα-helixtrans-60.5-41.5173179.5-93.1000112.3V261 Y302 H303 T309V261-F306 HydrophobicContact CG2-CD1 4.29Å; V261-F306 WeakPolarHBondContact O-CE1 3.46Å; Y302-F306 WeakPolarHBondContact O-CB 3.5Å; Y302-F306 PolarHBondContact O-N 3.34Å; H303-F306 PolarHBondContact O-N 3.19Å; F306-T309 PolarHBondContact O-OG1 3.35Å
307L94.2Very high90.1Very high1 Ų152.9 Ų52.91%0.00528%0.276CS..Hα-helixtrans-66.1-43.7176.1-176.261.5000111.5V261 A264 R271 V275 V278 H303 L304 F305 T309 S310 L313 V321V261-L307 HydrophobicContact CG2-CB 4.14Å; A264-L307 HydrophobicContact CB-CD1 3.79Å; R271-L307 HydrophobicContact CG-CD1 3.87Å; V275-L307 HydrophobicContact CG2-CD2 4.12Å; V278-L307 HydrophobicContact CG2-CD2 4.04Å; H303-L307 PolarHBondContact O-N 3.02Å; H303-L307 VanDerWaalsContact O-N 3.09Å; L304-L307 PolarHBondContact O-N 3.35Å; F305-L307 VanDerWaalsContact C-N 3.33Å; F305-L307 PolarHBondContact O-N 3.05Å; L307-T309 VanDerWaalsContact C-N 3.32Å; L307-T309 PolarHBondContact O-N 3.05Å; L307-S310 WeakPolarHBondContact O-CB 3.4Å; L307-S310 PolarHBondContact O-N 3.12Å; L307-S310 PolarHBondContact O-OG 3.13Å; L307-L313 HydrophobicContact CD1-CD1 4.48Å; L307-V321 HydrophobicContact CD2-CG2 3.74Å; L307-V321 HydrophobicContact CG-CG2 4.17Å
308L93.1Very high90Very high6 Ų648.7 Ų48.73%0.03125%0.253CS..Hα-helixtrans-61.2-37.4-179.7-176.964.9000113.2L304 F305 S310 R318 V321 L322 I325 M348 F351L304-L308 VanDerWaalsContact O-CB 3.31Å; L304-L308 WeakPolarHBondContact O-CB 3.43Å; L304-L308 PolarHBondContact O-N 3.2Å; F305-L308 PolarHBondContact O-N 2.94Å; L308-S310 VanDerWaalsContact C-N 3.27Å; L308-S310 PolarHBondContact O-N 3.39Å; L308-R318 HydrophobicContact CD1-CG 3.69Å; L308-V321 HydrophobicContact CB-CG1 3.95Å; L308-V321 HydrophobicContact CD1-CB 4.44Å; L308-V321 HydrophobicContact CD1-CG1 4.34Å; L308-L322 HydrophobicContact CD1-CD2 4.04Å; L308-L322 HydrophobicContact CD1-CG 3.89Å; L308-L322 HydrophobicContact CD2-CD2 3.71Å; L308-L322 HydrophobicContact CD2-CG 4.45Å; L308-I325 HydrophobicContact CD2-CD1 3.86Å; L308-M348 HydrophobicContact CD2-CE 3.61Å; L308-F351 HydrophobicContact CD1-CE2 4.04Å; L308-F351 HydrophobicContact CD1-CZ 4.21Å; L308-F351 HydrophobicContact CD2-CE2 3.86Å; L308-F351 HydrophobicContact CG-CE2 3.92Å; L308-F351 HydrophobicContact CG-CZ 4.3Å
309T89.7Confident89.9Confident71 Ų7148.2 Ų48.244%0.43625%0.254SS..THydrogen-bonded Turntrans-82.30.7179.849.90000113.7F305 F306 L307F305-T309 HydrophobicContact CD1-CG2 4.49Å; F305-T309 HydrophobicContact CD2-CG2 4.32Å; F305-T309 HydrophobicContact CE1-CG2 4.04Å; F305-T309 HydrophobicContact CE2-CG2 3.84Å; F305-T309 HydrophobicContact CZ-CG2 3.71Å; F305-T309 WeakPolarHBondContact O-CG2 3.26Å; F305-T309 PolarHBondContact O-N 3.35Å; F305-T309 PolarHBondContact O-OG1 2.92Å; F306-T309 PolarHBondContact O-OG1 3.35Å; L307-T309 VanDerWaalsContact C-N 3.32Å; L307-T309 PolarHBondContact O-N 3.05Å
310S85.8Confident89.8Confident18 Ų1848.9 Ų48.913%0.12626%0.256CS..  trans-72.5131.4178.872.30000112.8L307 L308 H312 L313L307-S310 WeakPolarHBondContact O-CB 3.4Å; L307-S310 PolarHBondContact O-N 3.12Å; L307-S310 PolarHBondContact O-OG 3.13Å; L308-S310 VanDerWaalsContact C-N 3.27Å; L308-S310 PolarHBondContact O-N 3.39Å; S310-H312 PolarHBondContact O-N 3.24Å; S310-L313 PolarHBondContact O-N 3.41Å
311S73.5Confident89.9Confident100 Ų10048.8 Ų48.870%0.69926%0.256SS*.THydrogen-bonded Turntrans-65-1.2-170.656.80000116.4
312H76.8Confident89.8Confident128 Ų12848.8 Ų48.859%0.59326%0.256SS*.THydrogen-bonded Turntrans-138.926.9-172.8-57.9-60.2000112.1R271 S310R271-H312 WeakPolarHBondContact CD-O 3.22Å; R271-H312 VanDerWaalsContact NH1-CB 3.34Å; S310-H312 PolarHBondContact O-N 3.24Å
313L84.9Confident89.8Confident12 Ų1248.5 Ų48.56%0.06326%0.261CS..  trans-80.3128.7170.1-167.665.8000109.9R271 V275 L307 S310 D317 R318 V321R271-L313 HydrophobicContact CG-CD1 4.28Å; V275-L313 HydrophobicContact CG2-CD1 3.63Å; L307-L313 HydrophobicContact CD1-CD1 4.48Å; S310-L313 PolarHBondContact O-N 3.41Å; L313-D317 HydrophobicContact CD1-CB 3.8Å; L313-D317 HydrophobicContact CG-CB 4.17Å; L313-R318 HydrophobicContact CD2-CB 4.08Å; L313-R318 HydrophobicContact CG-CB 4.47Å; L313-V321 HydrophobicContact CD2-CG2 4.27Å
314D84.8Confident89.9Confident85 Ų8546 Ų4646%0.45525%0.25SC..  trans-64.9148177.1-174.2-88000111.5D316 D317 R318D314-D316 PolarHBondContact O-N 3.45Å; D314-D316 PolarHBondContact OD1-N 3.11Å; D314-D317 HydrophobicContact CB-CB 4.13Å; D314-D317 PolarHBondContact O-N 2.73Å; D314-R318 PolarHBondContact O-N 2.69Å
315P82.6Confident89.9Confident78 Ų7846 Ų4651%0.50625%0.249SC..Hα-helixtrans-57.4-38.6178.3-27.236.9000115.4D317 R318 L319P315-D317 VanDerWaalsContact C-N 3.32Å; P315-R318 WeakPolarHBondContact O-CB 3.1Å; P315-R318 PolarHBondContact O-N 3.39Å; P315-L319 PolarHBondContact O-N 3.5Å
316D83.4Confident90Very high87 Ų8744.6 Ų44.647%0.46524%0.244SC..Hα-helixtrans-71.6-32.1178.2-85.914000110.3D314 S320 K547D314-D316 PolarHBondContact O-N 3.45Å; D314-D316 PolarHBondContact OD1-N 3.11Å; D316-S320 PolarHBondContact O-N 3.33Å; D316-S320 PolarHBondContact O-OG 2.85Å; D316-K547 IonicContact OD2-NZ 3.21Å; D316-K547 PolarHBondContact OD2-NZ 2.96Å
317D90.8Very high90Very high35 Ų3542.2 Ų42.219%0.18723%0.234CC..Hα-helixtrans-73.5-36.6174.9-69.8-17000112.2V275 K279 L313 D314 P315 L319 S320 V321V275-D317 HydrophobicContact CG1-CB 3.88Å; V275-D317 WeakPolarHBondContact CG1-OD1 3.37Å; V275-D317 HydrophobicContact CG2-CB 4.01Å; K279-D317 IonicContact NZ-OD1 2.91Å; K279-D317 PolarHBondContact NZ-OD1 3Å; L313-D317 HydrophobicContact CD1-CB 3.8Å; L313-D317 HydrophobicContact CG-CB 4.17Å; D314-D317 HydrophobicContact CB-CB 4.13Å; D314-D317 PolarHBondContact O-N 2.73Å; P315-D317 VanDerWaalsContact C-N 3.32Å; D317-L319 PolarHBondContact O-N 3.42Å; D317-S320 WeakPolarHBondContact O-CB 3.08Å; D317-S320 PolarHBondContact O-N 3.42Å; D317-S320 VanDerWaalsContact O-N 3.15Å; D317-V321 WeakPolarHBondContact O-CG2 3.26Å; D317-V321 PolarHBondContact O-N 3.17Å
318R92.1Very high90.1Very high64 Ų6442.2 Ų42.224%0.24223%0.234CC..Hα-helixtrans-57.2-48.4172.9-178.6-171.5-59.7165.77.6111.5L308 L313 D314 P315 S320 V321 L322 D355L308-R318 HydrophobicContact CD1-CG 3.69Å; L313-R318 HydrophobicContact CD2-CB 4.08Å; L313-R318 HydrophobicContact CG-CB 4.47Å; D314-R318 PolarHBondContact O-N 2.69Å; P315-R318 WeakPolarHBondContact O-CB 3.1Å; P315-R318 PolarHBondContact O-N 3.39Å; R318-S320 PolarHBondContact O-N 2.97Å; R318-V321 PolarHBondContact O-N 2.65Å; R318-L322 HydrophobicContact CG-CD1 4.12Å; R318-L322 WeakPolarHBondContact O-CG 3.44Å; R318-L322 PolarHBondContact O-N 2.97Å; R318-D355 IonicContact CZ-OD2 2.79Å; R318-D355 IonicContact NH1-OD2 3.04Å; R318-D355 PolarHBondContact NH1-OD2 3.31Å
319L93.1Very high90.2Very high38 Ų3841.9 Ų41.920%0.19923%0.232CC..Hα-helixtrans-58.5-41176.6179.461.1000111.1P315 D317 V321 L322 L323 D359 V360 A363P315-L319 PolarHBondContact O-N 3.5Å; D317-L319 PolarHBondContact O-N 3.42Å; L319-V321 PolarHBondContact O-N 2.91Å; L319-L322 PolarHBondContact O-N 3.35Å; L319-L323 HydrophobicContact CD1-CD1 4.38Å; L319-L323 HydrophobicContact CD1-CG 4.25Å; L319-L323 HydrophobicContact CG-CD1 4.14Å; L319-L323 HydrophobicContact CG-CG 4.44Å; L319-L323 VanDerWaalsContact O-CG 3.31Å; L319-L323 WeakPolarHBondContact O-CG 3.47Å; L319-L323 PolarHBondContact O-N 3.38Å; L319-D359 HydrophobicContact CD1-CB 4.01Å; L319-D359 HydrophobicContact CD2-CB 3.78Å; L319-V360 HydrophobicContact CB-CG2 4.43Å; L319-V360 HydrophobicContact CD1-CG2 4.47Å; L319-A363 HydrophobicContact CD1-CB 4.14Å
320S93.7Very high90.5Very high28 Ų2844 Ų4420%0.19624%0.237CC..Hα-helixtrans-63-39.6178.7-52.90000112.6K279 D316 D317 R318 A324K279-S320 VanDerWaalsContact CE-CB 3.49Å; K279-S320 WeakPolarHBondContact CE-OG 3.18Å; D316-S320 PolarHBondContact O-N 3.33Å; D316-S320 PolarHBondContact O-OG 2.85Å; D317-S320 WeakPolarHBondContact O-CB 3.08Å; D317-S320 PolarHBondContact O-N 3.42Å; D317-S320 VanDerWaalsContact O-N 3.15Å; R318-S320 PolarHBondContact O-N 2.97Å; S320-A324 PolarHBondContact O-N 3.36Å
321V96.4Very high90.8Very high0 Ų044.2 Ų44.20%024%0.24CC..Hα-helixtrans-70.3-39.6175.4178.70000111.5V278 L304 L307 L308 L313 D317 R318 L319 A324 I325V278-V321 HydrophobicContact CG1-CG2 4.29Å; L304-V321 HydrophobicContact CB-CG1 4.21Å; L304-V321 WeakPolarHBondContact O-CG1 3.27Å; L307-V321 HydrophobicContact CD2-CG2 3.74Å; L307-V321 HydrophobicContact CG-CG2 4.17Å; L308-V321 HydrophobicContact CB-CG1 3.95Å; L308-V321 HydrophobicContact CD1-CB 4.44Å; L308-V321 HydrophobicContact CD1-CG1 4.34Å; L313-V321 HydrophobicContact CD2-CG2 4.27Å; D317-V321 WeakPolarHBondContact O-CG2 3.26Å; D317-V321 PolarHBondContact O-N 3.17Å; R318-V321 PolarHBondContact O-N 2.65Å; L319-V321 PolarHBondContact O-N 2.91Å; V321-A324 PolarHBondContact O-N 3.1Å; V321-I325 HydrophobicContact CG1-CD1 4.2Å; V321-I325 WeakPolarHBondContact O-CG1 3.39Å; V321-I325 PolarHBondContact O-N 2.83Å
322L95.9Very high91.8Very high0 Ų040.7 Ų40.70%022%0.216CC..Hα-helixtrans-62.6-43.2175.3-73.8168.4000112.1L308 R318 L319 A324 I325 G326 M348 F351 V360 A363 I367L308-L322 HydrophobicContact CD1-CD2 4.04Å; L308-L322 HydrophobicContact CD1-CG 3.89Å; L308-L322 HydrophobicContact CD2-CD2 3.71Å; L308-L322 HydrophobicContact CD2-CG 4.45Å; R318-L322 HydrophobicContact CG-CD1 4.12Å; R318-L322 WeakPolarHBondContact O-CG 3.44Å; R318-L322 PolarHBondContact O-N 2.97Å; L319-L322 PolarHBondContact O-N 3.35Å; L322-A324 PolarHBondContact O-N 2.89Å; L322-I325 PolarHBondContact O-N 2.96Å; L322-G326 PolarHBondContact O-N 3.13Å; L322-M348 HydrophobicContact CD2-CE 3.72Å; L322-M348 HydrophobicContact CD2-SD 3.75Å; L322-F351 HydrophobicContact CD2-CD2 4.23Å; L322-F351 HydrophobicContact CD2-CE2 4.44Å; L322-V360 HydrophobicContact CD1-CB 4.35Å; L322-V360 HydrophobicContact CD1-CG1 3.73Å; L322-V360 HydrophobicContact CD1-CG2 4.27Å; L322-A363 HydrophobicContact CB-CB 3.92Å; L322-I367 HydrophobicContact CB-CD1 4.42Å; L322-I367 HydrophobicContact CD2-CD1 3.96Å; L322-I367 WeakPolarHBondContact O-CD1 3.5Å
323L95.1Very high92.5Very high91 Ų9139.2 Ų39.248%0.47621%0.209SC..Hα-helixtrans-61.1-44.6176.4-69.6172.2000111.3L319 I325 G326 E327 A363L319-L323 HydrophobicContact CD1-CD1 4.38Å; L319-L323 HydrophobicContact CD1-CG 4.25Å; L319-L323 HydrophobicContact CG-CD1 4.14Å; L319-L323 HydrophobicContact CG-CG 4.44Å; L319-L323 VanDerWaalsContact O-CG 3.31Å; L319-L323 WeakPolarHBondContact O-CG 3.47Å; L319-L323 PolarHBondContact O-N 3.38Å; L323-I325 VanDerWaalsContact C-N 3.34Å; L323-I325 PolarHBondContact O-N 3.11Å; L323-G326 WeakPolarHBondContact O-CA 3.26Å; L323-G326 PolarHBondContact O-N 2.87Å; L323-G326 VanDerWaalsContact O-N 3.07Å; L323-E327 WeakPolarHBondContact O-CG 3.36Å; L323-E327 PolarHBondContact O-N 3.32Å; L323-A363 HydrophobicContact CD2-CB 4.41Å
324A96.6Very high93Very high4 Ų443.4 Ų43.43%0.03323%0.228CC..Hα-helixtrans-62.5-37.1175.600000113.2V278 L304 S320 V321 L322 C328V278-A324 HydrophobicContact CG1-CB 3.63Å; L304-A324 HydrophobicContact CD1-CB 4.14Å; S320-A324 PolarHBondContact O-N 3.36Å; V321-A324 PolarHBondContact O-N 3.1Å; L322-A324 PolarHBondContact O-N 2.89Å; A324-C328 PolarHBondContact O-N 3.01Å; A324-C328 VanDerWaalsContact O-N 3.09Å; A324-C328 PolarHBondContact O-SG 3.15Å
325I96.9Very high93.5Very high0 Ų039.4 Ų39.40%021%0.207CC..Hα-helixtrans-63.1-44.4171.3-68.5168000109.9L304 L308 V321 L322 L323 C328 T329 L339 I367L304-I325 HydrophobicContact CB-CD1 3.94Å; L304-I325 HydrophobicContact CB-CG1 3.58Å; L304-I325 HydrophobicContact CD1-CG1 3.76Å; L304-I325 HydrophobicContact CG-CG1 4.31Å; L308-I325 HydrophobicContact CD2-CD1 3.86Å; V321-I325 HydrophobicContact CG1-CD1 4.2Å; V321-I325 WeakPolarHBondContact O-CG1 3.39Å; V321-I325 PolarHBondContact O-N 2.83Å; L322-I325 PolarHBondContact O-N 2.96Å; L323-I325 VanDerWaalsContact C-N 3.34Å; L323-I325 PolarHBondContact O-N 3.11Å; I325-C328 WeakPolarHBondContact O-CB 2.95Å; I325-C328 PolarHBondContact O-N 3.47Å; I325-T329 HydrophobicContact CG2-CG2 4.13Å; I325-T329 WeakPolarHBondContact O-CG2 3.47Å; I325-T329 PolarHBondContact O-N 3.41Å; I325-T329 PolarHBondContact O-OG1 3.34Å; I325-T329 VanDerWaalsContact O-OG1 3.1Å; I325-L339 HydrophobicContact CG2-CD1 4.15Å; I325-L339 HydrophobicContact CG2-CD2 4.27Å; I325-I367 HydrophobicContact CB-CD1 4.25Å; I325-I367 HydrophobicContact CG2-CD1 4.01Å; I325-I367 HydrophobicContact CG2-CG1 4.27Å; I325-I367 HydrophobicContact CG2-CG2 4.16Å
326G95.9Very high94.1Very high2 Ų236.6 Ų36.62%0.02119%0.187CC..Hα-helixtrans-58.6-47.2176.900000113.4L322 L323 C328 T329 E330L322-G326 PolarHBondContact O-N 3.13Å; L323-G326 WeakPolarHBondContact O-CA 3.26Å; L323-G326 PolarHBondContact O-N 2.87Å; L323-G326 VanDerWaalsContact O-N 3.07Å; G326-C328 VanDerWaalsContact C-N 3.3Å; G326-C328 PolarHBondContact O-N 2.93Å; G326-T329 PolarHBondContact O-N 3Å; G326-T329 PolarHBondContact O-OG1 3.31Å; G326-E330 WeakPolarHBondContact O-CB 3.39Å; G326-E330 PolarHBondContact O-N 3.33Å
327E95.3Very high94.5Very high38 Ų3834.7 Ų34.718%0.17818%0.18CC..Hα-helixtrans-58.4-42174.5-69.4173.1140.800111.4S282 I285 T286 L323 A331S282-E327 VanDerWaalsContact CA-OE2 3.29Å; S282-E327 WeakPolarHBondContact CA-OE2 3.39Å; S282-E327 WeakPolarHBondContact CB-OE2 3.35Å; S282-E327 VanDerWaalsContact OG-CD 3.3Å; S282-E327 PolarHBondContact OG-OE1 3.37Å; S282-E327 PolarHBondContact OG-OE2 3.05Å; I285-E327 HydrophobicContact CD1-CB 4.12Å; I285-E327 HydrophobicContact CG1-CB 4.33Å; T286-E327 WeakPolarHBondContact CA-OE1 3.45Å; T286-E327 WeakPolarHBondContact CB-OE1 3.25Å; T286-E327 PolarHBondContact OG1-OE1 3.37Å; L323-E327 WeakPolarHBondContact O-CG 3.36Å; L323-E327 PolarHBondContact O-N 3.32Å; E327-A331 WeakPolarHBondContact O-CB 3.41Å; E327-A331 PolarHBondContact O-N 3.25Å
328C96.4Very high94.7Very high1 Ų133.2 Ų33.21%0.00717%0.172CC..Hα-helixtrans-65.6-49.6176.1-67.30000111.9V301 A324 I325 G326 E330 A331 S332 H335V301-C328 HydrophobicContact CG2-CB 4.01Å; A324-C328 PolarHBondContact O-N 3.01Å; A324-C328 VanDerWaalsContact O-N 3.09Å; A324-C328 PolarHBondContact O-SG 3.15Å; I325-C328 WeakPolarHBondContact O-CB 2.95Å; I325-C328 PolarHBondContact O-N 3.47Å; G326-C328 VanDerWaalsContact C-N 3.3Å; G326-C328 PolarHBondContact O-N 2.93Å; C328-E330 VanDerWaalsContact C-N 3.34Å; C328-E330 PolarHBondContact O-N 2.95Å; C328-A331 PolarHBondContact O-N 2.92Å; C328-S332 PolarHBondContact O-N 3.3Å; C328-H335 HydrophobicContact CB-CB 4.27Å; C328-H335 WeakPolarHBondContact O-CB 3.29Å; C328-H335 PolarHBondContact O-ND1 2.86Å
