A0A3Q0KMG4_SCHMA Loading...

Major facilitator superfamily domain-containing protein 12

AlphaFold DB , UniProt , Accession A0A3Q0KMG4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 607 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
1M78.2Confident90.1Very high76 Ų7660.5 Ų60.537%0.37428%0.282SS..  0151.20-171.9166.566.700111.9K6 L169 E175 L179M1-K6 HydrophobicContact CB-CG 4.43Å; M1-K6 HydrophobicContact CE-CB 4.06Å; M1-K6 HydrophobicContact CE-CG 3.41Å; M1-K6 VanDerWaalsContact CE-CG 3.41Å; M1-K6 WeakPolarHBondContact O-CE 3.4Å; M1-L169 HydrophobicContact SD-CB 4.34Å; M1-L169 HydrophobicContact SD-CD1 4.43Å; M1-L169 HydrophobicContact SD-CD2 4.03Å; M1-E175 WeakPolarHBondContact CB-OE1 3.15Å; M1-E175 PolarHBondContact N-OE1 2.63Å; M1-L179 HydrophobicContact CE-CD1 3.94Å; M1-L179 HydrophobicContact CE-CD2 3.53Å; M1-L179 HydrophobicContact CE-CG 4.29Å
2K88.2Confident90.3Very high169 Ų16955.5 Ų55.574%0.73526%0.258SS*.  trans-64.1145.5173.2-70-173.8179.5-176.10110.7I4 S5 K6K2-I4 VanDerWaalsContact C-N 3.25Å; K2-I4 HydrophobicContact CB-CG2 4.42Å; K2-I4 PolarHBondContact O-N 3.45Å; K2-S5 PolarHBondContact O-N 2.85Å; K2-S5 VanDerWaalsContact O-N 3.15Å; K2-K6 PolarHBondContact O-N 3.05Å
3W88.7Confident90.5Very high159 Ų15951.5 Ų51.560%0.60224%0.239SC*.Hα-helixtrans-56.9-35.6179.9-90.9106.6000113.9S5 K6 I7 L178 L182W3-S5 VanDerWaalsContact C-N 3.3Å; W3-S5 PolarHBondContact O-N 3.5Å; W3-K6 HydrophobicContact CD2-CD 4.19Å; W3-K6 HydrophobicContact CE3-CB 4.34Å; W3-K6 HydrophobicContact CE3-CD 4.09Å; W3-K6 HydrophobicContact CZ3-CD 4.46Å; W3-K6 WeakPolarHBondContact O-CA 3.26Å; W3-K6 WeakPolarHBondContact O-CB 3.18Å; W3-K6 PolarHBondContact O-N 2.89Å; W3-I7 PolarHBondContact O-N 3.15Å; W3-L178 HydrophobicContact CH2-CD2 4.35Å; W3-L182 HydrophobicContact CZ3-CD1 4.48Å
4I91Very high90.7Very high127 Ų12747.8 Ų47.865%0.65122%0.222SC*.Hα-helixtrans-62.2-38179.5-151.8139.2000112.4K2 A8K2-I4 VanDerWaalsContact C-N 3.25Å; K2-I4 HydrophobicContact CB-CG2 4.42Å; K2-I4 PolarHBondContact O-N 3.45Å; I4-A8 VanDerWaalsContact O-CB 3.27Å; I4-A8 WeakPolarHBondContact O-CB 3.43Å; I4-A8 PolarHBondContact O-N 2.82Å
5S90.4Very high90.9Very high26 Ų2644.7 Ų44.718%0.18221%0.208CC..Hα-helixtrans-74.8-27.6175.5-59.10000112.1K2 W3 Y9 G299K2-S5 PolarHBondContact O-N 2.85Å; K2-S5 VanDerWaalsContact O-N 3.15Å; W3-S5 VanDerWaalsContact C-N 3.3Å; W3-S5 PolarHBondContact O-N 3.5Å; S5-Y9 WeakPolarHBondContact O-CB 3.37Å; S5-Y9 PolarHBondContact O-N 3.04Å; S5-G299 PolarHBondContact OG-O 3.02Å
6K91.2Very high91.1Very high26 Ų2642.5 Ų42.511%0.11320%0.197CC..Hα-helixtrans-66.2-47.1172.9-63.8-179174.1-173.30110.8M1 K2 W3 Y9 G10 E175 L178 L179 L182M1-K6 HydrophobicContact CB-CG 4.43Å; M1-K6 HydrophobicContact CE-CB 4.06Å; M1-K6 HydrophobicContact CE-CG 3.41Å; M1-K6 VanDerWaalsContact CE-CG 3.41Å; M1-K6 WeakPolarHBondContact O-CE 3.4Å; K2-K6 PolarHBondContact O-N 3.05Å; W3-K6 HydrophobicContact CD2-CD 4.19Å; W3-K6 HydrophobicContact CE3-CB 4.34Å; W3-K6 HydrophobicContact CE3-CD 4.09Å; W3-K6 HydrophobicContact CZ3-CD 4.46Å; W3-K6 WeakPolarHBondContact O-CA 3.26Å; W3-K6 WeakPolarHBondContact O-CB 3.18Å; W3-K6 PolarHBondContact O-N 2.89Å; K6-Y9 PolarHBondContact O-N 2.83Å; K6-G10 PolarHBondContact O-N 3.24Å; K6-G10 VanDerWaalsContact O-N 3.1Å; K6-E175 WeakPolarHBondContact CE-OE1 3.27Å; K6-E175 IonicContact NZ-OE1 3.2Å; K6-E175 PolarHBondContact NZ-OE1 3.43Å; K6-L178 HydrophobicContact CD-CD2 3.97Å; K6-L179 HydrophobicContact CB-CD2 3.98Å; K6-L179 HydrophobicContact CG-CD2 4.06Å; K6-L182 HydrophobicContact CB-CD1 3.87Å
7I92.4Very high91.1Very high76 Ų7640.6 Ų40.639%0.3919%0.189SC..Hα-helixtrans-63.3-49.9176.4-69.6168.9000110.2W3 Y9 G10 T11 F186W3-I7 PolarHBondContact O-N 3.15Å; I7-Y9 VanDerWaalsContact C-N 3.26Å; I7-Y9 PolarHBondContact O-N 2.64Å; I7-G10 WeakPolarHBondContact O-CA 3.49Å; I7-G10 PolarHBondContact O-N 2.95Å; I7-T11 PolarHBondContact O-N 2.93Å; I7-T11 VanDerWaalsContact O-N 3.07Å; I7-F186 HydrophobicContact CG2-CE2 4.23Å; I7-F186 HydrophobicContact CG2-CZ 3.83Å
8A93.5Very high91.3Very high3 Ų338.3 Ų38.33%0.02518%0.178CC..Hα-helixtrans-60.2-3517900000112.9I4 T11 I295 F296 V300I4-A8 VanDerWaalsContact O-CB 3.27Å; I4-A8 WeakPolarHBondContact O-CB 3.43Å; I4-A8 PolarHBondContact O-N 2.82Å; A8-T11 PolarHBondContact O-OG1 2.94Å; A8-I295 HydrophobicContact CB-CG2 4.23Å; A8-F296 WeakPolarHBondContact O-CA 3.4Å; A8-F296 WeakPolarHBondContact O-CB 3.34Å; A8-F296 WeakPolarHBondContact O-CD2 3.38Å; A8-V300 HydrophobicContact CB-CG2 4Å
9Y92.9Very high91.4Very high0 Ų036.3 Ų36.30%017%0.169CC..Hα-helixtrans-63.4-47.7171.7175.5-96.8000111.4S5 K6 I7 T11 G12 H162 I165 I166 L169 L179 F296S5-Y9 WeakPolarHBondContact O-CB 3.37Å; S5-Y9 PolarHBondContact O-N 3.04Å; K6-Y9 PolarHBondContact O-N 2.83Å; I7-Y9 VanDerWaalsContact C-N 3.26Å; I7-Y9 PolarHBondContact O-N 2.64Å; Y9-T11 VanDerWaalsContact C-N 3.28Å; Y9-T11 PolarHBondContact O-N 3.44Å; Y9-G12 PolarHBondContact O-N 3.15Å; Y9-G12 VanDerWaalsContact O-N 3.12Å; Y9-H162 AromaticContact CE1-CE1 3.92Å; Y9-H162 AromaticContact CE2-CE1 3.86Å; Y9-H162 AromaticContact CE2-NE2 3.74Å; Y9-H162 WeakPolarHBondContact CE2-O 3.42Å; Y9-H162 AromaticContact CZ-CE1 3.52Å; Y9-H162 AromaticContact CZ-NE2 3.87Å; Y9-H162 PolarHBondContact O-NE2 3.01Å; Y9-H162 PolarHBondContact OH-O 3.43Å; Y9-I165 HydrophobicContact CD2-CG2 4.14Å; Y9-I165 HydrophobicContact CE2-CB 4.27Å; Y9-I165 HydrophobicContact CE2-CG2 3.96Å; Y9-I166 HydrophobicContact CE1-CD1 4.22Å; Y9-I166 HydrophobicContact CE1-CG1 4.13Å; Y9-I166 WeakPolarHBondContact OH-CB 3.33Å; Y9-L169 HydrophobicContact CD2-CD1 3.47Å; Y9-L169 VanDerWaalsContact CD2-CD1 3.47Å; Y9-L169 HydrophobicContact CE2-CD1 4.05Å; Y9-L169 HydrophobicContact CG-CD1 3.93Å; Y9-L179 HydrophobicContact CD1-CB 3.91Å; Y9-L179 HydrophobicContact CD1-CD2 3.76Å; Y9-L179 HydrophobicContact CD1-CG 4.28Å; Y9-L179 HydrophobicContact CE1-CB 3.91Å; Y9-L179 HydrophobicContact CG-CD2 4.25Å; Y9-F296 HydrophobicContact CD2-CE2 4.22Å
10G91.4Very high91.4Very high0 Ų035.8 Ų35.80%017%0.169CC..Hα-helixtrans-56.7-38.517900000113.5K6 I7 G12K6-G10 PolarHBondContact O-N 3.24Å; K6-G10 VanDerWaalsContact O-N 3.1Å; I7-G10 WeakPolarHBondContact O-CA 3.49Å; I7-G10 PolarHBondContact O-N 2.95Å; G10-G12 VanDerWaalsContact C-N 3.3Å; G10-G12 PolarHBondContact O-N 3.15Å
11T93.3Very high91.3Very high4 Ų434.5 Ų34.53%0.02517%0.166CC..Hα-helixtrans-74-15.7179.660.80000114.2I7 A8 Y9 Q13 M14 F186 F292I7-T11 PolarHBondContact O-N 2.93Å; I7-T11 VanDerWaalsContact O-N 3.07Å; A8-T11 PolarHBondContact O-OG1 2.94Å; Y9-T11 VanDerWaalsContact C-N 3.28Å; Y9-T11 PolarHBondContact O-N 3.44Å; T11-Q13 VanDerWaalsContact C-N 3.27Å; T11-Q13 PolarHBondContact O-N 3.47Å; T11-Q13 VanDerWaalsContact O-N 3.17Å; T11-M14 HydrophobicContact CG2-SD 4.05Å; T11-M14 WeakPolarHBondContact O-CB 3.44Å; T11-M14 WeakPolarHBondContact O-CG 3.33Å; T11-M14 PolarHBondContact O-N 3.38Å; T11-F186 HydrophobicContact CG2-CD1 3.71Å; T11-F186 HydrophobicContact CG2-CD2 4.22Å; T11-F186 HydrophobicContact CG2-CE1 3.68Å; T11-F186 HydrophobicContact CG2-CE2 4.2Å; T11-F186 HydrophobicContact CG2-CG 4.01Å; T11-F186 HydrophobicContact CG2-CZ 3.95Å; T11-F292 HydrophobicContact CG2-CD1 3.79Å; T11-F292 HydrophobicContact CG2-CE1 4.22Å
12G92.5Very high91.9Very high0 Ų030.9 Ų30.90%015%0.148CC..THydrogen-bonded Turntrans-59.4-31.8-170.300000115.3Y9 G10 H111 F296Y9-G12 PolarHBondContact O-N 3.15Å; Y9-G12 VanDerWaalsContact O-N 3.12Å; G10-G12 VanDerWaalsContact C-N 3.3Å; G10-G12 PolarHBondContact O-N 3.15Å; G12-H111 PolarHBondContact O-CE1 3.43Å; G12-H111 VanDerWaalsContact O-CE1 3.32Å; G12-H111 PolarHBondContact O-NE2 3.4Å; G12-H111 VanDerWaalsContact O-NE2 3.09Å; G12-F296 VanDerWaalsContact CA-CB 3.46Å
13Q92.5Very high92.2Very high3 Ų323.4 Ų23.41%0.01412%0.116CC..THydrogen-bonded Turntrans-89.7-2.7179.265.3161.13300114.5T11 L15 K16 D17 R183T11-Q13 VanDerWaalsContact C-N 3.27Å; T11-Q13 PolarHBondContact O-N 3.47Å; T11-Q13 VanDerWaalsContact O-N 3.17Å; Q13-L15 VanDerWaalsContact C-N 3.33Å; Q13-L15 PolarHBondContact O-N 3.25Å; Q13-K16 WeakPolarHBondContact O-CA 3.17Å; Q13-K16 WeakPolarHBondContact O-CB 3.27Å; Q13-K16 PolarHBondContact O-N 3.44Å; Q13-D17 WeakPolarHBondContact CG-OD2 3.5Å; Q13-D17 PolarHBondContact NE2-OD2 2.99Å; Q13-D17 PolarHBondContact O-N 2.99Å; Q13-R183 HydrophobicContact CG-CG 3.75Å; Q13-R183 PolarHBondContact NE2-O 3.42Å; Q13-R183 VanDerWaalsContact NE2-O 3.15Å
14M93.1Very high92.3Very high0 Ų016.8 Ų16.80%09%0.094CC..Hα-helixtrans-60.6-37.9-169.4-75.5-173.873.100113.5T11 K16 D17 L18 F186 I189 F292T11-M14 HydrophobicContact CG2-SD 4.05Å; T11-M14 WeakPolarHBondContact O-CB 3.44Å; T11-M14 WeakPolarHBondContact O-CG 3.33Å; T11-M14 PolarHBondContact O-N 3.38Å; M14-K16 PolarHBondContact O-N 2.94Å; M14-D17 PolarHBondContact O-N 2.93Å; M14-D17 VanDerWaalsContact O-N 3.16Å; M14-L18 WeakPolarHBondContact O-CB 3.45Å; M14-L18 WeakPolarHBondContact O-CD1 3.3Å; M14-L18 WeakPolarHBondContact O-CG 3.44Å; M14-L18 PolarHBondContact O-N 3.45Å; M14-F186 HydrophobicContact CG-CB 3.97Å; M14-F186 HydrophobicContact SD-CB 3.89Å; M14-F186 HydrophobicContact SD-CD1 3.78Å; M14-F186 HydrophobicContact SD-CG 4.19Å; M14-I189 HydrophobicContact CE-CG2 4.24Å; M14-F292 HydrophobicContact CB-CB 3.91Å; M14-F292 HydrophobicContact CB-CD2 4.08Å; M14-F292 HydrophobicContact CB-CG 4.08Å; M14-F292 HydrophobicContact CE-CD1 4.29Å; M14-F292 HydrophobicContact CE-CD2 3.57Å; M14-F292 HydrophobicContact CE-CE1 4.06Å; M14-F292 HydrophobicContact CE-CE2 3.28Å; M14-F292 HydrophobicContact CE-CG 4.07Å; M14-F292 HydrophobicContact CE-CZ 3.55Å; M14-F292 HydrophobicContact CG-CB 4.5Å; M14-F292 HydrophobicContact CG-CG 4.37Å; M14-F292 HydrophobicContact SD-CB 4.15Å; M14-F292 HydrophobicContact SD-CD1 3.48Å; M14-F292 WeakPolarHBondContact SD-CD1 3.45Å; M14-F292 HydrophobicContact SD-CD2 3.64Å; M14-F292 HydrophobicContact SD-CE1 3.65Å; M14-F292 HydrophobicContact SD-CE2 3.81Å; M14-F292 HydrophobicContact SD-CG 3.47Å; M14-F292 WeakPolarHBondContact SD-CG 3.3Å; M14-F292 HydrophobicContact SD-CZ 3.81Å
15L94.6Very high92.2Very high1 Ų111 Ų111%0.0056%0.064CC..Hα-helixtrans-56.4-43.4175.1173.561.7000111.4Q13 V19 C115Q13-L15 VanDerWaalsContact C-N 3.33Å; Q13-L15 PolarHBondContact O-N 3.25Å; L15-V19 HydrophobicContact CD1-CG2 4.43Å; L15-V19 WeakPolarHBondContact O-CG2 3.2Å; L15-V19 PolarHBondContact O-N 3.44Å; L15-V19 VanDerWaalsContact O-N 3.15Å; L15-C115 HydrophobicContact CD2-CB 3.72Å
16K93.9Very high92.2Very high10 Ų109.8 Ų9.84%0.0436%0.056CC..Hα-helixtrans-69.7-36.7178.9179.5-133.86660.20111.6Q13 M14 S20 M118 W155 V158 Q159Q13-K16 WeakPolarHBondContact O-CA 3.17Å; Q13-K16 WeakPolarHBondContact O-CB 3.27Å; Q13-K16 PolarHBondContact O-N 3.44Å; M14-K16 PolarHBondContact O-N 2.94Å; K16-S20 WeakPolarHBondContact O-CB 3.42Å; K16-S20 PolarHBondContact O-N 3.06Å; K16-M118 HydrophobicContact CB-CE 4.32Å; K16-M118 HydrophobicContact CB-SD 4.37Å; K16-W155 HydrophobicContact CD-CD2 3.94Å; K16-W155 HydrophobicContact CD-CG 4.18Å; K16-W155 HydrophobicContact CD-CZ2 4.26Å; K16-W155 HydrophobicContact CG-CB 4.49Å; K16-W155 HydrophobicContact CG-CD2 3.39Å; K16-W155 HydrophobicContact CG-CE3 3.71Å; K16-W155 HydrophobicContact CG-CG 3.77Å; K16-W155 HydrophobicContact CG-CZ2 4.27Å; K16-W155 HydrophobicContact CG-CZ3 4.36Å; K16-W155 VanDerWaalsContact NZ-CZ2 3.34Å; K16-W155 WeakPolarHBondContact O-CZ3 3.49Å; K16-V158 HydrophobicContact CB-CB 4.23Å; K16-V158 HydrophobicContact CB-CG1 3.8Å; K16-V158 HydrophobicContact CG-CG1 4.46Å; K16-Q159 HydrophobicContact CD-CB 4.01Å
17D91.9Very high92.3Very high10 Ų108.7 Ų8.75%0.0535%0.051CC..Hα-helixtrans-70.1-44.7175.8-61.7-32.3000111.5Q13 M14 V19 S20 G21 S187Q13-D17 WeakPolarHBondContact CG-OD2 3.5Å; Q13-D17 PolarHBondContact NE2-OD2 2.99Å; Q13-D17 PolarHBondContact O-N 2.99Å; M14-D17 PolarHBondContact O-N 2.93Å; M14-D17 VanDerWaalsContact O-N 3.16Å; D17-V19 VanDerWaalsContact C-N 3.32Å; D17-V19 PolarHBondContact O-N 3.37Å; D17-S20 CarbonylContact O-C 3.49Å; D17-S20 WeakPolarHBondContact O-CA 3.42Å; D17-S20 WeakPolarHBondContact O-CB 3.45Å; D17-S20 PolarHBondContact O-N 3.38Å; D17-G21 PolarHBondContact O-N 3Å; D17-S187 WeakPolarHBondContact OD2-CA 3.36Å; D17-S187 VanDerWaalsContact OD2-CB 3.28Å; D17-S187 WeakPolarHBondContact OD2-CB 3.38Å; D17-S187 PolarHBondContact OD2-OG 3.45Å
18L93.1Very high92.3Very high0 Ų05.2 Ų5.20%03%0.033CC..Hα-helixtrans-56.8-46.1176.7-69.8160.2000111.9M14 S20 G21 V22 G190 T194 V285 I288M14-L18 WeakPolarHBondContact O-CB 3.45Å; M14-L18 WeakPolarHBondContact O-CD1 3.3Å; M14-L18 WeakPolarHBondContact O-CG 3.44Å; M14-L18 PolarHBondContact O-N 3.45Å; L18-S20 VanDerWaalsContact C-N 3.34Å; L18-G21 PolarHBondContact O-N 3.34Å; L18-V22 PolarHBondContact O-N 3.15Å; L18-G190 WeakPolarHBondContact CD2-O 3.21Å; L18-T194 VanDerWaalsContact CD2-OG1 3.23Å; L18-T194 WeakPolarHBondContact CD2-OG1 3.49Å; L18-T194 PolarHBondContact O-OG1 2.96Å; L18-V285 HydrophobicContact CB-CG1 3.65Å; L18-I288 HydrophobicContact CD1-CB 4.3Å; L18-I288 HydrophobicContact CD1-CG2 3.92Å
19V93.9Very high92.2Very high0 Ų05.1 Ų5.10%03%0.032CC..Hα-helixtrans-64.3-38.4174.5167.30000111.5L15 D17 G21 I23 M118 F122 V151 V285L15-V19 HydrophobicContact CD1-CG2 4.43Å; L15-V19 WeakPolarHBondContact O-CG2 3.2Å; L15-V19 PolarHBondContact O-N 3.44Å; L15-V19 VanDerWaalsContact O-N 3.15Å; D17-V19 VanDerWaalsContact C-N 3.32Å; D17-V19 PolarHBondContact O-N 3.37Å; V19-G21 PolarHBondContact O-N 2.93Å; V19-I23 HydrophobicContact CG1-CD1 3.75Å; V19-I23 HydrophobicContact CG1-CG1 4.46Å; V19-I23 WeakPolarHBondContact O-CG1 3.13Å; V19-I23 PolarHBondContact O-N 3.48Å; V19-I23 VanDerWaalsContact O-N 3.11Å; V19-M118 HydrophobicContact CB-CE 3.53Å; V19-M118 HydrophobicContact CG1-CE 3.52Å; V19-M118 HydrophobicContact CG2-CE 3.73Å; V19-F122 HydrophobicContact CB-CD2 4.26Å; V19-F122 HydrophobicContact CB-CE2 4.21Å; V19-F122 HydrophobicContact CB-CZ 4.44Å; V19-F122 HydrophobicContact CG1-CD2 3.44Å; V19-F122 VanDerWaalsContact CG1-CD2 3.44Å; V19-F122 HydrophobicContact CG1-CE2 3.62Å; V19-F122 HydrophobicContact CG1-CG 4.03Å; V19-F122 HydrophobicContact CG1-CZ 4.33Å; V19-F122 HydrophobicContact CG2-CB 4.38Å; V19-F122 HydrophobicContact CG2-CD1 3.89Å; V19-F122 HydrophobicContact CG2-CD2 4.06Å; V19-F122 HydrophobicContact CG2-CE1 4.01Å; V19-F122 HydrophobicContact CG2-CE2 4.22Å; V19-F122 HydrophobicContact CG2-CG 3.85Å; V19-F122 HydrophobicContact CG2-CZ 4.17Å; V19-V151 HydrophobicContact CG1-CG1 3.99Å; V19-V285 HydrophobicContact CG2-CG1 4.33Å
20S91.1Very high92.2Very high25 Ų255.1 Ų5.118%0.1753%0.032CC..Hα-helixtrans-54.3-50.8172-172.20000112K16 D17 L18 V22 I23 C24 W155K16-S20 WeakPolarHBondContact O-CB 3.42Å; K16-S20 PolarHBondContact O-N 3.06Å; D17-S20 CarbonylContact O-C 3.49Å; D17-S20 WeakPolarHBondContact O-CA 3.42Å; D17-S20 WeakPolarHBondContact O-CB 3.45Å; D17-S20 PolarHBondContact O-N 3.38Å; L18-S20 VanDerWaalsContact C-N 3.34Å; S20-V22 PolarHBondContact O-N 3.21Å; S20-I23 PolarHBondContact O-N 3.08Å; S20-C24 WeakPolarHBondContact O-CB 3.49Å; S20-C24 PolarHBondContact O-N 2.87Å; S20-C24 PolarHBondContact O-SG 3.36Å; S20-C24 VanDerWaalsContact O-SG 3.33Å; S20-W155 VanDerWaalsContact CA-CH2 3.47Å; S20-W155 VanDerWaalsContact CB-CZ3 3.49Å; S20-W155 WeakPolarHBondContact OG-CH2 3.32Å
21G89.4Confident92.3Very high9 Ų95.1 Ų5.19%0.0933%0.032CC..Hα-helixtrans-55.1-53.7-176.400000110.5D17 L18 V19 I23 C24 I25D17-G21 PolarHBondContact O-N 3Å; L18-G21 PolarHBondContact O-N 3.34Å; V19-G21 PolarHBondContact O-N 2.93Å; G21-I23 PolarHBondContact O-N 3.33Å; G21-C24 PolarHBondContact O-N 3.03Å; G21-I25 WeakPolarHBondContact O-CD1 2.89Å; G21-I25 VanDerWaalsContact O-CG1 3.23Å; G21-I25 WeakPolarHBondContact O-CG1 3.32Å; G21-I25 PolarHBondContact O-N 3.22Å
22V91.9Very high92.2Very high1 Ų16 Ų61%0.0064%0.036CC..Hα-helixtrans-57.8-46.8179.3-176.40000111.6L18 S20 I25 F26 F122 F126 T194 V281 V285L18-V22 PolarHBondContact O-N 3.15Å; S20-V22 PolarHBondContact O-N 3.21Å; V22-I25 PolarHBondContact O-N 3.42Å; V22-F26 HydrophobicContact CB-CD2 4.47Å; V22-F26 HydrophobicContact CG1-CD2 3.75Å; V22-F26 HydrophobicContact CG1-CE2 4.43Å; V22-F26 PolarHBondContact O-N 3.05Å; V22-F122 HydrophobicContact CB-CE2 4.19Å; V22-F122 HydrophobicContact CB-CZ 3.69Å; V22-F122 HydrophobicContact CG1-CE2 4.26Å; V22-F122 HydrophobicContact CG1-CZ 3.76Å; V22-F122 HydrophobicContact CG2-CZ 3.88Å; V22-F126 HydrophobicContact CB-CE2 4.49Å; V22-F126 HydrophobicContact CG1-CD2 4.05Å; V22-F126 HydrophobicContact CG1-CE1 4.48Å; V22-F126 HydrophobicContact CG1-CE2 3.54Å; V22-F126 HydrophobicContact CG1-CZ 3.8Å; V22-T194 HydrophobicContact CB-CG2 4.44Å; V22-T194 HydrophobicContact CG2-CG2 3.32Å; V22-V281 HydrophobicContact CG2-CG1 4.32Å; V22-V285 HydrophobicContact CG2-CG1 4.33Å; V22-V285 HydrophobicContact CG2-CG2 3.97Å
23I93.3Very high92Very high11 Ų118.6 Ų8.66%0.0565%0.05CC..Hα-helixtrans-62-49.3179.3-68.2172.1000110.2V19 S20 G21 I25 Y27 F122 M125 F126 M148 V151V19-I23 HydrophobicContact CG1-CD1 3.75Å; V19-I23 HydrophobicContact CG1-CG1 4.46Å; V19-I23 WeakPolarHBondContact O-CG1 3.13Å; V19-I23 PolarHBondContact O-N 3.48Å; V19-I23 VanDerWaalsContact O-N 3.11Å; S20-I23 PolarHBondContact O-N 3.08Å; G21-I23 PolarHBondContact O-N 3.33Å; I23-I25 VanDerWaalsContact C-N 3.27Å; I23-I25 PolarHBondContact O-N 2.98Å; I23-Y27 HydrophobicContact CG2-CD2 4.27Å; I23-Y27 HydrophobicContact CG2-CG 4.42Å; I23-Y27 WeakPolarHBondContact O-CB 3.2Å; I23-Y27 PolarHBondContact O-N 3.3Å; I23-F122 HydrophobicContact CD1-CE2 4.45Å; I23-F122 HydrophobicContact CG1-CE2 4.13Å; I23-M125 HydrophobicContact CD1-CE 4.12Å; I23-M125 HydrophobicContact CG1-CE 3.87Å; I23-F126 HydrophobicContact CG1-CE2 4.36Å; I23-M148 HydrophobicContact CD1-CE 4.28Å; I23-V151 HydrophobicContact CD1-CG1 3.92Å
24C90.2Very high91.9Very high20 Ų208.5 Ų8.514%0.1355%0.049CC..Hα-helixtrans-59.7-39.4-179-70.30000112S20 G21 V389 M390S20-C24 WeakPolarHBondContact O-CB 3.49Å; S20-C24 PolarHBondContact O-N 2.87Å; S20-C24 PolarHBondContact O-SG 3.36Å; S20-C24 VanDerWaalsContact O-SG 3.33Å; G21-C24 PolarHBondContact O-N 3.03Å; C24-V389 HydrophobicContact CB-CG1 3.78Å; C24-M390 VanDerWaalsContact O-CA 3.31Å; C24-M390 WeakPolarHBondContact O-CA 3.48Å
25I88.9Confident91.7Very high6 Ų68.5 Ų8.53%0.0315%0.049CC..Hα-helixtrans-81.3-44-174.1-60.5154.4000112G21 V22 I23 L195 S393 M407G21-I25 WeakPolarHBondContact O-CD1 2.89Å; G21-I25 VanDerWaalsContact O-CG1 3.23Å; G21-I25 WeakPolarHBondContact O-CG1 3.32Å; G21-I25 PolarHBondContact O-N 3.22Å; V22-I25 PolarHBondContact O-N 3.42Å; I23-I25 VanDerWaalsContact C-N 3.27Å; I23-I25 PolarHBondContact O-N 2.98Å; I25-L195 HydrophobicContact CD1-CD1 4.31Å; I25-L195 HydrophobicContact CD1-CD2 3.23Å; I25-L195 HydrophobicContact CD1-CG 3.76Å; I25-L195 HydrophobicContact CG1-CD2 4.28Å; I25-S393 WeakPolarHBondContact CG2-OG 3.05Å; I25-S393 WeakPolarHBondContact O-CB 3.22Å; I25-S393 PolarHBondContact O-OG 3.26Å; I25-M407 HydrophobicContact CG2-CG 4.35Å
26F91Very high91.5Very high1 Ų111.9 Ų11.90%0.0047%0.073CC..Hα-helixtrans-107.9-15.5-166.9-58.3-56.6000114.5V22 I28 I29 F30 F126 T198 F202 F278 M407 V408V22-F26 HydrophobicContact CB-CD2 4.47Å; V22-F26 HydrophobicContact CG1-CD2 3.75Å; V22-F26 HydrophobicContact CG1-CE2 4.43Å; V22-F26 PolarHBondContact O-N 3.05Å; F26-I28 PolarHBondContact O-N 3.5Å; F26-I29 PolarHBondContact O-N 2.9Å; F26-F30 WeakPolarHBondContact O-CB 3.34Å; F26-F30 PolarHBondContact O-N 3.37Å; F26-F126 HydrophobicContact CB-CE1 4.16Å; F26-F126 HydrophobicContact CB-CZ 4.35Å; F26-T198 HydrophobicContact CE1-CG2 4.24Å; F26-T198 HydrophobicContact CE2-CG2 3.69Å; F26-T198 HydrophobicContact CZ-CG2 3.27Å; F26-F202 HydrophobicContact CE1-CE2 4.18Å; F26-F202 HydrophobicContact CZ-CE2 4.37Å; F26-F278 HydrophobicContact CB-CD1 4.31Å; F26-F278 HydrophobicContact CB-CE1 3.82Å; F26-F278 AromaticContact CD1-CE1 3.73Å; F26-F278 HydrophobicContact CD1-CE1 3.73Å; F26-F278 HydrophobicContact CD2-CD1 4.47Å; F26-F278 HydrophobicContact CD2-CE1 4.26Å; F26-F278 HydrophobicContact CE1-CE1 4.41Å; F26-F278 HydrophobicContact CG-CD1 4.24Å; F26-F278 AromaticContact CG-CE1 3.66Å; F26-F278 HydrophobicContact CG-CE1 3.66Å; F26-M407 HydrophobicContact CD1-CE 3.78Å; F26-M407 HydrophobicContact CD1-SD 3.79Å; F26-M407 HydrophobicContact CE1-CE 3.38Å; F26-M407 HydrophobicContact CE1-CG 4.4Å; F26-M407 HydrophobicContact CE1-SD 3.81Å; F26-V408 HydrophobicContact CE1-CG2 4.02Å; F26-V408 HydrophobicContact CZ-CG2 3.9Å