329T95.3Very high94.9Very high0 Ų030.1 Ų30.10%016%0.161CC..Hα-helixtrans-75.6-18.3-176.258.80000113.4I325 G326 H335 Q336 L339 T370I325-T329 HydrophobicContact CG2-CG2 4.13Å; I325-T329 WeakPolarHBondContact O-CG2 3.47Å; I325-T329 PolarHBondContact O-N 3.41Å; I325-T329 PolarHBondContact O-OG1 3.34Å; I325-T329 VanDerWaalsContact O-OG1 3.1Å; G326-T329 PolarHBondContact O-N 3Å; G326-T329 PolarHBondContact O-OG1 3.31Å; T329-H335 HydrophobicContact CG2-CB 4.48Å; T329-Q336 VanDerWaalsContact O-CG 3.25Å; T329-Q336 WeakPolarHBondContact O-CG 3.32Å; T329-Q336 PolarHBondContact O-NE2 2.97Å; T329-L339 HydrophobicContact CG2-CB 4.34Å; T329-L339 HydrophobicContact CG2-CD2 4.08Å; T329-T370 WeakPolarHBondContact CB-OG1 3.44Å; T329-T370 WeakPolarHBondContact O-CB 3.29Å; T329-T370 PolarHBondContact OG1-OG1 3.36Å
330E94.5Very high94.9Very high114 Ų11431.7 Ų31.753%0.53317%0.172SC..Hα-helixtrans-71.6-36167-178.2162.4-129.300111.5G326 C328 F366 T370G326-E330 WeakPolarHBondContact O-CB 3.39Å; G326-E330 PolarHBondContact O-N 3.33Å; C328-E330 VanDerWaalsContact C-N 3.34Å; C328-E330 PolarHBondContact O-N 2.95Å; E330-F366 HydrophobicContact CB-CE1 4.43Å; E330-F366 HydrophobicContact CB-CZ 4.12Å; E330-F366 HydrophobicContact CG-CZ 4.4Å; E330-T370 HydrophobicContact CB-CG2 3.98Å
331A93.9Very high94.8Very high24 Ų2435.8 Ų35.820%0.19819%0.192CC..Hα-helixtrans-83-23.7-169.900000116.4P289 A292 E327 C328P289-A331 HydrophobicContact CB-CB 4.16Å; A292-A331 HydrophobicContact CB-CB 3.36Å; E327-A331 WeakPolarHBondContact O-CB 3.41Å; E327-A331 PolarHBondContact O-N 3.25Å; C328-A331 PolarHBondContact O-N 2.92Å
332S93Very high94.7Very high26 Ų2637.1 Ų37.118%0.18220%0.201CC..  trans-153.2139.8-172.7-177.20000114.6C328 E334 H335 Q336C328-S332 PolarHBondContact O-N 3.3Å; S332-E334 VanDerWaalsContact C-N 3.28Å; S332-E334 PolarHBondContact O-N 2.89Å; S332-E334 PolarHBondContact OG-N 3.5Å; S332-H335 PolarHBondContact O-N 3.26Å; S332-Q336 WeakPolarHBondContact O-CG 3.46Å; S332-Q336 PolarHBondContact O-N 3.21Å
333E92.7Very high94.5Very high96 Ų9638.8 Ų38.845%0.44922%0.217SC..Hα-helixtrans-66.2-28.1172.1-62.8-169.1150.400112.7Q336 S337 S377E333-Q336 VanDerWaalsContact CA-OE1 3.3Å; E333-Q336 PolarHBondContact O-N 2.85Å; E333-S337 WeakPolarHBondContact O-CB 3.43Å; E333-S337 PolarHBondContact O-N 3.39Å; E333-S337 PolarHBondContact O-OG 2.62Å; E333-S377 PolarHBondContact OE1-OG 3.4Å
334E94Very high94.5Very high101 Ų10134.4 Ų34.447%0.47220%0.195SC..Hα-helixtrans-64-45.2173.317760.5-148.800110.5A296 S332 Q336 S337 Q338A296-E334 HydrophobicContact CB-CB 3.94Å; A296-E334 HydrophobicContact CB-CG 3.63Å; S332-E334 VanDerWaalsContact C-N 3.28Å; S332-E334 PolarHBondContact O-N 2.89Å; S332-E334 PolarHBondContact OG-N 3.5Å; E334-Q336 VanDerWaalsContact C-N 3.33Å; E334-Q336 PolarHBondContact O-N 3.07Å; E334-S337 WeakPolarHBondContact O-CB 3.38Å; E334-S337 PolarHBondContact O-N 3Å; E334-Q338 VanDerWaalsContact O-CG 3.26Å; E334-Q338 WeakPolarHBondContact O-CG 3.16Å; E334-Q338 PolarHBondContact O-N 3.17Å; E334-Q338 PolarHBondContact OE1-NE2 3.38Å
335H95.8Very high94.3Very high0 Ų036 Ų360%020%0.202CC..Hα-helixtrans-63.5-37175.1-73.4155.1000113.2A292 A296 V301 C328 T329 S332 S337 L339A292-H335 PolarHBondContact O-CE1 3.36Å; A296-H335 WeakPolarHBondContact CA-NE2 3.31Å; A296-H335 PolarHBondContact N-NE2 2.93Å; V301-H335 HydrophobicContact CG2-CB 3.87Å; C328-H335 HydrophobicContact CB-CB 4.27Å; C328-H335 WeakPolarHBondContact O-CB 3.29Å; C328-H335 PolarHBondContact O-ND1 2.86Å; T329-H335 HydrophobicContact CG2-CB 4.48Å; S332-H335 PolarHBondContact O-N 3.26Å; H335-S337 VanDerWaalsContact C-N 3.34Å; H335-L339 PolarHBondContact O-N 3.1Å; H335-L339 VanDerWaalsContact O-N 3.1Å
336Q95.1Very high94.2Very high19 Ų1939.9 Ų39.99%0.08923%0.227CC..Hα-helixtrans-64.8-42175.7-65.1158.1-1.700110.3T329 S332 E333 E334 L339 V340 A374T329-Q336 VanDerWaalsContact O-CG 3.25Å; T329-Q336 WeakPolarHBondContact O-CG 3.32Å; T329-Q336 PolarHBondContact O-NE2 2.97Å; S332-Q336 WeakPolarHBondContact O-CG 3.46Å; S332-Q336 PolarHBondContact O-N 3.21Å; E333-Q336 VanDerWaalsContact CA-OE1 3.3Å; E333-Q336 PolarHBondContact O-N 2.85Å; E334-Q336 VanDerWaalsContact C-N 3.33Å; E334-Q336 PolarHBondContact O-N 3.07Å; Q336-L339 PolarHBondContact O-N 3.27Å; Q336-V340 WeakPolarHBondContact O-CG2 3.49Å; Q336-V340 PolarHBondContact O-N 2.74Å; Q336-V340 VanDerWaalsContact O-N 3.14Å; Q336-A374 HydrophobicContact CB-CB 4.16Å; Q336-A374 HydrophobicContact CG-CB 4.36Å
337S92.8Very high94.1Very high47 Ų4742.3 Ų42.333%0.32924%0.239SC..Hα-helixtrans-62.4-47.9175.8-550000111.3E333 E334 H335 L339 V340 D341E333-S337 WeakPolarHBondContact O-CB 3.43Å; E333-S337 PolarHBondContact O-N 3.39Å; E333-S337 PolarHBondContact O-OG 2.62Å; E334-S337 WeakPolarHBondContact O-CB 3.38Å; E334-S337 PolarHBondContact O-N 3Å; H335-S337 VanDerWaalsContact C-N 3.34Å; S337-L339 VanDerWaalsContact C-N 3.26Å; S337-L339 PolarHBondContact O-N 3.36Å; S337-V340 WeakPolarHBondContact O-CA 3.11Å; S337-V340 WeakPolarHBondContact O-CB 3.48Å; S337-V340 PolarHBondContact O-N 2.95Å; S337-D341 PolarHBondContact O-N 3.41Å
338Q94.9Very high94.1Very high4 Ų440.5 Ų40.52%0.01923%0.231CC..Hα-helixtrans-56.7-36.3175-66.8174.311.200113.1A296 V301 Y302 E334 C342A296-Q338 PolarHBondContact O-NE2 3.04Å; V301-Q338 HydrophobicContact CB-CB 3.92Å; V301-Q338 HydrophobicContact CG1-CB 4.22Å; Y302-Q338 HydrophobicContact CD2-CB 4.31Å; Y302-Q338 HydrophobicContact CD2-CG 4.23Å; Y302-Q338 HydrophobicContact CE2-CB 3.85Å; Y302-Q338 HydrophobicContact CE2-CG 3.55Å; E334-Q338 VanDerWaalsContact O-CG 3.26Å; E334-Q338 WeakPolarHBondContact O-CG 3.16Å; E334-Q338 PolarHBondContact O-N 3.17Å; E334-Q338 PolarHBondContact OE1-NE2 3.38Å; Q338-C342 WeakPolarHBondContact O-CB 3.37Å; Q338-C342 PolarHBondContact O-N 3.4Å; Q338-C342 VanDerWaalsContact O-N 3.14Å; Q338-C342 PolarHBondContact O-SG 2.83Å
339L95.5Very high93.9Very high0 Ų044.6 Ų44.60%025%0.252CS..Hα-helixtrans-70.2-34.8175.5-170.167.2000112.5V301 I325 T329 H335 Q336 S337 C342 G344 I367V301-L339 HydrophobicContact CG1-CB 3.83Å; V301-L339 HydrophobicContact CG1-CD1 3.9Å; V301-L339 HydrophobicContact CG1-CG 4.48Å; I325-L339 HydrophobicContact CG2-CD1 4.15Å; I325-L339 HydrophobicContact CG2-CD2 4.27Å; T329-L339 HydrophobicContact CG2-CB 4.34Å; T329-L339 HydrophobicContact CG2-CD2 4.08Å; H335-L339 PolarHBondContact O-N 3.1Å; H335-L339 VanDerWaalsContact O-N 3.1Å; Q336-L339 PolarHBondContact O-N 3.27Å; S337-L339 VanDerWaalsContact C-N 3.26Å; S337-L339 PolarHBondContact O-N 3.36Å; L339-C342 PolarHBondContact O-SG 3.34Å; L339-C342 VanDerWaalsContact O-SG 3.38Å; L339-G344 VanDerWaalsContact O-CA 3.28Å; L339-G344 WeakPolarHBondContact O-CA 3.37Å; L339-G344 PolarHBondContact O-N 3.4Å; L339-I367 HydrophobicContact CD2-CG2 3.28Å
340V92.8Very high93.8Very high70 Ų7047.2 Ų47.242%0.42427%0.268SS..Hα-helixtrans-68.2-49.6175175.30000109.9Q336 S337 C342 G343 L345Q336-V340 WeakPolarHBondContact O-CG2 3.49Å; Q336-V340 PolarHBondContact O-N 2.74Å; Q336-V340 VanDerWaalsContact O-N 3.14Å; S337-V340 WeakPolarHBondContact O-CA 3.11Å; S337-V340 WeakPolarHBondContact O-CB 3.48Å; S337-V340 PolarHBondContact O-N 2.95Å; V340-C342 VanDerWaalsContact C-N 3.3Å; V340-C342 PolarHBondContact O-N 3.29Å; V340-G343 PolarHBondContact O-N 3.38Å; V340-L345 HydrophobicContact CG2-CD1 3.95Å; V340-L345 HydrophobicContact CG2-CG 4.21Å
341D92.5Very high93.8Very high115 Ų11543.1 Ų43.162%0.61525%0.248SC*.Hα-helixtrans-60.3-36.3-177.2-69.5-20.1000112.9Y302 S337 G343Y302-D341 HydrophobicContact CE1-CB 4.18Å; Y302-D341 WeakPolarHBondContact OH-CB 3.25Å; Y302-D341 PolarHBondContact OH-OD2 3.34Å; S337-D341 PolarHBondContact O-N 3.41Å; D341-G343 PolarHBondContact O-N 3.05Å
342C93.6Very high93.7Very high28 Ų2844.9 Ų44.919%0.18925%0.254CS..THydrogen-bonded Turntrans-801.6177.1810000114.4Y302 F305 Q338 L339 V340Y302-C342 HydrophobicContact CD1-CB 3.64Å; Y302-C342 HydrophobicContact CE1-CB 3.85Å; F305-C342 HydrophobicContact CD1-CB 3.9Å; F305-C342 VanDerWaalsContact CD1-SG 3.57Å; F305-C342 HydrophobicContact CE1-CB 4.29Å; F305-C342 WeakPolarHBondContact CE1-O 3.39Å; F305-C342 HydrophobicContact CG-CB 4.33Å; F305-C342 WeakPolarHBondContact CG-SG 3.43Å; F305-C342 WeakPolarHBondContact CZ-O 3.45Å; Q338-C342 WeakPolarHBondContact O-CB 3.37Å; Q338-C342 PolarHBondContact O-N 3.4Å; Q338-C342 VanDerWaalsContact O-N 3.14Å; Q338-C342 PolarHBondContact O-SG 2.83Å; L339-C342 PolarHBondContact O-SG 3.34Å; L339-C342 VanDerWaalsContact O-SG 3.38Å; V340-C342 VanDerWaalsContact C-N 3.3Å; V340-C342 PolarHBondContact O-N 3.29Å
343G92.5Very high93.7Very high34 Ų3448.2 Ų48.235%0.35127%0.274SS..THydrogen-bonded Turntrans72.630.7-175.600000113.4V340 D341 P346V340-G343 PolarHBondContact O-N 3.38Å; D341-G343 PolarHBondContact O-N 3.05Å; G343-P346 WeakPolarHBondContact O-CD 3.49Å
344G93.6Very high93.7Very high0 Ų050.6 Ų50.60%029%0.285CS..Hα-helixtrans-70.5-33.3-17800000114.6L339 I347 M348L339-G344 VanDerWaalsContact O-CA 3.28Å; L339-G344 WeakPolarHBondContact O-CA 3.37Å; L339-G344 PolarHBondContact O-N 3.4Å; G344-I347 PolarHBondContact O-N 3.22Å; G344-I347 VanDerWaalsContact O-N 3.15Å; G344-M348 WeakPolarHBondContact O-CG 3.41Å; G344-M348 PolarHBondContact O-N 3.48Å
345L93.2Very high93.4Very high38 Ų3847 Ų4720%0.19927%0.268CS..Hα-helixtrans-59.9-47.4-176.6-58.8-177.3000113.5V340 I347 M348 I349 L368 C371V340-L345 HydrophobicContact CG2-CD1 3.95Å; V340-L345 HydrophobicContact CG2-CG 4.21Å; L345-I347 VanDerWaalsContact C-N 3.3Å; L345-I347 PolarHBondContact O-N 3.27Å; L345-M348 PolarHBondContact O-N 3.39Å; L345-I349 WeakPolarHBondContact O-CG1 3.32Å; L345-I349 PolarHBondContact O-N 3.04Å; L345-L368 HydrophobicContact CD2-CD2 3.95Å; L345-C371 HydrophobicContact CD2-CB 3.97Å
346P93.9Very high93Very high80 Ų8052.6 Ų52.652%0.51931%0.308SS..Hα-helixtrans-54.3-43.3172.3-28.135000113.5G343 I349 T350G343-P346 WeakPolarHBondContact O-CD 3.49Å; P346-I349 WeakPolarHBondContact O-CB 3.39Å; P346-I349 PolarHBondContact O-N 3.36Å; P346-T350 PolarHBondContact O-N 3.04Å; P346-T350 PolarHBondContact O-OG1 2.83Å
347I94.1Very high92.9Very high53 Ų5353.6 Ų53.627%0.27232%0.317SS..Hα-helixtrans-67.1-38.2-179.9-62.9-60.6000111.5F305 G344 L345 I349 T350 F351F305-I347 HydrophobicContact CE2-CB 4.03Å; F305-I347 HydrophobicContact CE2-CG1 3.8Å; F305-I347 HydrophobicContact CE2-CG2 4.29Å; F305-I347 HydrophobicContact CZ-CG1 3.95Å; G344-I347 PolarHBondContact O-N 3.22Å; G344-I347 VanDerWaalsContact O-N 3.15Å; L345-I347 VanDerWaalsContact C-N 3.3Å; L345-I347 PolarHBondContact O-N 3.27Å; I347-I349 VanDerWaalsContact C-N 3.33Å; I347-T350 PolarHBondContact O-N 2.91Å; I347-F351 HydrophobicContact CG2-CD2 3.78Å; I347-F351 HydrophobicContact CG2-CE2 3.36Å; I347-F351 HydrophobicContact CG2-CZ 4.17Å; I347-F351 WeakPolarHBondContact O-CD2 3.49Å; I347-F351 PolarHBondContact O-N 3.34Å
348M95.8Very high92.9Very high0 Ų055.4 Ų55.40%032%0.32CS..Hα-helixtrans-63.7-38.5171.9-64.1-55.2116.900112L308 L322 G344 L345 F351 L352 A364 I367 L368L308-M348 HydrophobicContact CD2-CE 3.61Å; L322-M348 HydrophobicContact CD2-CE 3.72Å; L322-M348 HydrophobicContact CD2-SD 3.75Å; G344-M348 WeakPolarHBondContact O-CG 3.41Å; G344-M348 PolarHBondContact O-N 3.48Å; L345-M348 PolarHBondContact O-N 3.39Å; M348-F351 HydrophobicContact CE-CD2 4.32Å; M348-F351 PolarHBondContact O-N 3.21Å; M348-L352 WeakPolarHBondContact O-CB 3.45Å; M348-L352 PolarHBondContact O-N 2.93Å; M348-A364 WeakPolarHBondContact O-CB 3.24Å; M348-A364 HydrophobicContact SD-CB 4.4Å; M348-I367 HydrophobicContact CG-CB 4.41Å; M348-I367 HydrophobicContact CG-CG2 3.93Å; M348-I367 HydrophobicContact SD-CB 4.18Å; M348-I367 HydrophobicContact SD-CD1 3.53Å; M348-I367 VanDerWaalsContact SD-CD1 3.53Å; M348-I367 HydrophobicContact SD-CG1 4.47Å; M348-I367 HydrophobicContact SD-CG2 4.02Å; M348-L368 HydrophobicContact CB-CD1 4.1Å; M348-L368 HydrophobicContact CB-CD2 3.8Å; M348-L368 HydrophobicContact CB-CG 3.77Å
349I93Very high92.8Very high88 Ų8859.2 Ų59.245%0.45134%0.341SS..Hα-helixtrans-64.5-46.4175.4-66.5164.3000110.2L345 P346 I347 F351 L352 T353 L368L345-I349 WeakPolarHBondContact O-CG1 3.32Å; L345-I349 PolarHBondContact O-N 3.04Å; P346-I349 WeakPolarHBondContact O-CB 3.39Å; P346-I349 PolarHBondContact O-N 3.36Å; I347-I349 VanDerWaalsContact C-N 3.33Å; I349-F351 PolarHBondContact O-N 3.47Å; I349-L352 WeakPolarHBondContact O-CB 3.43Å; I349-L352 PolarHBondContact O-N 3.28Å; I349-L352 VanDerWaalsContact O-N 3.08Å; I349-T353 HydrophobicContact CG2-CG2 4.45Å; I349-T353 PolarHBondContact O-N 2.92Å; I349-T353 PolarHBondContact O-OG1 3Å; I349-L368 HydrophobicContact CG1-CD1 4.05Å; I349-L368 HydrophobicContact CG1-CD2 4.26Å
350T93.7Very high92.6Very high55 Ų5559.3 Ų59.334%0.33734%0.341SS..Hα-helixtrans-56.2-46.8173.7-64.40000111.7P346 I347 L352 T353 E354P346-T350 PolarHBondContact O-N 3.04Å; P346-T350 PolarHBondContact O-OG1 2.83Å; I347-T350 PolarHBondContact O-N 2.91Å; T350-L352 VanDerWaalsContact C-N 3.3Å; T350-L352 PolarHBondContact O-N 3.16Å; T350-T353 PolarHBondContact O-N 3.18Å; T350-T353 PolarHBondContact O-OG1 2.64Å; T350-E354 HydrophobicContact CG2-CB 4.41Å; T350-E354 HydrophobicContact CG2-CG 4.5Å; T350-E354 WeakPolarHBondContact O-CB 3.09Å; T350-E354 PolarHBondContact O-N 3.33Å
351F93.4Very high92.7Very high27 Ų2760.8 Ų60.812%0.11834%0.339CS..Hα-helixtrans-63.3-34.4176-73.8-48.9000113L308 L322 I347 M348 I349 D355 V360 R361 A364L308-F351 HydrophobicContact CD1-CE2 4.04Å; L308-F351 HydrophobicContact CD1-CZ 4.21Å; L308-F351 HydrophobicContact CD2-CE2 3.86Å; L308-F351 HydrophobicContact CG-CE2 3.92Å; L308-F351 HydrophobicContact CG-CZ 4.3Å; L322-F351 HydrophobicContact CD2-CD2 4.23Å; L322-F351 HydrophobicContact CD2-CE2 4.44Å; I347-F351 HydrophobicContact CG2-CD2 3.78Å; I347-F351 HydrophobicContact CG2-CE2 3.36Å; I347-F351 HydrophobicContact CG2-CZ 4.17Å; I347-F351 WeakPolarHBondContact O-CD2 3.49Å; I347-F351 PolarHBondContact O-N 3.34Å; M348-F351 HydrophobicContact CE-CD2 4.32Å; M348-F351 PolarHBondContact O-N 3.21Å; I349-F351 PolarHBondContact O-N 3.47Å; F351-D355 HydrophobicContact CD1-CB 4.31Å; F351-D355 VanDerWaalsContact O-CB 3.27Å; F351-D355 WeakPolarHBondContact O-CB 3.4Å; F351-D355 PolarHBondContact O-N 2.83Å; F351-V360 HydrophobicContact CB-CG1 4Å; F351-V360 HydrophobicContact CD1-CG1 4.09Å; F351-V360 HydrophobicContact CG-CG1 4.18Å; F351-R361 VanDerWaalsContact O-CG 3.31Å; F351-R361 WeakPolarHBondContact O-CG 3.5Å; F351-A364 HydrophobicContact CB-CB 3.95Å