27Y93.8Very high91.5Very high2 Ų211.8 Ų11.81%0.0087%0.073CC..Hα-helixtrans-52.4-53.3-171.8175.8-90.7000113.1I23 Y31 V42 L45 L46 M148I23-Y27 HydrophobicContact CG2-CD2 4.27Å; I23-Y27 HydrophobicContact CG2-CG 4.42Å; I23-Y27 WeakPolarHBondContact O-CB 3.2Å; I23-Y27 PolarHBondContact O-N 3.3Å; Y27-Y31 HydrophobicContact CD1-CD2 4.47Å; Y27-Y31 AromaticContact CD2-CD2 3.71Å; Y27-Y31 HydrophobicContact CD2-CD2 3.71Å; Y27-Y31 AromaticContact CD2-CE2 3.53Å; Y27-Y31 HydrophobicContact CD2-CE2 3.53Å; Y27-Y31 HydrophobicContact CE1-CD2 4.32Å; Y27-Y31 AromaticContact CE2-CD2 3.54Å; Y27-Y31 HydrophobicContact CE2-CD2 3.54Å; Y27-Y31 AromaticContact CE2-CE2 3.29Å; Y27-Y31 HydrophobicContact CE2-CE2 3.29Å; Y27-Y31 HydrophobicContact CG-CD2 4.16Å; Y27-Y31 HydrophobicContact CG-CE2 4.4Å; Y27-Y31 AromaticContact CZ-CD2 3.83Å; Y27-Y31 VanDerWaalsContact O-CD2 3.23Å; Y27-Y31 WeakPolarHBondContact O-CD2 3.4Å; Y27-Y31 PolarHBondContact O-N 3.12Å; Y27-V42 HydrophobicContact CD1-CG1 4.14Å; Y27-V42 HydrophobicContact CE1-CG1 3.57Å; Y27-V42 PolarHBondContact OH-O 3.33Å; Y27-L45 HydrophobicContact CE2-CD2 4.47Å; Y27-L45 WeakPolarHBondContact OH-CB 3.46Å; Y27-L45 WeakPolarHBondContact OH-CD2 3.49Å; Y27-L45 VanDerWaalsContact OH-CG 3.28Å; Y27-L45 WeakPolarHBondContact OH-CG 3.31Å; Y27-L46 HydrophobicContact CD1-CD1 4.32Å; Y27-L46 HydrophobicContact CE1-CB 3.74Å; Y27-L46 HydrophobicContact CE1-CD1 3.96Å; Y27-L46 HydrophobicContact CE1-CD2 4.43Å; Y27-L46 HydrophobicContact CE1-CG 4.24Å; Y27-L46 HydrophobicContact CE2-CD1 4.16Å; Y27-L46 WeakPolarHBondContact OH-CA 3.33Å; Y27-L46 WeakPolarHBondContact OH-CB 3.22Å; Y27-L46 PolarHBondContact OH-N 2.96Å; Y27-M148 HydrophobicContact CD2-SD 4.36Å; Y27-M148 HydrophobicContact CE2-SD 3.8Å
28I93.2Very high91.6Very high3 Ų313.5 Ų13.52%0.0159%0.086CC..Hα-helixtrans-61.4-52.1-177.7-65.4176.2000109.7F26 F30 Y31 E32 M390 Y391 P394F26-I28 PolarHBondContact O-N 3.5Å; I28-F30 PolarHBondContact O-N 3.15Å; I28-Y31 PolarHBondContact O-N 2.98Å; I28-E32 HydrophobicContact CG2-CG 4.21Å; I28-E32 VanDerWaalsContact CG2-OE2 3.22Å; I28-E32 WeakPolarHBondContact CG2-OE2 3.31Å; I28-E32 WeakPolarHBondContact O-CB 3.24Å; I28-E32 WeakPolarHBondContact O-CG 3.41Å; I28-E32 PolarHBondContact O-N 3.41Å; I28-M390 HydrophobicContact CD1-CG 3.73Å; I28-M390 HydrophobicContact CD1-SD 4.24Å; I28-M390 HydrophobicContact CG1-CG 4.21Å; I28-Y391 HydrophobicContact CD1-CD1 3.72Å; I28-Y391 HydrophobicContact CD1-CE1 3.56Å; I28-Y391 HydrophobicContact CD1-CE2 4.49Å; I28-Y391 HydrophobicContact CD1-CG 4.29Å; I28-P394 HydrophobicContact CB-CG 4.08Å; I28-P394 HydrophobicContact CD1-CG 4.2Å; I28-P394 HydrophobicContact CG2-CG 3.8Å
29I91Very high91.6Very high2 Ų214.8 Ų14.81%0.0110%0.095CC..Hα-helixtrans-66.9-40.1-174-65.1170000111.9F26 N33 I270 S393 P394 L397 M407F26-I29 PolarHBondContact O-N 2.9Å; I29-N33 HydrophobicContact CG2-CB 4.43Å; I29-N33 WeakPolarHBondContact O-CA 3.27Å; I29-N33 VanDerWaalsContact O-CB 3.22Å; I29-N33 WeakPolarHBondContact O-CB 3.02Å; I29-N33 PolarHBondContact O-N 3.41Å; I29-I270 HydrophobicContact CG2-CB 3.98Å; I29-I270 HydrophobicContact CG2-CD1 3.5Å; I29-I270 VanDerWaalsContact CG2-CD1 3.5Å; I29-I270 HydrophobicContact CG2-CG1 3.99Å; I29-I270 HydrophobicContact CG2-CG2 4.4Å; I29-S393 VanDerWaalsContact CD1-CB 3.43Å; I29-P394 HydrophobicContact CG1-CG 4.23Å; I29-L397 HydrophobicContact CD1-CD2 4.39Å; I29-M407 HydrophobicContact CD1-CG 4.2Å; I29-M407 HydrophobicContact CD1-SD 3.32Å; I29-M407 WeakPolarHBondContact CD1-SD 3.41Å
30F92.1Very high91.6Very high0 Ų017 Ų170%011%0.111CC..Iπ-helixtrans-61-47.7177.7178.6-97.6000111.4F26 I28 C34 I35 F126 L275 F278F26-F30 WeakPolarHBondContact O-CB 3.34Å; F26-F30 PolarHBondContact O-N 3.37Å; I28-F30 PolarHBondContact O-N 3.15Å; F30-C34 HydrophobicContact CD2-CB 4.24Å; F30-C34 HydrophobicContact CE2-CB 4.44Å; F30-C34 WeakPolarHBondContact O-CA 3.29Å; F30-C34 WeakPolarHBondContact O-CB 3.18Å; F30-C34 PolarHBondContact O-N 3.19Å; F30-I35 HydrophobicContact CD1-CG1 4.13Å; F30-I35 HydrophobicContact CE1-CD1 4.03Å; F30-I35 HydrophobicContact CE1-CG1 3.7Å; F30-I35 HydrophobicContact CZ-CD1 4.04Å; F30-I35 HydrophobicContact CZ-CG1 4.18Å; F30-I35 PolarHBondContact O-N 3.39Å; F30-I35 VanDerWaalsContact O-N 3.08Å; F30-F126 HydrophobicContact CB-CE1 3.92Å; F30-F126 HydrophobicContact CD1-CD1 4.08Å; F30-F126 HydrophobicContact CD1-CE1 4.02Å; F30-F126 AromaticContact CD2-CD1 3.76Å; F30-F126 HydrophobicContact CD2-CD1 3.76Å; F30-F126 HydrophobicContact CD2-CE1 4.02Å; F30-F126 HydrophobicContact CE1-CD1 4.2Å; F30-F126 AromaticContact CE2-CD1 3.88Å; F30-F126 HydrophobicContact CE2-CD1 3.88Å; F30-F126 AromaticContact CG-CD1 3.86Å; F30-F126 HydrophobicContact CG-CD1 3.86Å; F30-F126 AromaticContact CG-CE1 3.71Å; F30-F126 HydrophobicContact CG-CE1 3.71Å; F30-F126 HydrophobicContact CZ-CD1 4.11Å; F30-L275 HydrophobicContact CE2-CD1 3.51Å; F30-L275 HydrophobicContact CZ-CD1 3.8Å; F30-F278 HydrophobicContact CD2-CB 4.28Å; F30-F278 HydrophobicContact CD2-CD1 4.2Å; F30-F278 AromaticContact CD2-CD2 3.75Å; F30-F278 HydrophobicContact CD2-CD2 3.75Å; F30-F278 HydrophobicContact CD2-CE2 4.1Å; F30-F278 AromaticContact CD2-CG 3.81Å; F30-F278 HydrophobicContact CD2-CG 3.81Å; F30-F278 HydrophobicContact CD2-CZ 4.47Å; F30-F278 HydrophobicContact CE2-CB 4.1Å; F30-F278 HydrophobicContact CE2-CD2 4.03Å; F30-F278 HydrophobicContact CE2-CG 4.08Å
31Y93.6Very high91.8Very high0 Ų018.2 Ų18.20%011%0.113CC..Iπ-helixtrans-76.4-36.5-177.8-76.7-64.4000113.4Y27 I28 I35 S36 L37 L45 M125 N144Y27-Y31 HydrophobicContact CD1-CD2 4.47Å; Y27-Y31 AromaticContact CD2-CD2 3.71Å; Y27-Y31 HydrophobicContact CD2-CD2 3.71Å; Y27-Y31 AromaticContact CD2-CE2 3.53Å; Y27-Y31 HydrophobicContact CD2-CE2 3.53Å; Y27-Y31 HydrophobicContact CE1-CD2 4.32Å; Y27-Y31 AromaticContact CE2-CD2 3.54Å; Y27-Y31 HydrophobicContact CE2-CD2 3.54Å; Y27-Y31 AromaticContact CE2-CE2 3.29Å; Y27-Y31 HydrophobicContact CE2-CE2 3.29Å; Y27-Y31 HydrophobicContact CG-CD2 4.16Å; Y27-Y31 HydrophobicContact CG-CE2 4.4Å; Y27-Y31 AromaticContact CZ-CD2 3.83Å; Y27-Y31 VanDerWaalsContact O-CD2 3.23Å; Y27-Y31 WeakPolarHBondContact O-CD2 3.4Å; Y27-Y31 PolarHBondContact O-N 3.12Å; I28-Y31 PolarHBondContact O-N 2.98Å; Y31-I35 HydrophobicContact CD1-CB 4.17Å; Y31-I35 HydrophobicContact CD1-CG1 3.92Å; Y31-I35 HydrophobicContact CD1-CG2 4.48Å; Y31-I35 HydrophobicContact CE1-CG1 4.28Å; Y31-S36 PolarHBondContact O-N 3.23Å; Y31-L37 HydrophobicContact CD1-CD1 3.84Å; Y31-L37 HydrophobicContact CG-CD1 4.42Å; Y31-L37 WeakPolarHBondContact O-CB 3.36Å; Y31-L37 PolarHBondContact O-N 3.36Å; Y31-L45 HydrophobicContact CD1-CD2 3.94Å; Y31-L45 HydrophobicContact CD2-CD2 4.07Å; Y31-L45 HydrophobicContact CE1-CD2 3.68Å; Y31-L45 HydrophobicContact CE2-CD2 3.83Å; Y31-L45 HydrophobicContact CG-CD2 4.13Å; Y31-M125 WeakPolarHBondContact OH-CG 3.4Å; Y31-N144 HydrophobicContact CE1-CB 3.84Å; Y31-N144 VanDerWaalsContact CE1-CG 3.46Å; Y31-N144 WeakPolarHBondContact CE1-OD1 3.42Å; Y31-N144 PolarHBondContact OH-OD1 2.83Å
32E91.9Very high92.1Very high23 Ų2317.8 Ų17.811%0.10711%0.109CC..Iπ-helixtrans-72.3-46.9176.8-68.9-175.6156.300111.7I28 S36 S39 V42 Y530I28-E32 HydrophobicContact CG2-CG 4.21Å; I28-E32 VanDerWaalsContact CG2-OE2 3.22Å; I28-E32 WeakPolarHBondContact CG2-OE2 3.31Å; I28-E32 WeakPolarHBondContact O-CB 3.24Å; I28-E32 WeakPolarHBondContact O-CG 3.41Å; I28-E32 PolarHBondContact O-N 3.41Å; E32-S36 WeakPolarHBondContact O-CA 3.48Å; E32-S39 WeakPolarHBondContact OE1-CA 3.28Å; E32-S39 VanDerWaalsContact OE1-CB 3.25Å; E32-S39 WeakPolarHBondContact OE1-CB 3.5Å; E32-S39 PolarHBondContact OE1-OG 3.44Å; E32-V42 HydrophobicContact CG-CB 4.38Å; E32-V42 HydrophobicContact CG-CG2 3.71Å; E32-Y530 PolarHBondContact OE2-OH 3.29Å
33N88.6Confident92.3Very high53 Ų5317.8 Ų17.828%0.28311%0.109SC..Iπ-helixtrans-97-38.2-169.7-61.3-9.6000113.9I29 I270I29-N33 HydrophobicContact CG2-CB 4.43Å; I29-N33 WeakPolarHBondContact O-CA 3.27Å; I29-N33 VanDerWaalsContact O-CB 3.22Å; I29-N33 WeakPolarHBondContact O-CB 3.02Å; I29-N33 PolarHBondContact O-N 3.41Å; N33-I270 WeakPolarHBondContact CB-O 3.04Å
34C88.6Confident92.5Very high1 Ų119.3 Ų19.31%0.00712%0.123CC..Iπ-helixtrans-88.3-48.4-178.9-54.20000112.3F30 S36 T271 I272F30-C34 HydrophobicContact CD2-CB 4.24Å; F30-C34 HydrophobicContact CE2-CB 4.44Å; F30-C34 WeakPolarHBondContact O-CA 3.29Å; F30-C34 WeakPolarHBondContact O-CB 3.18Å; F30-C34 PolarHBondContact O-N 3.19Å; C34-S36 VanDerWaalsContact C-N 3.33Å; C34-T271 PolarHBondContact SG-O 3.25Å; C34-T271 VanDerWaalsContact SG-O 3.36Å; C34-I272 WeakPolarHBondContact O-CG1 3.44Å
35I90.2Very high92.8Very high1 Ų118.6 Ų18.61%0.00512%0.118CC..SBendtrans-83.5-15.4-179.2-53.7-58.5000112F30 Y31 L37 V133 K140F30-I35 HydrophobicContact CD1-CG1 4.13Å; F30-I35 HydrophobicContact CE1-CD1 4.03Å; F30-I35 HydrophobicContact CE1-CG1 3.7Å; F30-I35 HydrophobicContact CZ-CD1 4.04Å; F30-I35 HydrophobicContact CZ-CG1 4.18Å; F30-I35 PolarHBondContact O-N 3.39Å; F30-I35 VanDerWaalsContact O-N 3.08Å; Y31-I35 HydrophobicContact CD1-CB 4.17Å; Y31-I35 HydrophobicContact CD1-CG1 3.92Å; Y31-I35 HydrophobicContact CD1-CG2 4.48Å; Y31-I35 HydrophobicContact CE1-CG1 4.28Å; I35-L37 HydrophobicContact CB-CG 4.41Å; I35-L37 HydrophobicContact CG2-CD1 4.24Å; I35-L37 HydrophobicContact CG2-CD2 4.31Å; I35-L37 HydrophobicContact CG2-CG 3.93Å; I35-V133 HydrophobicContact CD1-CG2 4.24Å; I35-K140 HydrophobicContact CG2-CD 4.02Å; I35-K140 PolarHBondContact O-NZ 2.96Å
36S90Very high93.1Very high71 Ų7118.3 Ų18.350%0.49712%0.117SC..  trans60.649-179.7-47.20000113Y31 E32 C34Y31-S36 PolarHBondContact O-N 3.23Å; E32-S36 WeakPolarHBondContact O-CA 3.48Å; C34-S36 VanDerWaalsContact C-N 3.33Å
37L92.9Very high93.4Very high8 Ų820.1 Ų20.14%0.04213%0.126CC..  trans-92149.5170.6-61.6-178.9000110.5Y31 I35 Q41 V42 K140 L141Y31-L37 HydrophobicContact CD1-CD1 3.84Å; Y31-L37 HydrophobicContact CG-CD1 4.42Å; Y31-L37 WeakPolarHBondContact O-CB 3.36Å; Y31-L37 PolarHBondContact O-N 3.36Å; I35-L37 HydrophobicContact CB-CG 4.41Å; I35-L37 HydrophobicContact CG2-CD1 4.24Å; I35-L37 HydrophobicContact CG2-CD2 4.31Å; I35-L37 HydrophobicContact CG2-CG 3.93Å; L37-Q41 HydrophobicContact CB-CB 4.22Å; L37-V42 HydrophobicContact CB-CG2 3.76Å; L37-K140 HydrophobicContact CD2-CB 4.15Å; L37-K140 HydrophobicContact CD2-CD 4.05Å; L37-L141 HydrophobicContact CD1-CD2 4.16Å
38S93.9Very high93.5Very high47 Ų4722.7 Ų22.733%0.32914%0.143SC..  trans-70.1151.317366.60000111.1S40 Q41 V42S38-S40 PolarHBondContact O-N 3.23Å; S38-S40 VanDerWaalsContact O-N 3.11Å; S38-S40 PolarHBondContact OG-OG 3.14Å; S38-Q41 VanDerWaalsContact N-OE1 3.13Å; S38-Q41 WeakPolarHBondContact O-CA 3.28Å; S38-Q41 VanDerWaalsContact O-CB 3.29Å; S38-Q41 WeakPolarHBondContact O-CB 3.33Å; S38-Q41 PolarHBondContact O-N 3.02Å; S38-Q41 WeakPolarHBondContact OG-CG 3.31Å; S38-Q41 PolarHBondContact OG-N 2.98Å; S38-Q41 PolarHBondContact OG-NE2 3.23Å; S38-V42 WeakPolarHBondContact O-CG2 3.19Å; S38-V42 PolarHBondContact O-N 2.77Å
39S93.3Very high93.6Very high26 Ų2622.5 Ų22.518%0.18214%0.143CC..Hα-helixtrans-50-41.4177.3-57.80000112.9E32 Q41 V42 G43 Q522E32-S39 WeakPolarHBondContact OE1-CA 3.28Å; E32-S39 VanDerWaalsContact OE1-CB 3.25Å; E32-S39 WeakPolarHBondContact OE1-CB 3.5Å; E32-S39 PolarHBondContact OE1-OG 3.44Å; S39-Q41 VanDerWaalsContact C-N 3.32Å; S39-Q41 PolarHBondContact O-N 3.09Å; S39-V42 PolarHBondContact O-N 3.05Å; S39-G43 PolarHBondContact O-N 3.47Å; S39-Q522 WeakPolarHBondContact O-CB 3.46Å
40S94.1Very high93.9Very high48 Ų4823 Ų2334%0.33615%0.145SC..Hα-helixtrans-60.4-36.4175.158.50000114.2S38 A44 Q519S38-S40 PolarHBondContact O-N 3.23Å; S38-S40 VanDerWaalsContact O-N 3.11Å; S38-S40 PolarHBondContact OG-OG 3.14Å; S40-A44 WeakPolarHBondContact O-CB 3.08Å; S40-A44 PolarHBondContact O-N 2.99Å; S40-Q519 PolarHBondContact O-NE2 3.43Å; S40-Q519 PolarHBondContact O-OE1 3.3Å
41Q96.1Very high94.1Very high50 Ų5026.4 Ų26.423%0.23416%0.162CC..Hα-helixtrans-75-40.3177.1-74.2165.97.300111.1L37 S38 S39 A44 L45 L141L37-Q41 HydrophobicContact CB-CB 4.22Å; S38-Q41 VanDerWaalsContact N-OE1 3.13Å; S38-Q41 WeakPolarHBondContact O-CA 3.28Å; S38-Q41 VanDerWaalsContact O-CB 3.29Å; S38-Q41 WeakPolarHBondContact O-CB 3.33Å; S38-Q41 PolarHBondContact O-N 3.02Å; S38-Q41 WeakPolarHBondContact OG-CG 3.31Å; S38-Q41 PolarHBondContact OG-N 2.98Å; S38-Q41 PolarHBondContact OG-NE2 3.23Å; S39-Q41 VanDerWaalsContact C-N 3.32Å; S39-Q41 PolarHBondContact O-N 3.09Å; Q41-A44 PolarHBondContact O-N 3.47Å; Q41-L45 WeakPolarHBondContact O-CB 3.33Å; Q41-L45 PolarHBondContact O-N 3.37Å; Q41-L141 HydrophobicContact CB-CD2 4.12Å; Q41-L141 HydrophobicContact CG-CD1 4.32Å
42V96.1Very high94.3Very high0 Ų027.2 Ų27.20%017%0.169CC..Hα-helixtrans-61.5-46.3175.6176.50000110.9Y27 E32 L37 S38 S39 A44 L45 L46Y27-V42 HydrophobicContact CD1-CG1 4.14Å; Y27-V42 HydrophobicContact CE1-CG1 3.57Å; Y27-V42 PolarHBondContact OH-O 3.33Å; E32-V42 HydrophobicContact CG-CB 4.38Å; E32-V42 HydrophobicContact CG-CG2 3.71Å; L37-V42 HydrophobicContact CB-CG2 3.76Å; S38-V42 WeakPolarHBondContact O-CG2 3.19Å; S38-V42 PolarHBondContact O-N 2.77Å; S39-V42 PolarHBondContact O-N 3.05Å; V42-A44 VanDerWaalsContact C-N 3.32Å; V42-A44 PolarHBondContact O-N 3.2Å; V42-L45 PolarHBondContact O-N 3.2Å; V42-L46 PolarHBondContact O-N 3.49Å; V42-L46 VanDerWaalsContact O-N 3.13Å
43G96Very high94.5Very high1 Ų126.1 Ų26.11%0.0116%0.164CC..Hα-helixtrans-62.1-39.2173.700000112.8S39 L45 L46 L47 Q519S39-G43 PolarHBondContact O-N 3.47Å; G43-L45 PolarHBondContact O-N 2.97Å; G43-L46 WeakPolarHBondContact O-CB 3.14Å; G43-L46 PolarHBondContact O-N 2.85Å; G43-L47 WeakPolarHBondContact O-CB 3.48Å; G43-L47 PolarHBondContact O-N 3.22Å; G43-Q519 PolarHBondContact O-OE1 3.39Å
44A96.1Very high94.8Very high42 Ų4223.6 Ų23.635%0.34715%0.151SC..Hα-helixtrans-68.5-38.6-17700000111.3S40 Q41 V42 L46 L47 C48S40-A44 WeakPolarHBondContact O-CB 3.08Å; S40-A44 PolarHBondContact O-N 2.99Å; Q41-A44 PolarHBondContact O-N 3.47Å; V42-A44 VanDerWaalsContact C-N 3.32Å; V42-A44 PolarHBondContact O-N 3.2Å; A44-L46 VanDerWaalsContact C-N 3.32Å; A44-L47 PolarHBondContact O-N 3.47Å; A44-C48 WeakPolarHBondContact O-CB 3.31Å; A44-C48 PolarHBondContact O-N 3.29Å
45L96.5Very high95.2Very high6 Ų628.6 Ų28.63%0.03118%0.177CC..Hα-helixtrans-59.6-43.8172.2178.666.2000110.9Y27 Y31 Q41 V42 G43 C48 G49 N144 G145 M148Y27-L45 HydrophobicContact CE2-CD2 4.47Å; Y27-L45 WeakPolarHBondContact OH-CB 3.46Å; Y27-L45 WeakPolarHBondContact OH-CD2 3.49Å; Y27-L45 VanDerWaalsContact OH-CG 3.28Å; Y27-L45 WeakPolarHBondContact OH-CG 3.31Å; Y31-L45 HydrophobicContact CD1-CD2 3.94Å; Y31-L45 HydrophobicContact CD2-CD2 4.07Å; Y31-L45 HydrophobicContact CE1-CD2 3.68Å; Y31-L45 HydrophobicContact CE2-CD2 3.83Å; Y31-L45 HydrophobicContact CG-CD2 4.13Å; Q41-L45 WeakPolarHBondContact O-CB 3.33Å; Q41-L45 PolarHBondContact O-N 3.37Å; V42-L45 PolarHBondContact O-N 3.2Å; G43-L45 PolarHBondContact O-N 2.97Å; L45-C48 PolarHBondContact O-N 3.08Å; L45-G49 PolarHBondContact O-N 3.43Å; L45-N144 HydrophobicContact CD1-CB 4.09Å; L45-N144 HydrophobicContact CD2-CB 3.92Å; L45-G145 VanDerWaalsContact CD1-N 3.29Å; L45-M148 HydrophobicContact CD1-CB 4.42Å
46L95.4Very high95.4Very high0 Ų029 Ų290%018%0.18CC..Hα-helixtrans-66-46177.9-171.869.9000110.8Y27 V42 G43 A44 C48 G49 Q50 M390 I518Y27-L46 HydrophobicContact CD1-CD1 4.32Å; Y27-L46 HydrophobicContact CE1-CB 3.74Å; Y27-L46 HydrophobicContact CE1-CD1 3.96Å; Y27-L46 HydrophobicContact CE1-CD2 4.43Å; Y27-L46 HydrophobicContact CE1-CG 4.24Å; Y27-L46 HydrophobicContact CE2-CD1 4.16Å; Y27-L46 WeakPolarHBondContact OH-CA 3.33Å; Y27-L46 WeakPolarHBondContact OH-CB 3.22Å; Y27-L46 PolarHBondContact OH-N 2.96Å; V42-L46 PolarHBondContact O-N 3.49Å; V42-L46 VanDerWaalsContact O-N 3.13Å; G43-L46 WeakPolarHBondContact O-CB 3.14Å; G43-L46 PolarHBondContact O-N 2.85Å; A44-L46 VanDerWaalsContact C-N 3.32Å; L46-C48 VanDerWaalsContact C-N 3.29Å; L46-C48 PolarHBondContact O-N 3.41Å; L46-G49 CarbonylContact O-C 3.58Å; L46-G49 WeakPolarHBondContact O-CA 3.38Å; L46-G49 PolarHBondContact O-N 2.97Å; L46-G49 VanDerWaalsContact O-N 3.1Å; L46-Q50 HydrophobicContact CG-CG 4.23Å; L46-Q50 VanDerWaalsContact O-CG 3.3Å; L46-Q50 WeakPolarHBondContact O-CG 3.32Å; L46-Q50 PolarHBondContact O-N 3.4Å; L46-M390 HydrophobicContact CD1-CE 4.46Å; L46-M390 HydrophobicContact CD2-CE 3.88Å; L46-M390 HydrophobicContact CD2-SD 3.76Å; L46-I518 HydrophobicContact CD2-CB 3.97Å; L46-I518 HydrophobicContact CD2-CD1 3.64Å; L46-I518 HydrophobicContact CD2-CG1 4.4Å; L46-I518 HydrophobicContact CD2-CG2 3.44Å; L46-I518 VanDerWaalsContact CD2-CG2 3.44Å
47L97.2Very high95.6Very high39 Ų3925.6 Ų25.620%0.20416%0.156CC..Hα-helixtrans-55.1-45.7177172.963.1000111.1G43 A44 G49 Q50 I51 G515 V516 Q519G43-L47 WeakPolarHBondContact O-CB 3.48Å; G43-L47 PolarHBondContact O-N 3.22Å; A44-L47 PolarHBondContact O-N 3.47Å; L47-G49 VanDerWaalsContact C-N 3.32Å; L47-G49 PolarHBondContact O-N 3.14Å; L47-Q50 PolarHBondContact O-N 3.29Å; L47-Q50 VanDerWaalsContact O-N 3.15Å; L47-I51 HydrophobicContact CD1-CD1 3.87Å; L47-I51 HydrophobicContact CD1-CG1 4.03Å; L47-I51 HydrophobicContact CG-CD1 3.84Å; L47-I51 HydrophobicContact CG-CG1 4.43Å; L47-I51 VanDerWaalsContact O-CG1 3.29Å; L47-I51 WeakPolarHBondContact O-CG1 3.36Å; L47-I51 PolarHBondContact O-N 3.31Å; L47-G515 VanDerWaalsContact CD1-C 3.46Å; L47-V516 HydrophobicContact CD1-CG2 4.02Å; L47-Q519 HydrophobicContact CB-CB 4.3Å; L47-Q519 HydrophobicContact CD2-CB 4.21Å; L47-Q519 HydrophobicContact CD2-CG 4.12Å
48C96.6Very high95.6Very high55 Ų5526.5 Ų26.537%0.37216%0.162SC..Hα-helixtrans-56.9-46.7176.2-171.70000111.7A44 L45 L46 Q50 I51 A52A44-C48 WeakPolarHBondContact O-CB 3.31Å; A44-C48 PolarHBondContact O-N 3.29Å; L45-C48 PolarHBondContact O-N 3.08Å; L46-C48 VanDerWaalsContact C-N 3.29Å; L46-C48 PolarHBondContact O-N 3.41Å; C48-Q50 PolarHBondContact O-N 2.94Å; C48-I51 PolarHBondContact O-N 2.92Å; C48-A52 PolarHBondContact O-N 3.47Å
49G96.3Very high95.5Very high0 Ų029 Ų290%017%0.172CC..Hα-helixtrans-62.2-40.9174.500000113.6L45 L46 L47 A52 N53 Q152L45-G49 PolarHBondContact O-N 3.43Å; L46-G49 CarbonylContact O-C 3.58Å; L46-G49 WeakPolarHBondContact O-CA 3.38Å; L46-G49 PolarHBondContact O-N 2.97Å; L46-G49 VanDerWaalsContact O-N 3.1Å; L47-G49 VanDerWaalsContact C-N 3.32Å; L47-G49 PolarHBondContact O-N 3.14Å; G49-A52 PolarHBondContact O-N 3.33Å; G49-N53 WeakPolarHBondContact O-CB 3.41Å; G49-N53 PolarHBondContact O-N 3.15Å; G49-Q152 VanDerWaalsContact O-CB 3.27Å; G49-Q152 WeakPolarHBondContact O-CB 3.08Å; G49-Q152 VanDerWaalsContact O-CG 3.3Å; G49-Q152 WeakPolarHBondContact O-CG 3.45Å
50Q96.2Very high95.4Very high11 Ų1128.1 Ų28.15%0.05117%0.165CC..Hα-helixtrans-69.4-35.8178.9-65.8-66.3-12.900112.3L46 L47 C48 N53 G54 K511L46-Q50 HydrophobicContact CG-CG 4.23Å; L46-Q50 VanDerWaalsContact O-CG 3.3Å; L46-Q50 WeakPolarHBondContact O-CG 3.32Å; L46-Q50 PolarHBondContact O-N 3.4Å; L47-Q50 PolarHBondContact O-N 3.29Å; L47-Q50 VanDerWaalsContact O-N 3.15Å; C48-Q50 PolarHBondContact O-N 2.94Å; Q50-N53 PolarHBondContact O-N 3.2Å; Q50-G54 PolarHBondContact O-N 3.47Å; Q50-K511 WeakPolarHBondContact CB-O 3.36Å
51I97Very high95.2Very high72 Ų7225.9 Ų25.937%0.36915%0.149SC..Hα-helixtrans-62.4-48.5172.3-68.7166000109.9L47 C48 N53 G54 L55 I512L47-I51 HydrophobicContact CD1-CD1 3.87Å; L47-I51 HydrophobicContact CD1-CG1 4.03Å; L47-I51 HydrophobicContact CG-CD1 3.84Å; L47-I51 HydrophobicContact CG-CG1 4.43Å; L47-I51 VanDerWaalsContact O-CG1 3.29Å; L47-I51 WeakPolarHBondContact O-CG1 3.36Å; L47-I51 PolarHBondContact O-N 3.31Å; C48-I51 PolarHBondContact O-N 2.92Å; I51-N53 VanDerWaalsContact C-N 3.33Å; I51-N53 PolarHBondContact O-N 3.35Å; I51-G54 PolarHBondContact O-N 3.48Å; I51-L55 HydrophobicContact CG2-CD1 4.04Å; I51-L55 HydrophobicContact CG2-CG 4.46Å; I51-L55 WeakPolarHBondContact O-CG 3.11Å; I51-L55 PolarHBondContact O-N 3.44Å; I51-I512 HydrophobicContact CB-CD1 4.37Å; I51-I512 HydrophobicContact CG1-CD1 4.05Å
52A96.5Very high94.7Very high18 Ų1827.6 Ų27.615%0.14915%0.154CC..Hα-helixtrans-60.4-42.5176.500000112.2C48 G49 A56 I149 V153C48-A52 PolarHBondContact O-N 3.47Å; G49-A52 PolarHBondContact O-N 3.33Å; A52-A56 VanDerWaalsContact O-CB 3.29Å; A52-A56 WeakPolarHBondContact O-CB 3.47Å; A52-A56 PolarHBondContact O-N 3.41Å; A52-I149 HydrophobicContact CB-CB 4.29Å; A52-I149 HydrophobicContact CB-CG1 3.97Å; A52-I149 HydrophobicContact CB-CG2 3.89Å; A52-V153 HydrophobicContact CB-CG2 4.45Å
53N96.3Very high94.2Very high0 Ų030.4 Ų30.40%017%0.169CC..Hα-helixtrans-57.9-54.9173.6-163.5-39.2000110.5G49 Q50 I51 L55 A56 T57 Q152 K511G49-N53 WeakPolarHBondContact O-CB 3.41Å; G49-N53 PolarHBondContact O-N 3.15Å; Q50-N53 PolarHBondContact O-N 3.2Å; I51-N53 VanDerWaalsContact C-N 3.33Å; I51-N53 PolarHBondContact O-N 3.35Å; N53-L55 VanDerWaalsContact C-N 3.32Å; N53-L55 PolarHBondContact O-N 2.89Å; N53-A56 WeakPolarHBondContact O-CB 3.33Å; N53-A56 PolarHBondContact O-N 2.88Å; N53-T57 WeakPolarHBondContact O-CG2 3.17Å; N53-T57 PolarHBondContact O-N 3.23Å; N53-T57 WeakPolarHBondContact OD1-CG2 3.45Å; N53-Q152 HydrophobicContact CB-CB 3.99Å; N53-Q152 PolarHBondContact ND2-OE1 3.39Å; N53-K511 HydrophobicContact CB-CB 4.47Å; N53-K511 HydrophobicContact CB-CD 4.22Å; N53-K511 HydrophobicContact CB-CG 4.22Å
54G95.6Very high93.7Very high0 Ų030.6 Ų30.60%017%0.17CC..Hα-helixtrans-56.4-44.5-177.700000112.1Q50 I51 T57 P58 F508Q50-G54 PolarHBondContact O-N 3.47Å; I51-G54 PolarHBondContact O-N 3.48Å; G54-T57 PolarHBondContact O-N 2.88Å; G54-T57 PolarHBondContact O-OG1 3.4Å; G54-P58 WeakPolarHBondContact O-CD 3.47Å; G54-F508 VanDerWaalsContact O-CD2 3.3Å; G54-F508 WeakPolarHBondContact O-CD2 3.1Å
55L96.1Very high92.9Very high106 Ų10630.5 Ų30.556%0.55516%0.164SC*.Hα-helixtrans-67.5-35.7177.3-68.4175.7000112.6I51 N53 P58 F508I51-L55 HydrophobicContact CG2-CD1 4.04Å; I51-L55 HydrophobicContact CG2-CG 4.46Å; I51-L55 WeakPolarHBondContact O-CG 3.11Å; I51-L55 PolarHBondContact O-N 3.44Å; N53-L55 VanDerWaalsContact C-N 3.32Å; N53-L55 PolarHBondContact O-N 2.89Å; L55-P58 WeakPolarHBondContact O-CD 3.44Å; L55-F508 HydrophobicContact CD2-CE2 4.37Å
56A95.4Very high91.8Very high9 Ų937.2 Ų37.27%0.07419%0.188CC..Hα-helixtrans-68.1-33.6178.200000112.3A52 N53 L59 I60 V153 A156A52-A56 VanDerWaalsContact O-CB 3.29Å; A52-A56 WeakPolarHBondContact O-CB 3.47Å; A52-A56 PolarHBondContact O-N 3.41Å; N53-A56 WeakPolarHBondContact O-CB 3.33Å; N53-A56 PolarHBondContact O-N 2.88Å; A56-L59 PolarHBondContact O-N 2.94Å; A56-I60 HydrophobicContact CB-CD1 3.92Å; A56-I60 VanDerWaalsContact O-CB 3.28Å; A56-I60 WeakPolarHBondContact O-CB 3.22Å; A56-I60 WeakPolarHBondContact O-CD1 3.27Å; A56-I60 WeakPolarHBondContact O-CG1 3.43Å; A56-I60 PolarHBondContact O-N 3.27Å; A56-V153 HydrophobicContact CB-CG1 4.48Å; A56-V153 HydrophobicContact CB-CG2 4.34Å; A56-A156 HydrophobicContact CB-CB 3.74Å
57T94.6Very high90.1Very high0 Ų041.9 Ų41.90%022%0.219CC..Hα-helixtrans-62.1-51.1-174.5590000115.4N53 G54 G61 A156 I160 G504 F508N53-T57 WeakPolarHBondContact O-CG2 3.17Å; N53-T57 PolarHBondContact O-N 3.23Å; N53-T57 WeakPolarHBondContact OD1-CG2 3.45Å; G54-T57 PolarHBondContact O-N 2.88Å; G54-T57 PolarHBondContact O-OG1 3.4Å; T57-G61 PolarHBondContact O-N 3.2Å; T57-A156 HydrophobicContact CG2-CB 3.8Å; T57-I160 HydrophobicContact CG2-CD1 4.16Å; T57-I160 HydrophobicContact CG2-CG1 4.13Å; T57-G504 WeakPolarHBondContact CB-O 3.07Å; T57-G504 PolarHBondContact OG1-O 3.4Å; T57-F508 PolarHBondContact OG1-N 3.47Å
58P91.8Very high88.1Confident26 Ų2645 Ų4517%0.16924%0.236CC..Hα-helixtrans-70.9-33.9177.430.1-35.1000111.7G54 L55 G61 Y62 I505G54-P58 WeakPolarHBondContact O-CD 3.47Å; L55-P58 WeakPolarHBondContact O-CD 3.44Å; P58-G61 PolarHBondContact O-N 3.04Å; P58-Y62 VanDerWaalsContact O-CB 3.27Å; P58-Y62 WeakPolarHBondContact O-CB 3.49Å; P58-Y62 PolarHBondContact O-N 3.5Å; P58-I505 HydrophobicContact CB-CD1 3.76Å; P58-I505 HydrophobicContact CB-CG1 4.41Å
59L92.2Very high85.4Confident101 Ų10147.2 Ų47.253%0.52925%0.251SS..Hα-helixtrans-61.9-50.1177.1179.361.9000110.7A56 Y62 L63A56-L59 PolarHBondContact O-N 2.94Å; L59-Y62 PolarHBondContact O-N 3.4Å; L59-L63 HydrophobicContact CD1-CD1 3.88Å; L59-L63 HydrophobicContact CD1-CG 4.2Å; L59-L63 HydrophobicContact CG-CD1 3.92Å; L59-L63 WeakPolarHBondContact O-CB 3.37Å; L59-L63 WeakPolarHBondContact O-CG 3.32Å; L59-L63 PolarHBondContact O-N 2.83Å
60I92.3Very high82.8Confident7 Ų752.8 Ų52.84%0.03629%0.287CS..Hα-helixtrans-66.7-40.1177.8-67.8163.3000110.6A56 Y62 L63 S64 W110 A156 A157 I160 P161A56-I60 HydrophobicContact CB-CD1 3.92Å; A56-I60 VanDerWaalsContact O-CB 3.28Å; A56-I60 WeakPolarHBondContact O-CB 3.22Å; A56-I60 WeakPolarHBondContact O-CD1 3.27Å; A56-I60 WeakPolarHBondContact O-CG1 3.43Å; A56-I60 PolarHBondContact O-N 3.27Å; I60-Y62 PolarHBondContact O-N 3.29Å; I60-L63 PolarHBondContact O-N 3.27Å; I60-S64 WeakPolarHBondContact O-CB 3.32Å; I60-S64 PolarHBondContact O-N 2.85Å; I60-S64 PolarHBondContact O-OG 3.31Å; I60-W110 HydrophobicContact CG1-CE3 4.44Å; I60-W110 HydrophobicContact CG1-CZ3 4.39Å; I60-A156 HydrophobicContact CD1-CB 3.89Å; I60-A157 HydrophobicContact CD1-CB 3.83Å; I60-I160 HydrophobicContact CG2-CB 4.37Å; I60-P161 HydrophobicContact CG2-CG 4.01Å
61G88.1Confident80Confident0 Ų058 Ų580%032%0.32CS..Hα-helixtrans-56.7-49.7174.400000111.7T57 P58 S64 D65T57-G61 PolarHBondContact O-N 3.2Å; P58-G61 PolarHBondContact O-N 3.04Å; G61-S64 PolarHBondContact O-N 3.4Å; G61-D65 PolarHBondContact O-N 3.17Å
62Y86.1Confident77Confident86 Ų8663.9 Ų63.934%0.33734%0.343SS..Hα-helixtrans-63.7-44.3177.1178.1-104.3000113.4P58 L59 I60 S64 D65 R66P58-Y62 VanDerWaalsContact O-CB 3.27Å; P58-Y62 WeakPolarHBondContact O-CB 3.49Å; P58-Y62 PolarHBondContact O-N 3.5Å; L59-Y62 PolarHBondContact O-N 3.4Å; I60-Y62 PolarHBondContact O-N 3.29Å; Y62-S64 VanDerWaalsContact C-N 3.27Å; Y62-S64 PolarHBondContact O-N 3Å; Y62-D65 PolarHBondContact O-N 2.91Å; Y62-R66 VanDerWaalsContact CZ-NE 3.28Å; Y62-R66 PolarHBondContact OH-NE 3.28Å; Y62-R66 PolarHBondContact OH-NH2 2.89Å
63L87Confident73.9Confident60 Ų6072.2 Ų72.231%0.31438%0.376SS..Hα-helixtrans-71.1-21.7178.1-68.8175.6000112.9L59 I60 Q106 W110L59-L63 HydrophobicContact CD1-CD1 3.88Å; L59-L63 HydrophobicContact CD1-CG 4.2Å; L59-L63 HydrophobicContact CG-CD1 3.92Å; L59-L63 WeakPolarHBondContact O-CB 3.37Å; L59-L63 WeakPolarHBondContact O-CG 3.32Å; L59-L63 PolarHBondContact O-N 2.83Å; I60-L63 PolarHBondContact O-N 3.27Å; L63-Q106 PolarHBondContact O-NE2 3Å; L63-W110 HydrophobicContact CB-CZ2 3.73Å; L63-W110 HydrophobicContact CD1-CH2 3.77Å; L63-W110 HydrophobicContact CD1-CZ2 3.62Å; L63-W110 HydrophobicContact CG-CZ2 4.28Å
64S83.6Confident70.7Confident4 Ų477.8 Ų77.83%0.02842%0.415CS..Hα-helixtrans-81.5-27.6177.3-640000112.7I60 G61 Y62I60-S64 WeakPolarHBondContact O-CB 3.32Å; I60-S64 PolarHBondContact O-N 2.85Å; I60-S64 PolarHBondContact O-OG 3.31Å; G61-S64 PolarHBondContact O-N 3.4Å; Y62-S64 VanDerWaalsContact C-N 3.27Å; Y62-S64 PolarHBondContact O-N 3Å
65D80Confident67.7Low41 Ų4183.2 Ų83.222%0.21945%0.448CS..Hα-helixtrans-83.9-17.8-177.5-76.5-20.6000114.1G61 Y62 R107 A500 F501G61-D65 PolarHBondContact O-N 3.17Å; Y62-D65 PolarHBondContact O-N 2.91Å; D65-R107 IonicContact OD1-CZ 3.73Å; D65-R107 IonicContact OD1-NE 2.64Å; D65-R107 IonicContact OD1-NH2 3.4Å; D65-R107 PolarHBondContact OD1-NH2 3.38Å; D65-A500 WeakPolarHBondContact OD1-CB 3.27Å; D65-A500 WeakPolarHBondContact OD2-CB 3.46Å; D65-F501 PolarHBondContact OD2-N 3.11Å
66R72.9Confident64.8Low146 Ų14683.6 Ų83.655%0.55146%0.455SS*.SBendtrans-88.2113.9-177.7-76.8-174.8167.4-134.9-7.7112.6Y62 L68 Q106Y62-R66 VanDerWaalsContact CZ-NE 3.28Å; Y62-R66 PolarHBondContact OH-NE 3.28Å; Y62-R66 PolarHBondContact OH-NH2 2.89Å; R66-L68 PolarHBondContact O-N 2.97Å; R66-Q106 PolarHBondContact O-NE2 3.2Å; R66-Q106 PolarHBondContact O-OE1 3.15Å
67P61Low61.5Low99 Ų9988.1 Ų88.164%0.64349%0.485SS*.  trans-55.3127.117724.6-33.4000110.7S69P67-S69 PolarHBondContact O-N 3.16Å
68L54.1Low58.7Low105 Ų10596.4 Ų96.455%0.5552%0.523SS..  trans-55.7110.1168.1-11781.4000107.2R66 P70R66-L68 PolarHBondContact O-N 2.97Å; L68-P70 VanDerWaalsContact O-N 3.15Å
69S40Very low55.8Low101 Ų101103.6 Ų103.671%0.70656%0.555SS**  trans-54.1124.8176.436.20000107.7P67 T71P67-S69 PolarHBondContact O-N 3.16Å; S69-T71 PolarHBondContact O-N 3.23Å
70P42.7Very low53.1Low116 Ų116106.9 Ų106.975%0.75357%0.572SS**  trans-58.4122.4166.824.2-28.8000104.7L68 K72L68-P70 VanDerWaalsContact O-N 3.15Å; P70-K72 PolarHBondContact O-N 3.24Å
71T37.3Very low50.3Low120 Ų120114.3 Ų114.374%0.73661%0.61SS**  trans-49.696.5168.945.30000107S69 K73S69-T71 PolarHBondContact O-N 3.23Å; T71-K73 PolarHBondContact O-N 3.04Å; T71-K73 VanDerWaalsContact O-N 3.13Å
72K33.3Very low48Very low197 Ų197118.2 Ų118.286%0.85764%0.642SS**  trans-54.4122.3160.4-95.1-175.8173.4-177.90103.3P70 S74P70-K72 PolarHBondContact O-N 3.24Å; K72-S74 VanDerWaalsContact C-N 3.33Å; K72-S74 PolarHBondContact O-N 3.27Å
73K31.1Very low45.7Very low193 Ų193120.7 Ų120.784%0.83967%0.671SS**  trans-49.3109.3164.5-76177.7174.5-179.60105.1T71 T75T71-K73 PolarHBondContact O-N 3.04Å; T71-K73 VanDerWaalsContact O-N 3.13Å; K73-T75 PolarHBondContact O-N 3.08Å
74S30.1Very low43.7Very low116 Ų116122.9 Ų122.981%0.81168%0.679SS**  trans-72.282.6167.7-165.20000105.2K72K72-S74 VanDerWaalsContact C-N 3.33Å; K72-S74 PolarHBondContact O-N 3.27Å
75T32Very low41.9Very low115 Ų115128.7 Ų128.771%0.70671%0.71SS**  trans-83.3128.5153.9-38.50000104K73K73-T75 PolarHBondContact O-N 3.08Å
76T34.4Very low40.3Very low114 Ų114129.6 Ų129.670%0.69973%0.729SS**SBendtrans99.2101170.6-36.20000116.6
77C27Very low38.9Very low104 Ų104126.5 Ų126.570%0.70373%0.73SS**  trans53.1104.6143.9-67.40000120.7
78H34.8Very low38.7Very low173 Ų173124.7 Ų124.780%0.80172%0.717SS**  174.3140.491.7-108.6-79.9000110L80H78-L80 PolarHBondContact O-N 3.25Å
79Q31.6Very low38.6Very low177 Ų177125 Ų12583%0.82771%0.714SS**  trans-54.5123.2176.3-67.1147.9-51.500111.4
80L35.5Very low39.4Very low170 Ų170127.5 Ų127.589%0.8971%0.712SS**  trans-143.7114.8149.5-101.4164.3000107.7H78 A82H78-L80 PolarHBondContact O-N 3.25Å; L80-A82 PolarHBondContact O-N 3.33Å
81I33Very low40.3Very low163 Ų163126.9 Ų126.984%0.83670%0.702SS**  trans-67.5109.2-179.1-65162.6000107.4
82A40.9Very low41.6Very low83 Ų83126.3 Ų126.369%0.68669%0.689SS**  trans-126.5106.2161.500000107.3L80 E84L80-A82 PolarHBondContact O-N 3.33Å; A82-E84 VanDerWaalsContact C-N 3.25Å; A82-E84 PolarHBondContact O-N 3.35Å
83C36.5Very low43.1Very low138 Ų138125.3 Ų125.393%0.93268%0.68SS**  trans-64.388.9166.3-83.70000108.3
84E46.7Very low44.8Very low106 Ų106120.8 Ų120.850%0.49567%0.665SS.*  trans-100.6122.7169.9-155.4-172.6152.600108.1A82 G86 K92A82-E84 VanDerWaalsContact C-N 3.25Å; A82-E84 PolarHBondContact O-N 3.35Å; E84-G86 PolarHBondContact O-N 3.12Å; E84-K92 IonicContact OE1-NZ 3.84Å; E84-K92 PolarHBondContact OE1-NZ 3.42Å; E84-K92 VanDerWaalsContact OE1-NZ 3.13Å
85D44.4Very low46.4Very low126 Ų126119.6 Ų119.667%0.67465%0.649SS**  trans-43.9129.1-172.4-94.5-39.3000114.4S87 V88D85-S87 PolarHBondContact O-N 3.09Å; D85-S87 VanDerWaalsContact O-N 3.13Å; D85-V88 HydrophobicContact CB-CG2 4.25Å; D85-V88 PolarHBondContact O-N 2.94Å; D85-V88 VanDerWaalsContact O-N 3.14Å
86G47.2Very low47.9Very low60 Ų60117.7 Ų117.762%0.61964%0.635SS**Hα-helixtrans-59.8-24.8179.600000114.3E84 K90E84-G86 PolarHBondContact O-N 3.12Å; G86-K90 PolarHBondContact O-N 3.13Å
87S43.9Very low49.3Very low81 Ų81121.5 Ų121.557%0.56664%0.636SS**Hα-helixtrans-62.4-48.5175-175.40000111.5D85 K89 K90 D91D85-S87 PolarHBondContact O-N 3.09Å; D85-S87 VanDerWaalsContact O-N 3.13Å; S87-K89 VanDerWaalsContact C-N 3.31Å; S87-K89 PolarHBondContact O-N 3.42Å; S87-K90 PolarHBondContact O-N 3.28Å; S87-K90 VanDerWaalsContact O-N 3.08Å; S87-D91 PolarHBondContact O-N 3.36Å
88V55.3Low50.9Low61 Ų61121.2 Ų121.237%0.3763%0.625SS.*Hα-helixtrans-65.8-34.3-176.9-178.50000111.7D85 K92D85-V88 HydrophobicContact CB-CG2 4.25Å; D85-V88 PolarHBondContact O-N 2.94Å; D85-V88 VanDerWaalsContact O-N 3.14Å; V88-K92 HydrophobicContact CG1-CD 4.11Å; V88-K92 WeakPolarHBondContact O-CB 3.47Å; V88-K92 VanDerWaalsContact O-CG 3.31Å; V88-K92 WeakPolarHBondContact O-CG 3.2Å; V88-K92 PolarHBondContact O-N 3.44Å; V88-K92 VanDerWaalsContact O-N 3.09Å
89K53.3Low52.1Low111 Ų111115.6 Ų115.648%0.48360%0.599SS.*Hα-helixtrans-67.8-35.1174.9-93.7176.5-178.8163.20112.7S87 R93S87-K89 VanDerWaalsContact C-N 3.31Å; S87-K89 PolarHBondContact O-N 3.42Å; K89-R93 WeakPolarHBondContact O-CB 3.5Å; K89-R93 VanDerWaalsContact O-CG 3.27Å; K89-R93 WeakPolarHBondContact O-CG 3.27Å; K89-R93 PolarHBondContact O-N 3.15Å; K89-R93 VanDerWaalsContact O-N 3.09Å
90K55.6Low53.3Low153 Ų153116.8 Ų116.867%0.66560%0.596SS**Hα-helixtrans-68.9-43.6179.6-162.2176.4179.9-177.30110.6G86 S87 R93 L94G86-K90 PolarHBondContact O-N 3.13Å; S87-K90 PolarHBondContact O-N 3.28Å; S87-K90 VanDerWaalsContact O-N 3.08Å; K90-R93 PolarHBondContact O-N 3.14Å; K90-L94 WeakPolarHBondContact O-CB 3.5Å; K90-L94 PolarHBondContact O-N 2.97Å
91D61.7Low54.3Low103 Ų103116.9 Ų116.955%0.55159%0.591SS**Hα-helixtrans-66.1-45.1177.9-70.7-16.2000112.5S87 R93 L94 L95S87-D91 PolarHBondContact O-N 3.36Å; D91-R93 VanDerWaalsContact C-N 3.27Å; D91-R93 PolarHBondContact O-N 2.98Å; D91-L94 PolarHBondContact O-N 3.47Å; D91-L95 WeakPolarHBondContact O-CB 3.22Å; D91-L95 PolarHBondContact O-N 3.26Å
92K66Low55.6Low108 Ų108113.6 Ų113.647%0.4758%0.575SS.*Hα-helixtrans-58.1-39.7173.8-74.7174.2-178.3169.80111.4E84 V88 N96E84-K92 IonicContact OE1-NZ 3.84Å; E84-K92 PolarHBondContact OE1-NZ 3.42Å; E84-K92 VanDerWaalsContact OE1-NZ 3.13Å; V88-K92 HydrophobicContact CG1-CD 4.11Å; V88-K92 WeakPolarHBondContact O-CB 3.47Å; V88-K92 VanDerWaalsContact O-CG 3.31Å; V88-K92 WeakPolarHBondContact O-CG 3.2Å; V88-K92 PolarHBondContact O-N 3.44Å; V88-K92 VanDerWaalsContact O-N 3.09Å; K92-N96 VanDerWaalsContact O-CB 3.25Å; K92-N96 WeakPolarHBondContact O-CB 3.45Å; K92-N96 PolarHBondContact O-N 3.33Å; K92-N96 PolarHBondContact O-ND2 3.05Å
93R64.9Low56.2Low177 Ų177120.1 Ų120.167%0.66858%0.582SS**Hα-helixtrans-68.9-40.9177.1-78.4177.5-176.7-171.32.6112.4K89 K90 D91 N96 R97K89-R93 WeakPolarHBondContact O-CB 3.5Å; K89-R93 VanDerWaalsContact O-CG 3.27Å; K89-R93 WeakPolarHBondContact O-CG 3.27Å; K89-R93 PolarHBondContact O-N 3.15Å; K89-R93 VanDerWaalsContact O-N 3.09Å; K90-R93 PolarHBondContact O-N 3.14Å; D91-R93 VanDerWaalsContact C-N 3.27Å; D91-R93 PolarHBondContact O-N 2.98Å; R93-N96 PolarHBondContact O-N 3.5Å; R93-R97 WeakPolarHBondContact O-CB 3.31Å; R93-R97 WeakPolarHBondContact O-CG 3.35Å; R93-R97 PolarHBondContact O-N 3.07Å
94L66.4Low57.7Low97 Ų97114.9 Ų114.951%0.50855%0.545SS..Hα-helixtrans-68.6-45-179-153.3148.3000110.6K90 D91 N96 R97 M98K90-L94 WeakPolarHBondContact O-CB 3.5Å; K90-L94 PolarHBondContact O-N 2.97Å; D91-L94 PolarHBondContact O-N 3.47Å; L94-N96 VanDerWaalsContact C-N 3.33Å; L94-N96 PolarHBondContact O-N 3.03Å; L94-R97 WeakPolarHBondContact O-CB 3.18Å; L94-R97 PolarHBondContact O-N 3.3Å; L94-M98 HydrophobicContact CD2-CG 4.25Å; L94-M98 HydrophobicContact CD2-SD 3.79Å; L94-M98 WeakPolarHBondContact O-CG 3.46Å; L94-M98 PolarHBondContact O-N 3.17Å
95L62.8Low58.9Low92 Ų92111 Ų11148%0.48253%0.534SS..Hα-helixtrans-59-43.5172.3-174.367000111.8D91 M98 K99D91-L95 WeakPolarHBondContact O-CB 3.22Å; D91-L95 PolarHBondContact O-N 3.26Å; L95-M98 PolarHBondContact O-N 3Å; L95-K99 HydrophobicContact CG-CD 4.42Å; L95-K99 WeakPolarHBondContact O-CB 3.2Å; L95-K99 VanDerWaalsContact O-CG 3.3Å; L95-K99 WeakPolarHBondContact O-CG 3.47Å; L95-K99 PolarHBondContact O-N 3.01Å
96N64.3Low60.5Low75 Ų75106.9 Ų106.940%0.40151%0.51SS..Hα-helixtrans-68.8-33.3177.5-75-13.7000112.9K92 R93 L94 R100K92-N96 VanDerWaalsContact O-CB 3.25Å; K92-N96 WeakPolarHBondContact O-CB 3.45Å; K92-N96 PolarHBondContact O-N 3.33Å; K92-N96 PolarHBondContact O-ND2 3.05Å; R93-N96 PolarHBondContact O-N 3.5Å; L94-N96 VanDerWaalsContact C-N 3.33Å; L94-N96 PolarHBondContact O-N 3.03Å; N96-R100 WeakPolarHBondContact O-CB 3.48Å; N96-R100 PolarHBondContact O-N 3.28Å
97R63.5Low62.3Low193 Ų193104.9 Ų104.973%0.72848%0.484SS*.Hα-helixtrans-65.1-48.2172-82.8-175.5178.8-167.60110.9R93 L94 K99 R100 Q101R93-R97 WeakPolarHBondContact O-CB 3.31Å; R93-R97 WeakPolarHBondContact O-CG 3.35Å; R93-R97 PolarHBondContact O-N 3.07Å; L94-R97 WeakPolarHBondContact O-CB 3.18Å; L94-R97 PolarHBondContact O-N 3.3Å; R97-K99 PolarHBondContact O-N 3.03Å; R97-R100 PolarHBondContact O-N 3.43Å; R97-Q101 WeakPolarHBondContact O-CG 3.31Å; R97-Q101 PolarHBondContact O-N 2.96Å
98M60.9Low64.5Low98 Ų98101.4 Ų101.448%0.48346%0.459SS..Hα-helixtrans-58.6-47.8175.6-69.5178.873.800111.1L94 L95 R100 Q101 L102L94-M98 HydrophobicContact CD2-CG 4.25Å; L94-M98 HydrophobicContact CD2-SD 3.79Å; L94-M98 WeakPolarHBondContact O-CG 3.46Å; L94-M98 PolarHBondContact O-N 3.17Å; L95-M98 PolarHBondContact O-N 3Å; M98-R100 VanDerWaalsContact C-N 3.34Å; M98-R100 PolarHBondContact O-N 2.88Å; M98-Q101 PolarHBondContact O-N 3.3Å; M98-L102 WeakPolarHBondContact O-CD1 3.44Å; M98-L102 PolarHBondContact O-N 2.71Å
99K59.6Low66Low55 Ų5599.2 Ų99.224%0.23945%0.446CS..Hα-helixtrans-57.9-42.6176.6-76.6179.2179.6-175.50113L95 R97 R103 L104L95-K99 HydrophobicContact CG-CD 4.42Å; L95-K99 WeakPolarHBondContact O-CB 3.2Å; L95-K99 VanDerWaalsContact O-CG 3.3Å; L95-K99 WeakPolarHBondContact O-CG 3.47Å; L95-K99 PolarHBondContact O-N 3.01Å; R97-K99 PolarHBondContact O-N 3.03Å; K99-R103 PolarHBondContact O-N 2.8Å; K99-R103 VanDerWaalsContact O-N 3.11Å; K99-L104 PolarHBondContact O-N 2.91Å
100R57.8Low67.8Low203 Ų20398 Ų9877%0.76644%0.439SS*.Hα-helixtrans-66-41.8176.3-84.8-172.4-179-166.51.6112.1N96 R97 M98 R103N96-R100 WeakPolarHBondContact O-CB 3.48Å; N96-R100 PolarHBondContact O-N 3.28Å; R97-R100 PolarHBondContact O-N 3.43Å; M98-R100 VanDerWaalsContact C-N 3.34Å; M98-R100 PolarHBondContact O-N 2.88Å; R100-R103 PolarHBondContact O-N 3.08Å
101Q56.6Low69.6Low171 Ų17190.7 Ų90.780%0.79941%0.407SS*.Hα-helixtrans-65.8-41.6178.6-76.2-161.7-19.300112R97 M98 R103R97-Q101 WeakPolarHBondContact O-CG 3.31Å; R97-Q101 PolarHBondContact O-N 2.96Å; M98-Q101 PolarHBondContact O-N 3.3Å; Q101-R103 VanDerWaalsContact C-N 3.29Å; Q101-R103 PolarHBondContact O-N 3.23Å
102L58.9Low71.1Confident95 Ų9587.7 Ų87.750%0.49739%0.391SS..THydrogen-bonded Turntrans-81.9-1.2178.2-75100000114.2M98 L104 L112M98-L102 WeakPolarHBondContact O-CD1 3.44Å; M98-L102 PolarHBondContact O-N 2.71Å; L102-L104 HydrophobicContact CB-CD1 3.45Å; L102-L104 VanDerWaalsContact CB-CD1 3.45Å; L102-L104 HydrophobicContact CB-CG 3.59Å; L102-L104 HydrophobicContact CD2-CD1 3.94Å; L102-L104 HydrophobicContact CG-CD1 4.21Å; L102-L104 PolarHBondContact O-N 3.28Å; L102-L112 HydrophobicContact CD2-CD2 4.33Å
103R54.8Low72.4Confident219 Ų21984.3 Ų84.383%0.82639%0.387SS*.THydrogen-bonded Turntrans4535.3-175-64-176.1175-174-0.9112.9K99 R100 Q101 G105K99-R103 PolarHBondContact O-N 2.8Å; K99-R103 VanDerWaalsContact O-N 3.11Å; R100-R103 PolarHBondContact O-N 3.08Å; Q101-R103 VanDerWaalsContact C-N 3.29Å; Q101-R103 PolarHBondContact O-N 3.23Å; R103-G105 PolarHBondContact O-N 3.48Å
104L66.4Low73.8Confident28 Ų2876 Ų7615%0.14736%0.356CS..  trans-78.1123.9-177.7-67.4160.2000108K99 L102 K108 L112 H297K99-L104 PolarHBondContact O-N 2.91Å; L102-L104 HydrophobicContact CB-CD1 3.45Å; L102-L104 VanDerWaalsContact CB-CD1 3.45Å; L102-L104 HydrophobicContact CB-CG 3.59Å; L102-L104 HydrophobicContact CD2-CD1 3.94Å; L102-L104 HydrophobicContact CG-CD1 4.21Å; L102-L104 PolarHBondContact O-N 3.28Å; L104-K108 HydrophobicContact CB-CB 4.37Å; L104-K108 HydrophobicContact CD2-CB 3.89Å; L104-K108 HydrophobicContact CD2-CD 4.42Å; L104-K108 HydrophobicContact CD2-CG 4.45Å; L104-L112 HydrophobicContact CD1-CD2 3.53Å; L104-H297 VanDerWaalsContact CD2-ND1 3.26Å; L104-H297 WeakPolarHBondContact CD2-ND1 3.23Å
105G71.9Confident75.2Confident26 Ų2671.5 Ų71.527%0.26833%0.333SS..  trans-68.1177.9165.600000110.8R103 S109 E302R103-G105 PolarHBondContact O-N 3.48Å; G105-S109 WeakPolarHBondContact O-CB 3.21Å; G105-S109 PolarHBondContact O-N 3.4Å; G105-S109 PolarHBondContact O-OG 3.44Å; G105-E302 WeakPolarHBondContact CA-OE2 3.27Å
106Q79.5Confident76.8Confident39 Ų3971.2 Ų71.218%0.18233%0.331CS..Hα-helixtrans-68.4-42.7-165.2-178.4154.5-3.100113.1L63 R66 S109 W110 E302L63-Q106 PolarHBondContact O-NE2 3Å; R66-Q106 PolarHBondContact O-NE2 3.2Å; R66-Q106 PolarHBondContact O-OE1 3.15Å; Q106-S109 WeakPolarHBondContact O-CB 3.41Å; Q106-S109 PolarHBondContact O-N 2.88Å; Q106-W110 PolarHBondContact O-N 2.99Å; Q106-E302 PolarHBondContact N-OE2 3.18Å
107R85Confident78.3Confident18 Ų1870.6 Ų70.67%0.06833%0.327CS..Hα-helixtrans-67.8-44.9-179.4-67.3179.2172.8-179.8-7.5110.3D65 S109 W110 H111 P161 S164 I165 D168D65-R107 IonicContact OD1-CZ 3.73Å; D65-R107 IonicContact OD1-NE 2.64Å; D65-R107 IonicContact OD1-NH2 3.4Å; D65-R107 PolarHBondContact OD1-NH2 3.38Å; R107-S109 VanDerWaalsContact C-N 3.32Å; R107-S109 PolarHBondContact O-N 3.33Å; R107-W110 PolarHBondContact O-N 3.16Å; R107-H111 WeakPolarHBondContact O-CB 3.36Å; R107-H111 PolarHBondContact O-N 3.01Å; R107-P161 HydrophobicContact CB-CB 4.07Å; R107-P161 VanDerWaalsContact O-CB 3.27Å; R107-P161 WeakPolarHBondContact O-CB 3.23Å; R107-S164 WeakPolarHBondContact CD-OG 3.41Å; R107-S164 PolarHBondContact NE-OG 3.22Å; R107-S164 VanDerWaalsContact NH1-C 3.35Å; R107-S164 PolarHBondContact NH1-O 3.41Å; R107-I165 HydrophobicContact CB-CD1 3.79Å; R107-I165 HydrophobicContact CB-CG1 3.68Å; R107-I165 HydrophobicContact CG-CG1 4.38Å; R107-D168 IonicContact CZ-OD1 3.9Å; R107-D168 IonicContact CZ-OD2 3.81Å; R107-D168 IonicContact NE-OD2 3.74Å; R107-D168 IonicContact NH1-OD1 3.13Å; R107-D168 PolarHBondContact NH1-OD1 3.42Å; R107-D168 IonicContact NH1-OD2 2.88Å; R107-D168 PolarHBondContact NH1-OD2 3.37Å