352L92.8Very high92.8Very high61 Ų6160.1 Ų60.132%0.31933%0.331SS..Hα-helixtrans-67.8-39.3175.4177.457.3000112.8M348 I349 T350 R361 A364 T365 L368M348-L352 WeakPolarHBondContact O-CB 3.45Å; M348-L352 PolarHBondContact O-N 2.93Å; I349-L352 WeakPolarHBondContact O-CB 3.43Å; I349-L352 PolarHBondContact O-N 3.28Å; I349-L352 VanDerWaalsContact O-N 3.08Å; T350-L352 VanDerWaalsContact C-N 3.3Å; T350-L352 PolarHBondContact O-N 3.16Å; L352-R361 HydrophobicContact CD1-CB 4.31Å; L352-R361 VanDerWaalsContact O-CD 3.28Å; L352-R361 WeakPolarHBondContact O-CD 2.81Å; L352-R361 WeakPolarHBondContact O-CG 3.41Å; L352-A364 HydrophobicContact CB-CB 4.4Å; L352-T365 WeakPolarHBondContact CD1-OG1 3.32Å; L352-L368 HydrophobicContact CD2-CD1 3.98Å
353T92.5Very high92.9Very high97 Ų9759.1 Ų59.160%0.59533%0.325SS*.Hα-helixtrans-93.4-32.3-173.453.60000114.5I349 T350I349-T353 HydrophobicContact CG2-CG2 4.45Å; I349-T353 PolarHBondContact O-N 2.92Å; I349-T353 PolarHBondContact O-OG1 3Å; T350-T353 PolarHBondContact O-N 3.18Å; T350-T353 PolarHBondContact O-OG1 2.64Å
354E91.4Very high93.1Very high146 Ų14657.5 Ų57.568%0.68231%0.308SS*.Hα-helixtrans-114.1-21.2-168-62.9174.3-145.600114.3T350T350-E354 HydrophobicContact CG2-CB 4.41Å; T350-E354 HydrophobicContact CG2-CG 4.5Å; T350-E354 WeakPolarHBondContact O-CB 3.09Å; T350-E354 PolarHBondContact O-N 3.33Å
355D89Confident93.1Very high24 Ų2459.7 Ų59.713%0.12832%0.321CS..  trans-75.5133.6-178.9-155.6-56.1000111.8R318 F351 S357 V360 R361R318-D355 IonicContact CZ-OD2 2.79Å; R318-D355 IonicContact NH1-OD2 3.04Å; R318-D355 PolarHBondContact NH1-OD2 3.31Å; F351-D355 HydrophobicContact CD1-CB 4.31Å; F351-D355 VanDerWaalsContact O-CB 3.27Å; F351-D355 WeakPolarHBondContact O-CB 3.4Å; F351-D355 PolarHBondContact O-N 2.83Å; D355-S357 VanDerWaalsContact C-N 3.3Å; D355-S357 PolarHBondContact O-N 2.93Å; D355-S357 WeakPolarHBondContact OD1-CB 3.42Å; D355-S357 PolarHBondContact OD1-N 3.44Å; D355-V360 HydrophobicContact CB-CB 4.47Å; D355-V360 HydrophobicContact CB-CG1 3.83Å; D355-R361 WeakPolarHBondContact O-CD 3.32Å
356S87.9Confident93.2Very high119 Ų11961.6 Ų61.683%0.83233%0.328SS*.SBendtrans-69.9-22.8176.758.80000114.1
357S91.2Very high93.3Very high39 Ų3957.8 Ų57.827%0.27330%0.304SS..  trans-80123.6-177.6175.90000111.3D355 V360 R361D355-S357 VanDerWaalsContact C-N 3.3Å; D355-S357 PolarHBondContact O-N 2.93Å; D355-S357 WeakPolarHBondContact OD1-CB 3.42Å; D355-S357 PolarHBondContact OD1-N 3.44Å; S357-V360 PolarHBondContact O-N 3.09Å; S357-V360 PolarHBondContact OG-N 3.37Å; S357-R361 WeakPolarHBondContact O-CG 3.41Å; S357-R361 PolarHBondContact O-N 2.93Å; S357-R361 VanDerWaalsContact O-N 3.09Å
358E92.9Very high93.3Very high86 Ų8657 Ų5740%0.40230%0.3SS..Hα-helixtrans-71.5-32.2-178.9-165.8-90.6175.400112.3R361 K362E358-R361 PolarHBondContact O-N 2.93Å; E358-K362 VanDerWaalsContact CD-CE 3.48Å; E358-K362 WeakPolarHBondContact O-CG 3.33Å; E358-K362 PolarHBondContact O-N 3.38Å; E358-K362 WeakPolarHBondContact OE1-CE 3.35Å; E358-K362 IonicContact OE1-NZ 2.73Å; E358-K362 PolarHBondContact OE1-NZ 3.37Å; E358-K362 WeakPolarHBondContact OE2-CE 3.23Å; E358-K362 IonicContact OE2-NZ 3.94Å; E358-K362 PolarHBondContact OE2-NZ 2.99Å
359D92.5Very high93.1Very high84 Ų8462.3 Ų62.345%0.44933%0.325SS..Hα-helixtrans-68.3-37.5172.3-65-50.2000112.4L319 K362 A363L319-D359 HydrophobicContact CD1-CB 4.01Å; L319-D359 HydrophobicContact CD2-CB 3.78Å; D359-K362 WeakPolarHBondContact O-CB 3.25Å; D359-K362 PolarHBondContact O-N 3Å; D359-A363 PolarHBondContact O-N 3.17Å
360V93.1Very high93Very high2 Ų258.3 Ų58.31%0.01230%0.304CS..Hα-helixtrans-64.1-45.8174.1167.70000110.8L319 L322 F351 D355 S357 K362 A363 A364L319-V360 HydrophobicContact CB-CG2 4.43Å; L319-V360 HydrophobicContact CD1-CG2 4.47Å; L322-V360 HydrophobicContact CD1-CB 4.35Å; L322-V360 HydrophobicContact CD1-CG1 3.73Å; L322-V360 HydrophobicContact CD1-CG2 4.27Å; F351-V360 HydrophobicContact CB-CG1 4Å; F351-V360 HydrophobicContact CD1-CG1 4.09Å; F351-V360 HydrophobicContact CG-CG1 4.18Å; D355-V360 HydrophobicContact CB-CB 4.47Å; D355-V360 HydrophobicContact CB-CG1 3.83Å; S357-V360 PolarHBondContact O-N 3.09Å; S357-V360 PolarHBondContact OG-N 3.37Å; V360-K362 VanDerWaalsContact C-N 3.32Å; V360-K362 PolarHBondContact O-N 2.58Å; V360-A363 PolarHBondContact O-N 3.34Å; V360-A364 WeakPolarHBondContact O-CB 3.46Å; V360-A364 PolarHBondContact O-N 2.75Å
361R93.9Very high92.7Very high100 Ų10055.8 Ų55.838%0.37729%0.289SS..Hα-helixtrans-61.8-38.2175.8-69.6-175-59.2177.76.3112.4F351 L352 D355 S357 E358 T365F351-R361 VanDerWaalsContact O-CG 3.31Å; F351-R361 WeakPolarHBondContact O-CG 3.5Å; L352-R361 HydrophobicContact CD1-CB 4.31Å; L352-R361 VanDerWaalsContact O-CD 3.28Å; L352-R361 WeakPolarHBondContact O-CD 2.81Å; L352-R361 WeakPolarHBondContact O-CG 3.41Å; D355-R361 WeakPolarHBondContact O-CD 3.32Å; S357-R361 WeakPolarHBondContact O-CG 3.41Å; S357-R361 PolarHBondContact O-N 2.93Å; S357-R361 VanDerWaalsContact O-N 3.09Å; E358-R361 PolarHBondContact O-N 2.93Å; R361-T365 WeakPolarHBondContact O-CB 3.46Å; R361-T365 PolarHBondContact O-N 2.96Å; R361-T365 PolarHBondContact O-OG1 2.91Å
362K95.3Very high92.1Very high102 Ų10261 Ų6144%0.44331%0.311SS..Hα-helixtrans-61.8-49.2172.4-82.5168.4168.11520112.1E358 D359 V360 T365 F366E358-K362 VanDerWaalsContact CD-CE 3.48Å; E358-K362 WeakPolarHBondContact O-CG 3.33Å; E358-K362 PolarHBondContact O-N 3.38Å; E358-K362 WeakPolarHBondContact OE1-CE 3.35Å; E358-K362 IonicContact OE1-NZ 2.73Å; E358-K362 PolarHBondContact OE1-NZ 3.37Å; E358-K362 WeakPolarHBondContact OE2-CE 3.23Å; E358-K362 IonicContact OE2-NZ 3.94Å; E358-K362 PolarHBondContact OE2-NZ 2.99Å; D359-K362 WeakPolarHBondContact O-CB 3.25Å; D359-K362 PolarHBondContact O-N 3Å; V360-K362 VanDerWaalsContact C-N 3.32Å; V360-K362 PolarHBondContact O-N 2.58Å; K362-T365 WeakPolarHBondContact O-CB 3.49Å; K362-T365 PolarHBondContact O-N 2.74Å; K362-F366 WeakPolarHBondContact O-CB 3.16Å; K362-F366 PolarHBondContact O-N 2.93Å
363A95.4Very high91.1Very high7 Ų764.6 Ų64.66%0.05832%0.324CS..Hα-helixtrans-61.3-45.517900000111.4L319 L322 L323 D359 V360 T365 F366 I367L319-A363 HydrophobicContact CD1-CB 4.14Å; L322-A363 HydrophobicContact CB-CB 3.92Å; L323-A363 HydrophobicContact CD2-CB 4.41Å; D359-A363 PolarHBondContact O-N 3.17Å; V360-A363 PolarHBondContact O-N 3.34Å; A363-T365 PolarHBondContact O-N 3.13Å; A363-F366 WeakPolarHBondContact O-CB 3.17Å; A363-F366 PolarHBondContact O-N 3.32Å; A363-I367 WeakPolarHBondContact O-CD1 3.47Å; A363-I367 VanDerWaalsContact O-CG1 3.29Å; A363-I367 WeakPolarHBondContact O-CG1 3.31Å; A363-I367 PolarHBondContact O-N 2.87Å
364A95.9Very high89.8Confident0 Ų060.3 Ų60.30%030%0.299CS..Hα-helixtrans-61.2-41.8174.700000112.7M348 F351 L352 V360 F366 I367 L368M348-A364 WeakPolarHBondContact O-CB 3.24Å; M348-A364 HydrophobicContact SD-CB 4.4Å; F351-A364 HydrophobicContact CB-CB 3.95Å; L352-A364 HydrophobicContact CB-CB 4.4Å; V360-A364 WeakPolarHBondContact O-CB 3.46Å; V360-A364 PolarHBondContact O-N 2.75Å; A364-F366 VanDerWaalsContact C-N 3.33Å; A364-F366 PolarHBondContact O-N 3.36Å; A364-I367 PolarHBondContact O-N 3.4Å; A364-L368 WeakPolarHBondContact O-CG 3.43Å; A364-L368 PolarHBondContact O-N 3.41Å
365T95.1Very high88.6Confident46 Ų4659.5 Ų59.528%0.28230%0.297SS..Hα-helixtrans-58.7-45173.9-58.20000111.4L352 R361 K362 A363 L368 Q369L352-T365 WeakPolarHBondContact CD1-OG1 3.32Å; R361-T365 WeakPolarHBondContact O-CB 3.46Å; R361-T365 PolarHBondContact O-N 2.96Å; R361-T365 PolarHBondContact O-OG1 2.91Å; K362-T365 WeakPolarHBondContact O-CB 3.49Å; K362-T365 PolarHBondContact O-N 2.74Å; A363-T365 PolarHBondContact O-N 3.13Å; T365-L368 PolarHBondContact O-N 3.29Å; T365-Q369 VanDerWaalsContact O-CG 3.32Å; T365-Q369 WeakPolarHBondContact O-CG 3.36Å; T365-Q369 PolarHBondContact O-N 2.63Å
366F95.2Very high87.5Confident78 Ų7863.7 Ų63.734%0.34232%0.319SS..Hα-helixtrans-62.9-48.4-179.7175.6-101.2000111.7E330 K362 A363 A364 L368 Q369 T370E330-F366 HydrophobicContact CB-CE1 4.43Å; E330-F366 HydrophobicContact CB-CZ 4.12Å; E330-F366 HydrophobicContact CG-CZ 4.4Å; K362-F366 WeakPolarHBondContact O-CB 3.16Å; K362-F366 PolarHBondContact O-N 2.93Å; A363-F366 WeakPolarHBondContact O-CB 3.17Å; A363-F366 PolarHBondContact O-N 3.32Å; A364-F366 VanDerWaalsContact C-N 3.33Å; A364-F366 PolarHBondContact O-N 3.36Å; F366-L368 VanDerWaalsContact C-N 3.33Å; F366-L368 PolarHBondContact O-N 3.33Å; F366-Q369 WeakPolarHBondContact O-CA 3.5Å; F366-Q369 WeakPolarHBondContact O-CB 3.39Å; F366-Q369 PolarHBondContact O-N 2.83Å; F366-T370 HydrophobicContact CE1-CG2 4.15Å; F366-T370 HydrophobicContact CE2-CG2 4.44Å; F366-T370 HydrophobicContact CZ-CG2 4.1Å; F366-T370 PolarHBondContact O-N 2.96Å
367I96.1Very high86.1Confident0 Ų060.8 Ų60.80%030%0.298CS..Hα-helixtrans-59-43.1176.7-63.7159.3000111.3L322 I325 L339 M348 A363 A364 Q369 T370 C371L322-I367 HydrophobicContact CB-CD1 4.42Å; L322-I367 HydrophobicContact CD2-CD1 3.96Å; L322-I367 WeakPolarHBondContact O-CD1 3.5Å; I325-I367 HydrophobicContact CB-CD1 4.25Å; I325-I367 HydrophobicContact CG2-CD1 4.01Å; I325-I367 HydrophobicContact CG2-CG1 4.27Å; I325-I367 HydrophobicContact CG2-CG2 4.16Å; L339-I367 HydrophobicContact CD2-CG2 3.28Å; M348-I367 HydrophobicContact CG-CB 4.41Å; M348-I367 HydrophobicContact CG-CG2 3.93Å; M348-I367 HydrophobicContact SD-CB 4.18Å; M348-I367 HydrophobicContact SD-CD1 3.53Å; M348-I367 VanDerWaalsContact SD-CD1 3.53Å; M348-I367 HydrophobicContact SD-CG1 4.47Å; M348-I367 HydrophobicContact SD-CG2 4.02Å; A363-I367 WeakPolarHBondContact O-CD1 3.47Å; A363-I367 VanDerWaalsContact O-CG1 3.29Å; A363-I367 WeakPolarHBondContact O-CG1 3.31Å; A363-I367 PolarHBondContact O-N 2.87Å; A364-I367 PolarHBondContact O-N 3.4Å; I367-Q369 VanDerWaalsContact C-N 3.3Å; I367-Q369 PolarHBondContact O-N 2.74Å; I367-T370 PolarHBondContact O-N 3.34Å; I367-T370 PolarHBondContact O-OG1 3.34Å; I367-C371 PolarHBondContact O-N 3.09Å; I367-C371 VanDerWaalsContact O-N 3.12Å; I367-C371 PolarHBondContact O-SG 2.82Å
368L94Very high84.3Confident36 Ų3663.5 Ų63.519%0.18831%0.309CS..Hα-helixtrans-63.8-35.2175.4-71.8171.2000112.2L345 M348 I349 L352 A364 T365 F366 K372L345-L368 HydrophobicContact CD2-CD2 3.95Å; M348-L368 HydrophobicContact CB-CD1 4.1Å; M348-L368 HydrophobicContact CB-CD2 3.8Å; M348-L368 HydrophobicContact CB-CG 3.77Å; I349-L368 HydrophobicContact CG1-CD1 4.05Å; I349-L368 HydrophobicContact CG1-CD2 4.26Å; L352-L368 HydrophobicContact CD2-CD1 3.98Å; A364-L368 WeakPolarHBondContact O-CG 3.43Å; A364-L368 PolarHBondContact O-N 3.41Å; T365-L368 PolarHBondContact O-N 3.29Å; F366-L368 VanDerWaalsContact C-N 3.33Å; F366-L368 PolarHBondContact O-N 3.33Å; L368-K372 WeakPolarHBondContact O-CB 3.45Å; L368-K372 PolarHBondContact O-N 3.03Å
369Q91.7Very high82.3Confident112 Ų11262.1 Ų62.152%0.52332%0.318SS..Hα-helixtrans-70-37.2175.5-73.8177.510.800112.9T365 F366 I367 K372 K373T365-Q369 VanDerWaalsContact O-CG 3.32Å; T365-Q369 WeakPolarHBondContact O-CG 3.36Å; T365-Q369 PolarHBondContact O-N 2.63Å; F366-Q369 WeakPolarHBondContact O-CA 3.5Å; F366-Q369 WeakPolarHBondContact O-CB 3.39Å; F366-Q369 PolarHBondContact O-N 2.83Å; I367-Q369 VanDerWaalsContact C-N 3.3Å; I367-Q369 PolarHBondContact O-N 2.74Å; Q369-K372 PolarHBondContact O-N 3.21Å; Q369-K373 WeakPolarHBondContact O-CG 3.32Å; Q369-K373 PolarHBondContact O-N 3.15Å
370T90.3Very high80Confident3 Ų363.5 Ų63.52%0.01833%0.329CS..Hα-helixtrans-64.8-46.617559.20000110.6T329 E330 F366 I367 K372 K373 A374T329-T370 WeakPolarHBondContact CB-OG1 3.44Å; T329-T370 WeakPolarHBondContact O-CB 3.29Å; T329-T370 PolarHBondContact OG1-OG1 3.36Å; E330-T370 HydrophobicContact CB-CG2 3.98Å; F366-T370 HydrophobicContact CE1-CG2 4.15Å; F366-T370 HydrophobicContact CE2-CG2 4.44Å; F366-T370 HydrophobicContact CZ-CG2 4.1Å; F366-T370 PolarHBondContact O-N 2.96Å; I367-T370 PolarHBondContact O-N 3.34Å; I367-T370 PolarHBondContact O-OG1 3.34Å; T370-K372 VanDerWaalsContact C-N 3.33Å; T370-K372 PolarHBondContact O-N 3.25Å; T370-K373 WeakPolarHBondContact O-CB 3.3Å; T370-K373 PolarHBondContact O-N 3.48Å; T370-K373 VanDerWaalsContact O-N 3.17Å; T370-A374 PolarHBondContact O-N 3.34Å
371C87.1Confident77.5Confident3 Ų372.4 Ų72.42%0.0237%0.37CS..Hα-helixtrans-65.1-33.5177-58.10000112.8L345 I367 K373 A374 M375L345-C371 HydrophobicContact CD2-CB 3.97Å; I367-C371 PolarHBondContact O-N 3.09Å; I367-C371 VanDerWaalsContact O-N 3.12Å; I367-C371 PolarHBondContact O-SG 2.82Å; C371-K373 VanDerWaalsContact C-N 3.34Å; C371-K373 PolarHBondContact O-N 3.42Å; C371-A374 WeakPolarHBondContact O-CB 3.29Å; C371-A374 PolarHBondContact O-N 3.41Å; C371-M375 WeakPolarHBondContact O-CG 3.39Å; C371-M375 PolarHBondContact O-N 3.1Å
372K79.8Confident75Confident136 Ų13670.5 Ų70.559%0.59138%0.382SS*.Hα-helixtrans-63.4-38.2173.8-178.2177.6177.3-179.90112.5L368 Q369 T370 A374 M375 L376L368-K372 WeakPolarHBondContact O-CB 3.45Å; L368-K372 PolarHBondContact O-N 3.03Å; Q369-K372 PolarHBondContact O-N 3.21Å; T370-K372 VanDerWaalsContact C-N 3.33Å; T370-K372 PolarHBondContact O-N 3.25Å; K372-A374 VanDerWaalsContact C-N 3.31Å; K372-M375 PolarHBondContact O-N 2.93Å; K372-L376 HydrophobicContact CG-CD1 4.09Å; K372-L376 VanDerWaalsContact O-CG 3.32Å; K372-L376 WeakPolarHBondContact O-CG 3.48Å; K372-L376 PolarHBondContact O-N 3.48Å
373K71.8Confident72.3Confident136 Ų13672.4 Ų72.459%0.59140%0.396SS*.Hα-helixtrans-61.3-43.1174.6-67.9172.7-174.3173.70110.3Q369 T370 C371 L376 S377Q369-K373 WeakPolarHBondContact O-CG 3.32Å; Q369-K373 PolarHBondContact O-N 3.15Å; T370-K373 WeakPolarHBondContact O-CB 3.3Å; T370-K373 PolarHBondContact O-N 3.48Å; T370-K373 VanDerWaalsContact O-N 3.17Å; C371-K373 VanDerWaalsContact C-N 3.34Å; C371-K373 PolarHBondContact O-N 3.42Å; K373-L376 CarbonylContact O-C 3.56Å; K373-L376 PolarHBondContact O-N 3.33Å; K373-S377 PolarHBondContact O-N 3.12Å; K373-S377 PolarHBondContact O-OG 3.23Å
374A66.3Low69.3Low8 Ų879.8 Ų79.87%0.06643%0.431CS..Hα-helixtrans-55-53.117400000113.1Q336 T370 C371 K372 L376 S377 L378Q336-A374 HydrophobicContact CB-CB 4.16Å; Q336-A374 HydrophobicContact CG-CB 4.36Å; T370-A374 PolarHBondContact O-N 3.34Å; C371-A374 WeakPolarHBondContact O-CB 3.29Å; C371-A374 PolarHBondContact O-N 3.41Å; K372-A374 VanDerWaalsContact C-N 3.31Å; A374-L376 PolarHBondContact O-N 2.95Å; A374-L376 VanDerWaalsContact O-N 3.14Å; A374-S377 WeakPolarHBondContact CA-OG 3.34Å; A374-S377 PolarHBondContact O-N 3.08Å; A374-S377 PolarHBondContact O-OG 3.47Å; A374-L378 HydrophobicContact CB-CD1 4.45Å; A374-L378 WeakPolarHBondContact O-CD1 3.41Å; A374-L378 PolarHBondContact O-N 3.43Å
375M65.8Low66.5Low129 Ų12988.6 Ų88.664%0.63547%0.473SS*.Hα-helixtrans-63-26.1-178.5-66.1-179.175.400112.1C371 K372 G379C371-M375 WeakPolarHBondContact O-CG 3.39Å; C371-M375 PolarHBondContact O-N 3.1Å; K372-M375 PolarHBondContact O-N 2.93Å; M375-G379 WeakPolarHBondContact O-CA 3.27Å; M375-G379 PolarHBondContact O-N 3.3Å; M375-G379 VanDerWaalsContact O-N 3.1Å