108K88.5Confident79.8Confident7 Ų761.4 Ų61.43%0.0329%0.293CS..Hα-helixtrans-58.8-37.9171.2-95.5166.9-177-980113.4L104 H111 L112 F296 H297 V300 E302L104-K108 HydrophobicContact CB-CB 4.37Å; L104-K108 HydrophobicContact CD2-CB 3.89Å; L104-K108 HydrophobicContact CD2-CD 4.42Å; L104-K108 HydrophobicContact CD2-CG 4.45Å; K108-H111 WeakPolarHBondContact O-CB 3.49Å; K108-H111 PolarHBondContact O-N 3.4Å; K108-L112 WeakPolarHBondContact O-CB 3.4Å; K108-L112 PolarHBondContact O-N 3.3Å; K108-F296 HydrophobicContact CG-CE1 4.09Å; K108-F296 HydrophobicContact CG-CZ 4.4Å; K108-F296 PolarHBondContact NZ-O 2.9Å; K108-H297 PolarHBondContact NZ-O 2.99Å; K108-H297 PolarHBondContact O-CE1 3.38Å; K108-H297 VanDerWaalsContact O-CE1 3.32Å; K108-V300 WeakPolarHBondContact CE-O 3.42Å; K108-V300 PolarHBondContact NZ-O 3.41Å; K108-E302 WeakPolarHBondContact CA-OE1 3.27Å; K108-E302 WeakPolarHBondContact CB-OE1 3.38Å; K108-E302 HydrophobicContact CD-CG 3.79Å; K108-E302 WeakPolarHBondContact CD-OE1 3.31Å; K108-E302 HydrophobicContact CG-CG 4.32Å; K108-E302 WeakPolarHBondContact CG-OE1 3.45Å; K108-E302 PolarHBondContact N-OE1 2.92Å
109S87.6Confident81.5Confident16 Ų1659.7 Ų59.711%0.11229%0.285CS..Hα-helixtrans-63.2-43177.9-66.50000111.9G105 Q106 R107 G113G105-S109 WeakPolarHBondContact O-CB 3.21Å; G105-S109 PolarHBondContact O-N 3.4Å; G105-S109 PolarHBondContact O-OG 3.44Å; Q106-S109 WeakPolarHBondContact O-CB 3.41Å; Q106-S109 PolarHBondContact O-N 2.88Å; R107-S109 VanDerWaalsContact C-N 3.32Å; R107-S109 PolarHBondContact O-N 3.33Å; S109-G113 PolarHBondContact O-N 3.49Å; S109-G113 VanDerWaalsContact O-N 3.08Å
110W90.4Very high83.1Confident84 Ų8462.4 Ų62.432%0.31830%0.301SS..Hα-helixtrans-67.1-42.2175-80.4109.6000112.1I60 L63 Q106 R107 L112 G113 G114 P161I60-W110 HydrophobicContact CG1-CE3 4.44Å; I60-W110 HydrophobicContact CG1-CZ3 4.39Å; L63-W110 HydrophobicContact CB-CZ2 3.73Å; L63-W110 HydrophobicContact CD1-CH2 3.77Å; L63-W110 HydrophobicContact CD1-CZ2 3.62Å; L63-W110 HydrophobicContact CG-CZ2 4.28Å; Q106-W110 PolarHBondContact O-N 2.99Å; R107-W110 PolarHBondContact O-N 3.16Å; W110-L112 PolarHBondContact O-N 3.01Å; W110-G113 PolarHBondContact O-N 3.44Å; W110-G114 PolarHBondContact O-N 2.75Å; W110-P161 HydrophobicContact CB-CB 4.46Å; W110-P161 HydrophobicContact CB-CG 3.7Å
111H93.6Very high84.9Confident0 Ų053 Ų530%027%0.267CS..Hα-helixtrans-55-51.4173.9-175.7-83.6000111.8G12 R107 K108 G113 G114 C115 A157 V158 P161 F296 H297G12-H111 PolarHBondContact O-CE1 3.43Å; G12-H111 VanDerWaalsContact O-CE1 3.32Å; G12-H111 PolarHBondContact O-NE2 3.4Å; G12-H111 VanDerWaalsContact O-NE2 3.09Å; R107-H111 WeakPolarHBondContact O-CB 3.36Å; R107-H111 PolarHBondContact O-N 3.01Å; K108-H111 WeakPolarHBondContact O-CB 3.49Å; K108-H111 PolarHBondContact O-N 3.4Å; H111-G113 VanDerWaalsContact C-N 3.33Å; H111-G113 PolarHBondContact O-N 3.34Å; H111-G114 PolarHBondContact O-N 3.48Å; H111-C115 VanDerWaalsContact CE1-SG 3.58Å; H111-C115 PolarHBondContact O-N 3.17Å; H111-C115 PolarHBondContact O-SG 2.96Å; H111-A157 WeakPolarHBondContact CA-O 3.16Å; H111-V158 PolarHBondContact CD2-O 3.34Å; H111-P161 HydrophobicContact CB-CB 4.44Å; H111-F296 HydrophobicContact CB-CE1 4.47Å; H111-F296 AromaticContact CD2-CE1 3.94Å; H111-F296 AromaticContact CE1-CD1 3.51Å; H111-F296 AromaticContact CE1-CE1 3.61Å; H111-F296 AromaticContact CG-CE1 3.75Å; H111-F296 AromaticContact ND1-CD1 3.72Å; H111-F296 AromaticContact ND1-CE1 3.53Å; H111-F296 AromaticContact NE2-CE1 3.82Å; H111-H297 AromaticContact CE1-NE2 3.98Å; H111-H297 AromaticContact ND1-CE1 3.99Å; H111-H297 AromaticContact ND1-NE2 3.13Å; H111-H297 PolarHBondContact ND1-NE2 3.2Å; H111-H297 VanDerWaalsContact ND1-NE2 3.13Å
112L93.6Very high86.8Confident40 Ų4044.9 Ų44.921%0.20923%0.229CC..Hα-helixtrans-61.3-42.3179-174.261.1000111.9L102 L104 K108 W110 G114 C115 L116L102-L112 HydrophobicContact CD2-CD2 4.33Å; L104-L112 HydrophobicContact CD1-CD2 3.53Å; K108-L112 WeakPolarHBondContact O-CB 3.4Å; K108-L112 PolarHBondContact O-N 3.3Å; W110-L112 PolarHBondContact O-N 3.01Å; L112-G114 VanDerWaalsContact C-N 3.31Å; L112-G114 PolarHBondContact O-N 3.18Å; L112-C115 PolarHBondContact O-N 3.23Å; L112-L116 HydrophobicContact CG-CD1 4.28Å; L112-L116 WeakPolarHBondContact O-CG 3.36Å; L112-L116 PolarHBondContact O-N 3.04Å
113G93.1Very high88.4Confident38 Ų3841.3 Ų41.339%0.39221%0.211SC..Hα-helixtrans-59.7-41.717600000112.4S109 W110 H111 L116 L117S109-G113 PolarHBondContact O-N 3.49Å; S109-G113 VanDerWaalsContact O-N 3.08Å; W110-G113 PolarHBondContact O-N 3.44Å; H111-G113 VanDerWaalsContact C-N 3.33Å; H111-G113 PolarHBondContact O-N 3.34Å; G113-L116 PolarHBondContact O-N 3.49Å; G113-L117 WeakPolarHBondContact O-CB 3.45Å; G113-L117 PolarHBondContact O-N 3.36Å
114G95.5Very high90.2Very high1 Ų134.8 Ų34.81%0.0119%0.192CC..Hα-helixtrans-62.1-45.7173.700000113W110 H111 L112 L116 L117 M118 G154 A157W110-G114 PolarHBondContact O-N 2.75Å; H111-G114 PolarHBondContact O-N 3.48Å; L112-G114 VanDerWaalsContact C-N 3.31Å; L112-G114 PolarHBondContact O-N 3.18Å; G114-L116 PolarHBondContact O-N 3.05Å; G114-L117 PolarHBondContact O-N 3.29Å; G114-M118 WeakPolarHBondContact O-CG 3.2Å; G114-M118 PolarHBondContact O-N 3Å; G114-G154 WeakPolarHBondContact CA-O 3.25Å; G114-A157 VanDerWaalsContact CA-CB 3.46Å
115C96Very high91.5Very high4 Ų433.4 Ų33.43%0.02719%0.185CC..Hα-helixtrans-59.6-45.6176.9-64.10000112.2L15 H111 L112 L117 M118 L119 T293L15-C115 HydrophobicContact CD2-CB 3.72Å; H111-C115 VanDerWaalsContact CE1-SG 3.58Å; H111-C115 PolarHBondContact O-N 3.17Å; H111-C115 PolarHBondContact O-SG 2.96Å; L112-C115 PolarHBondContact O-N 3.23Å; C115-L117 VanDerWaalsContact C-N 3.35Å; C115-L117 PolarHBondContact O-N 3.48Å; C115-M118 PolarHBondContact O-N 3.02Å; C115-L119 VanDerWaalsContact O-CB 3.25Å; C115-L119 WeakPolarHBondContact O-CB 3.47Å; C115-L119 PolarHBondContact O-N 3Å; C115-T293 HydrophobicContact CB-CG2 3.9Å; C115-T293 VanDerWaalsContact SG-CG2 3.6Å
116L95.5Very high92.4Very high85 Ų8532.2 Ų32.245%0.44517%0.173SC..Hα-helixtrans-64.1-39.3178.6-70.6174.1000112.1L112 G113 G114 L119 I120L112-L116 HydrophobicContact CG-CD1 4.28Å; L112-L116 WeakPolarHBondContact O-CG 3.36Å; L112-L116 PolarHBondContact O-N 3.04Å; G113-L116 PolarHBondContact O-N 3.49Å; G114-L116 PolarHBondContact O-N 3.05Å; L116-L119 HydrophobicContact CD2-CD2 4.13Å; L116-L119 WeakPolarHBondContact O-CB 3.34Å; L116-L119 PolarHBondContact O-N 2.71Å; L116-I120 WeakPolarHBondContact O-CG1 3.46Å; L116-I120 PolarHBondContact O-N 3.5Å
117L95.9Very high92.7Very high62 Ų6231.4 Ų31.433%0.32518%0.175SC..Hα-helixtrans-65.5-44177.3-176.458.8000111.4G113 G114 C115 I120 A121 C150 V153G113-L117 WeakPolarHBondContact O-CB 3.45Å; G113-L117 PolarHBondContact O-N 3.36Å; G114-L117 PolarHBondContact O-N 3.29Å; C115-L117 VanDerWaalsContact C-N 3.35Å; C115-L117 PolarHBondContact O-N 3.48Å; L117-I120 PolarHBondContact O-N 3.03Å; L117-A121 VanDerWaalsContact O-CB 3.28Å; L117-A121 WeakPolarHBondContact O-CB 3.21Å; L117-A121 PolarHBondContact O-N 3.32Å; L117-C150 HydrophobicContact CD1-CB 4.13Å; L117-C150 WeakPolarHBondContact CD2-O 3.22Å; L117-C150 HydrophobicContact CG-CB 4.48Å; L117-C150 WeakPolarHBondContact CG-O 3.32Å; L117-V153 HydrophobicContact CD2-CB 4.14Å; L117-V153 HydrophobicContact CD2-CG1 3.99Å
118M95.3Very high92.8Very high0 Ų030.9 Ų30.90%017%0.173CC..Hα-helixtrans-65.7-40.5176.1-67.8-178.464.100112.3K16 V19 G114 C115 I120 A121 F122 G154 W155 V158K16-M118 HydrophobicContact CB-CE 4.32Å; K16-M118 HydrophobicContact CB-SD 4.37Å; V19-M118 HydrophobicContact CB-CE 3.53Å; V19-M118 HydrophobicContact CG1-CE 3.52Å; V19-M118 HydrophobicContact CG2-CE 3.73Å; G114-M118 WeakPolarHBondContact O-CG 3.2Å; G114-M118 PolarHBondContact O-N 3Å; C115-M118 PolarHBondContact O-N 3.02Å; M118-I120 PolarHBondContact O-N 2.65Å; M118-A121 PolarHBondContact O-N 3.24Å; M118-F122 WeakPolarHBondContact O-CB 3.16Å; M118-F122 PolarHBondContact O-N 2.91Å; M118-G154 VanDerWaalsContact SD-C 3.59Å; M118-W155 HydrophobicContact CE-CE3 4.25Å; M118-W155 HydrophobicContact SD-CB 4.38Å; M118-W155 PolarHBondContact SD-N 2.84Å; M118-V158 HydrophobicContact SD-CG2 4.14Å
119L95.2Very high92.5Very high63 Ų6333.3 Ų33.333%0.3319%0.189SC..Hα-helixtrans-54.3-38.2176.9166.665.2000112.2C115 L116 P123 V286 V290C115-L119 VanDerWaalsContact O-CB 3.25Å; C115-L119 WeakPolarHBondContact O-CB 3.47Å; C115-L119 PolarHBondContact O-N 3Å; L116-L119 HydrophobicContact CD2-CD2 4.13Å; L116-L119 WeakPolarHBondContact O-CB 3.34Å; L116-L119 PolarHBondContact O-N 2.71Å; L119-P123 WeakPolarHBondContact O-CD 3.38Å; L119-P123 WeakPolarHBondContact O-CG 3.3Å; L119-V286 HydrophobicContact CB-CG1 4.26Å; L119-V286 HydrophobicContact CD1-CG1 3.11Å; L119-V286 HydrophobicContact CG-CG1 4.23Å; L119-V290 HydrophobicContact CD1-CG2 3.72Å; L119-V290 HydrophobicContact CD2-CG2 4.24Å; L119-V290 HydrophobicContact CG-CG2 4.5Å
120I94.4Very high92.3Very high112 Ų11238.1 Ų38.157%0.57421%0.21SC*.Hα-helixtrans-85.4-49.4179.3-61.8168.8000110.8L116 L117 M118 L124L116-I120 WeakPolarHBondContact O-CG1 3.46Å; L116-I120 PolarHBondContact O-N 3.5Å; L117-I120 PolarHBondContact O-N 3.03Å; M118-I120 PolarHBondContact O-N 2.65Å; I120-L124 HydrophobicContact CG2-CD1 4.12Å; I120-L124 WeakPolarHBondContact O-CD1 3.39Å; I120-L124 VanDerWaalsContact O-CG 3.32Å; I120-L124 WeakPolarHBondContact O-CG 3.17Å
121A95.7Very high92Very high5 Ų542.1 Ų42.14%0.04123%0.226CC..Hα-helixtrans-73.5-34.6-169.200000113.6L117 M118 L124 M125 C150 V151L117-A121 VanDerWaalsContact O-CB 3.28Å; L117-A121 WeakPolarHBondContact O-CB 3.21Å; L117-A121 PolarHBondContact O-N 3.32Å; M118-A121 PolarHBondContact O-N 3.24Å; A121-L124 PolarHBondContact O-N 3.42Å; A121-M125 PolarHBondContact O-N 3.09Å; A121-M125 VanDerWaalsContact O-N 3.11Å; A121-C150 HydrophobicContact CB-CB 3.55Å; A121-V151 HydrophobicContact CB-CG2 3.67Å
122F95.2Very high91.6Very high0 Ų042.5 Ų42.50%023%0.229CC..Hα-helixtrans-72.1-45.3-173.2175.6-99.9000113.9V19 V22 I23 M118 L124 M125 F126 V151 A282 V285 V286V19-F122 HydrophobicContact CB-CD2 4.26Å; V19-F122 HydrophobicContact CB-CE2 4.21Å; V19-F122 HydrophobicContact CB-CZ 4.44Å; V19-F122 HydrophobicContact CG1-CD2 3.44Å; V19-F122 VanDerWaalsContact CG1-CD2 3.44Å; V19-F122 HydrophobicContact CG1-CE2 3.62Å; V19-F122 HydrophobicContact CG1-CG 4.03Å; V19-F122 HydrophobicContact CG1-CZ 4.33Å; V19-F122 HydrophobicContact CG2-CB 4.38Å; V19-F122 HydrophobicContact CG2-CD1 3.89Å; V19-F122 HydrophobicContact CG2-CD2 4.06Å; V19-F122 HydrophobicContact CG2-CE1 4.01Å; V19-F122 HydrophobicContact CG2-CE2 4.22Å; V19-F122 HydrophobicContact CG2-CG 3.85Å; V19-F122 HydrophobicContact CG2-CZ 4.17Å; V22-F122 HydrophobicContact CB-CE2 4.19Å; V22-F122 HydrophobicContact CB-CZ 3.69Å; V22-F122 HydrophobicContact CG1-CE2 4.26Å; V22-F122 HydrophobicContact CG1-CZ 3.76Å; V22-F122 HydrophobicContact CG2-CZ 3.88Å; I23-F122 HydrophobicContact CD1-CE2 4.45Å; I23-F122 HydrophobicContact CG1-CE2 4.13Å; M118-F122 WeakPolarHBondContact O-CB 3.16Å; M118-F122 PolarHBondContact O-N 2.91Å; F122-L124 PolarHBondContact O-N 3.42Å; F122-M125 HydrophobicContact CD2-CE 3.86Å; F122-M125 HydrophobicContact CE2-CE 4.03Å; F122-M125 WeakPolarHBondContact O-CB 3.09Å; F122-M125 PolarHBondContact O-N 3.31Å; F122-M125 VanDerWaalsContact O-N 3.09Å; F122-F126 HydrophobicContact CD2-CD2 4.25Å; F122-F126 HydrophobicContact CD2-CE2 4.41Å; F122-F126 AromaticContact CE2-CD2 3.67Å; F122-F126 HydrophobicContact CE2-CD2 3.67Å; F122-F126 AromaticContact CE2-CE2 3.62Å; F122-F126 HydrophobicContact CE2-CE2 3.62Å; F122-F126 AromaticContact CZ-CD2 3.98Å; F122-F126 HydrophobicContact CZ-CD2 3.98Å; F122-F126 HydrophobicContact CZ-CE2 4.13Å; F122-F126 PolarHBondContact O-N 2.79Å; F122-V151 HydrophobicContact CB-CG2 4.01Å; F122-A282 HydrophobicContact CD1-CB 4.03Å; F122-A282 HydrophobicContact CE1-CB 3.62Å; F122-A282 HydrophobicContact CZ-CB 4.27Å; F122-V285 HydrophobicContact CE1-CB 4.46Å; F122-V285 HydrophobicContact CE1-CG1 3.93Å; F122-V285 HydrophobicContact CZ-CG1 4.41Å; F122-V286 HydrophobicContact CB-CG2 4.43Å; F122-V286 HydrophobicContact CD1-CG2 3.42Å; F122-V286 VanDerWaalsContact CD1-CG2 3.42Å; F122-V286 HydrophobicContact CE1-CG2 4.05Å; F122-V286 HydrophobicContact CG-CG2 4.34Å
123P93.8Very high91Very high20 Ų2041.7 Ų41.713%0.1323%0.225CC..Hα-helixtrans-60.7-32.2172.4-25.437000113L119 M125 G127 L283 V286L119-P123 WeakPolarHBondContact O-CD 3.38Å; L119-P123 WeakPolarHBondContact O-CG 3.3Å; P123-M125 VanDerWaalsContact C-N 3.31Å; P123-G127 WeakPolarHBondContact O-CA 3.45Å; P123-G127 PolarHBondContact O-N 3.39Å; P123-L283 HydrophobicContact CB-CD2 3.85Å; P123-L283 HydrophobicContact CG-CD2 4.23Å; P123-V286 HydrophobicContact CG-CB 4.35Å; P123-V286 HydrophobicContact CG-CG1 4.42Å; P123-V286 HydrophobicContact CG-CG2 4Å
124L93Very high90.6Very high82 Ų8243.3 Ų43.343%0.42924%0.242SC..Hα-helixtrans-70.4-28.1175.6-65.3174000113I120 A121 F122 Q128 F147I120-L124 HydrophobicContact CG2-CD1 4.12Å; I120-L124 WeakPolarHBondContact O-CD1 3.39Å; I120-L124 VanDerWaalsContact O-CG 3.32Å; I120-L124 WeakPolarHBondContact O-CG 3.17Å; A121-L124 PolarHBondContact O-N 3.42Å; F122-L124 PolarHBondContact O-N 3.42Å; L124-Q128 WeakPolarHBondContact O-CG 3.28Å; L124-F147 HydrophobicContact CB-CD1 3.86Å; L124-F147 HydrophobicContact CB-CE1 3.58Å; L124-F147 HydrophobicContact CB-CE2 4.32Å; L124-F147 HydrophobicContact CB-CG 4.37Å; L124-F147 HydrophobicContact CB-CZ 3.83Å; L124-F147 HydrophobicContact CD1-CD1 4.37Å; L124-F147 HydrophobicContact CD1-CE1 3.71Å; L124-F147 HydrophobicContact CD1-CZ 4.37Å; L124-F147 HydrophobicContact CG-CE1 4.25Å
125M93.5Very high90.4Very high0 Ų046 Ų460%026%0.256CS..Hα-helixtrans-70.2-44.8179-169.218074.500112.3I23 Y31 A121 F122 P123 F147 M148 V151I23-M125 HydrophobicContact CD1-CE 4.12Å; I23-M125 HydrophobicContact CG1-CE 3.87Å; Y31-M125 WeakPolarHBondContact OH-CG 3.4Å; A121-M125 PolarHBondContact O-N 3.09Å; A121-M125 VanDerWaalsContact O-N 3.11Å; F122-M125 HydrophobicContact CD2-CE 3.86Å; F122-M125 HydrophobicContact CE2-CE 4.03Å; F122-M125 WeakPolarHBondContact O-CB 3.09Å; F122-M125 PolarHBondContact O-N 3.31Å; F122-M125 VanDerWaalsContact O-N 3.09Å; P123-M125 VanDerWaalsContact C-N 3.31Å; M125-F147 HydrophobicContact CB-CB 4.09Å; M125-F147 HydrophobicContact CG-CB 4.28Å; M125-M148 HydrophobicContact SD-SD 3.81Å; M125-V151 HydrophobicContact SD-CG2 4.37Å
126F90.4Very high90.3Very high0 Ų048.9 Ų48.90%027%0.274CS..Hα-helixtrans-97.5-15179.6-79.3-72.9000113.9V22 I23 F26 F30 F122 Q128 F278 A282V22-F126 HydrophobicContact CB-CE2 4.49Å; V22-F126 HydrophobicContact CG1-CD2 4.05Å; V22-F126 HydrophobicContact CG1-CE1 4.48Å; V22-F126 HydrophobicContact CG1-CE2 3.54Å; V22-F126 HydrophobicContact CG1-CZ 3.8Å; I23-F126 HydrophobicContact CG1-CE2 4.36Å; F26-F126 HydrophobicContact CB-CE1 4.16Å; F26-F126 HydrophobicContact CB-CZ 4.35Å; F30-F126 HydrophobicContact CB-CE1 3.92Å; F30-F126 HydrophobicContact CD1-CD1 4.08Å; F30-F126 HydrophobicContact CD1-CE1 4.02Å; F30-F126 AromaticContact CD2-CD1 3.76Å; F30-F126 HydrophobicContact CD2-CD1 3.76Å; F30-F126 HydrophobicContact CD2-CE1 4.02Å; F30-F126 HydrophobicContact CE1-CD1 4.2Å; F30-F126 AromaticContact CE2-CD1 3.88Å; F30-F126 HydrophobicContact CE2-CD1 3.88Å; F30-F126 AromaticContact CG-CD1 3.86Å; F30-F126 HydrophobicContact CG-CD1 3.86Å; F30-F126 AromaticContact CG-CE1 3.71Å; F30-F126 HydrophobicContact CG-CE1 3.71Å; F30-F126 HydrophobicContact CZ-CD1 4.11Å; F122-F126 HydrophobicContact CD2-CD2 4.25Å; F122-F126 HydrophobicContact CD2-CE2 4.41Å; F122-F126 AromaticContact CE2-CD2 3.67Å; F122-F126 HydrophobicContact CE2-CD2 3.67Å; F122-F126 AromaticContact CE2-CE2 3.62Å; F122-F126 HydrophobicContact CE2-CE2 3.62Å; F122-F126 AromaticContact CZ-CD2 3.98Å; F122-F126 HydrophobicContact CZ-CD2 3.98Å; F122-F126 HydrophobicContact CZ-CE2 4.13Å; F122-F126 PolarHBondContact O-N 2.79Å; F126-Q128 VanDerWaalsContact C-N 3.34Å; F126-Q128 PolarHBondContact O-N 2.86Å; F126-F278 HydrophobicContact CB-CB 4.23Å; F126-F278 HydrophobicContact CD1-CB 4.05Å; F126-F278 HydrophobicContact CD1-CD1 4.23Å; F126-F278 HydrophobicContact CD1-CG 4.37Å; F126-F278 HydrophobicContact CE1-CD1 4.42Å; F126-A282 HydrophobicContact CB-CB 3.91Å
127G86.6Confident90.2Very high22 Ų2248 Ų4823%0.22727%0.272CS..  trans-9634.7-177.800000114.3P123P123-G127 WeakPolarHBondContact O-CA 3.45Å; P123-G127 PolarHBondContact O-N 3.39Å
128Q85.7Confident90.1Very high8 Ų853.6 Ų53.64%0.03729%0.289CS..  trans-72141.2-175.9-62-171.2-29.700111L124 F126 L132 N144 L275L124-Q128 WeakPolarHBondContact O-CG 3.28Å; F126-Q128 VanDerWaalsContact C-N 3.34Å; F126-Q128 PolarHBondContact O-N 2.86Å; Q128-L132 HydrophobicContact CB-CD2 4.12Å; Q128-L132 HydrophobicContact CG-CD2 4.01Å; Q128-N144 PolarHBondContact NE2-OD1 3.39Å; Q128-N144 PolarHBondContact OE1-OD1 3.25Å; Q128-L275 WeakPolarHBondContact O-CD2 3.35Å
129P83.4Confident90.1Very high57 Ų5754 Ų5437%0.3729%0.293SS..  trans-73.5150172.230.2-34.1000110.8Y131 L132P129-Y131 HydrophobicContact CB-CD1 3.52Å; P129-Y131 HydrophobicContact CB-CE1 3.33Å; P129-Y131 HydrophobicContact CB-CG 4.44Å; P129-Y131 HydrophobicContact CG-CD1 3.57Å; P129-Y131 HydrophobicContact CG-CE1 2.97Å; P129-Y131 HydrophobicContact CG-CE2 4.01Å; P129-Y131 HydrophobicContact CG-CG 4.3Å; P129-Y131 WeakPolarHBondContact CG-OH 3.47Å; P129-Y131 PolarHBondContact O-N 2.94Å; P129-Y131 VanDerWaalsContact O-N 3.08Å; P129-L132 WeakPolarHBondContact O-CB 3.4Å; P129-L132 PolarHBondContact O-N 3.32Å
130E83.2Confident90Very high118 Ų11851.9 Ų51.955%0.55128%0.281SS*.G310 helixtrans-56.4-30.2-174.8-68.4173.3-162.600113.5L132 V133 I272 L275E130-L132 PolarHBondContact O-N 2.85Å; E130-L132 VanDerWaalsContact O-N 3.11Å; E130-V133 WeakPolarHBondContact O-CB 3.38Å; E130-V133 PolarHBondContact O-N 3.26Å; E130-I272 HydrophobicContact CG-CG2 4.49Å; E130-L275 HydrophobicContact CG-CD2 4.14Å
131Y84Confident90Very high167 Ų16749 Ų4966%0.65527%0.267SS*.G310 helixtrans-59.7-25.5178.171.3-106.8000113.2P129 V133 G134P129-Y131 HydrophobicContact CB-CD1 3.52Å; P129-Y131 HydrophobicContact CB-CE1 3.33Å; P129-Y131 HydrophobicContact CB-CG 4.44Å; P129-Y131 HydrophobicContact CG-CD1 3.57Å; P129-Y131 HydrophobicContact CG-CE1 2.97Å; P129-Y131 HydrophobicContact CG-CE2 4.01Å; P129-Y131 HydrophobicContact CG-CG 4.3Å; P129-Y131 WeakPolarHBondContact CG-OH 3.47Å; P129-Y131 PolarHBondContact O-N 2.94Å; P129-Y131 VanDerWaalsContact O-N 3.08Å; Y131-V133 PolarHBondContact O-N 3.34Å; Y131-G134 PolarHBondContact O-N 3.24Å; Y131-G134 VanDerWaalsContact O-N 3.12Å
132L84Confident89.9Confident9 Ų953.7 Ų53.75%0.04729%0.29CS..G310 helixtrans-67.4-25.7179.7-151.382.9000111.8Q128 P129 E130 G134 L135 I143Q128-L132 HydrophobicContact CB-CD2 4.12Å; Q128-L132 HydrophobicContact CG-CD2 4.01Å; P129-L132 WeakPolarHBondContact O-CB 3.4Å; P129-L132 PolarHBondContact O-N 3.32Å; E130-L132 PolarHBondContact O-N 2.85Å; E130-L132 VanDerWaalsContact O-N 3.11Å; L132-G134 PolarHBondContact O-N 2.92Å; L132-L135 HydrophobicContact CD1-CD1 3.4Å; L132-L135 VanDerWaalsContact CD1-CD1 3.4Å; L132-L135 HydrophobicContact CG-CD1 3.89Å; L132-L135 WeakPolarHBondContact O-CB 3.14Å; L132-L135 PolarHBondContact O-N 2.74Å; L132-I143 HydrophobicContact CD1-CD1 3.83Å; L132-I143 HydrophobicContact CD1-CG2 4.45Å; L132-I143 HydrophobicContact CD2-CG2 4.12Å
133V82.6Confident89.9Confident22 Ų2256.1 Ų56.113%0.13330%0.303CS..G310 helixtrans-68.8-25175.9-173.50000111.3I35 E130 Y131 K140 I272I35-V133 HydrophobicContact CD1-CG2 4.24Å; E130-V133 WeakPolarHBondContact O-CB 3.38Å; E130-V133 PolarHBondContact O-N 3.26Å; Y131-V133 PolarHBondContact O-N 3.34Å; V133-K140 WeakPolarHBondContact O-CE 3.23Å; V133-K140 PolarHBondContact O-NZ 3.12Å; V133-I272 HydrophobicContact CG1-CD1 3.86Å; V133-I272 HydrophobicContact CG1-CG1 4.35Å
134G84.5Confident89.9Confident72 Ų7255.1 Ų55.174%0.74230%0.296SS*.G310 helixtrans-82.8-7.9176.300000115.1Y131 L132Y131-G134 PolarHBondContact O-N 3.24Å; Y131-G134 VanDerWaalsContact O-N 3.12Å; L132-G134 PolarHBondContact O-N 2.92Å
135L91.2Very high90Very high58 Ų5851.6 Ų51.630%0.30428%0.28SS..SBendtrans-70.8155.2-178.2-72.6178.7000112.7L132 A139 K140 I143L132-L135 HydrophobicContact CD1-CD1 3.4Å; L132-L135 VanDerWaalsContact CD1-CD1 3.4Å; L132-L135 HydrophobicContact CG-CD1 3.89Å; L132-L135 WeakPolarHBondContact O-CB 3.14Å; L132-L135 PolarHBondContact O-N 2.74Å; L135-A139 HydrophobicContact CB-CB 4.26Å; L135-A139 HydrophobicContact CD1-CB 4.38Å; L135-K140 HydrophobicContact CB-CG 4.17Å; L135-K140 WeakPolarHBondContact O-CE 3.14Å; L135-I143 HydrophobicContact CD1-CD1 3.97Å
136P93.6Very high90.1Very high64 Ų6456.4 Ų56.442%0.41630%0.303SS..  trans-60.5150171.327.5-35.6000111.1W138 A139 K140P136-W138 VanDerWaalsContact C-N 3.28Å; P136-W138 HydrophobicContact CG-CZ2 4.17Å; P136-W138 PolarHBondContact O-N 2.95Å; P136-A139 HydrophobicContact CG-CB 3.97Å; P136-A139 WeakPolarHBondContact O-CB 3.48Å; P136-A139 PolarHBondContact O-N 3.12Å; P136-K140 PolarHBondContact O-N 3.23Å; P136-K140 VanDerWaalsContact O-N 3.09Å
137V93.6Very high90.3Very high66 Ų6658.8 Ų58.840%0.431%0.314SS..Hα-helixtrans-53-42.5-173.4177.40000112.9A139 K140 L141V137-A139 VanDerWaalsContact C-N 3.28Å; V137-A139 PolarHBondContact O-N 3.43Å; V137-K140 WeakPolarHBondContact O-CB 3.31Å; V137-K140 PolarHBondContact O-N 3.49Å; V137-L141 HydrophobicContact CG1-CD1 4Å; V137-L141 HydrophobicContact CG1-CG 4.33Å; V137-L141 WeakPolarHBondContact O-CG 3.46Å; V137-L141 PolarHBondContact O-N 3.15Å