376L66.8Low63.7Low112 Ų11296.2 Ų96.259%0.58650%0.502SS*.Hα-helixtrans-85.5-28.3174.5-65.6171.5000113.3K372 K373 A374 V380K372-L376 HydrophobicContact CG-CD1 4.09Å; K372-L376 VanDerWaalsContact O-CG 3.32Å; K372-L376 WeakPolarHBondContact O-CG 3.48Å; K372-L376 PolarHBondContact O-N 3.48Å; K373-L376 CarbonylContact O-C 3.56Å; K373-L376 PolarHBondContact O-N 3.33Å; A374-L376 PolarHBondContact O-N 2.95Å; A374-L376 VanDerWaalsContact O-N 3.14Å; L376-V380 WeakPolarHBondContact O-CG2 3.34Å
377S57.9Low60.8Low57 Ų5798 Ų9840%0.39951%0.511SS..Hα-helixtrans-73.4-49.5172.153.80000111.3E333 K373 A374 G379 V380E333-S377 PolarHBondContact OE1-OG 3.4Å; K373-S377 PolarHBondContact O-N 3.12Å; K373-S377 PolarHBondContact O-OG 3.23Å; A374-S377 WeakPolarHBondContact CA-OG 3.34Å; A374-S377 PolarHBondContact O-N 3.08Å; A374-S377 PolarHBondContact O-OG 3.47Å; S377-G379 PolarHBondContact O-N 2.84Å; S377-V380 PolarHBondContact O-N 3.22Å
378L53.5Low57.9Low97 Ų97102.2 Ų102.251%0.50855%0.546SS..Hα-helixtrans-62.4-33.1172.5-79.697.4000112.2A374 V380 H381 G382A374-L378 HydrophobicContact CB-CD1 4.45Å; A374-L378 WeakPolarHBondContact O-CD1 3.41Å; A374-L378 PolarHBondContact O-N 3.43Å; L378-V380 PolarHBondContact O-N 3.21Å; L378-H381 PolarHBondContact O-N 3.23Å; L378-G382 PolarHBondContact O-N 3.2Å
379G49.8Very low55.3Low57 Ų57109.1 Ų109.159%0.58858%0.577SS**THydrogen-bonded Turntrans-65-3179.800000116.1M375 S377M375-G379 WeakPolarHBondContact O-CA 3.27Å; M375-G379 PolarHBondContact O-N 3.3Å; M375-G379 VanDerWaalsContact O-N 3.1Å; S377-G379 PolarHBondContact O-N 2.84Å
380V46.2Very low53Low112 Ų112111.3 Ų111.368%0.67959%0.593SS**THydrogen-bonded Turntrans-106.4-16.5-178.6173.80000113.9L376 S377 L378L376-V380 WeakPolarHBondContact O-CG2 3.34Å; S377-V380 PolarHBondContact O-N 3.22Å; L378-V380 PolarHBondContact O-N 3.21Å
381H40.5Very low50.3Low189 Ų189118.3 Ų118.388%0.87563%0.625SS**THydrogen-bonded Turntrans-136.6-1.9-175.6-93.415.7000117L378L378-H381 PolarHBondContact O-N 3.23Å
382G40.8Very low48.1Very low60 Ų60126.8 Ų126.862%0.61966%0.664SS**SBendtrans-98.9-46.5-169.800000118.2L378L378-G382 PolarHBondContact O-N 3.2Å
383L38.1Very low46.2Very low143 Ų143125.8 Ų125.875%0.74967%0.672SS**SBendtrans-130.71.7-152.6-112.1108.9000117.8
384M33Very low44.8Very low162 Ų162125.3 Ų125.380%0.79868%0.683SS**SBendtrans-89.6-15.1178.1-70.4-102.674.200114.2
385E37.8Very low44.2Very low185 Ų185131.8 Ų131.886%0.86472%0.715SS**SBendtrans-98.12.1-170.5-89.7-171.6164.600116.2
386K36.2Very low43.9Very low206 Ų206129.1 Ų129.190%0.89670%0.703SS**SBendtrans-129.89.7179.6-73.9-170.2177.1176.80116.8
387Q32.7Very low43.6Very low116 Ų116129.4 Ų129.454%0.54270%0.704SS.*SBendtrans-122.77.8168-79.5178.5-71.900113.8E389 N390Q387-E389 PolarHBondContact O-N 3.18Å; Q387-N390 PolarHBondContact O-N 2.9Å
388A35.1Very low43.9Very low88 Ų88130.5 Ų130.573%0.72770%0.703SS**THydrogen-bonded Turntrans-7116.6-175.300000116.5
389E40.3Very low44.4Very low181 Ų181131.8 Ų131.885%0.84671%0.707SS**THydrogen-bonded Turntrans-128.2-4.7176.5-75.3-163.8153.100115.5Q387Q387-E389 PolarHBondContact O-N 3.18Å
390N42.8Very low45Very low158 Ų158135.6 Ų135.685%0.84571%0.707SS**SBendtrans-151.166.6175.7-79.5-73.2000112.9Q387Q387-N390 PolarHBondContact O-N 2.9Å
391E34.6Very low46.1Very low149 Ų149134.9 Ų134.970%0.69670%0.695SS**  trans-126.7139.6162-72.9-163.9147.100111.5
392E40.8Very low47.9Very low182 Ų182129.9 Ų129.985%0.8568%0.675SS**PPolyproline II helixtrans-68.6162.2178.1-66.3-177.3133.500111.8
393P38.8Very low49.8Very low115 Ų115130 Ų13075%0.74767%0.666SS**PPolyproline II helixtrans-59.6142.1-175.6-22.633.5000112.7L395P393-L395 PolarHBondContact O-N 3.43Å
394P42.7Very low51.6Low126 Ų126125.6 Ų125.682%0.81865%0.65SS**PPolyproline II helixtrans-61.3125.7-17824.7-34000111N396P394-N396 PolarHBondContact O-N 2.93Å
395L54.6Low54Low143 Ų143123.5 Ų123.575%0.74963%0.633SS**PPolyproline II helixtrans-54.1130179.6-78.7166000111.2P393 I397P393-L395 PolarHBondContact O-N 3.43Å; L395-I397 PolarHBondContact O-N 2.83Å
396N57.9Low56.2Low73 Ų73118.2 Ų118.239%0.3961%0.608SS.*  trans-70.885.6-173.6-173.8-0.5000111.8P394 E398 E399 F400P394-N396 PolarHBondContact O-N 2.93Å; N396-E398 PolarHBondContact O-N 3.23Å; N396-E398 WeakPolarHBondContact OD1-CB 3.45Å; N396-E398 PolarHBondContact OD1-N 3.48Å; N396-E399 HydrophobicContact CB-CB 4.15Å; N396-E399 WeakPolarHBondContact CB-OE2 3.46Å; N396-E399 VanDerWaalsContact ND2-CG 3.28Å; N396-E399 WeakPolarHBondContact ND2-CG 3.37Å; N396-E399 PolarHBondContact ND2-OE2 3.28Å; N396-E399 WeakPolarHBondContact O-CB 3.47Å; N396-E399 PolarHBondContact O-N 3.43Å; N396-E399 PolarHBondContact OD1-N 2.84Å; N396-F400 WeakPolarHBondContact O-CD2 3.23Å; N396-F400 PolarHBondContact O-N 3.46Å
397I60.6Low58.5Low118 Ų118112.8 Ų112.861%0.60559%0.588SS**Hα-helixtrans-54.5-26.8176.5-70.4167.5000111.8L395 F400 K401L395-I397 PolarHBondContact O-N 2.83Å; I397-F400 PolarHBondContact O-N 3.49Å; I397-K401 HydrophobicContact CG2-CD 4.41Å; I397-K401 WeakPolarHBondContact O-CG 3.25Å; I397-K401 PolarHBondContact O-N 2.99Å
398E65.1Low61Low81 Ų81111.8 Ų111.838%0.37959%0.586SS.*Hα-helixtrans-76.1-30.4178.8-150.457.3-138.800112.6N396 K401 N402 R405N396-E398 PolarHBondContact O-N 3.23Å; N396-E398 WeakPolarHBondContact OD1-CB 3.45Å; N396-E398 PolarHBondContact OD1-N 3.48Å; E398-K401 PolarHBondContact O-N 2.96Å; E398-K401 VanDerWaalsContact OE2-CD 3.27Å; E398-K401 WeakPolarHBondContact OE2-CD 3.24Å; E398-K401 IonicContact OE2-NZ 2.68Å; E398-K401 PolarHBondContact OE2-NZ 3.45Å; E398-N402 WeakPolarHBondContact O-CB 3.4Å; E398-N402 PolarHBondContact O-N 3.32Å; E398-N402 PolarHBondContact O-ND2 3.24Å; E398-N402 VanDerWaalsContact O-ND2 3.13Å; E398-R405 IonicContact OE1-CZ 3.77Å; E398-R405 IonicContact OE1-NH1 2.65Å; E398-R405 IonicContact OE1-NH2 2.65Å; E398-R405 PolarHBondContact OE1-NH2 3.38Å
399E62.9Low63.3Low124 Ų124115.4 Ų115.458%0.57958%0.581SS**Hα-helixtrans-65.3-41.8168.1-95.3171.9151.700112N396 N402 S403N396-E399 HydrophobicContact CB-CB 4.15Å; N396-E399 WeakPolarHBondContact CB-OE2 3.46Å; N396-E399 VanDerWaalsContact ND2-CG 3.28Å; N396-E399 WeakPolarHBondContact ND2-CG 3.37Å; N396-E399 PolarHBondContact ND2-OE2 3.28Å; N396-E399 WeakPolarHBondContact O-CB 3.47Å; N396-E399 PolarHBondContact O-N 3.43Å; N396-E399 PolarHBondContact OD1-N 2.84Å; E399-N402 PolarHBondContact O-N 2.96Å; E399-S403 WeakPolarHBondContact O-CB 3.49Å; E399-S403 PolarHBondContact O-N 3.5Å
400F64.1Low65.4Low136 Ų136113.7 Ų113.760%0.59657%0.566SS**Hα-helixtrans-64.9-39.8175.1-71-73.4000112.3N396 I397 S403 A404N396-F400 WeakPolarHBondContact O-CD2 3.23Å; N396-F400 PolarHBondContact O-N 3.46Å; I397-F400 PolarHBondContact O-N 3.49Å; F400-S403 PolarHBondContact O-N 2.81Å; F400-A404 WeakPolarHBondContact O-CB 3.5Å; F400-A404 PolarHBondContact O-N 3.4Å
401K69.4Low67.4Low97 Ų97110.1 Ų110.142%0.42255%0.547SS..Hα-helixtrans-64-39.5171.3-71.6169.4-172.41650112.3I397 E398 A404 R405I397-K401 HydrophobicContact CG2-CD 4.41Å; I397-K401 WeakPolarHBondContact O-CG 3.25Å; I397-K401 PolarHBondContact O-N 2.99Å; E398-K401 PolarHBondContact O-N 2.96Å; E398-K401 VanDerWaalsContact OE2-CD 3.27Å; E398-K401 WeakPolarHBondContact OE2-CD 3.24Å; E398-K401 IonicContact OE2-NZ 2.68Å; E398-K401 PolarHBondContact OE2-NZ 3.45Å; K401-A404 PolarHBondContact O-N 3.04Å; K401-R405 WeakPolarHBondContact O-CB 3.34Å; K401-R405 VanDerWaalsContact O-CG 3.27Å; K401-R405 WeakPolarHBondContact O-CG 3.44Å; K401-R405 PolarHBondContact O-N 3.27Å; K401-R405 PolarHBondContact O-NE 3.4Å
402N77.6Confident69.7Low85 Ų85108.4 Ų108.446%0.45554%0.538SS..Hα-helixtrans-64.1-43.4175.3-74.2-26.9000111.6E398 E399 R405 E406E398-N402 WeakPolarHBondContact O-CB 3.4Å; E398-N402 PolarHBondContact O-N 3.32Å; E398-N402 PolarHBondContact O-ND2 3.24Å; E398-N402 VanDerWaalsContact O-ND2 3.13Å; E399-N402 PolarHBondContact O-N 2.96Å; N402-R405 PolarHBondContact O-N 2.99Å; N402-R405 PolarHBondContact OD1-NE 3.25Å; N402-R405 PolarHBondContact OD1-NH2 3.38Å; N402-E406 WeakPolarHBondContact O-CB 3.49Å; N402-E406 PolarHBondContact O-N 2.93Å
403S80.6Confident71.6Confident63 Ų63105 Ų10544%0.44153%0.526SS..Hα-helixtrans-62.7-44.3175.6-168.40000111.8E399 F400 R405 E406 I407E399-S403 WeakPolarHBondContact O-CB 3.49Å; E399-S403 PolarHBondContact O-N 3.5Å; F400-S403 PolarHBondContact O-N 2.81Å; S403-R405 PolarHBondContact O-N 3.06Å; S403-E406 PolarHBondContact O-N 3.49Å; S403-I407 VanDerWaalsContact O-CG1 3.3Å; S403-I407 WeakPolarHBondContact O-CG1 3.13Å; S403-I407 PolarHBondContact O-N 3.49Å
404A75.8Confident73.4Confident49 Ų49104.8 Ų104.841%0.40552%0.518SS..Hα-helixtrans-62.3-42.7174.400000112.7F400 K401 E406 I407 I408F400-A404 WeakPolarHBondContact O-CB 3.5Å; F400-A404 PolarHBondContact O-N 3.4Å; K401-A404 PolarHBondContact O-N 3.04Å; A404-E406 VanDerWaalsContact C-N 3.31Å; A404-E406 PolarHBondContact O-N 2.95Å; A404-I407 PolarHBondContact O-N 2.94Å; A404-I408 WeakPolarHBondContact O-CG1 3.2Å; A404-I408 PolarHBondContact O-N 3.29Å
405R82.8Confident75.1Confident119 Ų119104.2 Ų104.245%0.44950%0.504SS..Hα-helixtrans-61.5-37.7174.5-75.9-177.1-77-124.33.7112.2E398 K401 N402 S403 R409E398-R405 IonicContact OE1-CZ 3.77Å; E398-R405 IonicContact OE1-NH1 2.65Å; E398-R405 IonicContact OE1-NH2 2.65Å; E398-R405 PolarHBondContact OE1-NH2 3.38Å; K401-R405 WeakPolarHBondContact O-CB 3.34Å; K401-R405 VanDerWaalsContact O-CG 3.27Å; K401-R405 WeakPolarHBondContact O-CG 3.44Å; K401-R405 PolarHBondContact O-N 3.27Å; K401-R405 PolarHBondContact O-NE 3.4Å; N402-R405 PolarHBondContact O-N 2.99Å; N402-R405 PolarHBondContact OD1-NE 3.25Å; N402-R405 PolarHBondContact OD1-NH2 3.38Å; S403-R405 PolarHBondContact O-N 3.06Å; R405-R409 WeakPolarHBondContact O-CG 3.09Å; R405-R409 PolarHBondContact O-N 3.38Å
406E85.4Confident76Confident73 Ų73104.5 Ų104.534%0.34150%0.499SS..Hα-helixtrans-71.6-39.5176.8176.860.7-169.200112.4N402 S403 A404 R409 R410N402-E406 WeakPolarHBondContact O-CB 3.49Å; N402-E406 PolarHBondContact O-N 2.93Å; S403-E406 PolarHBondContact O-N 3.49Å; A404-E406 VanDerWaalsContact C-N 3.31Å; A404-E406 PolarHBondContact O-N 2.95Å; E406-R409 PolarHBondContact O-N 3.13Å; E406-R410 WeakPolarHBondContact O-CG 3.29Å; E406-R410 PolarHBondContact O-N 3.46Å; E406-R410 VanDerWaalsContact O-N 3.09Å; E406-R410 IonicContact OE1-CZ 3.77Å; E406-R410 IonicContact OE1-NE 2.97Å; E406-R410 PolarHBondContact OE1-NE 3.43Å; E406-R410 IonicContact OE1-NH2 3.15Å; E406-R410 PolarHBondContact OE1-NH2 2.99Å
407I83.4Confident76.5Confident92 Ų92103.8 Ų103.847%0.47250%0.498SS..Hα-helixtrans-62.3-43.6175.1-70.1164.2000110.8S403 A404 R409 R410 I411S403-I407 VanDerWaalsContact O-CG1 3.3Å; S403-I407 WeakPolarHBondContact O-CG1 3.13Å; S403-I407 PolarHBondContact O-N 3.49Å; A404-I407 PolarHBondContact O-N 2.94Å; I407-R409 PolarHBondContact O-N 3.38Å; I407-R410 PolarHBondContact O-N 3.48Å; I407-I411 HydrophobicContact CG2-CD1 3.99Å; I407-I411 WeakPolarHBondContact O-CG1 3.25Å; I407-I411 PolarHBondContact O-N 3.25Å
408I86.6Confident76.6Confident95 Ų95103.8 Ų103.849%0.48750%0.495SS..Hα-helixtrans-59.4-47.3176.4-69.4166.7000111A404 R410 I411 E412A404-I408 WeakPolarHBondContact O-CG1 3.2Å; A404-I408 PolarHBondContact O-N 3.29Å; I408-R410 VanDerWaalsContact C-N 3.26Å; I408-R410 PolarHBondContact O-N 3.3Å; I408-I411 WeakPolarHBondContact O-CB 3.49Å; I408-I411 PolarHBondContact O-N 3.01Å; I408-I411 VanDerWaalsContact O-N 3.11Å; I408-E412 HydrophobicContact CG2-CG 4.44Å; I408-E412 WeakPolarHBondContact O-CG 3.31Å; I408-E412 PolarHBondContact O-N 3.16Å
409R82.2Confident76.2Confident164 Ų164106.2 Ų106.262%0.61951%0.51SS*.Hα-helixtrans-59.5-34.5176.6-74.8176.3177168.9-1.5113.5R405 E406 I407 L413R405-R409 WeakPolarHBondContact O-CG 3.09Å; R405-R409 PolarHBondContact O-N 3.38Å; E406-R409 PolarHBondContact O-N 3.13Å; I407-R409 PolarHBondContact O-N 3.38Å; R409-L413 WeakPolarHBondContact O-CB 3.37Å; R409-L413 PolarHBondContact O-N 2.96Å
410R84.7Confident76Confident146 Ų146107 Ų10755%0.55151%0.511SS*.Hα-helixtrans-71.2-37.1176.3-70.6175.3-171.1-1682.9112E406 I407 I408 L413 L414E406-R410 WeakPolarHBondContact O-CG 3.29Å; E406-R410 PolarHBondContact O-N 3.46Å; E406-R410 VanDerWaalsContact O-N 3.09Å; E406-R410 IonicContact OE1-CZ 3.77Å; E406-R410 IonicContact OE1-NE 2.97Å; E406-R410 PolarHBondContact OE1-NE 3.43Å; E406-R410 IonicContact OE1-NH2 3.15Å; E406-R410 PolarHBondContact OE1-NH2 2.99Å; I407-R410 PolarHBondContact O-N 3.48Å; I408-R410 VanDerWaalsContact C-N 3.26Å; I408-R410 PolarHBondContact O-N 3.3Å; R410-L413 PolarHBondContact O-N 2.85Å; R410-L414 WeakPolarHBondContact O-CB 3.37Å; R410-L414 WeakPolarHBondContact O-CD1 3.34Å; R410-L414 VanDerWaalsContact O-CG 3.23Å; R410-L414 WeakPolarHBondContact O-CG 3.47Å; R410-L414 PolarHBondContact O-N 3.36Å
411I84.7Confident75.5Confident83 Ų83106.1 Ų106.143%0.42651%0.509SS..Hα-helixtrans-63.3-51.7173.4-66.1164.5000109.7I407 I408 L413 L414 E415I407-I411 HydrophobicContact CG2-CD1 3.99Å; I407-I411 WeakPolarHBondContact O-CG1 3.25Å; I407-I411 PolarHBondContact O-N 3.25Å; I408-I411 WeakPolarHBondContact O-CB 3.49Å; I408-I411 PolarHBondContact O-N 3.01Å; I408-I411 VanDerWaalsContact O-N 3.11Å; I411-L413 VanDerWaalsContact C-N 3.26Å; I411-L413 PolarHBondContact O-N 3.42Å; I411-L414 PolarHBondContact O-N 3.41Å; I411-L414 VanDerWaalsContact O-N 3.11Å; I411-E415 HydrophobicContact CG2-CG 4.36Å; I411-E415 WeakPolarHBondContact O-CG 3.45Å; I411-E415 PolarHBondContact O-N 2.74Å
412E82.8Confident74.8Confident112 Ų112107 Ų10752%0.52352%0.517SS..Hα-helixtrans-56.2-38.3176.5-69.1173.917100112.6I408 K416I408-E412 HydrophobicContact CG2-CG 4.44Å; I408-E412 WeakPolarHBondContact O-CG 3.31Å; I408-E412 PolarHBondContact O-N 3.16Å; E412-K416 VanDerWaalsContact O-CB 3.26Å; E412-K416 WeakPolarHBondContact O-CB 3.39Å; E412-K416 PolarHBondContact O-N 2.76Å; E412-K416 VanDerWaalsContact O-N 3.12Å
413L81.7Confident73.5Confident112 Ų112105.6 Ų105.659%0.58652%0.523SS*.Hα-helixtrans-69.4-42.7176.9-174.265.6000112.2R409 R410 I411 K416 T417R409-L413 WeakPolarHBondContact O-CB 3.37Å; R409-L413 PolarHBondContact O-N 2.96Å; R410-L413 PolarHBondContact O-N 2.85Å; I411-L413 VanDerWaalsContact C-N 3.26Å; I411-L413 PolarHBondContact O-N 3.42Å; L413-K416 PolarHBondContact O-N 3.23Å; L413-T417 PolarHBondContact O-N 3.13Å; L413-T417 PolarHBondContact O-OG1 3.01Å
414L76.4Confident72.1Confident110 Ų110110.6 Ų110.658%0.57654%0.539SS*.Hα-helixtrans-66.2-43.8178.1-73.8167.2000111.7R410 I411 K416 T417 Q418R410-L414 WeakPolarHBondContact O-CB 3.37Å; R410-L414 WeakPolarHBondContact O-CD1 3.34Å; R410-L414 VanDerWaalsContact O-CG 3.23Å; R410-L414 WeakPolarHBondContact O-CG 3.47Å; R410-L414 PolarHBondContact O-N 3.36Å; I411-L414 PolarHBondContact O-N 3.41Å; I411-L414 VanDerWaalsContact O-N 3.11Å; L414-K416 VanDerWaalsContact C-N 3.28Å; L414-K416 PolarHBondContact O-N 2.94Å; L414-T417 PolarHBondContact O-N 3.35Å; L414-Q418 PolarHBondContact O-N 3.13Å
415E76.8Confident70.7Confident114 Ų114116.4 Ų116.453%0.53356%0.558SS.*Hα-helixtrans-58.2-41.9173.5-71174.116700111.2I411 T417 L419I411-E415 HydrophobicContact CG2-CG 4.36Å; I411-E415 WeakPolarHBondContact O-CG 3.45Å; I411-E415 PolarHBondContact O-N 2.74Å; E415-T417 PolarHBondContact O-N 3.45Å; E415-L419 WeakPolarHBondContact O-CB 3.32Å; E415-L419 WeakPolarHBondContact O-CG 3.29Å; E415-L419 PolarHBondContact O-N 3.19Å
416K74.6Confident68.9Low148 Ų148119 Ų11964%0.64358%0.575SS**Hα-helixtrans-72.2-15.1176.7-161172-170.4173.20114.1E412 L413 L414E412-K416 VanDerWaalsContact O-CB 3.26Å; E412-K416 WeakPolarHBondContact O-CB 3.39Å; E412-K416 PolarHBondContact O-N 2.76Å; E412-K416 VanDerWaalsContact O-N 3.12Å; L413-K416 PolarHBondContact O-N 3.23Å; L414-K416 VanDerWaalsContact C-N 3.28Å; L414-K416 PolarHBondContact O-N 2.94Å
417T68.3Low66.8Low59 Ų59124.7 Ų124.736%0.36260%0.602SS.*Hα-helixtrans-90.3-42.3175.1-49.80000110.6L413 L414 E415 L419 K420 E421L413-T417 PolarHBondContact O-N 3.13Å; L413-T417 PolarHBondContact O-OG1 3.01Å; L414-T417 PolarHBondContact O-N 3.35Å; E415-T417 PolarHBondContact O-N 3.45Å; T417-L419 VanDerWaalsContact C-N 3.28Å; T417-L419 PolarHBondContact O-N 3.36Å; T417-K420 WeakPolarHBondContact O-CA 3.46Å; T417-K420 WeakPolarHBondContact O-CB 3.47Å; T417-K420 PolarHBondContact O-N 3.25Å; T417-E421 PolarHBondContact O-N 2.9Å
418Q61.9Low64.6Low117 Ų117127.4 Ų127.455%0.54762%0.617SS.*Hα-helixtrans-60.1-37.7171.1-69.7-174.816.900112.2L414 K420 E421 I422L414-Q418 PolarHBondContact O-N 3.13Å; Q418-K420 PolarHBondContact O-N 3.13Å; Q418-E421 PolarHBondContact O-N 2.87Å; Q418-I422 WeakPolarHBondContact O-CD1 3.38Å; Q418-I422 VanDerWaalsContact O-CG1 3.27Å; Q418-I422 WeakPolarHBondContact O-CG1 3.39Å; Q418-I422 PolarHBondContact O-N 3.39Å; Q418-I422 VanDerWaalsContact O-N 3.08Å
419L57.9Low62.3Low133 Ų133130.3 Ų130.370%0.69663%0.632SS**Hα-helixtrans-65.7-12.9173.4-76.9167.6000114.5E415 T417E415-L419 WeakPolarHBondContact O-CB 3.32Å; E415-L419 WeakPolarHBondContact O-CG 3.29Å; E415-L419 PolarHBondContact O-N 3.19Å; T417-L419 VanDerWaalsContact C-N 3.28Å; T417-L419 PolarHBondContact O-N 3.36Å
420K58.1Low59.9Low140 Ų140130.8 Ų130.861%0.60965%0.646SS**Hα-helixtrans-94.1-42.7171.1-73.1-175.3170.7-164.90112.2T417 Q418 I422 G423 E424T417-K420 WeakPolarHBondContact O-CA 3.46Å; T417-K420 WeakPolarHBondContact O-CB 3.47Å; T417-K420 PolarHBondContact O-N 3.25Å; Q418-K420 PolarHBondContact O-N 3.13Å; K420-I422 VanDerWaalsContact C-N 3.28Å; K420-I422 PolarHBondContact O-N 3.2Å; K420-G423 WeakPolarHBondContact O-CA 3.4Å; K420-G423 PolarHBondContact O-N 3.11Å; K420-E424 PolarHBondContact O-N 3.36Å
421E54.5Low57.2Low118 Ų118129.4 Ų129.455%0.55166%0.658SS**Hα-helixtrans-59.8-39.6177.7-69172.2155.100111.3T417 Q418 G423 E424 E425T417-E421 PolarHBondContact O-N 2.9Å; Q418-E421 PolarHBondContact O-N 2.87Å; E421-G423 PolarHBondContact O-N 2.83Å; E421-E424 PolarHBondContact O-N 3.28Å; E421-E425 PolarHBondContact O-N 3.44Å
422I54.5Low55.6Low115 Ų115130.2 Ų130.259%0.5967%0.668SS**Hα-helixtrans-65.3-21.3174.2-64.6165000112.7Q418 K420Q418-I422 WeakPolarHBondContact O-CD1 3.38Å; Q418-I422 VanDerWaalsContact O-CG1 3.27Å; Q418-I422 WeakPolarHBondContact O-CG1 3.39Å; Q418-I422 PolarHBondContact O-N 3.39Å; Q418-I422 VanDerWaalsContact O-N 3.08Å; K420-I422 VanDerWaalsContact C-N 3.28Å; K420-I422 PolarHBondContact O-N 3.2Å
423G50.6Low53Low55 Ų55131.9 Ų131.957%0.56768%0.681SS**Hα-helixtrans-84.8-23.2179.600000114.7K420 E421K420-G423 WeakPolarHBondContact O-CA 3.4Å; K420-G423 PolarHBondContact O-N 3.11Å; E421-G423 PolarHBondContact O-N 2.83Å
424E50.3Low50.5Low168 Ų168131.4 Ų131.479%0.78569%0.686SS**Hα-helixtrans-99.1-17.4-175.2-67.9178.9-173.300112.9K420 E421 Q426K420-E424 PolarHBondContact O-N 3.36Å; E421-E424 PolarHBondContact O-N 3.28Å; E424-Q426 VanDerWaalsContact C-N 3.31Å; E424-Q426 PolarHBondContact O-N 3.21Å
425E47Very low48.3Very low172 Ų172132 Ų13280%0.80470%0.695SS**THydrogen-bonded Turntrans-82.35175.8-68.7-166.7154.700114.9E421E421-E425 PolarHBondContact O-N 3.44Å
426Q43.9Very low46.1Very low173 Ų173134.1 Ų134.181%0.80871%0.705SS**THydrogen-bonded Turntrans-113.62-170.5-162.313588.300115.5E424E424-Q426 VanDerWaalsContact C-N 3.31Å; E424-Q426 PolarHBondContact O-N 3.21Å
427E42.2Very low44Very low193 Ų193134.1 Ų134.190%0.90271%0.711SS**SBendtrans-100.8-10.5178.1-119.5-179.4-173.700115.1
428D37.2Very low42.3Very low148 Ų148138.3 Ų138.379%0.79173%0.726SS**SBendtrans-118.1136.4-177.8-111.4-32.1000114.4
429I38.5Very low41.2Very low157 Ų157138.6 Ų138.681%0.80574%0.738SS**  trans98.890.7169.6-53.3161.4000116.8
430L31.6Very low39.7Very low173 Ų173140.2 Ų140.291%0.90674%0.74SS**  trans-66140.2153.1-70.8156.2000111.2
431C27.3Very low38.2Very low118 Ų118142.5 Ų142.580%0.79775%0.75SS**  trans-73.2173.5167.3-88.10000112.8
432P52.6Low37.6Very low100 Ų100141.9 Ų141.965%0.64976%0.756SS**  cis-134.2177.7-13.829.3-7.8000114.3
433N26.9Very low37.3Very low147 Ų147141.9 Ų141.979%0.78676%0.763SS**  174.1142115-89.1-31.6000116.9
434S29.2Very low37Very low101 Ų101144 Ų14471%0.70677%0.768SS**  trans74.8108.9147.1-64.90000123.1
435V30.7Very low36.1Very low124 Ų124143.4 Ų143.475%0.75277%0.769SS**  59.5126.9112.4171.40000117.4
436E30.7Very low35Very low158 Ų158146.5 Ų146.574%0.73877%0.773SS**  cis-164.3174.712.4-133.2178.2144.300113.5
437L29.5Very low34.6Very low147 Ų147146 Ų14677%0.7778%0.775SS**  trans63.6111.2149.5-78.2153.2000122.1
438Q32.8Very low34.7Very low147 Ų147142.4 Ų142.469%0.68777%0.768SS**  trans-79.3159.2158.1-99.9-159.613.500111.9F440Q438-F440 VanDerWaalsContact OE1-CE2 3.28Å
439P38.8Very low34.3Very low123 Ų123139.4 Ų139.480%0.79976%0.764SS**  -149.2159.789.436.3-16.7000118.3
440F27Very low33.9Very low167 Ų167140.5 Ų140.573%0.73277%0.766SS**  trans-50.4161.7160.4-72-100.3000112.7Q438Q438-F440 VanDerWaalsContact OE1-CE2 3.28Å
441K26.6Very low33.7Very low189 Ų189139 Ų13982%0.82275%0.752SS**  cis-166.7-159.343.9-142.8177.8-173.8174.50110.7
442P42.8Very low33.7Very low104 Ų104141.9 Ų141.968%0.67576%0.759SS**  trans-114.3-141.8-13445-24.2000113
443P46.5Very low32.6Very low115 Ų115143.8 Ų143.875%0.74776%0.759SS**  -109.5-130.3-58.438.6-19.7000108.9
444P46.2Very low32.6Very low101 Ų101141.4 Ų141.466%0.65676%0.759SS**  cis-127.5175.3-4439.6-23.9000115.4
445L29.9Very low32.6Very low155 Ų155143.7 Ų143.781%0.81276%0.764SS**  trans63.6133.8140.2-88.1163.3000124.8
446R25Very low32.5Very low236 Ų236146.6 Ų146.689%0.89177%0.766SS**  trans97125.2153.9-66.6-178-177.3-171.71.7120.6
447L34.1Very low32.3Very low164 Ų164144.8 Ų144.886%0.85977%0.766SS**  trans-76.5176.4159.7-68.7159.9000110.3
448P44.1Very low32.2Very low116 Ų116143.3 Ų143.375%0.75376%0.763SS**  cis-148177.415.546-27000119.6
449A29.9Very low31.9Very low85 Ų85141 Ų14170%0.70276%0.763SS**  trans89.7151.7134.700000124.1
450Q29.5Very low31.4Very low180 Ų180141.8 Ų141.884%0.84176%0.759SS**  trans84.9139.9161.8-64.5-162.924.700118.9
451K28.4Very low31.4Very low142 Ų142141.1 Ų141.162%0.61776%0.763SS**  cis-171.1147.4-23-145.4-170.7-165.1-153.90108.4E453K451-E453 VanDerWaalsContact CE-OE2 3.24Å; K451-E453 WeakPolarHBondContact CE-OE2 3.43Å; K451-E453 IonicContact NZ-OE1 3.51Å; K451-E453 IonicContact NZ-OE2 2.57Å; K451-E453 PolarHBondContact NZ-OE2 2.68Å
452L27.4Very low31.4Very low179 Ų179143.2 Ų143.294%0.93777%0.765SS**  trans-159135.5136.7-146.872.3000111.4
453E29.6Very low31Very low140 Ų140143.6 Ų143.665%0.65477%0.768SS**  trans-125.8153-179.9-64.4163.7130.700110K451K451-E453 VanDerWaalsContact CE-OE2 3.24Å; K451-E453 WeakPolarHBondContact CE-OE2 3.43Å; K451-E453 IonicContact NZ-OE1 3.51Å; K451-E453 IonicContact NZ-OE2 2.57Å; K451-E453 PolarHBondContact NZ-OE2 2.68Å
454A25.7Very low30.1Very low96 Ų96145 Ų14579%0.79377%0.768SS**  trans-167.1142.315000000110.2
455N28.8Very low29.2Very low149 Ų149147.8 Ų147.880%0.79777%0.772SS**  cis-168.9174.3-26-140.5-24.4000108.9
456K28.5Very low29Very low185 Ų185149 Ų14980%0.80477%0.77SS**  trans80138.4172.3-50.7178.8-179.9177.80115.7
457T27Very low29.1Very low121 Ų121143.6 Ų143.674%0.74277%0.769SS**  cis-154.31322.2-4.20000111.4
458T27.6Very low28.7Very low116 Ų116141.7 Ų141.771%0.71277%0.769SS**  trans49.399.3130.5-53.90000119
459S26.2Very low27.8Very low97 Ų97139 Ų13968%0.67876%0.763SS**  9615584.595.30000113.6
460I28.8Very low27.8Very low140 Ų140142.5 Ų142.572%0.71877%0.77SS**  cis-1621503.3-131.5161.7000111.4
461L26.1Very low27.8Very low154 Ų154141.8 Ų141.881%0.80677%0.771SS**  trans56.4129.8153.1-63.9162000125.7
462R26.8Very low27.8Very low233 Ų233140.8 Ų140.888%0.87978%0.782SS**  trans-54-173.4148.5-53165.9168.4171.3-5112.6
463P34.5Very low27.8Very low111 Ų111138 Ų13872%0.72178%0.778SS**  cis-142.2171.23.134-10.1000118.7
464I27.4Very low27.7Very low146 Ų146139 Ų13975%0.74979%0.787SS**  trans12.1118.7141.7-48.1167.9000119
465H27.4Very low27.8Very low159 Ų159143 Ų14374%0.73679%0.79SS**  -179.5128.2118.5-109.6-78.9000117
466K26.2Very low27.6Very low179 Ų179144.3 Ų144.378%0.77880%0.795SS**  trans45.5137.6145.2-77-177.4177.1-178.60125
467S26.1Very low27.5Very low123 Ų123141.6 Ų141.686%0.8679%0.794SS**  trans74.3144.8158.781.30000116.2
468S26.2Very low27.6Very low124 Ų124145.2 Ų145.287%0.86780%0.799SS**  cis-153.2154.42.6-172.60000109.5
469G25.5Very low27.5Very low61 Ų61145.6 Ų145.663%0.62981%0.807SS**  trans109.3110.5163.700000117.1
470D29.3Very low27.5Very low157 Ų157149.8 Ų149.884%0.8482%0.818SS**  trans74.2138.4144-53.9-16.7000123.5
471N30.3Very low27.4Very low165 Ų165147.3 Ų147.388%0.88282%0.818SS**  trans72.964.3163.9-58.6-21.7000118.7
472S28.6Very low27.5Very low121 Ų121148.7 Ų148.785%0.84682%0.821SS**  trans-80.6137.1158.654.20000113
473S28.2Very low27.5Very low122 Ų122143.3 Ų143.385%0.85381%0.813SS**  trans-51.9153.1179.4-173.70000115.7
474L26.8Very low27.1Very low161 Ų161147.1 Ų147.184%0.84382%0.819SS**  trans-124.4128.3173.3-136.2161.8000110.6
475Q26.8Very low27Very low180 Ų180148.8 Ų148.884%0.84182%0.82SS**  trans-66.8153.9176.7-62.9169.2-53.300111.8
476L26Very low26.9Very low175 Ų175148.2 Ų148.292%0.91683%0.828SS**  trans-111.399168.3-162.180.1000111.5
477V25.6Very low26.9Very low128 Ų128145.1 Ų145.178%0.77682%0.824SS**  trans-133.4117.6159.4176.60000109.2
478K29.9Very low26.9Very low197 Ų197144.7 Ų144.786%0.85782%0.821SS**  trans24.8127.1157.7-63.3178.9176.2178.70119.8
479S24.5Very low26.9Very low124 Ų124149.4 Ų149.487%0.86782%0.82SS**  trans-155.5135131.856.80000113.1
480M27.1Very low26.9Very low186 Ų186153.9 Ų153.992%0.91683%0.829SS**  trans-88.4155.8164.1-63.7162.357.400110.6
481A27.3Very low26.8Very low87 Ų87153.7 Ų153.772%0.71983%0.826SS**  trans-179.8119.4139.700000108.1
482E27Very low27.3Very low183 Ų183151.2 Ų151.286%0.85582%0.819SS**  63.6147.5101.5-64.2-160.2123.100114.7
483V27.2Very low28.4Very low120 Ų120151.4 Ų151.473%0.72782%0.817SS**  cis-158.4160.948.9-161.70000112.7
484K26.8Very low28.2Very low192 Ų192149.2 Ų149.284%0.83581%0.814SS**  trans97.7105.2159.8-57.7-178.1-177175.10115.2
485K25.3Very low28.2Very low180 Ų180150.8 Ų150.878%0.78382%0.817SS**  cis81.299.635-164.7-171.6-176.3177.10115
486V24.3Very low28.5Very low147 Ų147148.8 Ų148.889%0.89181%0.807SS**  trans-138.4140.7135.7176.80000108.5
487T26.6Very low28.7Very low114 Ų114147.4 Ų147.470%0.69981%0.806SS**  trans-125.6136.4-175.442.50000112
488S25.1Very low29Very low114 Ų114148.4 Ų148.480%0.79780%0.8SS**  trans-179.9150.8153.351.70000111.1
489R26.6Very low29Very low224 Ų224151 Ų15185%0.84580%0.804SS**  cis-175.2136.9-32.2-119.7-175.5-176.1-172.41.9106.4
490L26.2Very low29.2Very low155 Ų155150.4 Ų150.481%0.81280%0.801SS**  trans67.2150.4148.7-61.2166.6000122.3
491I26.8Very low29.2Very low152 Ų152145.6 Ų145.678%0.77980%0.798SS**  trans-96.5-177-177.96.4172.3000110.3
492P41.1Very low29.2Very low114 Ų114145.2 Ų145.274%0.7480%0.803SS**  cis-129.1-115-17.3270.5000113.8
493P52Low29.3Very low125 Ų125144.1 Ų144.181%0.81280%0.803SS**  trans-121.1178.2-136.938.7-17000116.7
494G24.2Very low29.4Very low75 Ų75145.2 Ų145.277%0.77381%0.81SS**  trans123.7159.1179.800000111.4
495E25.4Very low29.5Very low194 Ų194143.7 Ų143.791%0.90781%0.807SS**  cis-157.1179.91-147.9174.1-166.400109.8
496E34.6Very low29.6Very low138 Ų138146.6 Ų146.665%0.64581%0.814SS**  trans-63.8159-177.3-52.7178.8149.300114.8K498E496-K498 IonicContact OE1-NZ 2.96Å; E496-K498 IonicContact OE2-NZ 2.82Å; E496-K498 PolarHBondContact OE2-NZ 3.25Å
497T30Very low29.8Very low146 Ų146143.2 Ų143.290%0.89680%0.797SS**  trans-140.4122.3144.4-520000111.4
498K32.1Very low29.9Very low150 Ų150143.8 Ų143.865%0.65280%0.8SS**  trans-92.6146.8-178.8-63.2175.6165.585.30112.3E496E496-K498 IonicContact OE1-NZ 2.96Å; E496-K498 IonicContact OE2-NZ 2.82Å; E496-K498 PolarHBondContact OE2-NZ 3.25Å
499R28.3Very low30Very low250 Ų250147.5 Ų147.594%0.94380%0.801SS**  trans154.7146.1145.2-91.3171.3177.7-164.2-0.3108.9
500S28.6Very low30Very low113 Ų113142.9 Ų142.979%0.7980%0.803SS**  cis-154.3141.1-7.848.60000106.1
501G26.9Very low30Very low84 Ų84138.7 Ų138.787%0.86680%0.798SS**  99.5120.273.100000110
502G27.4Very low29.9Very low79 Ų79135.1 Ų135.181%0.81480%0.799SS**  trans155.994.9-179.900000113.7
503D29.6Very low29.1Very low161 Ų161141.3 Ų141.386%0.86181%0.807SS**  trans-66.2159.7172-65.6-73000113
504V30.5Very low27.9Very low143 Ų143143 Ų14387%0.86781%0.808SS**  -163.6122111.9145.40000110.2
505M29Very low27.9Very low159 Ų159143.1 Ų143.178%0.78381%0.809SS**  trans-84.9141.2169.1174.478.4131.300109.9
506R26.8Very low27.9Very low242 Ų242142.2 Ų142.291%0.91381%0.807SS**  trans-138.7128.3146.6-160.7178.1-71.9-168.60.4110.5
507S28.9Very low27.4Very low76 Ų76140.9 Ų140.953%0.53181%0.813SS.*  trans-117.2-165.1-175.7-168.20000110.4
508V27.3Very low27.1Very low126 Ų126138.8 Ų138.876%0.76480%0.804SS**  trans84.598.2176.5-168.70000112.6
509K27.8Very low26.7Very low191 Ų191138.5 Ų138.583%0.8381%0.81SS**  91.9125.651.9-79.1-179.3177.6-178.20113
510S26.8Very low26.6Very low127 Ų127132.1 Ų132.189%0.88880%0.799SS**  trans149.3134.9133.4-168.50000110.5
511G25.5Very low26.3Very low68 Ų68138.3 Ų138.370%0.70181%0.805SS**  cis159.6127.4-8.500000114
512G24.2Very low26.2Very low77 Ų77139.8 Ų139.879%0.79480%0.801SS**  trans77.6158.9165.100000117.2