138W94.1Very high90.7Very high180 Ų18057.7 Ų57.768%0.68230%0.303SS*.Hα-helixtrans-61.2-36.9179.569.3-97.6000112.3P136 L141 L142P136-W138 VanDerWaalsContact C-N 3.28Å; P136-W138 HydrophobicContact CG-CZ2 4.17Å; P136-W138 PolarHBondContact O-N 2.95Å; W138-L141 PolarHBondContact O-N 3.25Å; W138-L142 WeakPolarHBondContact O-CB 3.5Å; W138-L142 PolarHBondContact O-N 3.34Å
139A94.3Very high91.3Very high10 Ų1059.3 Ų59.38%0.08331%0.311CS..Hα-helixtrans-73.6-40.7178.700000110.8L135 P136 V137 L141 L142 I143L135-A139 HydrophobicContact CB-CB 4.26Å; L135-A139 HydrophobicContact CD1-CB 4.38Å; P136-A139 HydrophobicContact CG-CB 3.97Å; P136-A139 WeakPolarHBondContact O-CB 3.48Å; P136-A139 PolarHBondContact O-N 3.12Å; V137-A139 VanDerWaalsContact C-N 3.28Å; V137-A139 PolarHBondContact O-N 3.43Å; A139-L141 VanDerWaalsContact C-N 3.31Å; A139-L141 PolarHBondContact O-N 3.35Å; A139-L142 PolarHBondContact O-N 3.11Å; A139-I143 WeakPolarHBondContact O-CB 3.47Å; A139-I143 WeakPolarHBondContact O-CG1 3.37Å; A139-I143 PolarHBondContact O-N 3.06Å
140K93.5Very high91.9Very high17 Ų1758.8 Ų58.87%0.07431%0.309CS..Hα-helixtrans-55.4-47.7171-67.3179.5173.1-175.90110.9I35 L37 V133 L135 P136 V137 N144I35-K140 HydrophobicContact CG2-CD 4.02Å; I35-K140 PolarHBondContact O-NZ 2.96Å; L37-K140 HydrophobicContact CD2-CB 4.15Å; L37-K140 HydrophobicContact CD2-CD 4.05Å; V133-K140 WeakPolarHBondContact O-CE 3.23Å; V133-K140 PolarHBondContact O-NZ 3.12Å; L135-K140 HydrophobicContact CB-CG 4.17Å; L135-K140 WeakPolarHBondContact O-CE 3.14Å; P136-K140 PolarHBondContact O-N 3.23Å; P136-K140 VanDerWaalsContact O-N 3.09Å; V137-K140 WeakPolarHBondContact O-CB 3.31Å; V137-K140 PolarHBondContact O-N 3.49Å; K140-N144 VanDerWaalsContact O-CB 3.22Å; K140-N144 WeakPolarHBondContact O-CB 3.46Å; K140-N144 PolarHBondContact O-N 3.3Å; K140-N144 PolarHBondContact O-ND2 3.23Å
141L94.3Very high92.5Very high53 Ų5353.2 Ų53.228%0.27728%0.282SS..Hα-helixtrans-65.3-42.1-179.8-73175.2000112.8L37 Q41 V137 W138 A139 G145L37-L141 HydrophobicContact CD1-CD2 4.16Å; Q41-L141 HydrophobicContact CB-CD2 4.12Å; Q41-L141 HydrophobicContact CG-CD1 4.32Å; V137-L141 HydrophobicContact CG1-CD1 4Å; V137-L141 HydrophobicContact CG1-CG 4.33Å; V137-L141 WeakPolarHBondContact O-CG 3.46Å; V137-L141 PolarHBondContact O-N 3.15Å; W138-L141 PolarHBondContact O-N 3.25Å; A139-L141 VanDerWaalsContact C-N 3.31Å; A139-L141 PolarHBondContact O-N 3.35Å; L141-G145 WeakPolarHBondContact O-CA 3.34Å; L141-G145 PolarHBondContact O-N 3.44Å
142L94.5Very high93.1Very high102 Ų10245.6 Ų45.653%0.53425%0.253SS..Hα-helixtrans-64.7-50179.9-172.4154.7000111.3W138 A139 G145 M146W138-L142 WeakPolarHBondContact O-CB 3.5Å; W138-L142 PolarHBondContact O-N 3.34Å; A139-L142 PolarHBondContact O-N 3.11Å; L142-G145 PolarHBondContact O-N 3.12Å; L142-M146 HydrophobicContact CD2-CG 4.36Å; L142-M146 WeakPolarHBondContact O-CG 3.43Å; L142-M146 PolarHBondContact O-N 3.27Å
143I94Very high93.7Very high51 Ų5147.4 Ų47.426%0.26226%0.264SS..Hα-helixtrans-65.4-48.8-177.1-66.7170.6000110.5L132 L135 A139 G145 M146 F147L132-I143 HydrophobicContact CD1-CD1 3.83Å; L132-I143 HydrophobicContact CD1-CG2 4.45Å; L132-I143 HydrophobicContact CD2-CG2 4.12Å; L135-I143 HydrophobicContact CD1-CD1 3.97Å; A139-I143 WeakPolarHBondContact O-CB 3.47Å; A139-I143 WeakPolarHBondContact O-CG1 3.37Å; A139-I143 PolarHBondContact O-N 3.06Å; I143-G145 VanDerWaalsContact C-N 3.3Å; I143-G145 PolarHBondContact O-N 3.14Å; I143-M146 PolarHBondContact O-N 3.41Å; I143-F147 HydrophobicContact CG2-CD2 4.06Å; I143-F147 HydrophobicContact CG2-CE2 3.5Å; I143-F147 VanDerWaalsContact CG2-CE2 3.5Å; I143-F147 HydrophobicContact CG2-CZ 4.25Å; I143-F147 WeakPolarHBondContact O-CD2 3.28Å; I143-F147 PolarHBondContact O-N 3.49Å
144N94Very high94.4Very high0 Ų046.4 Ų46.40%026%0.258CS..Hα-helixtrans-64.9-35.7176.9-74.5-63000112.2Y31 L45 Q128 K140 F147 M148Y31-N144 HydrophobicContact CE1-CB 3.84Å; Y31-N144 VanDerWaalsContact CE1-CG 3.46Å; Y31-N144 WeakPolarHBondContact CE1-OD1 3.42Å; Y31-N144 PolarHBondContact OH-OD1 2.83Å; L45-N144 HydrophobicContact CD1-CB 4.09Å; L45-N144 HydrophobicContact CD2-CB 3.92Å; Q128-N144 PolarHBondContact NE2-OD1 3.39Å; Q128-N144 PolarHBondContact OE1-OD1 3.25Å; K140-N144 VanDerWaalsContact O-CB 3.22Å; K140-N144 WeakPolarHBondContact O-CB 3.46Å; K140-N144 PolarHBondContact O-N 3.3Å; K140-N144 PolarHBondContact O-ND2 3.23Å; N144-F147 PolarHBondContact O-N 3.07Å; N144-M148 VanDerWaalsContact O-CB 3.28Å; N144-M148 WeakPolarHBondContact O-CB 3.35Å; N144-M148 PolarHBondContact O-N 3.29Å
145G95.2Very high94.9Very high8 Ų843.8 Ų43.88%0.08223%0.226CC..Hα-helixtrans-60.6-44.717500000112.1L45 L141 L142 I143 M148 I149L45-G145 VanDerWaalsContact CD1-N 3.29Å; L141-G145 WeakPolarHBondContact O-CA 3.34Å; L141-G145 PolarHBondContact O-N 3.44Å; L142-G145 PolarHBondContact O-N 3.12Å; I143-G145 VanDerWaalsContact C-N 3.3Å; I143-G145 PolarHBondContact O-N 3.14Å; G145-M148 PolarHBondContact O-N 2.89Å; G145-I149 WeakPolarHBondContact O-CB 3.17Å; G145-I149 WeakPolarHBondContact O-CD1 3.32Å; G145-I149 VanDerWaalsContact O-CG1 3.22Å; G145-I149 WeakPolarHBondContact O-CG1 3.29Å; G145-I149 PolarHBondContact O-N 3.05Å
146M95.6Very high95.1Very high100 Ų10041 Ų4149%0.49321%0.211SC..Hα-helixtrans-61.1-48.4176.1-71.2-64.299.900112.1L142 I143 M148 I149 C150L142-M146 HydrophobicContact CD2-CG 4.36Å; L142-M146 WeakPolarHBondContact O-CG 3.43Å; L142-M146 PolarHBondContact O-N 3.27Å; I143-M146 PolarHBondContact O-N 3.41Å; M146-M148 PolarHBondContact O-N 3.48Å; M146-I149 HydrophobicContact CE-CD1 3.65Å; M146-I149 PolarHBondContact O-N 3.33Å; M146-C150 PolarHBondContact O-N 3.14Å; M146-C150 PolarHBondContact O-SG 3.5Å; M146-C150 VanDerWaalsContact O-SG 3.35Å
147F95.4Very high95.1Very high50 Ų5038.3 Ų38.322%0.21919%0.194CC..Hα-helixtrans-61.9-44.3177-64.8-45.1000112L124 M125 I143 N144 I149 C150 V151L124-F147 HydrophobicContact CB-CD1 3.86Å; L124-F147 HydrophobicContact CB-CE1 3.58Å; L124-F147 HydrophobicContact CB-CE2 4.32Å; L124-F147 HydrophobicContact CB-CG 4.37Å; L124-F147 HydrophobicContact CB-CZ 3.83Å; L124-F147 HydrophobicContact CD1-CD1 4.37Å; L124-F147 HydrophobicContact CD1-CE1 3.71Å; L124-F147 HydrophobicContact CD1-CZ 4.37Å; L124-F147 HydrophobicContact CG-CE1 4.25Å; M125-F147 HydrophobicContact CB-CB 4.09Å; M125-F147 HydrophobicContact CG-CB 4.28Å; I143-F147 HydrophobicContact CG2-CD2 4.06Å; I143-F147 HydrophobicContact CG2-CE2 3.5Å; I143-F147 VanDerWaalsContact CG2-CE2 3.5Å; I143-F147 HydrophobicContact CG2-CZ 4.25Å; I143-F147 WeakPolarHBondContact O-CD2 3.28Å; I143-F147 PolarHBondContact O-N 3.49Å; N144-F147 PolarHBondContact O-N 3.07Å; F147-I149 PolarHBondContact O-N 3.07Å; F147-C150 PolarHBondContact O-N 3.39Å; F147-V151 WeakPolarHBondContact O-CG2 3.42Å; F147-V151 PolarHBondContact O-N 3.35Å
148M95.1Very high95.2Very high0 Ų035.2 Ų35.20%018%0.175CC..Hα-helixtrans-60.3-45.2178.1-167.968.9-130.200111.6I23 Y27 L45 M125 N144 G145 M146 V151 Q152I23-M148 HydrophobicContact CD1-CE 4.28Å; Y27-M148 HydrophobicContact CD2-SD 4.36Å; Y27-M148 HydrophobicContact CE2-SD 3.8Å; L45-M148 HydrophobicContact CD1-CB 4.42Å; M125-M148 HydrophobicContact SD-SD 3.81Å; N144-M148 VanDerWaalsContact O-CB 3.28Å; N144-M148 WeakPolarHBondContact O-CB 3.35Å; N144-M148 PolarHBondContact O-N 3.29Å; G145-M148 PolarHBondContact O-N 2.89Å; M146-M148 PolarHBondContact O-N 3.48Å; M148-V151 PolarHBondContact O-N 3.42Å; M148-Q152 HydrophobicContact CE-CG 3.38Å; M148-Q152 VanDerWaalsContact CE-NE2 3.27Å; M148-Q152 HydrophobicContact CG-CG 4.41Å; M148-Q152 VanDerWaalsContact O-CB 3.3Å; M148-Q152 WeakPolarHBondContact O-CB 3.31Å; M148-Q152 WeakPolarHBondContact O-CG 3.15Å; M148-Q152 PolarHBondContact O-N 3.01Å
149I96.8Very high95.2Very high42 Ų4227.3 Ų27.322%0.21515%0.146CC..Hα-helixtrans-59.5-48175.9-73.5163.4000110.7A52 G145 M146 F147 V151 Q152 V153A52-I149 HydrophobicContact CB-CB 4.29Å; A52-I149 HydrophobicContact CB-CG1 3.97Å; A52-I149 HydrophobicContact CB-CG2 3.89Å; G145-I149 WeakPolarHBondContact O-CB 3.17Å; G145-I149 WeakPolarHBondContact O-CD1 3.32Å; G145-I149 VanDerWaalsContact O-CG1 3.22Å; G145-I149 WeakPolarHBondContact O-CG1 3.29Å; G145-I149 PolarHBondContact O-N 3.05Å; M146-I149 HydrophobicContact CE-CD1 3.65Å; M146-I149 PolarHBondContact O-N 3.33Å; F147-I149 PolarHBondContact O-N 3.07Å; I149-V151 PolarHBondContact O-N 2.97Å; I149-Q152 PolarHBondContact O-N 3.41Å; I149-V153 HydrophobicContact CG2-CG2 4.28Å; I149-V153 WeakPolarHBondContact O-CG2 3.36Å; I149-V153 PolarHBondContact O-N 3.11Å
150C96.7Very high95.1Very high46 Ų4626.8 Ų26.831%0.31114%0.142SC..Hα-helixtrans-60.7-45.4179.6-71.40000112.2L117 A121 M146 F147 Q152 V153 G154L117-C150 HydrophobicContact CD1-CB 4.13Å; L117-C150 WeakPolarHBondContact CD2-O 3.22Å; L117-C150 HydrophobicContact CG-CB 4.48Å; L117-C150 WeakPolarHBondContact CG-O 3.32Å; A121-C150 HydrophobicContact CB-CB 3.55Å; M146-C150 PolarHBondContact O-N 3.14Å; M146-C150 PolarHBondContact O-SG 3.5Å; M146-C150 VanDerWaalsContact O-SG 3.35Å; F147-C150 PolarHBondContact O-N 3.39Å; C150-Q152 VanDerWaalsContact C-N 3.29Å; C150-Q152 PolarHBondContact O-N 2.72Å; C150-V153 PolarHBondContact O-N 2.86Å; C150-G154 PolarHBondContact O-N 3.15Å
151V96.6Very high95Very high0 Ų026 Ų260%014%0.139CC..Hα-helixtrans-60.2-41.4176172.70000110.9V19 I23 A121 F122 M125 F147 M148 I149 G154 W155V19-V151 HydrophobicContact CG1-CG1 3.99Å; I23-V151 HydrophobicContact CD1-CG1 3.92Å; A121-V151 HydrophobicContact CB-CG2 3.67Å; F122-V151 HydrophobicContact CB-CG2 4.01Å; M125-V151 HydrophobicContact SD-CG2 4.37Å; F147-V151 WeakPolarHBondContact O-CG2 3.42Å; F147-V151 PolarHBondContact O-N 3.35Å; M148-V151 PolarHBondContact O-N 3.42Å; I149-V151 PolarHBondContact O-N 2.97Å; V151-G154 PolarHBondContact O-N 3.42Å; V151-W155 WeakPolarHBondContact O-CB 3.37Å; V151-W155 PolarHBondContact O-N 2.96Å
152Q95.9Very high94.8Very high7 Ų723.5 Ų23.53%0.03313%0.125CC..Hα-helixtrans-72.2-38-177.8-71.2-77.333.900113.7G49 N53 M148 I149 C150 W155 A156G49-Q152 VanDerWaalsContact O-CB 3.27Å; G49-Q152 WeakPolarHBondContact O-CB 3.08Å; G49-Q152 VanDerWaalsContact O-CG 3.3Å; G49-Q152 WeakPolarHBondContact O-CG 3.45Å; N53-Q152 HydrophobicContact CB-CB 3.99Å; N53-Q152 PolarHBondContact ND2-OE1 3.39Å; M148-Q152 HydrophobicContact CE-CG 3.38Å; M148-Q152 VanDerWaalsContact CE-NE2 3.27Å; M148-Q152 HydrophobicContact CG-CG 4.41Å; M148-Q152 VanDerWaalsContact O-CB 3.3Å; M148-Q152 WeakPolarHBondContact O-CB 3.31Å; M148-Q152 WeakPolarHBondContact O-CG 3.15Å; M148-Q152 PolarHBondContact O-N 3.01Å; I149-Q152 PolarHBondContact O-N 3.41Å; C150-Q152 VanDerWaalsContact C-N 3.29Å; C150-Q152 PolarHBondContact O-N 2.72Å; Q152-W155 WeakPolarHBondContact O-CB 3.45Å; Q152-W155 PolarHBondContact O-N 3.43Å; Q152-A156 PolarHBondContact O-N 3.46Å; Q152-A156 VanDerWaalsContact O-N 3.09Å
153V96.3Very high94.5Very high48 Ų4819.2 Ų19.229%0.29110%0.103SC..Hα-helixtrans-65.9-42.5171.6172.80000110.1A52 A56 L117 I149 C150 W155 A156 A157A52-V153 HydrophobicContact CB-CG2 4.45Å; A56-V153 HydrophobicContact CB-CG1 4.48Å; A56-V153 HydrophobicContact CB-CG2 4.34Å; L117-V153 HydrophobicContact CD2-CB 4.14Å; L117-V153 HydrophobicContact CD2-CG1 3.99Å; I149-V153 HydrophobicContact CG2-CG2 4.28Å; I149-V153 WeakPolarHBondContact O-CG2 3.36Å; I149-V153 PolarHBondContact O-N 3.11Å; C150-V153 PolarHBondContact O-N 2.86Å; V153-W155 VanDerWaalsContact C-N 3.29Å; V153-W155 PolarHBondContact O-N 3.46Å; V153-A156 PolarHBondContact O-N 2.91Å; V153-A157 WeakPolarHBondContact O-CB 3.23Å; V153-A157 PolarHBondContact O-N 2.92Å
154G96.3Very high94.1Very high0 Ų016.8 Ų16.80%09%0.091CC..Hα-helixtrans-59.2-42174.800000112G114 M118 C150 V151 A157 V158G114-G154 WeakPolarHBondContact CA-O 3.25Å; M118-G154 VanDerWaalsContact SD-C 3.59Å; C150-G154 PolarHBondContact O-N 3.15Å; V151-G154 PolarHBondContact O-N 3.42Å; G154-A157 PolarHBondContact O-N 3.35Å; G154-V158 WeakPolarHBondContact O-CG2 3.42Å; G154-V158 PolarHBondContact O-N 2.92Å
155W95.2Very high93.8Very high18 Ų1816.9 Ų16.97%0.0689%0.091CC..Hα-helixtrans-58.1-50.5174.8-175.6-67.8000112.9K16 S20 M118 V151 Q152 V153 A157 V158 Q159K16-W155 HydrophobicContact CD-CD2 3.94Å; K16-W155 HydrophobicContact CD-CG 4.18Å; K16-W155 HydrophobicContact CD-CZ2 4.26Å; K16-W155 HydrophobicContact CG-CB 4.49Å; K16-W155 HydrophobicContact CG-CD2 3.39Å; K16-W155 HydrophobicContact CG-CE3 3.71Å; K16-W155 HydrophobicContact CG-CG 3.77Å; K16-W155 HydrophobicContact CG-CZ2 4.27Å; K16-W155 HydrophobicContact CG-CZ3 4.36Å; K16-W155 VanDerWaalsContact NZ-CZ2 3.34Å; K16-W155 WeakPolarHBondContact O-CZ3 3.49Å; S20-W155 VanDerWaalsContact CA-CH2 3.47Å; S20-W155 VanDerWaalsContact CB-CZ3 3.49Å; S20-W155 WeakPolarHBondContact OG-CH2 3.32Å; M118-W155 HydrophobicContact CE-CE3 4.25Å; M118-W155 HydrophobicContact SD-CB 4.38Å; M118-W155 PolarHBondContact SD-N 2.84Å; V151-W155 WeakPolarHBondContact O-CB 3.37Å; V151-W155 PolarHBondContact O-N 2.96Å; Q152-W155 WeakPolarHBondContact O-CB 3.45Å; Q152-W155 PolarHBondContact O-N 3.43Å; V153-W155 VanDerWaalsContact C-N 3.29Å; V153-W155 PolarHBondContact O-N 3.46Å; W155-A157 VanDerWaalsContact C-N 3.25Å; W155-A157 PolarHBondContact O-N 3.09Å; W155-V158 PolarHBondContact O-N 2.93Å; W155-Q159 WeakPolarHBondContact O-CB 2.9Å; W155-Q159 PolarHBondContact O-N 3Å
156A95.3Very high93.3Very high0 Ų017.3 Ų17.30%09%0.091CC..Hα-helixtrans-58.7-40.3177.600000111.3A56 T57 I60 Q152 V153 V158 Q159 I160A56-A156 HydrophobicContact CB-CB 3.74Å; T57-A156 HydrophobicContact CG2-CB 3.8Å; I60-A156 HydrophobicContact CD1-CB 3.89Å; Q152-A156 PolarHBondContact O-N 3.46Å; Q152-A156 VanDerWaalsContact O-N 3.09Å; V153-A156 PolarHBondContact O-N 2.91Å; A156-V158 PolarHBondContact O-N 3.35Å; A156-Q159 PolarHBondContact O-N 3.28Å; A156-I160 WeakPolarHBondContact O-CG1 2.87Å; A156-I160 PolarHBondContact O-N 2.93Å; A156-I160 VanDerWaalsContact O-N 3.14Å
157A94.5Very high92.5Very high7 Ų713 Ų136%0.0587%0.07CC..Hα-helixtrans-68-28.7178.800000114.3I60 H111 G114 V153 G154 W155 P161I60-A157 HydrophobicContact CD1-CB 3.83Å; H111-A157 WeakPolarHBondContact CA-O 3.16Å; G114-A157 VanDerWaalsContact CA-CB 3.46Å; V153-A157 WeakPolarHBondContact O-CB 3.23Å; V153-A157 PolarHBondContact O-N 2.92Å; G154-A157 PolarHBondContact O-N 3.35Å; W155-A157 VanDerWaalsContact C-N 3.25Å; W155-A157 PolarHBondContact O-N 3.09Å; A157-P161 WeakPolarHBondContact O-CD 3.49Å; A157-P161 WeakPolarHBondContact O-CG 3.36Å
158V95.2Very high91.6Very high0 Ų014.8 Ų14.80%08%0.082CC..Hα-helixtrans-79.2-47.7171.4175.90000110.7K16 H111 M118 G154 W155 A156 H162K16-V158 HydrophobicContact CB-CB 4.23Å; K16-V158 HydrophobicContact CB-CG1 3.8Å; K16-V158 HydrophobicContact CG-CG1 4.46Å; H111-V158 PolarHBondContact CD2-O 3.34Å; M118-V158 HydrophobicContact SD-CG2 4.14Å; G154-V158 WeakPolarHBondContact O-CG2 3.42Å; G154-V158 PolarHBondContact O-N 2.92Å; W155-V158 PolarHBondContact O-N 2.93Å; A156-V158 PolarHBondContact O-N 3.35Å; V158-H162 WeakPolarHBondContact O-CB 3.22Å; V158-H162 PolarHBondContact O-N 3.43Å
159Q93.6Very high91Very high14 Ų1416.6 Ų16.67%0.0659%0.092CC..Hα-helixtrans-66.6-52-169.5-177.5176.3-51.200113.5K16 W155 A156 H162 L163 S507K16-Q159 HydrophobicContact CD-CB 4.01Å; W155-Q159 WeakPolarHBondContact O-CB 2.9Å; W155-Q159 PolarHBondContact O-N 3Å; A156-Q159 PolarHBondContact O-N 3.28Å; Q159-H162 PolarHBondContact O-N 2.78Å; Q159-L163 HydrophobicContact CG-CD1 3.85Å; Q159-L163 HydrophobicContact CG-CG 4.47Å; Q159-L163 WeakPolarHBondContact O-CB 3.48Å; Q159-L163 WeakPolarHBondContact O-CG 3.23Å; Q159-L163 PolarHBondContact O-N 3.33Å; Q159-S507 PolarHBondContact NE2-OG 3.41Å
160I92.3Very high90.3Very high0 Ų015.1 Ų15.10%08%0.084CC..Hα-helixtrans-69.4-46.1-169.5-56.7-58.1000112.3T57 I60 A156 H162 L163 S164 A500T57-I160 HydrophobicContact CG2-CD1 4.16Å; T57-I160 HydrophobicContact CG2-CG1 4.13Å; I60-I160 HydrophobicContact CG2-CB 4.37Å; A156-I160 WeakPolarHBondContact O-CG1 2.87Å; A156-I160 PolarHBondContact O-N 2.93Å; A156-I160 VanDerWaalsContact O-N 3.14Å; I160-H162 PolarHBondContact O-N 3.44Å; I160-L163 PolarHBondContact O-N 3.11Å; I160-S164 PolarHBondContact O-N 3.08Å; I160-S164 VanDerWaalsContact O-N 3.09Å; I160-S164 PolarHBondContact O-OG 3.43Å; I160-A500 HydrophobicContact CG2-CB 4.24Å
161P91.3Very high89.3Confident0 Ų017.7 Ų17.70%010%0.095CC..Hα-helixtrans-63.1-40.1174.2-2336.3000112.5I60 R107 W110 H111 A157 L163 S164 I165I60-P161 HydrophobicContact CG2-CG 4.01Å; R107-P161 HydrophobicContact CB-CB 4.07Å; R107-P161 VanDerWaalsContact O-CB 3.27Å; R107-P161 WeakPolarHBondContact O-CB 3.23Å; W110-P161 HydrophobicContact CB-CB 4.46Å; W110-P161 HydrophobicContact CB-CG 3.7Å; H111-P161 HydrophobicContact CB-CB 4.44Å; A157-P161 WeakPolarHBondContact O-CD 3.49Å; A157-P161 WeakPolarHBondContact O-CG 3.36Å; P161-L163 PolarHBondContact O-N 3Å; P161-S164 WeakPolarHBondContact CA-OG 3.14Å; P161-S164 PolarHBondContact O-N 3.12Å; P161-S164 PolarHBondContact O-OG 3.39Å; P161-I165 WeakPolarHBondContact O-CD1 3.33Å; P161-I165 WeakPolarHBondContact O-CG1 3.22Å; P161-I165 PolarHBondContact O-N 3.33Å
162H91.8Very high88.4Confident0 Ų024.1 Ų24.10%013%0.125CC..Hα-helixtrans-61.9-44.3178.5-176.8-88.5000112.7Y9 V158 Q159 I160 S164 F296Y9-H162 AromaticContact CE1-CE1 3.92Å; Y9-H162 AromaticContact CE2-CE1 3.86Å; Y9-H162 AromaticContact CE2-NE2 3.74Å; Y9-H162 WeakPolarHBondContact CE2-O 3.42Å; Y9-H162 AromaticContact CZ-CE1 3.52Å; Y9-H162 AromaticContact CZ-NE2 3.87Å; Y9-H162 PolarHBondContact O-NE2 3.01Å; Y9-H162 PolarHBondContact OH-O 3.43Å; V158-H162 WeakPolarHBondContact O-CB 3.22Å; V158-H162 PolarHBondContact O-N 3.43Å; Q159-H162 PolarHBondContact O-N 2.78Å; I160-H162 PolarHBondContact O-N 3.44Å; H162-S164 PolarHBondContact O-N 3.04Å; H162-F296 AromaticContact CD2-CE2 3.85Å
163L88Confident87.3Confident13 Ų1328.9 Ų28.97%0.06815%0.147CC..Hα-helixtrans-65.6-36176.6-74.3174.1000112.5Q159 I160 P161 I166 L484Q159-L163 HydrophobicContact CG-CD1 3.85Å; Q159-L163 HydrophobicContact CG-CG 4.47Å; Q159-L163 WeakPolarHBondContact O-CB 3.48Å; Q159-L163 WeakPolarHBondContact O-CG 3.23Å; Q159-L163 PolarHBondContact O-N 3.33Å; I160-L163 PolarHBondContact O-N 3.11Å; P161-L163 PolarHBondContact O-N 3Å; L163-I166 WeakPolarHBondContact O-CG2 3.31Å; L163-L484 HydrophobicContact CD2-CD1 4.47Å
164S85.9Confident86.2Confident0 Ų033 Ų330%017%0.168CC..Hα-helixtrans-75.4-33.9-179.960.30000113.4R107 I160 P161 H162 I166 N167 A500R107-S164 WeakPolarHBondContact CD-OG 3.41Å; R107-S164 PolarHBondContact NE-OG 3.22Å; R107-S164 VanDerWaalsContact NH1-C 3.35Å; R107-S164 PolarHBondContact NH1-O 3.41Å; I160-S164 PolarHBondContact O-N 3.08Å; I160-S164 VanDerWaalsContact O-N 3.09Å; I160-S164 PolarHBondContact O-OG 3.43Å; P161-S164 WeakPolarHBondContact CA-OG 3.14Å; P161-S164 PolarHBondContact O-N 3.12Å; P161-S164 PolarHBondContact O-OG 3.39Å; H162-S164 PolarHBondContact O-N 3.04Å; S164-I166 PolarHBondContact O-N 3.08Å; S164-I166 VanDerWaalsContact O-N 3.13Å; S164-N167 PolarHBondContact O-N 2.73Å; S164-N167 VanDerWaalsContact O-N 3.09Å; S164-A500 VanDerWaalsContact CB-CB 3.46Å
165I86.1Confident85.5Confident2 Ų234 Ų341%0.0117%0.172CC..Hα-helixtrans-55.6-30.5177-74.7165.4000112Y9 R107 P161 N167 D168 L169 F296Y9-I165 HydrophobicContact CD2-CG2 4.14Å; Y9-I165 HydrophobicContact CE2-CB 4.27Å; Y9-I165 HydrophobicContact CE2-CG2 3.96Å; R107-I165 HydrophobicContact CB-CD1 3.79Å; R107-I165 HydrophobicContact CB-CG1 3.68Å; R107-I165 HydrophobicContact CG-CG1 4.38Å; P161-I165 WeakPolarHBondContact O-CD1 3.33Å; P161-I165 WeakPolarHBondContact O-CG1 3.22Å; P161-I165 PolarHBondContact O-N 3.33Å; I165-N167 PolarHBondContact O-N 2.87Å; I165-N167 VanDerWaalsContact O-N 3.15Å; I165-D168 PolarHBondContact O-N 2.95Å; I165-L169 HydrophobicContact CG2-CD1 3.62Å; I165-L169 HydrophobicContact CG2-CD2 4.47Å; I165-L169 HydrophobicContact CG2-CG 3.78Å; I165-L169 WeakPolarHBondContact O-CG 3.24Å; I165-L169 PolarHBondContact O-N 3.15Å; I165-F296 HydrophobicContact CD1-CZ 3.9Å
166I84.8Confident84.7Confident17 Ų1734 Ų349%0.08717%0.172CC..Hα-helixtrans-55.1-36.1178.8-153.5173.1000112.6Y9 L163 S164 D168 R176 L179 A180Y9-I166 HydrophobicContact CE1-CD1 4.22Å; Y9-I166 HydrophobicContact CE1-CG1 4.13Å; Y9-I166 WeakPolarHBondContact OH-CB 3.33Å; L163-I166 WeakPolarHBondContact O-CG2 3.31Å; S164-I166 PolarHBondContact O-N 3.08Å; S164-I166 VanDerWaalsContact O-N 3.13Å; I166-D168 VanDerWaalsContact C-N 3.34Å; I166-R176 WeakPolarHBondContact CD1-O 3.32Å; I166-L179 HydrophobicContact CD1-CB 3.81Å; I166-L179 HydrophobicContact CG1-CB 3.86Å; I166-L179 HydrophobicContact CG1-CD1 4.07Å; I166-A180 HydrophobicContact CD1-CB 4.07Å