513R25.2Very low25.9Very low243 Ų243140.9 Ų140.992%0.91780%0.797SS**  cis-150.2151.4-8.4-85.6-169-174.2-161.42111.4
514I27.9Very low25.6Very low161 Ų161142.9 Ų142.983%0.82680%0.801SS**  trans-12.4137.1150.7-59.1154.5000117.3
515G23.3Very low25.2Very low78 Ų78139.7 Ų139.780%0.80480%0.797SS**  trans-155.1138156.700000110.2
516M25.2Very low25.1Very low174 Ų174136 Ų13686%0.85780%0.8SS**  trans-106.2158.6-170-67.2-179.86600113.9
517S24Very low25Very low111 Ų111130 Ų13078%0.77680%0.795SS**  trans64.2124.1145.7-160.70000120.2
518S23.7Very low24.7Very low101 Ų101135 Ų13571%0.70681%0.81SS**  -166.5119110.7-169.60000109.8
519D24.8Very low24.6Very low144 Ų144134.8 Ų134.877%0.7781%0.812SS**  trans-64.5139.1154.9-63.1-71.5000109.2
520V25.2Very low24.4Very low117 Ų117134.5 Ų134.571%0.70981%0.813SS**  trans-139.3101.6154.1178.90000107.4
521W22Very low24.3Very low243 Ų243137.2 Ų137.292%0.9281%0.814SS**  trans-73.5129.4157.4-78.4-13.9000109.2
522S24.3Very low24.3Very low114 Ų114140.3 Ų140.380%0.79781%0.81SS**  trans-126.2108.3155-69.90000107.4
523S21.6Very low24.4Very low103 Ų103143.3 Ų143.372%0.7281%0.808SS**  trans-82.2170.3177.3-66.60000112.1
524E23.2Very low24.7Very low202 Ų202138 Ų13894%0.94480%0.798SS**  trans81.8114.3163.5-56.4-170.4144.700117.7
525G23.4Very low25Very low77 Ų77133.8 Ų133.879%0.79478%0.782SS**  trans165.142.3-177.700000111S527G525-S527 PolarHBondContact O-N 3.46Å
526G25.9Very low25.8Very low82 Ų82133.6 Ų133.685%0.84576%0.762SS**  trans-68.2123.3-172.300000112.8
527S25.2Very low26.7Very low115 Ų115126.8 Ų126.880%0.80473%0.728SS**  trans-145.5119.1162.3-74.70000107.6G525G525-S527 PolarHBondContact O-N 3.46Å
528E23Very low26.9Very low181 Ų181125.3 Ų125.385%0.84672%0.718SS**  trans-63.1132.3178-64172.3118.700110.7H530E528-H530 PolarHBondContact O-N 2.96Å
529P24.7Very low27.3Very low122 Ų122127.8 Ų127.879%0.79272%0.718SS**  trans-73108.5165.729.2-30.4000108.8M531P529-M531 PolarHBondContact O-N 3.23Å
530H24.2Very low27.5Very low185 Ų185125.3 Ų125.386%0.85671%0.709SS**  trans-51.9124.2171.1-97.2-83.8000110.8E528 E532E528-H530 PolarHBondContact O-N 2.96Å; H530-E532 PolarHBondContact O-N 2.89Å; H530-E532 VanDerWaalsContact O-N 3.15Å
531M23.7Very low27.9Very low184 Ų184123.7 Ų123.791%0.90670%0.696SS**  trans-71.8102.6174.1-71.3-108.5-91.400110.3P529P529-M531 PolarHBondContact O-N 3.23Å
532E25.9Very low28.1Very low133 Ų133116.7 Ų116.762%0.62168%0.684SS**  trans-77.7126.4168.2-76.6-144.3128.300111.6K36 H530 N534K36-E532 IonicContact NZ-OE2 3.45Å; H530-E532 PolarHBondContact O-N 2.89Å; H530-E532 VanDerWaalsContact O-N 3.15Å; E532-N534 PolarHBondContact O-N 2.94Å
533N26.2Very low28.4Very low140 Ų140115.6 Ų115.675%0.74967%0.673SS**  trans-70.4109.4173.5-88.3-47.9000111.1S535N533-S535 PolarHBondContact O-N 2.97Å
534N31Very low28.7Very low132 Ų132116.8 Ų116.871%0.70666%0.662SS**  trans-69.724.7171.9-98.6-32.1000114.4E532 L536E532-N534 PolarHBondContact O-N 2.94Å; N534-L536 VanDerWaalsContact C-N 3.29Å; N534-L536 PolarHBondContact O-N 2.83Å
535S34.7Very low29.2Very low71 Ų71111.6 Ų111.650%0.49764%0.64SS.*G310 helixtrans-81.40.9-177.264.70000114.5N533 F537 S538N533-S535 PolarHBondContact O-N 2.97Å; S535-F537 PolarHBondContact O-N 3.18Å; S535-F537 VanDerWaalsContact O-N 3.13Å; S535-S538 PolarHBondContact O-N 3.02Å; S535-S538 PolarHBondContact O-OG 3.26Å; S535-S538 VanDerWaalsContact O-OG 3.08Å
536L40.1Very low29.2Very low75 Ų75112.3 Ų112.339%0.39363%0.629SS.*G310 helixtrans-59.9-22.2178.7-83.3160.7000113.6K36 L40 N534K36-L536 VanDerWaalsContact CE-CD1 3.43Å; L40-L536 HydrophobicContact CD1-CD2 4.01Å; L40-L536 HydrophobicContact CD2-CD2 4.48Å; N534-L536 VanDerWaalsContact C-N 3.29Å; N534-L536 PolarHBondContact O-N 2.83Å
537F44.1Very low29.1Very low30 Ų30115.2 Ų115.213%0.13262%0.619CS.*G310 helixtrans-112.823.9-177-52.7-78.4000112.7F84 N120 R123 V124 S535 H539F84-F537 HydrophobicContact CB-CE1 4.42Å; F84-F537 HydrophobicContact CD2-CE1 4.42Å; F84-F537 HydrophobicContact CG-CE1 4.42Å; N120-F537 WeakPolarHBondContact ND2-CE2 3.48Å; N120-F537 VanDerWaalsContact ND2-CZ 3.26Å; N120-F537 WeakPolarHBondContact ND2-CZ 3.48Å; N120-F537 WeakPolarHBondContact OD1-CD2 3.42Å; N120-F537 VanDerWaalsContact OD1-CE2 3.22Å; N120-F537 WeakPolarHBondContact OD1-CE2 3.43Å; R123-F537 PolarHBondContact NH2-O 3.08Å; V124-F537 HydrophobicContact CG1-CD1 4Å; V124-F537 HydrophobicContact CG1-CE1 3.46Å; V124-F537 VanDerWaalsContact CG1-CE1 3.46Å; V124-F537 HydrophobicContact CG1-CZ 4.13Å; S535-F537 PolarHBondContact O-N 3.18Å; S535-F537 VanDerWaalsContact O-N 3.13Å; F537-H539 PolarHBondContact O-N 2.83Å
538S27.5Very low29.1Very low81 Ų81114 Ų11457%0.56661%0.608SS**  trans-89.250.2169.773.40000111.9S535 P540S535-S538 PolarHBondContact O-N 3.02Å; S535-S538 PolarHBondContact O-OG 3.26Å; S535-S538 VanDerWaalsContact O-OG 3.08Å; S538-P540 WeakPolarHBondContact O-CD 3.32Å
539H33.2Very low29.2Very low153 Ų153114.6 Ų114.671%0.70861%0.608SS**  trans-86.3114.2152.7-112.8-77.5000106.9F537 L541F537-H539 PolarHBondContact O-N 2.83Å; H539-L541 PolarHBondContact O-N 3.44Å
540P28.4Very low29.2Very low91 Ų91111.9 Ų111.959%0.59160%0.602SS**  trans-55.8131.8154.4-13.628.4000106.6S538 S542S538-P540 WeakPolarHBondContact O-CD 3.32Å; P540-S542 PolarHBondContact O-N 3.2Å; P540-S542 PolarHBondContact O-OG 2.88Å
541L34.7Very low29.5Very low83 Ų83110 Ų11044%0.43560%0.596SS.*  trans-66.982.1157.9-70.9166.8000105.6H539 V543H539-L541 PolarHBondContact O-N 3.44Å; L541-V543 VanDerWaalsContact C-N 3.28Å; L541-V543 PolarHBondContact O-N 3.3Å
542S25.9Very low29.3Very low96 Ų96112.1 Ų112.167%0.67159%0.594SS**  trans-65.386.7-172.2-65.90000110.2P540 W544P540-S542 PolarHBondContact O-N 3.2Å; P540-S542 PolarHBondContact O-OG 2.88Å; S542-W544 PolarHBondContact O-N 3.16Å
543V29Very low29.2Very low92 Ų92111.1 Ų111.156%0.55860%0.601SS**  trans39.876.8166.5-175.60000112.2L541 L545L541-V543 VanDerWaalsContact C-N 3.28Å; L541-V543 PolarHBondContact O-N 3.3Å; V543-L545 HydrophobicContact CG1-CB 3.99Å; V543-L545 HydrophobicContact CG1-CD1 4.12Å; V543-L545 HydrophobicContact CG1-CG 4.39Å; V543-L545 PolarHBondContact O-N 2.81Å
544W29.7Very low29.1Very low127 Ų127110.2 Ų110.248%0.48160%0.604SS.*  trans-75.662.2169-151.169.4000110.9F130 A134 H135 S542 T546F130-W544 HydrophobicContact CZ-CE3 4.39Å; A134-W544 HydrophobicContact CB-CH2 4.32Å; H135-W544 AromaticContact CD2-CH2 3.73Å; H135-W544 AromaticContact CD2-CZ2 3.85Å; H135-W544 AromaticContact CE1-CH2 3.39Å; H135-W544 WeakPolarHBondContact CE1-CH2 3.36Å; H135-W544 AromaticContact ND1-CH2 3.94Å; H135-W544 AromaticContact NE2-CH2 3.25Å; H135-W544 WeakPolarHBondContact NE2-CH2 3.31Å; H135-W544 AromaticContact NE2-CZ2 3.45Å; H135-W544 WeakPolarHBondContact NE2-CZ2 3.29Å; S542-W544 PolarHBondContact O-N 3.16Å; W544-T546 VanDerWaalsContact C-N 3.32Å; W544-T546 PolarHBondContact NE1-OG1 3.22Å
545L32Very low28.8Very low93 Ų93114.6 Ų114.649%0.48761%0.612SS.*  trans-100.544.7160.8-86.4165.5000109.4V543 K547V543-L545 HydrophobicContact CG1-CB 3.99Å; V543-L545 HydrophobicContact CG1-CD1 4.12Å; V543-L545 HydrophobicContact CG1-CG 4.39Å; V543-L545 PolarHBondContact O-N 2.81Å; L545-K547 PolarHBondContact O-N 2.99Å
546T23.8Very low28.3Very low93 Ų93120.4 Ų120.457%0.57163%0.631SS**  trans-67.390154.6360000108.2W544W544-T546 VanDerWaalsContact C-N 3.32Å; W544-T546 PolarHBondContact NE1-OG1 3.22Å
547K25.1Very low27.5Very low143 Ų143122.9 Ų122.962%0.62266%0.655SS**  trans21.8110161.7-57.8-167.9175.6-154.80114.8D316 L545 K549D316-K547 IonicContact OD2-NZ 3.21Å; D316-K547 PolarHBondContact OD2-NZ 2.96Å; L545-K547 PolarHBondContact O-N 2.99Å; K547-K549 PolarHBondContact O-N 3.49Å; K547-K549 VanDerWaalsContact O-N 3.17Å
548P24.6Very low26.6Very low90 Ų90130.8 Ų130.858%0.58469%0.692SS**  trans-48.8128.2154.2-19.331.2000107.6G550P548-G550 VanDerWaalsContact C-N 3.3Å; P548-G550 PolarHBondContact O-N 3.43Å
549K24.6Very low26.5Very low193 Ų193130.6 Ų130.684%0.83970%0.704SS**  trans-67.696.5173.5-82.4-176.9175.31780107.7K547 I551K547-K549 PolarHBondContact O-N 3.49Å; K547-K549 VanDerWaalsContact O-N 3.17Å; K549-I551 PolarHBondContact O-N 3.01Å
550G24.6Very low26.1Very low64 Ų64129 Ų12966%0.6671%0.709SS**  trans-51.6137.9161.400000109P548 R552P548-G550 VanDerWaalsContact C-N 3.3Å; P548-G550 PolarHBondContact O-N 3.43Å; G550-R552 PolarHBondContact O-N 2.94Å
551I30.3Very low26Very low145 Ų145132.4 Ų132.474%0.74472%0.723SS**SBendtrans-71.391.4-176.7-60.4169.5000109.2K549K549-I551 PolarHBondContact O-N 3.01Å
552R21.1Very low25.6Very low230 Ų230137 Ų13787%0.86875%0.747SS**  trans-166.8155.6151.7-159.4151.5-86-171.2-6.4114G550G550-R552 PolarHBondContact O-N 2.94Å
553C23.3Very low25.6Very low112 Ų112140 Ų14076%0.75776%0.755SS**  trans-48.9144.6-172.8-64.10000119.6
554C22.6Very low25.5Very low121 Ų121139.2 Ų139.282%0.81877%0.766SS**  trans16.1110.6143.4-51.60000120.8
555Y25.6Very low25.2Very low223 Ų223141.7 Ų141.788%0.87579%0.785SS**  -165.9156.6113.251.7-99.4000111.1
556E24Very low24.9Very low193 Ų193148 Ų14890%0.90280%0.802SS**  trans-94.8146.7-174.3-59.8178.4135.600112.9
557S24.1Very low25Very low127 Ų127153 Ų15389%0.88882%0.816SS**  trans-161.3151.9145.3-166.80000111.2
558Q25.4Very low25.2Very low196 Ų196153.7 Ų153.792%0.91683%0.825SS**  trans-93.9146.3-170.1-66.2172.4-7.900112.9
559G24.9Very low25.5Very low78 Ų78154.8 Ų154.880%0.80483%0.832SS**  trans-130.6132.7168.500000110.9
560S24.7Very low25.9Very low118 Ų118151 Ų15183%0.82583%0.827SS**  trans-100134.8-174.444.70000112.6
561N25.8Very low26.1Very low164 Ų164156.5 Ų156.588%0.87784%0.835SS**  trans-89.4137.3176.5-78.5-36000111.8
562L26.6Very low26.1Very low180 Ų180156.7 Ų156.794%0.94283%0.833SS**  trans-115.8116.9165.1-76.1170.3000108.7
563N26.4Very low26.3Very low158 Ų158153.1 Ų153.185%0.84583%0.826SS**  trans-114.6132178.1-160.74.9000109.7
564G25.7Very low26.5Very low75 Ų75152.8 Ų152.877%0.77383%0.825SS**  trans-142.282.7-169.500000112
565M24.7Very low27.3Very low179 Ų179154.3 Ų154.388%0.88283%0.83SS**  trans-84.4131.2-172.3-152.7172.9-165.600111.8
566R24.6Very low27.6Very low227 Ų227148.1 Ų148.186%0.85782%0.819SS**  trans-118.5123.7172.3-159.3177.2-167.2-174.52.2110
567K26.9Very low28.7Very low196 Ų196147.3 Ų147.385%0.85282%0.821SS**  trans-81.2153.5-179.3-64.9-176.8176.5-175.50111.9
568I28.5Very low29.5Very low158 Ų158144.1 Ų144.181%0.8181%0.809SS**  trans-126.8142.6177.7-58174.2000108.7
569P30.4Very low30.7Very low114 Ų114145.7 Ų145.774%0.7481%0.806SS**  trans-85.4165.5170.4-4.424.4000113.4
570P33.2Very low32.1Very low113 Ų113143.7 Ų143.773%0.73478%0.779SS**  trans-91.3161.5-159.836.7-37.8000116.4
571E29.3Very low33.3Very low179 Ų179143.1 Ų143.184%0.83678%0.782SS**  trans41.2141.3143.1-71.8175-175.600120.5
572E29.5Very low34.6Very low149 Ų149137.4 Ų137.470%0.69676%0.762SS**  cis-165-177.2-12.5-144-164.7-140.200108.4
573H26.3Very low36.1Very low156 Ų156130.8 Ų130.872%0.72273%0.73SS**  trans101.4132.2159.7-51.8-31.5000121.9
574S27.5Very low37.4Very low104 Ų104129.1 Ų129.173%0.72773%0.726SS**  trans68.8117.7153.672.30000119.8S576S574-S576 PolarHBondContact O-N 3.2Å
575V40.1Very low38.8Very low154 Ų154129.5 Ų129.593%0.93371%0.709SS**  trans-64.4110.4163.6176.80000109.2
576S31.7Very low40.3Very low92 Ų92124.4 Ų124.464%0.64369%0.688SS**  trans-142.8133165.160.70000110.6S574 G578S574-S576 PolarHBondContact O-N 3.2Å; S576-G578 PolarHBondContact O-N 2.84Å
577N47.3Very low41.9Very low176 Ų176119.2 Ų119.294%0.94167%0.672SS**  trans-74.271.2177.3-91.6-22.6000110.8R579N577-R579 PolarHBondContact O-N 3.49Å
578G39.7Very low43.2Very low61 Ų61118.8 Ų118.863%0.62967%0.673SS**  trans-81.199.117900000112.9S576S576-G578 PolarHBondContact O-N 2.84Å
579R50.1Low44.5Very low229 Ų229116 Ų11686%0.86466%0.657SS**  trans-68132.3162.4-63.5-176.7-176.8-175.31108.8N577N577-R579 PolarHBondContact O-N 3.49Å
580C56.3Low46Very low35 Ų35112.4 Ų112.424%0.23663%0.633CS.*  trans-79.4156.3174.193.20000111G582 C583C580-G582 PolarHBondContact O-N 3.32Å; C580-G582 PolarHBondContact SG-N 3.17Å; C580-C583 WeakPolarHBondContact O-CB 3.43Å; C580-C583 PolarHBondContact O-N 3.39Å; C580-C583 PolarHBondContact SG-SG 2.82Å
581A48.3Very low47.3Very low107 Ų107110.9 Ų110.988%0.88462%0.621SS**THydrogen-bonded Turntrans-63.2-14-176.700000114.6
582G53.6Low48.9Very low44 Ų44108 Ų10845%0.45462%0.621SS.*THydrogen-bonded Turntrans-87.9-10172.200000114.9C580 V584C580-G582 PolarHBondContact O-N 3.32Å; C580-G582 PolarHBondContact SG-N 3.17Å; G582-V584 VanDerWaalsContact C-N 3.28Å; G582-V584 PolarHBondContact O-N 2.87Å; G582-V584 VanDerWaalsContact O-N 3.16Å
583C59.2Low49.9Very low41 Ų41111.8 Ų111.828%0.27763%0.629SS.*THydrogen-bonded Turntrans-89.546.8-175.6-69.60000113.3C580C580-C583 WeakPolarHBondContact O-CB 3.43Å; C580-C583 PolarHBondContact O-N 3.39Å; C580-C583 PolarHBondContact SG-SG 2.82Å
584V53.5Low51.5Low123 Ų123105.8 Ų105.875%0.74560%0.604SS**THydrogen-bonded Turntrans-95.5-17.8174.9-1750000112G582G582-V584 VanDerWaalsContact C-N 3.28Å; G582-V584 PolarHBondContact O-N 2.87Å; G582-V584 VanDerWaalsContact O-N 3.16Å
585L54.3Low53.2Low82 Ų82103.8 Ų103.843%0.42958%0.583SS.*SBendtrans-81.6141.4179.3-61.3175.9000112.3E589L585-E589 VanDerWaalsContact CA-OE2 3.24Å; L585-E589 WeakPolarHBondContact CA-OE2 3.16Å; L585-E589 HydrophobicContact CB-CB 4.27Å; L585-E589 HydrophobicContact CD2-CB 4.2Å; L585-E589 WeakPolarHBondContact CD2-OE2 3.38Å
586T57Low54.2Low72 Ų7299.6 Ų99.644%0.44256%0.564SS.*  trans-77.4164.2169.2690000110.8E588 E589T586-E588 PolarHBondContact O-N 3.49Å; T586-E588 VanDerWaalsContact O-N 3.12Å; T586-E589 PolarHBondContact N-OE2 3.15Å; T586-E589 PolarHBondContact O-N 3.09Å; T586-E589 VanDerWaalsContact O-N 3.11Å
587F57Low55.6Low119 Ų11999 Ų9952%0.52256%0.56SS.*G310 helixtrans-59.5-27.3-178.3-142.8-69.6000112.3E589 M608 V611F587-E589 VanDerWaalsContact C-N 3.34Å; F587-M608 HydrophobicContact CB-CE 4.46Å; F587-M608 HydrophobicContact CD2-CE 3.62Å; F587-M608 HydrophobicContact CD2-SD 3.41Å; F587-M608 WeakPolarHBondContact CD2-SD 3.31Å; F587-M608 HydrophobicContact CE2-CE 4.24Å; F587-M608 HydrophobicContact CE2-SD 3.45Å; F587-M608 WeakPolarHBondContact CE2-SD 3.45Å; F587-M608 HydrophobicContact CG-CE 4.34Å; F587-M608 HydrophobicContact CG-SD 4.24Å; F587-M608 HydrophobicContact CZ-SD 4.31Å; F587-V611 HydrophobicContact CE2-CG1 4.16Å; F587-V611 HydrophobicContact CZ-CG1 3.9Å
588E55.2Low56.3Low186 Ų18691.7 Ų91.787%0.86952%0.522SS*.G310 helixtrans-76.5-17.9-178.1-65.6164.6178.400113T586T586-E588 PolarHBondContact O-N 3.49Å; T586-E588 VanDerWaalsContact O-N 3.12Å