167N78.5Confident83.6Confident8 Ų837.4 Ų37.44%0.04319%0.193CC..Hα-helixtrans-79.9-21.7-175-62.3-50.6000111.9S164 I165 R176 V496 A499S164-N167 PolarHBondContact O-N 2.73Å; S164-N167 VanDerWaalsContact O-N 3.09Å; I165-N167 PolarHBondContact O-N 2.87Å; I165-N167 VanDerWaalsContact O-N 3.15Å; N167-R176 PolarHBondContact O-NH2 3.07Å; N167-R176 PolarHBondContact OD1-NH1 3.29Å; N167-V496 HydrophobicContact CB-CB 4.19Å; N167-V496 HydrophobicContact CB-CG1 3.44Å; N167-V496 VanDerWaalsContact CB-CG1 3.44Å; N167-V496 HydrophobicContact CB-CG2 4.02Å; N167-A499 VanDerWaalsContact ND2-CB 3.31Å; N167-A499 WeakPolarHBondContact ND2-CB 3.46Å
168D78Confident83Confident88 Ų8839.2 Ų39.247%0.47120%0.201SC..Hα-helixtrans-86.8-27.1175-64.8-2.9000112.2R107 I165 I166R107-D168 IonicContact CZ-OD1 3.9Å; R107-D168 IonicContact CZ-OD2 3.81Å; R107-D168 IonicContact NE-OD2 3.74Å; R107-D168 IonicContact NH1-OD1 3.13Å; R107-D168 PolarHBondContact NH1-OD1 3.42Å; R107-D168 IonicContact NH1-OD2 2.88Å; R107-D168 PolarHBondContact NH1-OD2 3.37Å; I165-D168 PolarHBondContact O-N 2.95Å; I166-D168 VanDerWaalsContact C-N 3.34Å
169L82.2Confident82.5Confident39 Ų3939.2 Ų39.220%0.20420%0.201CC..Hα-helixtrans-73.8-30.6-176.9-75.1174.3000113.1M1 Y9 I165 L179 V300M1-L169 HydrophobicContact SD-CB 4.34Å; M1-L169 HydrophobicContact SD-CD1 4.43Å; M1-L169 HydrophobicContact SD-CD2 4.03Å; Y9-L169 HydrophobicContact CD2-CD1 3.47Å; Y9-L169 VanDerWaalsContact CD2-CD1 3.47Å; Y9-L169 HydrophobicContact CE2-CD1 4.05Å; Y9-L169 HydrophobicContact CG-CD1 3.93Å; I165-L169 HydrophobicContact CG2-CD1 3.62Å; I165-L169 HydrophobicContact CG2-CD2 4.47Å; I165-L169 HydrophobicContact CG2-CG 3.78Å; I165-L169 WeakPolarHBondContact O-CG 3.24Å; I165-L169 PolarHBondContact O-N 3.15Å; L169-L179 HydrophobicContact CB-CD1 4.39Å; L169-L179 HydrophobicContact CD1-CD1 4.45Å; L169-V300 HydrophobicContact CD1-CG1 4.3Å; L169-V300 HydrophobicContact CD2-CG1 3.95Å
170T82.5Confident81.8Confident10 Ų1039.6 Ų39.66%0.06121%0.207CC..  trans-154.3139.8-178.4-174.20000112.3Q172 E175 R176 L179T170-Q172 PolarHBondContact OG1-N 2.94Å; T170-E175 WeakPolarHBondContact CB-OE2 3.15Å; T170-E175 HydrophobicContact CG2-CB 3.84Å; T170-E175 HydrophobicContact CG2-CG 3.95Å; T170-E175 PolarHBondContact OG1-OE2 2.93Å; T170-R176 HydrophobicContact CG2-CB 4.47Å; T170-R176 HydrophobicContact CG2-CG 3.57Å; T170-R176 PolarHBondContact O-NE 3.29Å; T170-R176 PolarHBondContact O-NH2 2.97Å; T170-L179 HydrophobicContact CG2-CD1 4.02Å
171D75.1Confident81.2Confident101 Ų10140.8 Ų40.854%0.5422%0.215SC..SBendtrans-89.6-13.9174.1-64-43.4000111.7R176 K306D171-R176 IonicContact OD1-NH2 2.8Å; D171-K306 IonicContact OD1-NZ 2.82Å; D171-K306 PolarHBondContact OD1-NZ 3.36Å; D171-K306 IonicContact OD2-NZ 3.61Å; D171-K306 PolarHBondContact OD2-NZ 3.26Å
172Q77.1Confident80.9Confident135 Ų13541.9 Ų41.963%0.63122%0.221SC*.  trans-82.9126.8-177.5-66.9-176.6-34.800111.8T170 D174 E175 R176T170-Q172 PolarHBondContact OG1-N 2.94Å; Q172-D174 PolarHBondContact O-N 3.45Å; Q172-E175 HydrophobicContact CB-CB 4.26Å; Q172-E175 PolarHBondContact O-N 3.49Å; Q172-R176 PolarHBondContact O-N 3.02Å; Q172-R176 VanDerWaalsContact O-N 3.12Å
173H73Confident80.7Confident107 Ų10742.9 Ų42.950%0.49522%0.224SC..Hα-helixtrans-58.3-44.4-178.1-171.166000112.6E175 R176 V177H173-E175 VanDerWaalsContact C-N 3.33Å; H173-E175 PolarHBondContact O-N 2.89Å; H173-R176 WeakPolarHBondContact O-CB 3.41Å; H173-R176 PolarHBondContact O-N 2.84Å; H173-V177 WeakPolarHBondContact O-CG2 3.45Å; H173-V177 PolarHBondContact O-N 3.01Å
174D72.9Confident80.4Confident134 Ų13444.2 Ų44.272%0.71723%0.229SC*.Hα-helixtrans-62.6-38.1180-63.1-29.3000112.7Q172 V177 L178Q172-D174 PolarHBondContact O-N 3.45Å; D174-V177 PolarHBondContact O-N 3.25Å; D174-L178 WeakPolarHBondContact O-CB 3.21Å; D174-L178 PolarHBondContact O-N 3.38Å
175E81.3Confident80.4Confident21 Ų2147.7 Ų47.710%0.09824%0.244CC..Hα-helixtrans-72.3-33.2178-165.6173.1-149.800111.2M1 K6 T170 Q172 H173 L178 L179M1-E175 WeakPolarHBondContact CB-OE1 3.15Å; M1-E175 PolarHBondContact N-OE1 2.63Å; K6-E175 WeakPolarHBondContact CE-OE1 3.27Å; K6-E175 IonicContact NZ-OE1 3.2Å; K6-E175 PolarHBondContact NZ-OE1 3.43Å; T170-E175 WeakPolarHBondContact CB-OE2 3.15Å; T170-E175 HydrophobicContact CG2-CB 3.84Å; T170-E175 HydrophobicContact CG2-CG 3.95Å; T170-E175 PolarHBondContact OG1-OE2 2.93Å; Q172-E175 HydrophobicContact CB-CB 4.26Å; Q172-E175 PolarHBondContact O-N 3.49Å; H173-E175 VanDerWaalsContact C-N 3.33Å; H173-E175 PolarHBondContact O-N 2.89Å; E175-L178 PolarHBondContact O-N 3.39Å; E175-L179 VanDerWaalsContact O-CG 3.29Å; E175-L179 WeakPolarHBondContact O-CG 3.47Å; E175-L179 PolarHBondContact O-N 2.78Å
176R78.5Confident80.6Confident18 Ų1849 Ų497%0.06825%0.25CC..Hα-helixtrans-63.8-44.7171.2-65.2-173.6-1771792.7111.6I166 N167 T170 D171 Q172 H173 L178 L179 A180I166-R176 WeakPolarHBondContact CD1-O 3.32Å; N167-R176 PolarHBondContact O-NH2 3.07Å; N167-R176 PolarHBondContact OD1-NH1 3.29Å; T170-R176 HydrophobicContact CG2-CB 4.47Å; T170-R176 HydrophobicContact CG2-CG 3.57Å; T170-R176 PolarHBondContact O-NE 3.29Å; T170-R176 PolarHBondContact O-NH2 2.97Å; D171-R176 IonicContact OD1-NH2 2.8Å; Q172-R176 PolarHBondContact O-N 3.02Å; Q172-R176 VanDerWaalsContact O-N 3.12Å; H173-R176 WeakPolarHBondContact O-CB 3.41Å; H173-R176 PolarHBondContact O-N 2.84Å; R176-L178 VanDerWaalsContact C-N 3.33Å; R176-L178 PolarHBondContact O-N 3.18Å; R176-L179 PolarHBondContact O-N 2.9Å; R176-A180 WeakPolarHBondContact O-CB 3.35Å; R176-A180 PolarHBondContact O-N 2.93Å
177V73.4Confident80.7Confident71 Ų7149 Ų4943%0.4325%0.251SS..Hα-helixtrans-61.9-42.9176.51750000110.6H173 D174 A180 S181H173-V177 WeakPolarHBondContact O-CG2 3.45Å; H173-V177 PolarHBondContact O-N 3.01Å; D174-V177 PolarHBondContact O-N 3.25Å; V177-A180 PolarHBondContact O-N 3.26Å; V177-S181 PolarHBondContact O-N 3.11Å
178L81.8Confident81.1Confident46 Ų4649 Ų4924%0.24125%0.254CS..Hα-helixtrans-59.2-48.1174.4178.366.9000111.7W3 K6 D174 E175 R176 A180 S181 L182W3-L178 HydrophobicContact CH2-CD2 4.35Å; K6-L178 HydrophobicContact CD-CD2 3.97Å; D174-L178 WeakPolarHBondContact O-CB 3.21Å; D174-L178 PolarHBondContact O-N 3.38Å; E175-L178 PolarHBondContact O-N 3.39Å; R176-L178 VanDerWaalsContact C-N 3.33Å; R176-L178 PolarHBondContact O-N 3.18Å; L178-A180 VanDerWaalsContact C-N 3.35Å; L178-A180 PolarHBondContact O-N 3.25Å; L178-S181 PolarHBondContact O-N 3.3Å; L178-S181 VanDerWaalsContact O-N 3.16Å; L178-S181 PolarHBondContact O-OG 3.27Å; L178-L182 HydrophobicContact CG-CD1 4.32Å; L178-L182 PolarHBondContact O-N 3.28Å
179L85.4Confident81.7Confident0 Ų047.3 Ų47.30%024%0.244CC..Hα-helixtrans-63.4-39.8178.9-72173.8000112.4M1 K6 Y9 I166 L169 T170 E175 R176 S181 L182 R183M1-L179 HydrophobicContact CE-CD1 3.94Å; M1-L179 HydrophobicContact CE-CD2 3.53Å; M1-L179 HydrophobicContact CE-CG 4.29Å; K6-L179 HydrophobicContact CB-CD2 3.98Å; K6-L179 HydrophobicContact CG-CD2 4.06Å; Y9-L179 HydrophobicContact CD1-CB 3.91Å; Y9-L179 HydrophobicContact CD1-CD2 3.76Å; Y9-L179 HydrophobicContact CD1-CG 4.28Å; Y9-L179 HydrophobicContact CE1-CB 3.91Å; Y9-L179 HydrophobicContact CG-CD2 4.25Å; I166-L179 HydrophobicContact CD1-CB 3.81Å; I166-L179 HydrophobicContact CG1-CB 3.86Å; I166-L179 HydrophobicContact CG1-CD1 4.07Å; L169-L179 HydrophobicContact CB-CD1 4.39Å; L169-L179 HydrophobicContact CD1-CD1 4.45Å; T170-L179 HydrophobicContact CG2-CD1 4.02Å; E175-L179 VanDerWaalsContact O-CG 3.29Å; E175-L179 WeakPolarHBondContact O-CG 3.47Å; E175-L179 PolarHBondContact O-N 2.78Å; R176-L179 PolarHBondContact O-N 2.9Å; L179-S181 VanDerWaalsContact C-N 3.3Å; L179-S181 PolarHBondContact O-N 3.36Å; L179-L182 PolarHBondContact O-N 3.45Å; L179-R183 WeakPolarHBondContact O-CB 3.25Å; L179-R183 PolarHBondContact O-N 3.25Å
180A78.8Confident82Confident21 Ų2145.4 Ų45.417%0.17423%0.234CC..Hα-helixtrans-63.7-37.1174.100000111.7I166 R176 V177 L178 R183 Y184I166-A180 HydrophobicContact CD1-CB 4.07Å; R176-A180 WeakPolarHBondContact O-CB 3.35Å; R176-A180 PolarHBondContact O-N 2.93Å; V177-A180 PolarHBondContact O-N 3.26Å; L178-A180 VanDerWaalsContact C-N 3.35Å; L178-A180 PolarHBondContact O-N 3.25Å; A180-R183 WeakPolarHBondContact O-CB 3.28Å; A180-R183 PolarHBondContact O-N 2.88Å; A180-Y184 VanDerWaalsContact O-CD2 3.22Å; A180-Y184 WeakPolarHBondContact O-CD2 3.45Å; A180-Y184 PolarHBondContact O-N 3.24Å
181S78.7Confident82.3Confident25 Ų2546.7 Ų46.718%0.17524%0.241CC..Hα-helixtrans-69.9-41176.375.90000113.2V177 L178 L179 R183 Y184 F185 Q426V177-S181 PolarHBondContact O-N 3.11Å; L178-S181 PolarHBondContact O-N 3.3Å; L178-S181 VanDerWaalsContact O-N 3.16Å; L178-S181 PolarHBondContact O-OG 3.27Å; L179-S181 VanDerWaalsContact C-N 3.3Å; L179-S181 PolarHBondContact O-N 3.36Å; S181-R183 VanDerWaalsContact C-N 3.25Å; S181-R183 PolarHBondContact O-N 2.88Å; S181-Y184 PolarHBondContact O-N 3.05Å; S181-F185 PolarHBondContact O-N 3.35Å; S181-Q426 PolarHBondContact OG-NE2 3.39Å
182L84.6Confident83Confident23 Ų2343.3 Ų43.312%0.1222%0.222CC..Hα-helixtrans-60.8-39175-76.1170.7000110.9W3 K6 L178 L179 Y184 F185 F186W3-L182 HydrophobicContact CZ3-CD1 4.48Å; K6-L182 HydrophobicContact CB-CD1 3.87Å; L178-L182 HydrophobicContact CG-CD1 4.32Å; L178-L182 PolarHBondContact O-N 3.28Å; L179-L182 PolarHBondContact O-N 3.45Å; L182-Y184 PolarHBondContact O-N 3Å; L182-F185 PolarHBondContact O-N 2.81Å; L182-F186 HydrophobicContact CD2-CE2 4.48Å; L182-F186 WeakPolarHBondContact O-CD2 3.48Å; L182-F186 PolarHBondContact O-N 3.39Å
183R87.8Confident83.5Confident21 Ų2138.8 Ų38.88%0.07920%0.204CC..Hα-helixtrans-56.3-48.2174.7-175.1-178.37589.54.5111.9Q13 L179 A180 S181 S187Q13-R183 HydrophobicContact CG-CG 3.75Å; Q13-R183 PolarHBondContact NE2-O 3.42Å; Q13-R183 VanDerWaalsContact NE2-O 3.15Å; L179-R183 WeakPolarHBondContact O-CB 3.25Å; L179-R183 PolarHBondContact O-N 3.25Å; A180-R183 WeakPolarHBondContact O-CB 3.28Å; A180-R183 PolarHBondContact O-N 2.88Å; S181-R183 VanDerWaalsContact C-N 3.25Å; S181-R183 PolarHBondContact O-N 2.88Å; R183-S187 PolarHBondContact O-N 3.12Å
184Y81.4Confident84.2Confident41 Ų4133.8 Ų33.816%0.16118%0.18CC..Hα-helixtrans-68.1-37.8176.5-77.6-68.4000113.5A180 S181 L182 S187 G188 S480 V481 L484A180-Y184 VanDerWaalsContact O-CD2 3.22Å; A180-Y184 WeakPolarHBondContact O-CD2 3.45Å; A180-Y184 PolarHBondContact O-N 3.24Å; S181-Y184 PolarHBondContact O-N 3.05Å; L182-Y184 PolarHBondContact O-N 3Å; Y184-S187 WeakPolarHBondContact O-CB 3.45Å; Y184-S187 PolarHBondContact O-N 2.87Å; Y184-G188 PolarHBondContact O-N 3.41Å; Y184-S480 PolarHBondContact OH-O 3.29Å; Y184-V481 HydrophobicContact CD2-CG2 4.22Å; Y184-V481 HydrophobicContact CE2-CG2 4.12Å; Y184-L484 HydrophobicContact CE2-CD2 3.66Å; Y184-L484 WeakPolarHBondContact OH-CB 3.02Å
185F86.2Confident85Confident74 Ų7427.5 Ų27.533%0.32515%0.147SC..Hα-helixtrans-59-48.8175.8177.3-101.3000111.3S181 L182 G188 I189 L419S181-F185 PolarHBondContact O-N 3.35Å; L182-F185 PolarHBondContact O-N 2.81Å; F185-G188 PolarHBondContact O-N 3.46Å; F185-I189 HydrophobicContact CD1-CD1 3.94Å; F185-I189 HydrophobicContact CE1-CD1 3.42Å; F185-I189 VanDerWaalsContact CE1-CD1 3.42Å; F185-I189 HydrophobicContact CE2-CD1 4.5Å; F185-I189 HydrophobicContact CZ-CD1 3.74Å; F185-I189 PolarHBondContact O-N 3.07Å; F185-I189 VanDerWaalsContact O-N 3.15Å; F185-L419 HydrophobicContact CD2-CD1 3.67Å; F185-L419 HydrophobicContact CE2-CD1 3.94Å; F185-L419 HydrophobicContact CG-CD1 4.46Å
186F89.8Confident85.4Confident28 Ų2830.8 Ų30.812%0.12317%0.165CC..Hα-helixtrans-68.2-32176.1-78.7-67.4000113.3I7 T11 M14 L182 I189 G190I7-F186 HydrophobicContact CG2-CE2 4.23Å; I7-F186 HydrophobicContact CG2-CZ 3.83Å; T11-F186 HydrophobicContact CG2-CD1 3.71Å; T11-F186 HydrophobicContact CG2-CD2 4.22Å; T11-F186 HydrophobicContact CG2-CE1 3.68Å; T11-F186 HydrophobicContact CG2-CE2 4.2Å; T11-F186 HydrophobicContact CG2-CG 4.01Å; T11-F186 HydrophobicContact CG2-CZ 3.95Å; M14-F186 HydrophobicContact CG-CB 3.97Å; M14-F186 HydrophobicContact SD-CB 3.89Å; M14-F186 HydrophobicContact SD-CD1 3.78Å; M14-F186 HydrophobicContact SD-CG 4.19Å; L182-F186 HydrophobicContact CD2-CE2 4.48Å; L182-F186 WeakPolarHBondContact O-CD2 3.48Å; L182-F186 PolarHBondContact O-N 3.39Å; F186-I189 HydrophobicContact CD1-CD1 4.26Å; F186-I189 HydrophobicContact CE1-CD1 4.48Å; F186-I189 PolarHBondContact O-N 3.45Å; F186-G190 PolarHBondContact O-N 2.98Å
187S87.6Confident85.8Confident17 Ų1731.1 Ų31.112%0.11917%0.169CC..Hα-helixtrans-58.3-48170.4-170.40000111.3D17 R183 Y184 I189 G190 D191D17-S187 WeakPolarHBondContact OD2-CA 3.36Å; D17-S187 VanDerWaalsContact OD2-CB 3.28Å; D17-S187 WeakPolarHBondContact OD2-CB 3.38Å; D17-S187 PolarHBondContact OD2-OG 3.45Å; R183-S187 PolarHBondContact O-N 3.12Å; Y184-S187 WeakPolarHBondContact O-CB 3.45Å; Y184-S187 PolarHBondContact O-N 2.87Å; S187-I189 VanDerWaalsContact C-N 3.32Å; S187-I189 PolarHBondContact O-N 2.91Å; S187-G190 WeakPolarHBondContact O-CA 3.48Å; S187-G190 PolarHBondContact O-N 2.64Å; S187-D191 PolarHBondContact O-N 3.12Å
188G87.4Confident86.5Confident9 Ų927.8 Ų27.89%0.09315%0.148CC..Hα-helixtrans-62.2-38.6178.900000112.5Y184 F185 G190 M192Y184-G188 PolarHBondContact O-N 3.41Å; F185-G188 PolarHBondContact O-N 3.46Å; G188-G190 VanDerWaalsContact C-N 3.33Å; G188-M192 WeakPolarHBondContact O-CB 3.37Å; G188-M192 WeakPolarHBondContact O-CG 3.47Å; G188-M192 PolarHBondContact O-N 3.4Å
189I90.6Very high86.7Confident52 Ų5229.2 Ų29.227%0.26715%0.151SC..Hα-helixtrans-64.1-39.1172.5-66.4171.7000111.5M14 F185 F186 S187 M192 T193M14-I189 HydrophobicContact CE-CG2 4.24Å; F185-I189 HydrophobicContact CD1-CD1 3.94Å; F185-I189 HydrophobicContact CE1-CD1 3.42Å; F185-I189 VanDerWaalsContact CE1-CD1 3.42Å; F185-I189 HydrophobicContact CE2-CD1 4.5Å; F185-I189 HydrophobicContact CZ-CD1 3.74Å; F185-I189 PolarHBondContact O-N 3.07Å; F185-I189 VanDerWaalsContact O-N 3.15Å; F186-I189 HydrophobicContact CD1-CD1 4.26Å; F186-I189 HydrophobicContact CE1-CD1 4.48Å; F186-I189 PolarHBondContact O-N 3.45Å; S187-I189 VanDerWaalsContact C-N 3.32Å; S187-I189 PolarHBondContact O-N 2.91Å; I189-M192 WeakPolarHBondContact O-CB 3.48Å; I189-T193 WeakPolarHBondContact O-CB 3.37Å; I189-T193 PolarHBondContact O-N 3.41Å; I189-T193 PolarHBondContact O-OG1 3.3Å
190G89.2Confident86.8Confident0 Ų034.2 Ų34.20%018%0.177CC..Hα-helixtrans-59-58.7174.700000111.1L18 F186 S187 G188 M192 T193 T194L18-G190 WeakPolarHBondContact CD2-O 3.21Å; F186-G190 PolarHBondContact O-N 2.98Å; S187-G190 WeakPolarHBondContact O-CA 3.48Å; S187-G190 PolarHBondContact O-N 2.64Å; G188-G190 VanDerWaalsContact C-N 3.33Å; G190-M192 PolarHBondContact O-N 2.94Å; G190-T193 WeakPolarHBondContact O-CB 3.34Å; G190-T193 PolarHBondContact O-N 2.95Å; G190-T194 PolarHBondContact O-N 3.48Å
191D86.8Confident87.1Confident37 Ų3736.2 Ų36.220%0.19818%0.182CC..Hα-helixtrans-56.6-39.8-178.5-66.2-28.8000111.9S187 T193 T194 L195 T415S187-D191 PolarHBondContact O-N 3.12Å; D191-T193 PolarHBondContact O-N 3.42Å; D191-T194 PolarHBondContact O-N 3.39Å; D191-L195 WeakPolarHBondContact O-CB 3.46Å; D191-L195 WeakPolarHBondContact O-CD1 3.36Å; D191-L195 WeakPolarHBondContact O-CG 3.34Å; D191-L195 PolarHBondContact O-N 3.18Å; D191-T415 HydrophobicContact CB-CG2 3.62Å
192M89.9Confident87.2Confident30 Ų3035.4 Ų35.415%0.14818%0.176CC..Hα-helixtrans-55.9-49.8171.8-82.9-64.8165.500113.7G188 I189 G190 T194 L195 L196 L412 T415 I416G188-M192 WeakPolarHBondContact O-CB 3.37Å; G188-M192 WeakPolarHBondContact O-CG 3.47Å; G188-M192 PolarHBondContact O-N 3.4Å; I189-M192 WeakPolarHBondContact O-CB 3.48Å; G190-M192 PolarHBondContact O-N 2.94Å; M192-T194 VanDerWaalsContact C-N 3.32Å; M192-T194 PolarHBondContact O-N 3.33Å; M192-L195 PolarHBondContact O-N 2.96Å; M192-L196 VanDerWaalsContact O-CB 3.28Å; M192-L196 WeakPolarHBondContact O-CB 3.4Å; M192-L196 PolarHBondContact O-N 3.27Å; M192-L412 HydrophobicContact SD-CD1 3.48Å; M192-L412 WeakPolarHBondContact SD-CD1 3.2Å; M192-L412 HydrophobicContact SD-CG 4.43Å; M192-T415 VanDerWaalsContact CE-CB 3.43Å; M192-T415 HydrophobicContact CE-CG2 3.56Å; M192-T415 VanDerWaalsContact CE-O 3.3Å; M192-T415 WeakPolarHBondContact CE-O 3.48Å; M192-T415 HydrophobicContact CG-CG2 3.93Å; M192-T415 HydrophobicContact SD-CG2 4.23Å; M192-I416 HydrophobicContact CE-CB 3.65Å; M192-I416 HydrophobicContact CE-CD1 4.46Å; M192-I416 HydrophobicContact CE-CG1 3.12Å; M192-I416 HydrophobicContact SD-CG1 3.89Å
193T88Confident87Confident40 Ų4037.2 Ų37.225%0.24518%0.183CC..Hα-helixtrans-64.3-43.3-175.7-56.10000109.7I189 G190 D191 L195 L196 V197 I288I189-T193 WeakPolarHBondContact O-CB 3.37Å; I189-T193 PolarHBondContact O-N 3.41Å; I189-T193 PolarHBondContact O-OG1 3.3Å; G190-T193 WeakPolarHBondContact O-CB 3.34Å; G190-T193 PolarHBondContact O-N 2.95Å; D191-T193 PolarHBondContact O-N 3.42Å; T193-L195 PolarHBondContact O-N 3.16Å; T193-L196 PolarHBondContact O-N 3.05Å; T193-V197 HydrophobicContact CG2-CG2 4.38Å; T193-V197 WeakPolarHBondContact O-CB 3.46Å; T193-V197 WeakPolarHBondContact O-CG2 3.4Å; T193-V197 PolarHBondContact O-N 3.11Å; T193-I288 HydrophobicContact CG2-CD1 3.7Å
194T87.8Confident86.6Confident1 Ų140.2 Ų40.21%0.00621%0.207CC..Hα-helixtrans-57-49.5174.3-67.60000111.7L18 V22 G190 D191 M192 T198 V285L18-T194 VanDerWaalsContact CD2-OG1 3.23Å; L18-T194 WeakPolarHBondContact CD2-OG1 3.49Å; L18-T194 PolarHBondContact O-OG1 2.96Å; V22-T194 HydrophobicContact CB-CG2 4.44Å; V22-T194 HydrophobicContact CG2-CG2 3.32Å; G190-T194 PolarHBondContact O-N 3.48Å; D191-T194 PolarHBondContact O-N 3.39Å; M192-T194 VanDerWaalsContact C-N 3.32Å; M192-T194 PolarHBondContact O-N 3.33Å; T194-T198 WeakPolarHBondContact O-CB 3.34Å; T194-T198 PolarHBondContact O-N 3.16Å; T194-T198 PolarHBondContact O-OG1 3.16Å; T194-V285 HydrophobicContact CG2-CG2 4.03Å
195L89.9Confident86.3Confident3 Ų341.9 Ų41.92%0.01622%0.216CC..Hα-helixtrans-66.1-44.5-178.2-78.7163.7000111.9I25 D191 M192 T193 T198 Y199 V408 P411 L412 T415I25-L195 HydrophobicContact CD1-CD1 4.31Å; I25-L195 HydrophobicContact CD1-CD2 3.23Å; I25-L195 HydrophobicContact CD1-CG 3.76Å; I25-L195 HydrophobicContact CG1-CD2 4.28Å; D191-L195 WeakPolarHBondContact O-CB 3.46Å; D191-L195 WeakPolarHBondContact O-CD1 3.36Å; D191-L195 WeakPolarHBondContact O-CG 3.34Å; D191-L195 PolarHBondContact O-N 3.18Å; M192-L195 PolarHBondContact O-N 2.96Å; T193-L195 PolarHBondContact O-N 3.16Å; L195-T198 PolarHBondContact O-N 3Å; L195-Y199 WeakPolarHBondContact O-CB 3.47Å; L195-Y199 PolarHBondContact O-N 3.43Å; L195-V408 HydrophobicContact CB-CG1 4.32Å; L195-V408 HydrophobicContact CD2-CG1 3.68Å; L195-V408 WeakPolarHBondContact O-CG1 3.43Å; L195-P411 HydrophobicContact CD1-CB 4.22Å; L195-P411 HydrophobicContact CD2-CB 3.91Å; L195-L412 HydrophobicContact CB-CB 4.3Å; L195-L412 HydrophobicContact CB-CD1 3.66Å; L195-T415 VanDerWaalsContact CD1-OG1 3.25Å; L195-T415 WeakPolarHBondContact CD1-OG1 3.22Å
196L89.7Confident85.6Confident90 Ų9042.2 Ų42.247%0.47122%0.218SC..Hα-helixtrans-63.2-47.5178-179.362.5000111.6M192 T193 T198 Y199 L200M192-L196 VanDerWaalsContact O-CB 3.28Å; M192-L196 WeakPolarHBondContact O-CB 3.4Å; M192-L196 PolarHBondContact O-N 3.27Å; T193-L196 PolarHBondContact O-N 3.05Å; L196-T198 VanDerWaalsContact C-N 3.29Å; L196-T198 PolarHBondContact O-N 2.87Å; L196-Y199 PolarHBondContact O-N 3.4Å; L196-L200 HydrophobicContact CD1-CG 4.48Å; L196-L200 HydrophobicContact CG-CD1 4.37Å; L196-L200 WeakPolarHBondContact O-CG 3.38Å; L196-L200 PolarHBondContact O-N 3.44Å
197V88Confident84.9Confident25 Ų2543.6 Ų43.615%0.15223%0.231CC..Hα-helixtrans-55.6-49.7175.3167.60000109.5T193 Y199 L200 F201 I284T193-V197 HydrophobicContact CG2-CG2 4.38Å; T193-V197 WeakPolarHBondContact O-CB 3.46Å; T193-V197 WeakPolarHBondContact O-CG2 3.4Å; T193-V197 PolarHBondContact O-N 3.11Å; V197-Y199 VanDerWaalsContact C-N 3.34Å; V197-Y199 PolarHBondContact O-N 3.15Å; V197-L200 PolarHBondContact O-N 3.24Å; V197-F201 HydrophobicContact CG1-CD2 3.98Å; V197-F201 HydrophobicContact CG1-CE2 3.96Å; V197-F201 VanDerWaalsContact O-CD2 3.31Å; V197-F201 WeakPolarHBondContact O-CD2 3.27Å; V197-F201 PolarHBondContact O-N 2.88Å; V197-I284 HydrophobicContact CG1-CB 4.39Å; V197-I284 HydrophobicContact CG1-CD1 4.13Å; V197-I284 HydrophobicContact CG1-CG2 3.94Å; V197-I284 HydrophobicContact CG2-CG2 4.21Å
198T86.3Confident84.3Confident1 Ų144.4 Ų44.41%0.00624%0.242CC..Hα-helixtrans-65.5-38.1-177-47.30000112.5F26 T194 L195 L196 L200 F201 F202 V281 V408F26-T198 HydrophobicContact CE1-CG2 4.24Å; F26-T198 HydrophobicContact CE2-CG2 3.69Å; F26-T198 HydrophobicContact CZ-CG2 3.27Å; T194-T198 WeakPolarHBondContact O-CB 3.34Å; T194-T198 PolarHBondContact O-N 3.16Å; T194-T198 PolarHBondContact O-OG1 3.16Å; L195-T198 PolarHBondContact O-N 3Å; L196-T198 VanDerWaalsContact C-N 3.29Å; L196-T198 PolarHBondContact O-N 2.87Å; T198-L200 PolarHBondContact O-N 3.49Å; T198-F201 PolarHBondContact O-N 3Å; T198-F202 HydrophobicContact CG2-CD2 3.73Å; T198-F202 HydrophobicContact CG2-CE2 3.52Å; T198-F202 WeakPolarHBondContact O-CD2 3.48Å; T198-F202 PolarHBondContact O-N 3.21Å; T198-F202 VanDerWaalsContact O-N 3.11Å; T198-V281 HydrophobicContact CG2-CG2 3.97Å; T198-V281 VanDerWaalsContact OG1-CG1 3.31Å; T198-V281 WeakPolarHBondContact OG1-CG1 3.35Å; T198-V408 HydrophobicContact CG2-CG2 4.15Å
199Y87.5Confident83.4Confident76 Ų7649 Ų4930%0.29826%0.264SS..Hα-helixtrans-60.4-45.8176177.5-99.9000111.4L195 L196 V197 F201 F202 E203 S405L195-Y199 WeakPolarHBondContact O-CB 3.47Å; L195-Y199 PolarHBondContact O-N 3.43Å; L196-Y199 PolarHBondContact O-N 3.4Å; V197-Y199 VanDerWaalsContact C-N 3.34Å; V197-Y199 PolarHBondContact O-N 3.15Å; Y199-F201 VanDerWaalsContact C-N 3.3Å; Y199-F201 PolarHBondContact O-N 3.28Å; Y199-F202 PolarHBondContact O-N 3.36Å; Y199-E203 PolarHBondContact O-N 3.21Å; Y199-S405 WeakPolarHBondContact CE2-OG 3.34Å
200L87Confident82.5Confident104 Ų10451.4 Ų51.455%0.54528%0.277SS..Hα-helixtrans-61.6-36.8177.8-67.7173000112.4L196 V197 T198 S204L196-L200 HydrophobicContact CD1-CG 4.48Å; L196-L200 HydrophobicContact CG-CD1 4.37Å; L196-L200 WeakPolarHBondContact O-CG 3.38Å; L196-L200 PolarHBondContact O-N 3.44Å; V197-L200 PolarHBondContact O-N 3.24Å; T198-L200 PolarHBondContact O-N 3.49Å; L200-S204 VanDerWaalsContact O-CB 3.32Å; L200-S204 WeakPolarHBondContact O-CB 3.47Å; L200-S204 PolarHBondContact O-N 3.19Å
201F85.2Confident81.8Confident63 Ų6357 Ų5728%0.27631%0.306SS..Hα-helixtrans-66.3-46.3175.6-89.4-85.3000112.4V197 T198 Y199 E203 S204 E205 I277 N280 V281 I284V197-F201 HydrophobicContact CG1-CD2 3.98Å; V197-F201 HydrophobicContact CG1-CE2 3.96Å; V197-F201 VanDerWaalsContact O-CD2 3.31Å; V197-F201 WeakPolarHBondContact O-CD2 3.27Å; V197-F201 PolarHBondContact O-N 2.88Å; T198-F201 PolarHBondContact O-N 3Å; Y199-F201 VanDerWaalsContact C-N 3.3Å; Y199-F201 PolarHBondContact O-N 3.28Å; F201-E203 VanDerWaalsContact C-N 3.33Å; F201-E203 PolarHBondContact O-N 2.83Å; F201-S204 PolarHBondContact O-N 3.47Å; F201-E205 PolarHBondContact O-N 3.2Å; F201-I277 HydrophobicContact CB-CG2 3.91Å; F201-N280 HydrophobicContact CE1-CB 3.98Å; F201-N280 HydrophobicContact CZ-CB 4.14Å; F201-V281 HydrophobicContact CD2-CG2 4.28Å; F201-I284 HydrophobicContact CE2-CD1 3.37Å; F201-I284 HydrophobicContact CZ-CD1 3.56Å
202F79.9Confident81.1Confident9 Ų960.6 Ų60.64%0.03933%0.325CS..Hα-helixtrans-64.6-37177.9-80.8-62.5000112.4F26 T198 Y199 E205 K206 I277 F278 M407 V408F26-F202 HydrophobicContact CE1-CE2 4.18Å; F26-F202 HydrophobicContact CZ-CE2 4.37Å; T198-F202 HydrophobicContact CG2-CD2 3.73Å; T198-F202 HydrophobicContact CG2-CE2 3.52Å; T198-F202 WeakPolarHBondContact O-CD2 3.48Å; T198-F202 PolarHBondContact O-N 3.21Å; T198-F202 VanDerWaalsContact O-N 3.11Å; Y199-F202 PolarHBondContact O-N 3.36Å; F202-E205 PolarHBondContact O-N 3.33Å; F202-K206 PolarHBondContact O-N 2.66Å; F202-K206 VanDerWaalsContact O-N 3.15Å; F202-I277 HydrophobicContact CD1-CD1 4.38Å; F202-I277 HydrophobicContact CE1-CD1 4.33Å; F202-I277 HydrophobicContact CZ-CG2 4.45Å; F202-F278 HydrophobicContact CZ-CZ 4.46Å; F202-M407 HydrophobicContact CE2-CE 3.91Å; F202-M407 HydrophobicContact CZ-CE 3.93Å; F202-V408 HydrophobicContact CD2-CG2 3.89Å; F202-V408 HydrophobicContact CE2-CG2 4Å
203E80.4Confident80.4Confident61 Ų6164 Ų6429%0.28534%0.338SS..Hα-helixtrans-73.2-34.2178.4-161.661.9-156.300112.5Y199 F201 E205 K206 S207Y199-E203 PolarHBondContact O-N 3.21Å; F201-E203 VanDerWaalsContact C-N 3.33Å; F201-E203 PolarHBondContact O-N 2.83Å; E203-E205 VanDerWaalsContact C-N 3.32Å; E203-E205 PolarHBondContact O-N 2.97Å; E203-K206 PolarHBondContact O-N 3.21Å; E203-S207 WeakPolarHBondContact O-CB 3.46Å; E203-S207 PolarHBondContact O-N 2.98Å; E203-S207 PolarHBondContact O-OG 3.09Å
204S80.6Confident79.6Confident83 Ų8364.7 Ų64.758%0.5835%0.345SS*.Hα-helixtrans-61.8-40.5173.9-176.20000111.8L200 F201 G208L200-S204 VanDerWaalsContact O-CB 3.32Å; L200-S204 WeakPolarHBondContact O-CB 3.47Å; L200-S204 PolarHBondContact O-N 3.19Å; F201-S204 PolarHBondContact O-N 3.47Å; S204-G208 PolarHBondContact O-N 3.41Å
205E74.4Confident78.9Confident76 Ų7668.3 Ų68.336%0.35537%0.367SS..Hα-helixtrans-68.4-44.7177.3-174.2-176.4-159.200111.6F201 F202 E203 S207 G208 L209 I277F201-E205 PolarHBondContact O-N 3.2Å; F202-E205 PolarHBondContact O-N 3.33Å; E203-E205 VanDerWaalsContact C-N 3.32Å; E203-E205 PolarHBondContact O-N 2.97Å; E205-S207 VanDerWaalsContact C-N 3.26Å; E205-S207 PolarHBondContact O-N 2.98Å; E205-G208 PolarHBondContact O-N 3.27Å; E205-G208 VanDerWaalsContact O-N 3.12Å; E205-L209 PolarHBondContact O-N 3.47Å; E205-I277 WeakPolarHBondContact OE2-CD1 3.22Å
206K71.7Confident77.7Confident82 Ų8272.9 Ų72.936%0.35739%0.391SS..Hα-helixtrans-56-44175.2-171.8-176.3-179.8-169.80111.3F202 E203 L209 L210F202-K206 PolarHBondContact O-N 2.66Å; F202-K206 VanDerWaalsContact O-N 3.15Å; E203-K206 PolarHBondContact O-N 3.21Å; K206-L209 PolarHBondContact O-N 2.94Å; K206-L210 HydrophobicContact CG-CD1 4.45Å; K206-L210 WeakPolarHBondContact O-CG 3.37Å; K206-L210 PolarHBondContact O-N 3.4Å
207S75.1Confident76.3Confident57 Ų5774 Ų7440%0.39939%0.394SS..Hα-helixtrans-63.3-43.2177-58.40000111.9E203 E205 L209 L210 L211E203-S207 WeakPolarHBondContact O-CB 3.46Å; E203-S207 PolarHBondContact O-N 2.98Å; E203-S207 PolarHBondContact O-OG 3.09Å; E205-S207 VanDerWaalsContact C-N 3.26Å; E205-S207 PolarHBondContact O-N 2.98Å; S207-L209 PolarHBondContact O-N 3.2Å; S207-L210 PolarHBondContact O-N 3.35Å; S207-L211 WeakPolarHBondContact O-CG 3.37Å; S207-L211 PolarHBondContact O-N 3.4Å
208G75.1Confident74.9Confident33 Ų3376.6 Ų76.634%0.3441%0.41SS..Hα-helixtrans-61.9-41.7175.500000113.1S204 E205 L211 L212S204-G208 PolarHBondContact O-N 3.41Å; E205-G208 PolarHBondContact O-N 3.27Å; E205-G208 VanDerWaalsContact O-N 3.12Å; G208-L211 PolarHBondContact O-N 2.98Å; G208-L212 WeakPolarHBondContact O-CG 3.48Å; G208-L212 PolarHBondContact O-N 3.34Å
209L69.3Low73.3Confident107 Ų10780.2 Ų80.256%0.5643%0.429SS*.Hα-helixtrans-66.4-39.7177.1-174.566.1000112.2E205 K206 S207 L211 L212 K213E205-L209 PolarHBondContact O-N 3.47Å; K206-L209 PolarHBondContact O-N 2.94Å; S207-L209 PolarHBondContact O-N 3.2Å; L209-L211 VanDerWaalsContact C-N 3.34Å; L209-L212 PolarHBondContact O-N 3.42Å; L209-K213 WeakPolarHBondContact O-CB 3.22Å; L209-K213 PolarHBondContact O-N 2.89Å
210L71.4Confident71.6Confident102 Ų10281.7 Ų81.753%0.53444%0.443SS..Hα-helixtrans-65.3-37.1176.1-72.1176.2000112.2K206 S207 K213 S214K206-L210 HydrophobicContact CG-CD1 4.45Å; K206-L210 WeakPolarHBondContact O-CG 3.37Å; K206-L210 PolarHBondContact O-N 3.4Å; S207-L210 PolarHBondContact O-N 3.35Å; L210-K213 PolarHBondContact O-N 3.26Å; L210-S214 PolarHBondContact O-N 2.92Å; L210-S214 PolarHBondContact O-OG 3.18Å
211L73.3Confident69.7Low116 Ų11682.6 Ų82.661%0.60745%0.448SS*.Hα-helixtrans-66.8-41173.2-69.8-177.3000112.2S207 G208 L209 K213 S214 V215S207-L211 WeakPolarHBondContact O-CG 3.37Å; S207-L211 PolarHBondContact O-N 3.4Å; G208-L211 PolarHBondContact O-N 2.98Å; L209-L211 VanDerWaalsContact C-N 3.34Å; L211-K213 VanDerWaalsContact C-N 3.29Å; L211-K213 PolarHBondContact O-N 3.38Å; L211-S214 PolarHBondContact O-N 2.96Å; L211-S214 PolarHBondContact O-OG 3.39Å; L211-V215 VanDerWaalsContact O-CG2 3.27Å; L211-V215 WeakPolarHBondContact O-CG2 3.36Å; L211-V215 PolarHBondContact O-N 3.09Å
212L73.3Confident68Low114 Ų11482.7 Ų82.760%0.59745%0.454SS*.Hα-helixtrans-64.8-36.1174.8-70.9174.8000112G208 L209 N216G208-L212 WeakPolarHBondContact O-CG 3.48Å; G208-L212 PolarHBondContact O-N 3.34Å; L209-L212 PolarHBondContact O-N 3.42Å; L212-N216 WeakPolarHBondContact O-CB 3.5Å; L212-N216 PolarHBondContact O-N 3.41Å
213K75.1Confident66.4Low101 Ų10188.3 Ų88.344%0.43948%0.484SS..Hα-helixtrans-67.5-42.4175.9-169.7177.3179.1-176.60111.9L209 L210 L211 N216 E217L209-K213 WeakPolarHBondContact O-CB 3.22Å; L209-K213 PolarHBondContact O-N 2.89Å; L210-K213 PolarHBondContact O-N 3.26Å; L211-K213 VanDerWaalsContact C-N 3.29Å; L211-K213 PolarHBondContact O-N 3.38Å; K213-N216 PolarHBondContact O-N 2.69Å; K213-E217 WeakPolarHBondContact CE-OE1 3.21Å; K213-E217 PolarHBondContact O-N 3.31Å
214S70.9Confident64.5Low54 Ų5492.4 Ų92.438%0.37851%0.508SS..Hα-helixtrans-66.8-37176.866.40000112L210 L211 E217 T218L210-S214 PolarHBondContact O-N 2.92Å; L210-S214 PolarHBondContact O-OG 3.18Å; L211-S214 PolarHBondContact O-N 2.96Å; L211-S214 PolarHBondContact O-OG 3.39Å; S214-E217 PolarHBondContact O-N 3.05Å; S214-T218 WeakPolarHBondContact O-CB 3.48Å; S214-T218 PolarHBondContact O-N 2.94Å; S214-T218 PolarHBondContact O-OG1 3.4Å
215V73.7Confident62.5Low77 Ų7791.5 Ų91.547%0.46750%0.502SS..Hα-helixtrans-64.3-46.6173.7173.30000111L211 E217 T218 D219L211-V215 VanDerWaalsContact O-CG2 3.27Å; L211-V215 WeakPolarHBondContact O-CG2 3.36Å; L211-V215 PolarHBondContact O-N 3.09Å; V215-E217 PolarHBondContact O-N 3.11Å; V215-T218 PolarHBondContact O-N 3.31Å; V215-T218 VanDerWaalsContact O-N 3.15Å; V215-D219 PolarHBondContact O-N 3.01Å
216N63.8Low60.7Low99 Ų9995 Ų9553%0.52952%0.518SS..Hα-helixtrans-65.5-34.5177.3-84.8-10.2000113.6L212 K213 T218 N220L212-N216 WeakPolarHBondContact O-CB 3.5Å; L212-N216 PolarHBondContact O-N 3.41Å; K213-N216 PolarHBondContact O-N 2.69Å; N216-T218 VanDerWaalsContact C-N 3.34Å; N216-N220 WeakPolarHBondContact O-CB 3.35Å; N216-N220 VanDerWaalsContact O-CG 3.3Å; N216-N220 PolarHBondContact O-N 3.17Å; N216-N220 PolarHBondContact O-ND2 2.81Å
217E60.9Low58.8Low113 Ų113100.1 Ų100.153%0.52855%0.548SS..Hα-helixtrans-70.7-33.1173.6-77.4178.6-177.200111.6K213 S214 V215 N221K213-E217 WeakPolarHBondContact CE-OE1 3.21Å; K213-E217 PolarHBondContact O-N 3.31Å; S214-E217 PolarHBondContact O-N 3.05Å; V215-E217 PolarHBondContact O-N 3.11Å; E217-N221 PolarHBondContact O-N 3.26Å; E217-N221 VanDerWaalsContact O-N 3.15Å
218T57.2Low56.8Low81 Ų81105.3 Ų105.350%0.49756%0.564SS.*Hα-helixtrans-70.2-44.1174.4-48.30000110.5S214 V215 N216 N220 N221 V222S214-T218 WeakPolarHBondContact O-CB 3.48Å; S214-T218 PolarHBondContact O-N 2.94Å; S214-T218 PolarHBondContact O-OG1 3.4Å; V215-T218 PolarHBondContact O-N 3.31Å; V215-T218 VanDerWaalsContact O-N 3.15Å; N216-T218 VanDerWaalsContact C-N 3.34Å; T218-N220 PolarHBondContact O-N 3.07Å; T218-N221 PolarHBondContact O-N 3.31Å; T218-V222 HydrophobicContact CG2-CG2 4.06Å; T218-V222 VanDerWaalsContact O-CB 3.26Å; T218-V222 WeakPolarHBondContact O-CB 3.36Å; T218-V222 WeakPolarHBondContact O-CG2 3.36Å; T218-V222 PolarHBondContact O-N 3.32Å
219D54.4Low54.8Low76 Ų76109.7 Ų109.741%0.40658%0.584SS.*Hα-helixtrans-65.7-35.6176.6-77.1-18.2000112.4V215 N221 V222 N223V215-D219 PolarHBondContact O-N 3.01Å; D219-N221 PolarHBondContact O-N 3.28Å; D219-V222 PolarHBondContact O-N 3.16Å; D219-N223 WeakPolarHBondContact O-CB 3.38Å; D219-N223 PolarHBondContact O-N 3.31Å; D219-N223 PolarHBondContact O-ND2 3.04Å
220N50.7Low53.1Low108 Ų108114.2 Ų114.258%0.57860%0.599SS**Hα-helixtrans-72.1-26.6176-75.9-43.4000113.6N216 T218N216-N220 WeakPolarHBondContact O-CB 3.35Å; N216-N220 VanDerWaalsContact O-CG 3.3Å; N216-N220 PolarHBondContact O-N 3.17Å; N216-N220 PolarHBondContact O-ND2 2.81Å; T218-N220 PolarHBondContact O-N 3.07Å
221N47.8Very low51.2Low123 Ų123114.2 Ų114.266%0.65861%0.608SS**Hα-helixtrans-85.6-28.6172.4-82.6-19.1000112.8E217 T218 D219 S225E217-N221 PolarHBondContact O-N 3.26Å; E217-N221 VanDerWaalsContact O-N 3.15Å; T218-N221 PolarHBondContact O-N 3.31Å; D219-N221 PolarHBondContact O-N 3.28Å; N221-S225 PolarHBondContact O-OG 3.3Å; N221-S225 VanDerWaalsContact O-OG 3.05Å
222V49.1Very low49.3Very low65 Ų65116 Ų11639%0.39462%0.617SS.*Hα-helixtrans-84.5-29.1179.6174.70000112.1T218 D219 N224 S225T218-V222 HydrophobicContact CG2-CG2 4.06Å; T218-V222 VanDerWaalsContact O-CB 3.26Å; T218-V222 WeakPolarHBondContact O-CB 3.36Å; T218-V222 WeakPolarHBondContact O-CG2 3.36Å; T218-V222 PolarHBondContact O-N 3.32Å; D219-V222 PolarHBondContact O-N 3.16Å; V222-N224 PolarHBondContact O-N 3.15Å; V222-N224 VanDerWaalsContact O-N 3.15Å; V222-S225 CarbonylContact O-C 3.55Å; V222-S225 PolarHBondContact O-N 3.25Å
223N45.6Very low47.2Very low126 Ų126117.6 Ų117.667%0.67463%0.625SS**THydrogen-bonded Turntrans-68.3-13.8175.2-71.4-24.7000113.7D219D219-N223 WeakPolarHBondContact O-CB 3.38Å; D219-N223 PolarHBondContact O-N 3.31Å; D219-N223 PolarHBondContact O-ND2 3.04Å
224N41.6Very low45.2Very low148 Ų148118.8 Ų118.879%0.79164%0.641SS**THydrogen-bonded Turntrans-94.1-5169.5-72.6-35.5000113.5V222V222-N224 PolarHBondContact O-N 3.15Å; V222-N224 VanDerWaalsContact O-N 3.15Å
225S37.2Very low43.3Very low64 Ų64121.5 Ų121.545%0.44866%0.656SS.*SBendtrans-140.582.9-177.1550000110.8N221 V222N221-S225 PolarHBondContact O-OG 3.3Å; N221-S225 VanDerWaalsContact O-OG 3.05Å; V222-S225 CarbonylContact O-C 3.55Å; V222-S225 PolarHBondContact O-N 3.25Å
226Q36.7Very low41.3Very low150 Ų150124.2 Ų124.270%0.70167%0.668SS**  trans6798.4156.2-51.2-171.7-32.800115.6F228Q226-F228 HydrophobicContact CB-CB 4.18Å; Q226-F228 PolarHBondContact O-N 2.81Å
227L33.2Very low39.7Very low188 Ų188126.4 Ų126.498%0.98469%0.685SS**  5.234.3117.7-149.4105.2000120.1
228F31.9Very low38.1Very low167 Ų167129 Ų12973%0.73270%0.701SS**  trans-147.275.2-169.3-124.4-86.3000107.1Q226Q226-F228 HydrophobicContact CB-CB 4.18Å; Q226-F228 PolarHBondContact O-N 2.81Å
229T34.8Very low36.9Very low124 Ų124131.1 Ų131.176%0.76171%0.713SS**  -177.5103.494.124.50000108.5
230K33Very low35.7Very low202 Ų202133.9 Ų133.988%0.87872%0.723SS**  trans-56.9146.3149.8-84.7176.8172.7174.70107.7
231S31.7Very low34.7Very low102 Ų102134.8 Ų134.871%0.71374%0.739SS**  trans84.794.2177.188.90000115.2
232L31.7Very low34Very low153 Ų153138.2 Ų138.280%0.80175%0.748SS**SBend-161.7121.9116.8-124.484.5000109.3
233L30.6Very low33.1Very low148 Ų148144.2 Ų144.278%0.77576%0.763SS**  trans7974.8156.7-58.9159.6000117.6
234T32.8Very low32.6Very low126 Ų126144.5 Ų144.577%0.77377%0.769SS**  -35.5135.2123.346.50000109.8
235T31.2Very low32.1Very low111 Ų111144.1 Ų144.168%0.68177%0.773SS**  179.3140.783-580000109.3
236D30.5Very low31.9Very low135 Ų135149 Ų14972%0.72279%0.793SS**  trans70.495158.3-61.6-14.8000121.7
237T30.3Very low31.8Very low144 Ų144151.3 Ų151.388%0.88380%0.801SS**  -178.512793.728.40000111.5
238I29Very low31.8Very low168 Ų168149.5 Ų149.586%0.86279%0.792SS**  trans-76.2112.6-175.8-65.6154.4000109.3
239V31.2Very low31.9Very low125 Ų125149.1 Ų149.176%0.75880%0.798SS**  trans-165.6135.9148.7167.10000107.9
240E29.4Very low31.7Very low134 Ų134148.9 Ų148.963%0.62680%0.801SS**  trans89.436.9167.5-127.583.9-170.500120.6K242 R243E240-K242 PolarHBondContact O-N 2.96Å; E240-R243 IonicContact OE1-NH2 2.77Å; E240-R243 PolarHBondContact OE1-NH2 3.06Å
241S29.5Very low31.9Very low128 Ų128146.1 Ų146.190%0.89579%0.794SS**THydrogen-bonded Turntrans-8561.2165.6-173.10000113.2
242K32Very low31.9Very low195 Ų195148.3 Ų148.385%0.84880%0.798SS**THydrogen-bonded Turntrans-146.313.2176-128.4178.1-173.7-179.70117.9E240E240-K242 PolarHBondContact O-N 2.96Å
243R31.9Very low31.8Very low190 Ų190148.2 Ų148.272%0.71780%0.798SS**SBendtrans-120.16.2-172.4-135.3-175-66.8-128.60.7116.8E240E240-R243 IonicContact OE1-NH2 2.77Å; E240-R243 PolarHBondContact OE1-NH2 3.06Å
244V33.7Very low31.9Very low133 Ų133149.9 Ų149.981%0.80680%0.802SS**SBendtrans-118.6-2.9-169.1-1790000114.5L246V244-L246 PolarHBondContact O-N 3.47Å
245T31.8Very low31.8Very low140 Ų140148 Ų14886%0.85979%0.794SS**THydrogen-bonded Turntrans-93.631.6-172.452.60000116
246L32.8Very low32Very low166 Ų166148.8 Ų148.887%0.86980%0.799SS**THydrogen-bonded Turntrans-134.414178-121.7158.6000114.9V244V244-L246 PolarHBondContact O-N 3.47Å
247F34.6Very low32Very low198 Ų198148.3 Ų148.387%0.86880%0.796SS**SBendtrans-118.210-173.6-115.6-82.7000115.7
248N32.9Very low32.2Very low151 Ų151146.2 Ų146.281%0.80778%0.783SS**  trans-106.310.2-171.4-101.513.2000117.2
249D33.8Very low32.3Very low159 Ų159140.1 Ų140.185%0.8576%0.762SS**SBendtrans-107.597.3172.3-71.8-28.2000110.9
250S30.9Very low32.2Very low118 Ų118141.6 Ų141.683%0.82576%0.758SS**  trans135.563.1159.565.90000113.8N252S250-N252 PolarHBondContact O-N 3.38Å
251I36.8Very low32.2Very low144 Ų144141.7 Ų141.774%0.73876%0.759SS**  trans-74.7102.3154.9-64.2175000106.9
252N31.8Very low32.2Very low149 Ų149139.6 Ų139.680%0.79774%0.744SS**  trans-126.7128.2155.1-92.9-22.9000109S250 Q254S250-N252 PolarHBondContact O-N 3.38Å; N252-Q254 PolarHBondContact O-N 3.27Å; N252-Q254 VanDerWaalsContact O-N 3.15Å
253N31Very low32.7Very low150 Ų150133.8 Ų133.880%0.80272%0.724SS**SBendtrans-56.8102.1-166.9-67-41.1000114.5
254Q31.3Very low33.2Very low183 Ų183128.4 Ų128.486%0.85571%0.713SS**  trans-164.610.3159.1-117.6171800115.7N252N252-Q254 PolarHBondContact O-N 3.27Å; N252-Q254 VanDerWaalsContact O-N 3.15Å
255S32.1Very low33.6Very low86 Ų86128 Ų12860%0.60170%0.702SS**  trans-102.79.8-15858.80000118.1N257 V258 G259S255-N257 VanDerWaalsContact C-N 3.35Å; S255-N257 PolarHBondContact O-N 3.47Å; S255-V258 PolarHBondContact O-N 2.97Å; S255-G259 PolarHBondContact O-N 3.27Å
256T34.1Very low34.6Very low129 Ų129123.6 Ų123.679%0.79168%0.676SS**THydrogen-bonded Turntrans-73.3-17.4-175.843.30000115.4
257N30.9Very low35.6Very low124 Ų124119.5 Ų119.566%0.66365%0.653SS**THydrogen-bonded Turntrans-98.5-24.4171.9-90.1-31.4000114.1S255 Q261S255-N257 VanDerWaalsContact C-N 3.35Å; S255-N257 PolarHBondContact O-N 3.47Å; N257-Q261 PolarHBondContact O-N 3.33Å
258V34.3Very low36.8Very low101 Ų101114 Ų11461%0.61263%0.627SS**Hα-helixtrans-73.6-33.7-178.3-1760000111.4S255 Q261 S262S255-V258 PolarHBondContact O-N 2.97Å; V258-Q261 PolarHBondContact O-N 2.98Å; V258-S262 WeakPolarHBondContact O-CB 3.34Å; V258-S262 PolarHBondContact O-N 3.15Å; V258-S262 VanDerWaalsContact O-N 3.08Å
259G30.8Very low38.3Very low40 Ų40110.2 Ų110.241%0.41261%0.607SS.*Hα-helixtrans-65.2-39176.900000113.9S255 V263S255-G259 PolarHBondContact O-N 3.27Å; G259-V263 WeakPolarHBondContact O-CB 3.46Å; G259-V263 WeakPolarHBondContact O-CG2 3.35Å; G259-V263 PolarHBondContact O-N 2.68Å
260K30.5Very low40.5Very low155 Ų155102.9 Ų102.967%0.67457%0.567SS**Hα-helixtrans-69-36.2177.7-78.4179.6178.5174.80112.1V264K260-V264 VanDerWaalsContact O-CG2 3.27Å; K260-V264 WeakPolarHBondContact O-CG2 3.17Å; K260-V264 PolarHBondContact O-N 3.17Å
261Q27.8Very low42.7Very low137 Ų13799.3 Ų99.364%0.6454%0.541SS*.Hα-helixtrans-77.4-33.6-177.6-147.9147.35.200112.6N257 V258 H265N257-Q261 PolarHBondContact O-N 3.33Å; V258-Q261 PolarHBondContact O-N 2.98Å; Q261-H265 PolarHBondContact O-CD2 3Å; Q261-H265 PolarHBondContact O-N 2.66Å
262S30.7Very low44.7Very low83 Ų8395.7 Ų95.758%0.5852%0.522SS*.Hα-helixtrans-69.3-37.2173.4-1760000112.7V258 H265 S266V258-S262 WeakPolarHBondContact O-CB 3.34Å; V258-S262 PolarHBondContact O-N 3.15Å; V258-S262 VanDerWaalsContact O-N 3.08Å; S262-H265 PolarHBondContact O-N 2.94Å; S262-S266 PolarHBondContact O-N 2.9Å
263V41.9Very low47Very low73 Ų7395.4 Ų95.444%0.44252%0.516SS..Hα-helixtrans-69.9-41.5178.8172.60000112G259 H265 S266 E267G259-V263 WeakPolarHBondContact O-CB 3.46Å; G259-V263 WeakPolarHBondContact O-CG2 3.35Å; G259-V263 PolarHBondContact O-N 2.68Å; V263-H265 VanDerWaalsContact C-N 3.29Å; V263-H265 PolarHBondContact O-N 3.2Å; V263-S266 PolarHBondContact O-N 2.97Å; V263-E267 PolarHBondContact O-N 3.01Å
264V43Very low49.5Very low78 Ų7888.3 Ų88.347%0.47348%0.478SS..Hα-helixtrans-64.5-35.4176.4175.40000111.2K260 S266 E267 Y268K260-V264 VanDerWaalsContact O-CG2 3.27Å; K260-V264 WeakPolarHBondContact O-CG2 3.17Å; K260-V264 PolarHBondContact O-N 3.17Å; V264-S266 VanDerWaalsContact C-N 3.33Å; V264-S266 PolarHBondContact O-N 2.93Å; V264-E267 PolarHBondContact O-N 3.13Å; V264-Y268 HydrophobicContact CG1-CE2 4.06Å; V264-Y268 WeakPolarHBondContact O-CD2 3.4Å; V264-Y268 WeakPolarHBondContact O-CE2 3.11Å
265H42.1Very low52Low124 Ų12480 Ų8057%0.57444%0.439SS*.Hα-helixtrans-70.4-25.5175.9-93-68.5000114.2Q261 S262 V263 N269Q261-H265 PolarHBondContact O-CD2 3Å; Q261-H265 PolarHBondContact O-N 2.66Å; S262-H265 PolarHBondContact O-N 2.94Å; V263-H265 VanDerWaalsContact C-N 3.29Å; V263-H265 PolarHBondContact O-N 3.2Å; H265-N269 PolarHBondContact O-ND2 3.33Å
266S52.5Low54.6Low47 Ų4778 Ų7833%0.32943%0.425SS..Hα-helixtrans-73.9-29.6175.8-169.80000112.2S262 V263 V264 Y268 N269 K404S262-S266 PolarHBondContact O-N 2.9Å; V263-S266 PolarHBondContact O-N 2.97Å; V264-S266 VanDerWaalsContact C-N 3.33Å; V264-S266 PolarHBondContact O-N 2.93Å; S266-Y268 PolarHBondContact O-N 2.93Å; S266-N269 PolarHBondContact O-N 3.43Å; S266-K404 WeakPolarHBondContact O-CE 3.37Å; S266-K404 PolarHBondContact O-NZ 3.3Å
267E54.7Low57.1Low81 Ų8172.7 Ų72.738%0.37939%0.391SS..Hα-helixtrans-65.7-25.5-174.9-166.7166.9-173.200113.6V263 V264 N403 K404V263-E267 PolarHBondContact O-N 3.01Å; V264-E267 PolarHBondContact O-N 3.13Å; E267-N403 PolarHBondContact OE1-ND2 3.47Å; E267-K404 WeakPolarHBondContact O-CG 3.47Å