589E55.4Low57.5Low100 Ų10092.3 Ų92.347%0.46751%0.508SS..G310 helixtrans-93.3-1.7-178.3-64.3171.6146.600113.1L585 T586 F587 T591L585-E589 VanDerWaalsContact CA-OE2 3.24Å; L585-E589 WeakPolarHBondContact CA-OE2 3.16Å; L585-E589 HydrophobicContact CB-CB 4.27Å; L585-E589 HydrophobicContact CD2-CB 4.2Å; L585-E589 WeakPolarHBondContact CD2-OE2 3.38Å; T586-E589 PolarHBondContact N-OE2 3.15Å; T586-E589 PolarHBondContact O-N 3.09Å; T586-E589 VanDerWaalsContact O-N 3.11Å; F587-E589 VanDerWaalsContact C-N 3.34Å; E589-T591 PolarHBondContact O-N 2.79Å
590V62.5Low58.1Low39 Ų3986 Ų8624%0.23650%0.5CS..  trans-80108.8178.4-175.90000110.2F595V590-F595 HydrophobicContact CG1-CD2 4.25Å
591T60.1Low58.2Low80 Ų8087.7 Ų87.749%0.49151%0.511SS..  trans-106.8165.3177.368.80000111.2E589 R593 S594 F595E589-T591 PolarHBondContact O-N 2.79Å; T591-R593 PolarHBondContact O-N 3.34Å; T591-R593 PolarHBondContact OG1-N 2.79Å; T591-S594 PolarHBondContact N-OG 3.42Å; T591-S594 PolarHBondContact O-N 2.98Å; T591-S594 VanDerWaalsContact O-N 3.1Å; T591-S594 PolarHBondContact O-OG 3.42Å; T591-S594 PolarHBondContact OG1-N 3.02Å; T591-S594 PolarHBondContact OG1-OG 3.43Å; T591-F595 WeakPolarHBondContact O-CB 3.43Å; T591-F595 PolarHBondContact O-N 3.45Å
592S61.8Low58.6Low119 Ų11983.9 Ų83.983%0.83248%0.478SS*.THydrogen-bonded Turntrans-56.4-19.8175.257.80000114.4
593R51.7Low58.7Low229 Ų22988.5 Ų88.586%0.86450%0.497SS*.THydrogen-bonded Turntrans-88.8-36.2176.6-62.8-173.7-179.9-142.51.2113.2T591T591-R593 PolarHBondContact O-N 3.34Å; T591-R593 PolarHBondContact OG1-N 2.79Å
594S58.9Low58.4Low29 Ų2993 Ų9320%0.20352%0.518CS..THydrogen-bonded Turntrans-80.9-24.317650.60000112.9T591 A596 S597 V598T591-S594 PolarHBondContact N-OG 3.42Å; T591-S594 PolarHBondContact O-N 2.98Å; T591-S594 VanDerWaalsContact O-N 3.1Å; T591-S594 PolarHBondContact O-OG 3.42Å; T591-S594 PolarHBondContact OG1-N 3.02Å; T591-S594 PolarHBondContact OG1-OG 3.43Å; S594-A596 PolarHBondContact O-N 3.16Å; S594-S597 WeakPolarHBondContact O-CB 3.47Å; S594-S597 PolarHBondContact O-N 3.49Å; S594-V598 WeakPolarHBondContact O-CG2 3.33Å; S594-V598 PolarHBondContact O-N 3.03Å
595F63.5Low58.5Low62 Ų6291.4 Ų91.427%0.27251%0.513SS..Hα-helixtrans-46.9-52.1-176-172-90.7000115.1V590 T591 S597 V598 Q599 L612 T616V590-F595 HydrophobicContact CG1-CD2 4.25Å; T591-F595 WeakPolarHBondContact O-CB 3.43Å; T591-F595 PolarHBondContact O-N 3.45Å; F595-S597 VanDerWaalsContact C-N 3.33Å; F595-S597 PolarHBondContact O-N 3.46Å; F595-V598 PolarHBondContact O-N 2.86Å; F595-Q599 WeakPolarHBondContact O-CB 3.39Å; F595-Q599 PolarHBondContact O-N 3.44Å; F595-L612 HydrophobicContact CD2-CD2 4.49Å; F595-L612 HydrophobicContact CE2-CB 4.48Å; F595-L612 HydrophobicContact CE2-CD2 3.99Å; F595-T616 WeakPolarHBondContact CZ-OG1 3.3Å
596A61Low59.1Low66 Ų6689 Ų8955%0.54550%0.502SS..Hα-helixtrans-68.6-31.3-177.700000112.9S594 S600S594-A596 PolarHBondContact O-N 3.16Å; A596-S600 WeakPolarHBondContact O-CB 3.43Å; A596-S600 PolarHBondContact O-N 3.34Å; A596-S600 PolarHBondContact O-OG 3.31Å
597S60.3Low59.2Low80 Ų8090.4 Ų90.456%0.55951%0.507SS*.Hα-helixtrans-72.5-39.8174.9176.40000111.5S594 F595 S600 S601S594-S597 WeakPolarHBondContact O-CB 3.47Å; S594-S597 PolarHBondContact O-N 3.49Å; F595-S597 VanDerWaalsContact C-N 3.33Å; F595-S597 PolarHBondContact O-N 3.46Å; S597-S600 PolarHBondContact O-OG 2.96Å; S597-S601 VanDerWaalsContact O-CB 3.31Å; S597-S601 WeakPolarHBondContact O-CB 3.45Å; S597-S601 PolarHBondContact O-N 3.44Å; S597-S601 PolarHBondContact O-OG 3.34Å
598V63.8Low59.4Low22 Ų2287.5 Ų87.513%0.13350%0.496CS..Hα-helixtrans-63.4-52.1172.7176.10000109.7S594 F595 S600 S601 H609 L612S594-V598 WeakPolarHBondContact O-CG2 3.33Å; S594-V598 PolarHBondContact O-N 3.03Å; F595-V598 PolarHBondContact O-N 2.86Å; V598-S600 PolarHBondContact O-N 3.46Å; V598-S600 VanDerWaalsContact O-N 3.13Å; V598-S601 PolarHBondContact O-N 2.88Å; V598-S601 PolarHBondContact O-OG 3.16Å; V598-H609 PolarHBondContact O-CD2 3.45Å; V598-H609 PolarHBondContact O-NE2 2.96Å; V598-L612 HydrophobicContact CG1-CD1 3.82Å
599Q64.6Low60Low75 Ų7579.5 Ų79.535%0.3546%0.459SS..Hα-helixtrans-60.2-27.7-176.3-171.7168.944.300114.3F595 T616F595-Q599 WeakPolarHBondContact O-CB 3.39Å; F595-Q599 PolarHBondContact O-N 3.44Å; Q599-T616 PolarHBondContact NE2-OG1 2.92Å
600S63Low60.5Low97 Ų9781.6 Ų81.668%0.67846%0.462SS*.Hα-helixtrans-95.7-8-176.253.40000115.5A596 S597 V598A596-S600 WeakPolarHBondContact O-CB 3.43Å; A596-S600 PolarHBondContact O-N 3.34Å; A596-S600 PolarHBondContact O-OG 3.31Å; S597-S600 PolarHBondContact O-OG 2.96Å; V598-S600 PolarHBondContact O-N 3.46Å; V598-S600 VanDerWaalsContact O-N 3.13Å
601S58.1Low60.6Low69 Ų6982.9 Ų82.948%0.48347%0.47SS..SBendtrans-98.93.7-169.1490000115.9S597 V598S597-S601 VanDerWaalsContact O-CB 3.31Å; S597-S601 WeakPolarHBondContact O-CB 3.45Å; S597-S601 PolarHBondContact O-N 3.44Å; S597-S601 PolarHBondContact O-OG 3.34Å; V598-S601 PolarHBondContact O-N 2.88Å; V598-S601 PolarHBondContact O-OG 3.16Å
602C56.3Low60.7Low27 Ų2779.6 Ų79.618%0.18245%0.45CS..  trans-125.2120.7-178.2-168.90000112.2H609C602-H609 VanDerWaalsContact CB-CE1 3.41Å; C602-H609 WeakPolarHBondContact CB-CE1 3.3Å; C602-H609 VanDerWaalsContact CB-NE2 3.33Å; C602-H609 WeakPolarHBondContact CB-NE2 3.39Å
603V56.1Low60.9Low141 Ų14178.4 Ų78.486%0.85543%0.431SS*.SBendtrans-85.8-22.5175.9-179.10000111.9
604N52.8Low61.7Low135 Ų13571.5 Ų71.572%0.72241%0.408SS*.SBendtrans-106.722.1-168-644.5000114.3C606N604-C606 PolarHBondContact O-N 2.95Å; N604-C606 VanDerWaalsContact O-N 3.11Å
605S55.9Low61.9Low90 Ų9072.7 Ų72.763%0.62942%0.42SS*.  trans41.354.2166.857.40000116.4
606C66.5Low61.9Low32 Ų3270.6 Ų70.622%0.21641%0.412CS..  trans-66.2164.3175.875.10000111.9N604 M608 H609 R610N604-C606 PolarHBondContact O-N 2.95Å; N604-C606 VanDerWaalsContact O-N 3.11Å; C606-M608 VanDerWaalsContact C-N 3.25Å; C606-M608 PolarHBondContact O-N 3.25Å; C606-M608 VanDerWaalsContact O-N 3.13Å; C606-H609 PolarHBondContact O-N 3.01Å; C606-H609 PolarHBondContact SG-ND1 3.22Å; C606-R610 PolarHBondContact O-N 2.87Å
607D59.2Low62.1Low102 Ų10271.9 Ų71.955%0.54541%0.407SS..Hα-helixtrans-55.8-36.5-172.3-63.9-64.7000113.8R610 V611D607-R610 PolarHBondContact O-N 3.37Å; D607-R610 IonicContact OD1-CZ 2.7Å; D607-R610 IonicContact OD1-NH1 3.93Å; D607-R610 PolarHBondContact OD1-NH1 2.93Å; D607-R610 IonicContact OD1-NH2 3.76Å; D607-R610 PolarHBondContact OD1-NH2 2.99Å; D607-V611 WeakPolarHBondContact O-CG2 3.47Å; D607-V611 PolarHBondContact O-N 3.33Å
608M59.8Low62.2Low58 Ų5875.9 Ų75.929%0.28641%0.41SS..Hα-helixtrans-60.5-47.6175.1-176.267.776.800111.7F587 C606 V611 L612F587-M608 HydrophobicContact CB-CE 4.46Å; F587-M608 HydrophobicContact CD2-CE 3.62Å; F587-M608 HydrophobicContact CD2-SD 3.41Å; F587-M608 WeakPolarHBondContact CD2-SD 3.31Å; F587-M608 HydrophobicContact CE2-CE 4.24Å; F587-M608 HydrophobicContact CE2-SD 3.45Å; F587-M608 WeakPolarHBondContact CE2-SD 3.45Å; F587-M608 HydrophobicContact CG-CE 4.34Å; F587-M608 HydrophobicContact CG-SD 4.24Å; F587-M608 HydrophobicContact CZ-SD 4.31Å; C606-M608 VanDerWaalsContact C-N 3.25Å; C606-M608 PolarHBondContact O-N 3.25Å; C606-M608 VanDerWaalsContact O-N 3.13Å; M608-V611 PolarHBondContact O-N 2.88Å; M608-L612 HydrophobicContact CG-CD1 4.17Å; M608-L612 WeakPolarHBondContact O-CG 3.42Å; M608-L612 PolarHBondContact O-N 2.98Å
609H68Low61.9Low18 Ų1881.5 Ų81.58%0.08343%0.432CS..Hα-helixtrans-65.8-37177.2-74.979.7000112.2V598 C602 C606 L612 Q613V598-H609 PolarHBondContact O-CD2 3.45Å; V598-H609 PolarHBondContact O-NE2 2.96Å; C602-H609 VanDerWaalsContact CB-CE1 3.41Å; C602-H609 WeakPolarHBondContact CB-CE1 3.3Å; C602-H609 VanDerWaalsContact CB-NE2 3.33Å; C602-H609 WeakPolarHBondContact CB-NE2 3.39Å; C606-H609 PolarHBondContact O-N 3.01Å; C606-H609 PolarHBondContact SG-ND1 3.22Å; H609-L612 PolarHBondContact O-N 3.48Å; H609-Q613 WeakPolarHBondContact O-CB 3.49Å; H609-Q613 PolarHBondContact O-N 3.06Å
610R65.6Low61.8Low144 Ų14485.6 Ų85.654%0.54345%0.445SS..Hα-helixtrans-60.8-47.6174.8-169.6175.769.9-129.5-10.8111.1C606 D607 Q613 E614C606-R610 PolarHBondContact O-N 2.87Å; D607-R610 PolarHBondContact O-N 3.37Å; D607-R610 IonicContact OD1-CZ 2.7Å; D607-R610 IonicContact OD1-NH1 3.93Å; D607-R610 PolarHBondContact OD1-NH1 2.93Å; D607-R610 IonicContact OD1-NH2 3.76Å; D607-R610 PolarHBondContact OD1-NH2 2.99Å; R610-Q613 PolarHBondContact O-N 3.32Å; R610-E614 WeakPolarHBondContact O-CB 3.43Å; R610-E614 PolarHBondContact O-N 3.46Å
611V66.1Low61.6Low65 Ų6587.2 Ų87.239%0.39444%0.443SS..Hα-helixtrans-63.7-43.2178.3173.10000111.9F587 D607 M608 E614 A615F587-V611 HydrophobicContact CE2-CG1 4.16Å; F587-V611 HydrophobicContact CZ-CG1 3.9Å; D607-V611 WeakPolarHBondContact O-CG2 3.47Å; D607-V611 PolarHBondContact O-N 3.33Å; M608-V611 PolarHBondContact O-N 2.88Å; V611-E614 PolarHBondContact O-N 3.28Å; V611-A615 WeakPolarHBondContact O-CB 3.41Å; V611-A615 PolarHBondContact O-N 3.44Å
612L62.6Low61.3Low12 Ų1289.9 Ų89.96%0.06345%0.448CS..Hα-helixtrans-67-36.5177.5-68.2171.5000112.6F595 V598 M608 H609 T616F595-L612 HydrophobicContact CD2-CD2 4.49Å; F595-L612 HydrophobicContact CE2-CB 4.48Å; F595-L612 HydrophobicContact CE2-CD2 3.99Å; V598-L612 HydrophobicContact CG1-CD1 3.82Å; M608-L612 HydrophobicContact CG-CD1 4.17Å; M608-L612 WeakPolarHBondContact O-CG 3.42Å; M608-L612 PolarHBondContact O-N 2.98Å; H609-L612 PolarHBondContact O-N 3.48Å; L612-T616 PolarHBondContact O-N 2.85Å; L612-T616 VanDerWaalsContact O-N 3.09Å; L612-T616 PolarHBondContact O-OG1 2.91Å
613Q65.9Low61Low93 Ų9397.5 Ų97.544%0.43547%0.473SS..Hα-helixtrans-65.3-47.2173.6-177.3177.8-1800111.2H609 R610 A615 T616 E617H609-Q613 WeakPolarHBondContact O-CB 3.49Å; H609-Q613 PolarHBondContact O-N 3.06Å; R610-Q613 PolarHBondContact O-N 3.32Å; Q613-A615 VanDerWaalsContact C-N 3.34Å; Q613-A615 PolarHBondContact O-N 3.33Å; Q613-T616 WeakPolarHBondContact O-CA 3.41Å; Q613-T616 VanDerWaalsContact O-CB 3.23Å; Q613-T616 WeakPolarHBondContact O-CB 3.44Å; Q613-T616 PolarHBondContact O-N 3.22Å; Q613-E617 WeakPolarHBondContact CG-OE1 3.49Å; Q613-E617 PolarHBondContact NE2-OE1 3.45Å; Q613-E617 PolarHBondContact O-N 2.9Å
614E68.2Low60.6Low85 Ų8598.3 Ų98.340%0.39747%0.465SS..Hα-helixtrans-63-40.1-179.9-165.4-179.7164.400111.9R610 V611 T616 E617 R618R610-E614 WeakPolarHBondContact O-CB 3.43Å; R610-E614 PolarHBondContact O-N 3.46Å; V611-E614 PolarHBondContact O-N 3.28Å; E614-T616 VanDerWaalsContact C-N 3.3Å; E614-T616 PolarHBondContact O-N 2.73Å; E614-E617 PolarHBondContact O-N 2.69Å; E614-R618 VanDerWaalsContact O-CG 3.3Å; E614-R618 WeakPolarHBondContact O-CG 3.44Å; E614-R618 PolarHBondContact O-N 2.98Å; E614-R618 IonicContact OE1-CZ 2.77Å; E614-R618 IonicContact OE1-NE 2.8Å; E614-R618 PolarHBondContact OE1-NE 3.04Å; E614-R618 IonicContact OE1-NH2 2.61Å; E614-R618 PolarHBondContact OE1-NH2 3.07Å
615A62.8Low60.5Low54 Ų5496.8 Ų96.845%0.44646%0.457SS..Hα-helixtrans-60.7-38.1171.700000112.5V611 Q613 F619V611-A615 WeakPolarHBondContact O-CB 3.41Å; V611-A615 PolarHBondContact O-N 3.44Å; Q613-A615 VanDerWaalsContact C-N 3.34Å; Q613-A615 PolarHBondContact O-N 3.33Å; A615-F619 PolarHBondContact O-N 3.28Å; A615-F619 VanDerWaalsContact O-N 3.09Å
616T63.1Low60Low18 Ų1899.5 Ų99.511%0.1146%0.457CS..Hα-helixtrans-63.5-44.7175.5-52.20000111.6F595 Q599 L612 Q613 E614 F619 R620F595-T616 WeakPolarHBondContact CZ-OG1 3.3Å; Q599-T616 PolarHBondContact NE2-OG1 2.92Å; L612-T616 PolarHBondContact O-N 2.85Å; L612-T616 VanDerWaalsContact O-N 3.09Å; L612-T616 PolarHBondContact O-OG1 2.91Å; Q613-T616 WeakPolarHBondContact O-CA 3.41Å; Q613-T616 VanDerWaalsContact O-CB 3.23Å; Q613-T616 WeakPolarHBondContact O-CB 3.44Å; Q613-T616 PolarHBondContact O-N 3.22Å; E614-T616 VanDerWaalsContact C-N 3.3Å; E614-T616 PolarHBondContact O-N 2.73Å; T616-F619 PolarHBondContact O-N 3.06Å; T616-R620 WeakPolarHBondContact O-CG 3.43Å; T616-R620 PolarHBondContact O-N 3.31Å
617E65.2Low58.8Low92 Ų9299.8 Ų99.843%0.4347%0.466SS..Hα-helixtrans-68.5-43.6-178.2-72.1174.2-167.800111.1Q613 E614 F619 R620 M621Q613-E617 WeakPolarHBondContact CG-OE1 3.49Å; Q613-E617 PolarHBondContact NE2-OE1 3.45Å; Q613-E617 PolarHBondContact O-N 2.9Å; E614-E617 PolarHBondContact O-N 2.69Å; E617-F619 VanDerWaalsContact C-N 3.34Å; E617-F619 PolarHBondContact O-N 3.33Å; E617-R620 PolarHBondContact O-N 3.06Å; E617-R620 VanDerWaalsContact O-N 3.16Å; E617-M621 WeakPolarHBondContact O-CG 3.47Å; E617-M621 PolarHBondContact O-N 3.4Å
618R63.7Low58.2Low165 Ų16597.6 Ų97.662%0.62346%0.457SS*.Hα-helixtrans-56.9-43.2172.4-69.7174.5-175.9-155.93.9112.2E614 M621 H622E614-R618 VanDerWaalsContact O-CG 3.3Å; E614-R618 WeakPolarHBondContact O-CG 3.44Å; E614-R618 PolarHBondContact O-N 2.98Å; E614-R618 IonicContact OE1-CZ 2.77Å; E614-R618 IonicContact OE1-NE 2.8Å; E614-R618 PolarHBondContact OE1-NE 3.04Å; E614-R618 IonicContact OE1-NH2 2.61Å; E614-R618 PolarHBondContact OE1-NH2 3.07Å; R618-M621 PolarHBondContact O-N 2.89Å; R618-H622 WeakPolarHBondContact O-CB 3.38Å; R618-H622 PolarHBondContact O-N 3.14Å
619F55.9Low57.4Low139 Ų139103.8 Ų103.861%0.6148%0.476SS*.Hα-helixtrans-64.9-41.4175.9-178.3-100.2000112.8A615 T616 E617 H622 R623A615-F619 PolarHBondContact O-N 3.28Å; A615-F619 VanDerWaalsContact O-N 3.09Å; T616-F619 PolarHBondContact O-N 3.06Å; E617-F619 VanDerWaalsContact C-N 3.34Å; E617-F619 PolarHBondContact O-N 3.33Å; F619-H622 PolarHBondContact O-N 3.05Å; F619-R623 PolarHBondContact O-N 3.08Å
620R63Low56Low162 Ų162113 Ų11361%0.61151%0.51SS*.Hα-helixtrans-62.8-44.8176.4-74.2175-179.9170.22.9111.8T616 E617 R623 F624T616-R620 WeakPolarHBondContact O-CG 3.43Å; T616-R620 PolarHBondContact O-N 3.31Å; E617-R620 PolarHBondContact O-N 3.06Å; E617-R620 VanDerWaalsContact O-N 3.16Å; R620-R623 PolarHBondContact O-N 3.42Å; R620-F624 PolarHBondContact O-N 3.42Å
621M58.8Low54.8Low131 Ų131112.6 Ų112.665%0.64552%0.515SS*.Hα-helixtrans-61.3-44.4175.3-70.8-172.572.900112.1E617 R618 R623 F624 N625E617-M621 WeakPolarHBondContact O-CG 3.47Å; E617-M621 PolarHBondContact O-N 3.4Å; R618-M621 PolarHBondContact O-N 2.89Å; M621-R623 VanDerWaalsContact C-N 3.31Å; M621-R623 PolarHBondContact O-N 3.33Å; M621-F624 PolarHBondContact O-N 3.42Å; M621-N625 PolarHBondContact O-N 2.67Å
622H51.9Low53.7Low125 Ų125115.5 Ų115.558%0.57952%0.524SS*.Hα-helixtrans-62.6-37.5178.9-164.4-80.5000112.4R618 F619 F626R618-H622 WeakPolarHBondContact O-CB 3.38Å; R618-H622 PolarHBondContact O-N 3.14Å; F619-H622 PolarHBondContact O-N 3.05Å; H622-F626 PolarHBondContact O-N 2.73Å
623R50.3Low52.6Low187 Ų187122.8 Ų122.871%0.70656%0.555SS**Hα-helixtrans-70.6-35175.2-168.8175.3176.1120.6-1.6112.6F619 R620 M621 F626 G627F619-R623 PolarHBondContact O-N 3.08Å; R620-R623 PolarHBondContact O-N 3.42Å; M621-R623 VanDerWaalsContact C-N 3.31Å; M621-R623 PolarHBondContact O-N 3.33Å; R623-F626 PolarHBondContact O-N 3.04Å; R623-G627 PolarHBondContact O-N 2.78Å
624F47.9Very low51.4Low157 Ų157121.8 Ų121.869%0.68956%0.559SS**Hα-helixtrans-64.8-46.7176.3-159.5-92.5000111.5R620 M621 F626 G627 V628R620-F624 PolarHBondContact O-N 3.42Å; M621-F624 PolarHBondContact O-N 3.42Å; F624-F626 PolarHBondContact O-N 3.08Å; F624-G627 PolarHBondContact O-N 2.98Å; F624-V628 HydrophobicContact CD1-CG2 4.5Å; F624-V628 HydrophobicContact CE1-CG2 4.43Å; F624-V628 PolarHBondContact O-N 3.33Å
625N49.1Very low50.2Low103 Ų103121.7 Ų121.755%0.55156%0.564SS**Hα-helixtrans-61.3-28.4176.4-73.4-12.4000113.5M621M621-N625 PolarHBondContact O-N 2.67Å
626F45.4Very low49Very low147 Ų147124.1 Ų124.165%0.64557%0.573SS**Hα-helixtrans-75.4-27.1175.1-120.3-86.7000113.7H622 R623 F624H622-F626 PolarHBondContact O-N 2.73Å; R623-F626 PolarHBondContact O-N 3.04Å; F624-F626 PolarHBondContact O-N 3.08Å
627G42.6Very low47.7Very low39 Ų39131.3 Ų131.340%0.40260%0.603SS.*Hα-helixtrans-67.7-50.8174.200000111.9R623 F624 R629 R630 E631R623-G627 PolarHBondContact O-N 2.78Å; F624-G627 PolarHBondContact O-N 2.98Å; G627-R629 VanDerWaalsContact C-N 3.29Å; G627-R629 PolarHBondContact O-N 3.44Å; G627-R630 WeakPolarHBondContact O-CB 3.39Å; G627-R630 PolarHBondContact O-N 3.4Å; G627-E631 PolarHBondContact O-N 3.2Å
628V47Very low46.3Very low56 Ų56134.1 Ų134.134%0.33962%0.616SS.*Hα-helixtrans-58.7-38.3-178.2-179.90000112.2F624 R630 E631 Q632F624-V628 HydrophobicContact CD1-CG2 4.5Å; F624-V628 HydrophobicContact CE1-CG2 4.43Å; F624-V628 PolarHBondContact O-N 3.33Å; V628-R630 PolarHBondContact O-N 3.3Å; V628-E631 PolarHBondContact O-N 3.1Å; V628-Q632 WeakPolarHBondContact O-CG 3.35Å; V628-Q632 PolarHBondContact O-N 2.93Å
629R42.3Very low45.2Very low187 Ų187133.3 Ų133.371%0.70662%0.619SS**Hα-helixtrans-65.9-15.9175.6-79.5-168.9176.2-150.9-1.2114.5G627G627-R629 VanDerWaalsContact C-N 3.29Å; G627-R629 PolarHBondContact O-N 3.44Å
630R38.3Very low44.2Very low211 Ų211130.5 Ų130.580%0.79662%0.617SS**Hα-helixtrans-88-39.2178-138.9177.9-169.9-172.22.4111.7G627 V628 K633 S634G627-R630 WeakPolarHBondContact O-CB 3.39Å; G627-R630 PolarHBondContact O-N 3.4Å; V628-R630 PolarHBondContact O-N 3.3Å; R630-K633 PolarHBondContact O-N 3.22Å; R630-S634 PolarHBondContact O-N 2.95Å
631E40.6Very low42.9Very low136 Ų136129.4 Ų129.464%0.63662%0.623SS**Hα-helixtrans-69.7-36.2176.6-68.4175.6152.500112.3G627 V628 K633 S634 V635G627-E631 PolarHBondContact O-N 3.2Å; V628-E631 PolarHBondContact O-N 3.1Å; E631-K633 PolarHBondContact O-N 2.98Å; E631-S634 PolarHBondContact O-N 3.47Å; E631-S634 PolarHBondContact O-OG 3.07Å; E631-V635 PolarHBondContact O-N 2.99Å
632Q43.4Very low41.8Very low126 Ų126128.4 Ų128.459%0.58963%0.625SS**Hα-helixtrans-65.2-25.3174.6-72.6177.3-1800113.5V628 T636V628-Q632 WeakPolarHBondContact O-CG 3.35Å; V628-Q632 PolarHBondContact O-N 2.93Å; Q632-T636 PolarHBondContact O-OG1 3.49Å
633K39.9Very low40.9Very low165 Ų165130.3 Ų130.372%0.71764%0.639SS**Hα-helixtrans-83.9-18.3177.1-80.3-170.7172.8-170.20114.4R630 E631R630-K633 PolarHBondContact O-N 3.22Å; E631-K633 PolarHBondContact O-N 2.98Å
634S39.1Very low39.9Very low72 Ų72127 Ų12750%0.50364%0.644SS.*Hα-helixtrans-78.7-42.8170.634.80000111.6R630 E631 T636 K637R630-S634 PolarHBondContact O-N 2.95Å; E631-S634 PolarHBondContact O-N 3.47Å; E631-S634 PolarHBondContact O-OG 3.07Å; S634-T636 VanDerWaalsContact C-N 3.33Å; S634-T636 PolarHBondContact O-N 2.99Å; S634-K637 PolarHBondContact O-N 3.46Å; S634-K637 VanDerWaalsContact O-N 3.11Å
635V43Very low39Very low83 Ų83124.3 Ų124.350%0.50365%0.651SS.*Hα-helixtrans-65.3-33.9-177.6178.20000112.4E631 K637 E638E631-V635 PolarHBondContact O-N 2.99Å; V635-K637 PolarHBondContact O-N 3.49Å; V635-E638 PolarHBondContact O-N 3.34Å
636T38.8Very low38Very low106 Ų106131.2 Ų131.265%0.6567%0.67SS**THydrogen-bonded Turntrans-68.5-12.3176.620.80000114.2Q632 S634Q632-T636 PolarHBondContact O-OG1 3.49Å; S634-T636 VanDerWaalsContact C-N 3.33Å; S634-T636 PolarHBondContact O-N 2.99Å
637K35Very low37.2Very low169 Ų169130.7 Ų130.774%0.73568%0.678SS**THydrogen-bonded Turntrans-97.9-9.7-178.8-141.2-177.1-178.3-169.30114.3S634 V635S634-K637 PolarHBondContact O-N 3.46Å; S634-K637 VanDerWaalsContact O-N 3.11Å; V635-K637 PolarHBondContact O-N 3.49Å
638E36.3Very low36.5Very low150 Ų150133.4 Ų133.470%0.70169%0.691SS**SBendtrans-95.80.2173.5-72.8-173.3141.900113.2V635V635-E638 PolarHBondContact O-N 3.34Å
639H40.7Very low35.6Very low148 Ų148137.6 Ų137.669%0.68572%0.717SS**SBendtrans-111.20.9-177.9-73.2-1.9000114.5
640S34.8Very low34.9Very low80 Ų80134.6 Ų134.656%0.55972%0.72SS**SBendtrans-81-26.8171.649.70000113.6
641D35.6Very low34.5Very low139 Ų139133.9 Ų133.974%0.74372%0.722SS**SBendtrans-103.313.8-159.1-66.615.5000113.7
642T36.4Very low33.7Very low111 Ų111136.1 Ų136.168%0.68174%0.737SS**  trans-12929-173-25.90000115
643N31.8Very low32.8Very low164 Ų164137.9 Ų137.988%0.87775%0.745SS**  trans-124.166.6170.7-84.7-44.4000112.2
644S30.1Very low32.1Very low117 Ų117140.3 Ų140.382%0.81875%0.75SS**SBendtrans-146.1146.5158.9-169.20000110.9
645A28Very low31.4Very low102 Ų102141.6 Ų141.684%0.84376%0.759SS**  trans59.699.8176.300000118
646R29.2Very low30.5Very low248 Ų248142.1 Ų142.194%0.93677%0.765SS**  trans-116.2122.3153-172.5-171.1-157.8-171.18.6107.4
647V28.1Very low29.8Very low135 Ų135144.8 Ų144.882%0.81877%0.77SS**  trans-174.2125.1151.2134.80000112.7
648S28.8Very low29.3Very low97 Ų97143.9 Ų143.968%0.67877%0.774SS**  trans70.6133.1145.7-65.30000126.2
649T27Very low28.8Very low144 Ų144145.4 Ų145.488%0.88378%0.783SS**  trans95.2150.713542.20000122.6
650T27.7Very low27.9Very low124 Ų124141.9 Ų141.976%0.76179%0.786SS**  trans-98.8151.3-156330000115.5
651K29Very low27.4Very low196 Ų196143.3 Ų143.385%0.85280%0.803SS**  trans53.5114.6150.8-70.5-177.8176.7178.90118
652L24.5Very low26.8Very low182 Ų182139.7 Ų139.795%0.95380%0.798SS**  trans-144.1172.1130.8-128.2121.9000111.7
653H25.3Very low26.4Very low163 Ų163142.2 Ų142.276%0.75581%0.806SS**  trans-125163.5-157.2-170.5-118.8000110.9
654R25.4Very low26Very low216 Ų216140.8 Ų140.882%0.81580%0.799SS**  trans85.2119.6161.3-107.4-178.3-161161.83.7121.4
655S24.3Very low25.9Very low100 Ų100141 Ų14170%0.69980%0.795SS**  100.6120.8118.7-106.20000123.2
656C23.8Very low25.7Very low93 Ų93141.2 Ų141.263%0.62879%0.791SS**  trans63.4112133.7-69.30000123
657E24.5Very low25.5Very low162 Ų162134.6 Ų134.676%0.75778%0.782SS**  58.1112.4113.9-62.6166.514600120.7
658N24.6Very low25.2Very low150 Ų150135.3 Ų135.380%0.80278%0.781SS**  -173129.8103.8-89.2-38.6000108.7
659M24.1Very low25Very low183 Ų183138.4 Ų138.490%0.90178%0.784SS**  63.4117.769.5-80.9-77.8-84.300114.2
660G23.3Very low24.9Very low73 Ų73139.8 Ų139.875%0.75378%0.781SS**  trans155.282.316100000118.4
661A23.8Very low24.7Very low111 Ų111142.3 Ų142.392%0.91778%0.783SS**  trans59151.2155.100000119.9
662G23.1Very low24.5Very low62 Ų62136.5 Ų136.564%0.63977%0.768SS**  cis143.5158.6-2.300000111.5
663I27.4Very low24.4Very low165 Ų165137.4 Ų137.485%0.84676%0.759SS**  trans74.4135.1167.4-54.5173.9000115.1
664D25.1Very low24.4Very low134 Ų134141.7 Ų141.772%0.71777%0.768SS**  cis-160.8173.4-26.6-121-47000113.4
665T26.8Very low24.4Very low120 Ų120138.7 Ų138.774%0.73676%0.761SS**  trans-34.5147.8173.957.30000122.3
666S24.3Very low24.6Very low108 Ų108141.7 Ų141.776%0.75576%0.764SS**  trans-177.8116.9130.930.60000109.5
667S24Very low24.7Very low108 Ų108144.1 Ų144.176%0.75577%0.77SS**  68.8139.285.688.30000114.1
668L22.8Very low24.7Very low151 Ų151139.7 Ų139.779%0.79177%0.768SS**  cis-169.5-179.7-11-146.2128.6000107.8
669Q24.6Very low24.7Very low161 Ų161139.2 Ų139.275%0.75277%0.77SS**  trans71.4121.6170.8-57.9178.6-13.600116.1
670Q24.1Very low24.7Very low173 Ų173136.1 Ų136.181%0.80876%0.762SS**  cis78.497.218.2-156.4-17660.800116.2
671H25.1Very low24.7Very low177 Ų177140.7 Ų140.782%0.81977%0.768SS**  trans-161.3166.5152.4-93.7-53.8000110.9
672S23.9Very low24.8Very low75 Ų75141.1 Ų141.152%0.52476%0.759SS.*  -168.8147.3-99.157.40000113
673W22.8Very low24.9Very low201 Ų201144 Ų14476%0.76177%0.767SS**  trans68.6123.9163.6-54.8100.2000120.8K675W673-K675 HydrophobicContact CZ3-CD 4.01Å; W673-K675 HydrophobicContact CZ3-CG 4.44Å
674R24.6Very low24.7Very low253 Ų253148 Ų14896%0.95577%0.772SS**  -148.9153.1103.7-98.1-176.1-167.5-131.12110.5
675K25.9Very low24.6Very low152 Ų152152.1 Ų152.166%0.66178%0.778SS**  trans-131.3178.8-173.7-107.1-166.2-172.7177.80110.3W673W673-K675 HydrophobicContact CZ3-CD 4.01Å; W673-K675 HydrophobicContact CZ3-CG 4.44Å
676H27.3Very low24.6Very low164 Ų164154.9 Ų154.976%0.75978%0.78SS**  trans98129.7163.7-63.1-75.4000115.5
677N26.4Very low24.6Very low143 Ų143156.9 Ų156.977%0.76579%0.788SS**  cis-135158-1.6-76.6-44000108.6
678G23.8Very low24.9Very low69 Ų69157.9 Ų157.971%0.71179%0.79SS**  cis97.6115.644.700000108
679V25Very low25Very low140 Ų140162.6 Ų162.685%0.84880%0.797SS**  -146.1151.570.3170.50000112.8
680T23.8Very low25.3Very low118 Ų118164.6 Ų164.672%0.72481%0.806SS**  trans-122.1151.3173.3-51.80000109.6
681L23.8Very low25.3Very low170 Ų170159.9 Ų159.989%0.8980%0.804SS**  trans-130.3148.7156.6-75.7178.9000111.9
682T25.4Very low25.3Very low119 Ų119156.4 Ų156.473%0.7381%0.806SS**  trans-118.5146.1-153.9-20.80000111.8
683P26.1Very low25.6Very low122 Ų122162.7 Ų162.779%0.79282%0.824SS**  trans-74.8141.8168.530.6-34.4000111.7
684R22.2Very low26.5Very low251 Ų251158.9 Ų158.995%0.94783%0.826SS**  trans-105.1147178.7-120.4-175.6173-160.3-2.8111.4
685Y23.2Very low26.6Very low219 Ų219151.1 Ų151.186%0.85981%0.81SS**  trans-134.7158.6-178.9-126.2-75.3000112.3
686K27Very low26.8Very low179 Ų179152 Ų15278%0.77881%0.814SS**  trans75125.1164.7-65.4-177.9176.7177.90119.1
687T25Very low26.8Very low150 Ų150154.9 Ų154.992%0.9282%0.818SS**  -146.9152.2110.6-22.60000111
688T29.4Very low27Very low128 Ų128159.4 Ų159.479%0.78582%0.824SS**  trans-109.6151.4-173.40.20000111.5
689R26.3Very low27.2Very low251 Ų251164.1 Ų164.195%0.94783%0.832SS**  trans-151.6151.2152-112.9178.1-175.2-164.50.3112.1
690Q29.3Very low27.3Very low202 Ų202160.4 Ų160.494%0.94482%0.822SS**  trans-94.8162.4-169-62.9160.6-49.600112.8
691G26.1Very low28.1Very low74 Ų74160.9 Ų160.976%0.76383%0.827SS**  trans171.596.8162.100000117.2
692A24.9Very low28.4Very low105 Ų105157.6 Ų157.687%0.86882%0.818SS**  trans60.5124.5152.600000123
693F30Very low28.6Very low206 Ų206160 Ų16090%0.90483%0.826SS**  trans-90.4175.6152-79.9-77.5000109.7
694P40.2Very low28.9Very low121 Ų121160.3 Ų160.379%0.78683%0.826SS**  cis-135.7-153.717.840-15.8000112.7
695S27.8Very low29.8Very low90 Ų90153.4 Ų153.463%0.62981%0.813SS**  cis-161.1158.8496.30000114.7
696K30.1Very low29.9Very low171 Ų171149.7 Ų149.774%0.74381%0.807SS**  trans65.4117.7144.8-70174.5-177.9170.70123.7
697R27.4Very low30Very low225 Ų225150.3 Ų150.385%0.84981%0.81SS**  82.3118.8125.5-68.6-174.6-173.7-158.43.1122.4
698R30.1Very low30.2Very low237 Ų237153.4 Ų153.489%0.89481%0.805SS**  trans1140.2141.7-58.9180178.8-179.2-1.1118.3
699I28.7Very low30.6Very low168 Ų168153.5 Ų153.586%0.86281%0.807SS**  -179.6139.6106.3-88.7154.1000108.8
700G27.2Very low31Very low62 Ų62148.9 Ų148.964%0.63980%0.797SS**  trans-110.1164.1156.600000108.7
701P40.3Very low31.8Very low129 Ų129144.6 Ų144.684%0.83879%0.786SS**  -150.3-166.369.939.8-19.1000115.6
702S30.8Very low32Very low101 Ų101150.2 Ų150.271%0.70678%0.784SS**  trans-54.8155.8175.952.50000117.4
703L27.7Very low32.3Very low170 Ų170152.1 Ų152.189%0.8978%0.775SS**  -178.5135.4125.7-96.1165.9000112.6
704T32.9Very low32.3Very low128 Ų128146.3 Ų146.379%0.78577%0.765SS**  trans-88.9-179.2159.5280000110
705P42Very low31.8Very low106 Ų106147 Ų14769%0.68876%0.763SS**  cis-135.3-1696.142.4-24.1000115
706L25.8Very low31.9Very low140 Ų140152.5 Ų152.573%0.73377%0.771SS**  176.8133.1126.8-94.2164.7000116.4
707K27.7Very low31.9Very low193 Ų193152.3 Ų152.384%0.83977%0.773SS**  trans62.2132.7147.2-76.9173.1-176.3177.80124.4
708R30.6Very low32.1Very low215 Ų215147.6 Ų147.681%0.81177%0.769SS**  trans-81.1179.6160.7-56.3177.6178.9162.7-2.8111.2
709P37.8Very low32.2Very low129 Ų129141.2 Ų141.284%0.83876%0.761SS**  -132.8168.289.931.8-17.5000115.4
710H33.8Very low32.3Very low155 Ų155140.6 Ų140.672%0.71876%0.759SS**  trans-121.2153175.7-135.122.2000107.8
711P45.8Very low32.4Very low111 Ų111142.7 Ų142.772%0.72176%0.764SS**  -149.3175.410537.8-21.2000112.6
712R30.9Very low32Very low192 Ų192143.5 Ų143.573%0.72576%0.757SS**  cis-162.5148.3-25.1-110.2-173.4149.2165.6-9.4108.3
713E31.4Very low32Very low145 Ų145146 Ų14668%0.67876%0.755SS**  trans36.3146.2132-61151.4-15300120.2
714A28.5Very low32.3Very low84 Ų84147.2 Ų147.269%0.69475%0.753SS**  cis-148.4142.129.500000111.9
715N31.2Very low32.2Very low137 Ų137150.1 Ų150.173%0.73375%0.754SS**  48.7130.595.9-58.5-17.6000114.5
716Y29.4Very low32Very low204 Ų204151.6 Ų151.680%0.876%0.761SS**  -145.9139.453.7-86.5-101.2000110.4
717Q29.8Very low32.1Very low168 Ų168148.7 Ų148.779%0.78577%0.766SS**  91.912457.6-150.317320.400113.8
718T31.4Very low32.8Very low126 Ų126147.5 Ų147.577%0.77377%0.767SS**  trans-85.3151.918047.30000112.9
719S31.7Very low33.4Very low103 Ų103145 Ų14572%0.7277%0.765SS**  158.7131.2106.762.80000115
720D30.8Very low33.5Very low155 Ų155153.8 Ų153.883%0.82978%0.782SS**  trans61.1136.3138.9-71.9-35.1000126.2
721S30.8Very low33.5Very low105 Ų105153.8 Ų153.873%0.73479%0.785SS**  trans101112.8134.971.20000122.1
722E31.8Very low32.8Very low147 Ų147156 Ų15669%0.68779%0.788SS**  trans74127.8134-70.7-151.2126.900125.3
723K31.2Very low32.9Very low153 Ų153154 Ų15467%0.66579%0.792SS**  trans83.4117.6134.3-75.9167.4-179.1146.70122.4
724K32.9Very low33Very low195 Ų195154.5 Ų154.585%0.84880%0.799SS**  trans61.9114.6137.1-68.7-175.4173.5-177.30120.3
725K31.1Very low33.3Very low190 Ų190158.9 Ų158.983%0.82681%0.805SS**  179.9116.8113.6-99.5173.7179.2179.70110.1
726T37.7Very low33.4Very low136 Ų136160.4 Ų160.483%0.83481%0.81SS**  53.9117.9102.663.30000116
727G28.4Very low33.7Very low80 Ų80157.3 Ų157.383%0.82581%0.811SS**  trans-179.190.3167.700000112.3
728L42.9Very low34Very low167 Ų167156.5 Ų156.587%0.87481%0.813SS**  trans-74.6145.7158.5-7685000108.5
729Q41.7Very low34.2Very low163 Ų163159 Ų15976%0.76282%0.816SS**  175.2146.8107.8-97.3-172.7-18.100112.3
730W39.9Very low34.5Very low314 Ų314164.1 Ų164.1100%1.18983%0.825SS**  trans73.90178.4-53.696.1000115.8

Retrieved 730 of 730 residues in 599.7 ms (Link to these results)