268Y58.2Low59.9Low82 Ų8266.9 Ų66.932%0.32236%0.36SS..Hα-helixtrans-102.4-16.7-178.4-58.2-76.5000114.3V264 S266 L397 K401 N403V264-Y268 HydrophobicContact CG1-CE2 4.06Å; V264-Y268 WeakPolarHBondContact O-CD2 3.4Å; V264-Y268 WeakPolarHBondContact O-CE2 3.11Å; S266-Y268 PolarHBondContact O-N 2.93Å; Y268-L397 WeakPolarHBondContact O-CD1 3.48Å; Y268-K401 WeakPolarHBondContact CD1-O 3.28Å; Y268-K401 WeakPolarHBondContact CE1-O 3.22Å; Y268-N403 VanDerWaalsContact CE1-OD1 3.3Å; Y268-N403 WeakPolarHBondContact CE1-OD1 3.3Å
269N65.7Low62.6Low72 Ų7267.2 Ų67.239%0.38535%0.35SS..  trans-112.3115.6-168.9-69.6-47.4000111.7H265 S266 T271 K404H265-N269 PolarHBondContact O-ND2 3.33Å; S266-N269 PolarHBondContact O-N 3.43Å; N269-T271 VanDerWaalsContact O-CG2 3.31Å; N269-T271 WeakPolarHBondContact O-CG2 3.44Å; N269-T271 PolarHBondContact O-N 2.96Å; N269-K404 WeakPolarHBondContact O-CE 3.42Å; N269-K404 PolarHBondContact O-NZ 2.92Å
270I78.5Confident65.4Low4 Ų468 Ų682%0.02135%0.345CS..  trans-63.3128.2169.2-56.7-165.9000108.1I29 N33 D274 F278 K404 M407I29-I270 HydrophobicContact CG2-CB 3.98Å; I29-I270 HydrophobicContact CG2-CD1 3.5Å; I29-I270 VanDerWaalsContact CG2-CD1 3.5Å; I29-I270 HydrophobicContact CG2-CG1 3.99Å; I29-I270 HydrophobicContact CG2-CG2 4.4Å; N33-I270 WeakPolarHBondContact CB-O 3.04Å; I270-D274 WeakPolarHBondContact CA-OD2 3.39Å; I270-D274 HydrophobicContact CG2-CB 3.99Å; I270-D274 VanDerWaalsContact CG2-OD2 3.31Å; I270-D274 WeakPolarHBondContact CG2-OD2 3.46Å; I270-F278 HydrophobicContact CD1-CZ 4.35Å; I270-F278 HydrophobicContact CG2-CE2 3.84Å; I270-F278 HydrophobicContact CG2-CZ 3.92Å; I270-K404 HydrophobicContact CG1-CD 4.21Å; I270-K404 HydrophobicContact CG1-CG 4.11Å; I270-M407 HydrophobicContact CD1-CE 3.22Å; I270-M407 HydrophobicContact CD1-SD 3.69Å
271T79Confident68.3Low43 Ų4360.6 Ų60.626%0.26431%0.313SS..  trans-121.2-179.5-176.7740000111.8C34 N269 Q273 D274C34-T271 PolarHBondContact SG-O 3.25Å; C34-T271 VanDerWaalsContact SG-O 3.36Å; N269-T271 VanDerWaalsContact O-CG2 3.31Å; N269-T271 WeakPolarHBondContact O-CG2 3.44Å; N269-T271 PolarHBondContact O-N 2.96Å; T271-Q273 PolarHBondContact O-N 3.35Å; T271-Q273 WeakPolarHBondContact OG1-CB 3.34Å; T271-Q273 PolarHBondContact OG1-N 3.5Å; T271-D274 PolarHBondContact N-OD2 2.89Å; T271-D274 PolarHBondContact O-N 3.46Å; T271-D274 VanDerWaalsContact O-N 3.16Å
272I78.2Confident71.4Confident68 Ų6854.1 Ų54.135%0.34928%0.282SS..G310 helixtrans-59.7-26.5173.5-60.8163.6000111.3C34 E130 V133 D274 L275C34-I272 WeakPolarHBondContact O-CG1 3.44Å; E130-I272 HydrophobicContact CG-CG2 4.49Å; V133-I272 HydrophobicContact CG1-CD1 3.86Å; V133-I272 HydrophobicContact CG1-CG1 4.35Å; I272-D274 PolarHBondContact O-N 2.85Å; I272-L275 WeakPolarHBondContact O-CB 3.28Å; I272-L275 PolarHBondContact O-N 2.97Å
273Q79.8Confident74.4Confident143 Ų14354.5 Ų54.567%0.66828%0.278SS*.G310 helixtrans-64.6-23.6178.6-62179.8-7.600112.7T271 L275 P276T271-Q273 PolarHBondContact O-N 3.35Å; T271-Q273 WeakPolarHBondContact OG1-CB 3.34Å; T271-Q273 PolarHBondContact OG1-N 3.5Å; Q273-L275 VanDerWaalsContact C-N 3.26Å; Q273-L275 PolarHBondContact O-N 3.11Å; Q273-P276 WeakPolarHBondContact O-CD 3.34Å
274D83.4Confident76.8Confident2 Ų253.9 Ų53.91%0.01127%0.271CS..G310 helixtrans-82.9-3.4-178.4-53.1-30.3000111.9I270 T271 I272 P276 I277 F278 K404I270-D274 WeakPolarHBondContact CA-OD2 3.39Å; I270-D274 HydrophobicContact CG2-CB 3.99Å; I270-D274 VanDerWaalsContact CG2-OD2 3.31Å; I270-D274 WeakPolarHBondContact CG2-OD2 3.46Å; T271-D274 PolarHBondContact N-OD2 2.89Å; T271-D274 PolarHBondContact O-N 3.46Å; T271-D274 VanDerWaalsContact O-N 3.16Å; I272-D274 PolarHBondContact O-N 2.85Å; D274-P276 VanDerWaalsContact C-CD 3.46Å; D274-I277 HydrophobicContact CB-CD1 4.45Å; D274-I277 VanDerWaalsContact O-CB 3.29Å; D274-I277 WeakPolarHBondContact O-CB 3.43Å; D274-I277 PolarHBondContact O-N 3.41Å; D274-F278 HydrophobicContact CB-CE2 4.05Å; D274-F278 VanDerWaalsContact O-CD2 3.23Å; D274-F278 WeakPolarHBondContact O-CD2 3.47Å; D274-F278 PolarHBondContact O-N 2.74Å; D274-K404 IonicContact OD1-NZ 3.99Å; D274-K404 IonicContact OD2-NZ 3.25Å; D274-K404 PolarHBondContact OD2-NZ 3.15Å
275L84.9Confident79.2Confident7 Ų750.2 Ų50.24%0.03725%0.249CC..Hα-helixtrans-55.8-40.8-178-171.157.9000114.4F30 Q128 E130 I272 Q273 I277 F278 R279F30-L275 HydrophobicContact CE2-CD1 3.51Å; F30-L275 HydrophobicContact CZ-CD1 3.8Å; Q128-L275 WeakPolarHBondContact O-CD2 3.35Å; E130-L275 HydrophobicContact CG-CD2 4.14Å; I272-L275 WeakPolarHBondContact O-CB 3.28Å; I272-L275 PolarHBondContact O-N 2.97Å; Q273-L275 VanDerWaalsContact C-N 3.26Å; Q273-L275 PolarHBondContact O-N 3.11Å; L275-I277 PolarHBondContact O-N 3.45Å; L275-F278 PolarHBondContact O-N 2.86Å; L275-R279 PolarHBondContact O-N 3.48Å
276P86.1Confident81.7Confident45 Ų4544.5 Ų44.529%0.29222%0.223SC..Hα-helixtrans-61.6-29.6174.8-23.236000113.5Q273 D274 R279 N280Q273-P276 WeakPolarHBondContact O-CD 3.34Å; D274-P276 VanDerWaalsContact C-CD 3.46Å; P276-R279 PolarHBondContact O-N 3.16Å; P276-N280 WeakPolarHBondContact O-CB 3.18Å; P276-N280 PolarHBondContact O-N 2.69Å; P276-N280 PolarHBondContact O-ND2 2.86Å; P276-N280 PolarHBondContact O-OD1 3.26Å
277I86.6Confident83.7Confident17 Ų1744.4 Ų44.49%0.08723%0.229CC..Hα-helixtrans-67.4-49.2178.7-62.1169.6000109.4F201 F202 E205 D274 L275 R279 N280 V281F201-I277 HydrophobicContact CB-CG2 3.91Å; F202-I277 HydrophobicContact CD1-CD1 4.38Å; F202-I277 HydrophobicContact CE1-CD1 4.33Å; F202-I277 HydrophobicContact CZ-CG2 4.45Å; E205-I277 WeakPolarHBondContact OE2-CD1 3.22Å; D274-I277 HydrophobicContact CB-CD1 4.45Å; D274-I277 VanDerWaalsContact O-CB 3.29Å; D274-I277 WeakPolarHBondContact O-CB 3.43Å; D274-I277 PolarHBondContact O-N 3.41Å; L275-I277 PolarHBondContact O-N 3.45Å; I277-R279 VanDerWaalsContact C-N 3.29Å; I277-R279 PolarHBondContact O-N 2.91Å; I277-N280 PolarHBondContact O-N 3.28Å; I277-N280 VanDerWaalsContact O-N 3.16Å; I277-V281 HydrophobicContact CG2-CG2 4.24Å; I277-V281 WeakPolarHBondContact O-CB 3.29Å; I277-V281 VanDerWaalsContact O-CG2 3.31Å; I277-V281 WeakPolarHBondContact O-CG2 3.33Å; I277-V281 PolarHBondContact O-N 3.5Å
278F89.1Confident85.5Confident3 Ų342.6 Ų42.61%0.01322%0.221CC..Hα-helixtrans-58.4-41.4176.9-66.6-70.9000112.2F26 F30 F126 F202 I270 D274 L275 A282F26-F278 HydrophobicContact CB-CD1 4.31Å; F26-F278 HydrophobicContact CB-CE1 3.82Å; F26-F278 AromaticContact CD1-CE1 3.73Å; F26-F278 HydrophobicContact CD1-CE1 3.73Å; F26-F278 HydrophobicContact CD2-CD1 4.47Å; F26-F278 HydrophobicContact CD2-CE1 4.26Å; F26-F278 HydrophobicContact CE1-CE1 4.41Å; F26-F278 HydrophobicContact CG-CD1 4.24Å; F26-F278 AromaticContact CG-CE1 3.66Å; F26-F278 HydrophobicContact CG-CE1 3.66Å; F30-F278 HydrophobicContact CD2-CB 4.28Å; F30-F278 HydrophobicContact CD2-CD1 4.2Å; F30-F278 AromaticContact CD2-CD2 3.75Å; F30-F278 HydrophobicContact CD2-CD2 3.75Å; F30-F278 HydrophobicContact CD2-CE2 4.1Å; F30-F278 AromaticContact CD2-CG 3.81Å; F30-F278 HydrophobicContact CD2-CG 3.81Å; F30-F278 HydrophobicContact CD2-CZ 4.47Å; F30-F278 HydrophobicContact CE2-CB 4.1Å; F30-F278 HydrophobicContact CE2-CD2 4.03Å; F30-F278 HydrophobicContact CE2-CG 4.08Å; F126-F278 HydrophobicContact CB-CB 4.23Å; F126-F278 HydrophobicContact CD1-CB 4.05Å; F126-F278 HydrophobicContact CD1-CD1 4.23Å; F126-F278 HydrophobicContact CD1-CG 4.37Å; F126-F278 HydrophobicContact CE1-CD1 4.42Å; F202-F278 HydrophobicContact CZ-CZ 4.46Å; I270-F278 HydrophobicContact CD1-CZ 4.35Å; I270-F278 HydrophobicContact CG2-CE2 3.84Å; I270-F278 HydrophobicContact CG2-CZ 3.92Å; D274-F278 HydrophobicContact CB-CE2 4.05Å; D274-F278 VanDerWaalsContact O-CD2 3.23Å; D274-F278 WeakPolarHBondContact O-CD2 3.47Å; D274-F278 PolarHBondContact O-N 2.74Å; L275-F278 PolarHBondContact O-N 2.86Å; F278-A282 VanDerWaalsContact O-CB 3.28Å; F278-A282 WeakPolarHBondContact O-CB 3.27Å; F278-A282 PolarHBondContact O-N 2.89Å
279R90.7Very high87.3Confident108 Ų10838.7 Ų38.741%0.40821%0.206SC..Hα-helixtrans-59-50.2174.1-175.7-177.665.5-146.7-2.1112.1L275 P276 I277 A282 L283L275-R279 PolarHBondContact O-N 3.48Å; P276-R279 PolarHBondContact O-N 3.16Å; I277-R279 VanDerWaalsContact C-N 3.29Å; I277-R279 PolarHBondContact O-N 2.91Å; R279-A282 PolarHBondContact O-N 3.26Å; R279-L283 HydrophobicContact CG-CD1 4.21Å; R279-L283 WeakPolarHBondContact O-CG 3.35Å; R279-L283 PolarHBondContact O-N 3.47Å
280N90.6Very high88.6Confident55 Ų5537.5 Ų37.529%0.29420%0.202SC..Hα-helixtrans-66.1-43.5-176.3-68.5-10.2000111F201 P276 I277 A282 L283 I284F201-N280 HydrophobicContact CE1-CB 3.98Å; F201-N280 HydrophobicContact CZ-CB 4.14Å; P276-N280 WeakPolarHBondContact O-CB 3.18Å; P276-N280 PolarHBondContact O-N 2.69Å; P276-N280 PolarHBondContact O-ND2 2.86Å; P276-N280 PolarHBondContact O-OD1 3.26Å; I277-N280 PolarHBondContact O-N 3.28Å; I277-N280 VanDerWaalsContact O-N 3.16Å; N280-A282 VanDerWaalsContact C-N 3.32Å; N280-A282 PolarHBondContact O-N 3.49Å; N280-L283 PolarHBondContact O-N 3.42Å; N280-I284 WeakPolarHBondContact O-CD1 3.26Å; N280-I284 VanDerWaalsContact O-CG1 3.27Å; N280-I284 WeakPolarHBondContact O-CG1 3.48Å; N280-I284 PolarHBondContact O-N 3.5Å
281V91.2Very high89.4Confident1 Ų142.1 Ų42.11%0.00623%0.226CC..Hα-helixtrans-57.7-46.6173.2170.20000110.4V22 T198 F201 I277 L283 I284 V285V22-V281 HydrophobicContact CG2-CG1 4.32Å; T198-V281 HydrophobicContact CG2-CG2 3.97Å; T198-V281 VanDerWaalsContact OG1-CG1 3.31Å; T198-V281 WeakPolarHBondContact OG1-CG1 3.35Å; F201-V281 HydrophobicContact CD2-CG2 4.28Å; I277-V281 HydrophobicContact CG2-CG2 4.24Å; I277-V281 WeakPolarHBondContact O-CB 3.29Å; I277-V281 VanDerWaalsContact O-CG2 3.31Å; I277-V281 WeakPolarHBondContact O-CG2 3.33Å; I277-V281 PolarHBondContact O-N 3.5Å; V281-L283 PolarHBondContact O-N 3.22Å; V281-I284 PolarHBondContact O-N 2.86Å; V281-V285 HydrophobicContact CG1-CG2 4.29Å; V281-V285 VanDerWaalsContact O-CB 3.29Å; V281-V285 WeakPolarHBondContact O-CB 3.2Å; V281-V285 VanDerWaalsContact O-CG2 3.31Å; V281-V285 WeakPolarHBondContact O-CG2 3.41Å; V281-V285 PolarHBondContact O-N 3.19Å
282A93.1Very high90.1Very high0 Ų042 Ų420%022%0.222CC..Hα-helixtrans-62.3-41.5-179.500000112.9F122 F126 F278 R279 N280 V286F122-A282 HydrophobicContact CD1-CB 4.03Å; F122-A282 HydrophobicContact CE1-CB 3.62Å; F122-A282 HydrophobicContact CZ-CB 4.27Å; F126-A282 HydrophobicContact CB-CB 3.91Å; F278-A282 VanDerWaalsContact O-CB 3.28Å; F278-A282 WeakPolarHBondContact O-CB 3.27Å; F278-A282 PolarHBondContact O-N 2.89Å; R279-A282 PolarHBondContact O-N 3.26Å; N280-A282 VanDerWaalsContact C-N 3.32Å; N280-A282 PolarHBondContact O-N 3.49Å; A282-V286 WeakPolarHBondContact O-CB 3.46Å; A282-V286 WeakPolarHBondContact O-CG2 3.15Å; A282-V286 PolarHBondContact O-N 2.65Å; A282-V286 VanDerWaalsContact O-N 3.09Å
283L93.6Very high90.9Very high92 Ų9239.2 Ų39.248%0.48221%0.208SC..Hα-helixtrans-65.6-44176.6-73171.1000112.4P123 R279 N280 V281 V286 G287P123-L283 HydrophobicContact CB-CD2 3.85Å; P123-L283 HydrophobicContact CG-CD2 4.23Å; R279-L283 HydrophobicContact CG-CD1 4.21Å; R279-L283 WeakPolarHBondContact O-CG 3.35Å; R279-L283 PolarHBondContact O-N 3.47Å; N280-L283 PolarHBondContact O-N 3.42Å; V281-L283 PolarHBondContact O-N 3.22Å; L283-V286 PolarHBondContact O-N 3.4Å; L283-G287 PolarHBondContact O-N 3.01Å
284I92.9Very high91.5Very high60 Ų6037 Ų3731%0.30820%0.199SC..Hα-helixtrans-64.5-47.9179.1-68.4165.5000110.4V197 F201 N280 V281 V286 G287 I288V197-I284 HydrophobicContact CG1-CB 4.39Å; V197-I284 HydrophobicContact CG1-CD1 4.13Å; V197-I284 HydrophobicContact CG1-CG2 3.94Å; V197-I284 HydrophobicContact CG2-CG2 4.21Å; F201-I284 HydrophobicContact CE2-CD1 3.37Å; F201-I284 HydrophobicContact CZ-CD1 3.56Å; N280-I284 WeakPolarHBondContact O-CD1 3.26Å; N280-I284 VanDerWaalsContact O-CG1 3.27Å; N280-I284 WeakPolarHBondContact O-CG1 3.48Å; N280-I284 PolarHBondContact O-N 3.5Å; V281-I284 PolarHBondContact O-N 2.86Å; I284-V286 VanDerWaalsContact C-N 3.29Å; I284-V286 PolarHBondContact O-N 3.43Å; I284-G287 PolarHBondContact O-N 3.39Å; I284-G287 VanDerWaalsContact O-N 3.15Å; I284-I288 HydrophobicContact CG2-CD1 3.77Å; I284-I288 HydrophobicContact CG2-CG1 4.41Å; I284-I288 WeakPolarHBondContact O-CG1 3.43Å; I284-I288 PolarHBondContact O-N 3.22Å
285V92.7Very high92Very high1 Ų140 Ų401%0.00622%0.215CC..Hα-helixtrans-54.8-46.5177.4154.30000111.2L18 V19 V22 F122 T194 V281 I288 G289L18-V285 HydrophobicContact CB-CG1 3.65Å; V19-V285 HydrophobicContact CG2-CG1 4.33Å; V22-V285 HydrophobicContact CG2-CG1 4.33Å; V22-V285 HydrophobicContact CG2-CG2 3.97Å; F122-V285 HydrophobicContact CE1-CB 4.46Å; F122-V285 HydrophobicContact CE1-CG1 3.93Å; F122-V285 HydrophobicContact CZ-CG1 4.41Å; T194-V285 HydrophobicContact CG2-CG2 4.03Å; V281-V285 HydrophobicContact CG1-CG2 4.29Å; V281-V285 VanDerWaalsContact O-CB 3.29Å; V281-V285 WeakPolarHBondContact O-CB 3.2Å; V281-V285 VanDerWaalsContact O-CG2 3.31Å; V281-V285 WeakPolarHBondContact O-CG2 3.41Å; V281-V285 PolarHBondContact O-N 3.19Å; V285-I288 PolarHBondContact O-N 3.35Å; V285-G289 PolarHBondContact O-N 3.44Å
286V94Very high92.4Very high4 Ų439.7 Ų39.72%0.02421%0.213CC..Hα-helixtrans-68.5-40.1179168.50000111.7L119 F122 P123 A282 L283 I284 I288 G289 V290L119-V286 HydrophobicContact CB-CG1 4.26Å; L119-V286 HydrophobicContact CD1-CG1 3.11Å; L119-V286 HydrophobicContact CG-CG1 4.23Å; F122-V286 HydrophobicContact CB-CG2 4.43Å; F122-V286 HydrophobicContact CD1-CG2 3.42Å; F122-V286 VanDerWaalsContact CD1-CG2 3.42Å; F122-V286 HydrophobicContact CE1-CG2 4.05Å; F122-V286 HydrophobicContact CG-CG2 4.34Å; P123-V286 HydrophobicContact CG-CB 4.35Å; P123-V286 HydrophobicContact CG-CG1 4.42Å; P123-V286 HydrophobicContact CG-CG2 4Å; A282-V286 WeakPolarHBondContact O-CB 3.46Å; A282-V286 WeakPolarHBondContact O-CG2 3.15Å; A282-V286 PolarHBondContact O-N 2.65Å; A282-V286 VanDerWaalsContact O-N 3.09Å; L283-V286 PolarHBondContact O-N 3.4Å; I284-V286 VanDerWaalsContact C-N 3.29Å; I284-V286 PolarHBondContact O-N 3.43Å; V286-I288 PolarHBondContact O-N 3.39Å; V286-G289 PolarHBondContact O-N 3.39Å; V286-V290 HydrophobicContact CG1-CG2 4.47Å; V286-V290 WeakPolarHBondContact O-CG2 3.44Å; V286-V290 PolarHBondContact O-N 3.35Å
287G94.2Very high92.7Very high44 Ų4439 Ų3945%0.45421%0.206SC..Hα-helixtrans-57.6-46.1174.300000112.7L283 I284 V290 L291L283-G287 PolarHBondContact O-N 3.01Å; I284-G287 PolarHBondContact O-N 3.39Å; I284-G287 VanDerWaalsContact O-N 3.15Å; G287-V290 PolarHBondContact O-N 2.97Å; G287-L291 PolarHBondContact O-N 3.48Å
288I94Very high92.9Very high43 Ų4343.3 Ų43.322%0.22124%0.237CC..Hα-helixtrans-63.4-43.1175-64.4169.2000110.5L18 T193 I284 V285 V286 V290 L291 F292L18-I288 HydrophobicContact CD1-CB 4.3Å; L18-I288 HydrophobicContact CD1-CG2 3.92Å; T193-I288 HydrophobicContact CG2-CD1 3.7Å; I284-I288 HydrophobicContact CG2-CD1 3.77Å; I284-I288 HydrophobicContact CG2-CG1 4.41Å; I284-I288 WeakPolarHBondContact O-CG1 3.43Å; I284-I288 PolarHBondContact O-N 3.22Å; V285-I288 PolarHBondContact O-N 3.35Å; V286-I288 PolarHBondContact O-N 3.39Å; I288-V290 VanDerWaalsContact C-N 3.35Å; I288-V290 PolarHBondContact O-N 3.47Å; I288-L291 WeakPolarHBondContact O-CB 3.38Å; I288-L291 PolarHBondContact O-N 2.96Å; I288-F292 HydrophobicContact CG2-CD2 3.97Å; I288-F292 HydrophobicContact CG2-CE2 3.61Å; I288-F292 VanDerWaalsContact O-CD2 3.27Å; I288-F292 WeakPolarHBondContact O-CD2 3.18Å; I288-F292 PolarHBondContact O-N 3.3Å
289G94.3Very high92.8Very high0 Ų044.3 Ų44.30%025%0.247CC..Hα-helixtrans-64.1-35.1178.700000114.1V285 V286 F292 T293V285-G289 PolarHBondContact O-N 3.44Å; V286-G289 PolarHBondContact O-N 3.39Å; G289-F292 PolarHBondContact O-N 2.87Å; G289-T293 WeakPolarHBondContact O-CB 3.41Å; G289-T293 PolarHBondContact O-N 3.34Å; G289-T293 PolarHBondContact O-OG1 3Å
290V94.6Very high92.7Very high48 Ų4839.4 Ų39.429%0.29123%0.229SC..Hα-helixtrans-62.5-43.1174.3169.10000111L119 V286 G287 I288 F292 T293 I294L119-V290 HydrophobicContact CD1-CG2 3.72Å; L119-V290 HydrophobicContact CD2-CG2 4.24Å; L119-V290 HydrophobicContact CG-CG2 4.5Å; V286-V290 HydrophobicContact CG1-CG2 4.47Å; V286-V290 WeakPolarHBondContact O-CG2 3.44Å; V286-V290 PolarHBondContact O-N 3.35Å; G287-V290 PolarHBondContact O-N 2.97Å; I288-V290 VanDerWaalsContact C-N 3.35Å; I288-V290 PolarHBondContact O-N 3.47Å; V290-F292 VanDerWaalsContact C-N 3.34Å; V290-F292 PolarHBondContact O-N 2.97Å; V290-T293 WeakPolarHBondContact O-CB 3.36Å; V290-T293 PolarHBondContact O-N 3.29Å; V290-I294 HydrophobicContact CG1-CD1 3.94Å; V290-I294 HydrophobicContact CG1-CG1 4.47Å; V290-I294 WeakPolarHBondContact O-CG1 3.45Å; V290-I294 PolarHBondContact O-N 2.92Å
291L94.7Very high92.1Very high101 Ų10146.8 Ų46.853%0.52925%0.253SS..Hα-helixtrans-55.9-48.6176.117966.4000111.4G287 I288 T293 I294 I295G287-L291 PolarHBondContact O-N 3.48Å; I288-L291 WeakPolarHBondContact O-CB 3.38Å; I288-L291 PolarHBondContact O-N 2.96Å; L291-T293 VanDerWaalsContact C-N 3.35Å; L291-T293 PolarHBondContact O-N 3.33Å; L291-I294 PolarHBondContact O-N 3.32Å; L291-I295 HydrophobicContact CG-CD1 4.39Å; L291-I295 WeakPolarHBondContact O-CG1 3.1Å; L291-I295 PolarHBondContact O-N 3.23Å; L291-I295 VanDerWaalsContact O-N 3.09Å
292F94.1Very high91.1Very high40 Ų4048.9 Ų48.918%0.17526%0.263CS..Hα-helixtrans-69.2-31.3179.1-71-63.1000113.8T11 M14 I288 G289 V290 I295 F296T11-F292 HydrophobicContact CG2-CD1 3.79Å; T11-F292 HydrophobicContact CG2-CE1 4.22Å; M14-F292 HydrophobicContact CB-CB 3.91Å; M14-F292 HydrophobicContact CB-CD2 4.08Å; M14-F292 HydrophobicContact CB-CG 4.08Å; M14-F292 HydrophobicContact CE-CD1 4.29Å; M14-F292 HydrophobicContact CE-CD2 3.57Å; M14-F292 HydrophobicContact CE-CE1 4.06Å; M14-F292 HydrophobicContact CE-CE2 3.28Å; M14-F292 HydrophobicContact CE-CG 4.07Å; M14-F292 HydrophobicContact CE-CZ 3.55Å; M14-F292 HydrophobicContact CG-CB 4.5Å; M14-F292 HydrophobicContact CG-CG 4.37Å; M14-F292 HydrophobicContact SD-CB 4.15Å; M14-F292 HydrophobicContact SD-CD1 3.48Å; M14-F292 WeakPolarHBondContact SD-CD1 3.45Å; M14-F292 HydrophobicContact SD-CD2 3.64Å; M14-F292 HydrophobicContact SD-CE1 3.65Å; M14-F292 HydrophobicContact SD-CE2 3.81Å; M14-F292 HydrophobicContact SD-CG 3.47Å; M14-F292 WeakPolarHBondContact SD-CG 3.3Å; M14-F292 HydrophobicContact SD-CZ 3.81Å; I288-F292 HydrophobicContact CG2-CD2 3.97Å; I288-F292 HydrophobicContact CG2-CE2 3.61Å; I288-F292 VanDerWaalsContact O-CD2 3.27Å; I288-F292 WeakPolarHBondContact O-CD2 3.18Å; I288-F292 PolarHBondContact O-N 3.3Å; G289-F292 PolarHBondContact O-N 2.87Å; V290-F292 VanDerWaalsContact C-N 3.34Å; V290-F292 PolarHBondContact O-N 2.97Å; F292-I295 HydrophobicContact CD1-CD1 3.95Å; F292-I295 HydrophobicContact CE1-CD1 4.37Å; F292-I295 PolarHBondContact O-N 3.43Å; F292-F296 PolarHBondContact O-N 3.5Å
293T93.4Very high89.6Confident10 Ų1052 Ų526%0.06129%0.294CS..Hα-helixtrans-64.3-43.2172.5-63.30000110.7C115 G289 V290 L291 I295 F296 H297C115-T293 HydrophobicContact CB-CG2 3.9Å; C115-T293 VanDerWaalsContact SG-CG2 3.6Å; G289-T293 WeakPolarHBondContact O-CB 3.41Å; G289-T293 PolarHBondContact O-N 3.34Å; G289-T293 PolarHBondContact O-OG1 3Å; V290-T293 WeakPolarHBondContact O-CB 3.36Å; V290-T293 PolarHBondContact O-N 3.29Å; L291-T293 VanDerWaalsContact C-N 3.35Å; L291-T293 PolarHBondContact O-N 3.33Å; T293-I295 VanDerWaalsContact C-N 3.35Å; T293-I295 PolarHBondContact O-N 2.93Å; T293-F296 PolarHBondContact O-N 3.31Å; T293-H297 PolarHBondContact O-CD2 3.33Å; T293-H297 VanDerWaalsContact O-CD2 3.23Å; T293-H297 PolarHBondContact O-N 3.41Å
294I93.7Very high87.7Confident95 Ų9557.1 Ų57.149%0.48731%0.313SS..Hα-helixtrans-60.2-46175-66.3165000110.4V290 L291 F296 H297 C298V290-I294 HydrophobicContact CG1-CD1 3.94Å; V290-I294 HydrophobicContact CG1-CG1 4.47Å; V290-I294 WeakPolarHBondContact O-CG1 3.45Å; V290-I294 PolarHBondContact O-N 2.92Å; L291-I294 PolarHBondContact O-N 3.32Å; I294-F296 VanDerWaalsContact C-N 3.33Å; I294-F296 PolarHBondContact O-N 3.29Å; I294-H297 PolarHBondContact O-N 2.86Å; I294-C298 WeakPolarHBondContact O-CB 3.47Å; I294-C298 PolarHBondContact O-N 2.94Å; I294-C298 PolarHBondContact O-SG 2.96Å; I294-C298 VanDerWaalsContact O-SG 3.41Å
295I93.6Very high85.7Confident66 Ų6659 Ų5934%0.33833%0.329SS..Hα-helixtrans-56.3-45.7177.5-67.3167.5000111.4A8 L291 F292 T293 G299A8-I295 HydrophobicContact CB-CG2 4.23Å; L291-I295 HydrophobicContact CG-CD1 4.39Å; L291-I295 WeakPolarHBondContact O-CG1 3.1Å; L291-I295 PolarHBondContact O-N 3.23Å; L291-I295 VanDerWaalsContact O-N 3.09Å; F292-I295 HydrophobicContact CD1-CD1 3.95Å; F292-I295 HydrophobicContact CE1-CD1 4.37Å; F292-I295 PolarHBondContact O-N 3.43Å; T293-I295 VanDerWaalsContact C-N 3.35Å; T293-I295 PolarHBondContact O-N 2.93Å; I295-G299 WeakPolarHBondContact O-CA 3.41Å; I295-G299 PolarHBondContact O-N 3.47Å
296F93.8Very high83.5Confident0 Ų066.1 Ų66.10%036%0.36CS..Hα-helixtrans-64.6-43.2177167.7-100.5000113A8 Y9 G12 K108 H111 H162 I165 F292 T293 I294 V300A8-F296 WeakPolarHBondContact O-CA 3.4Å; A8-F296 WeakPolarHBondContact O-CB 3.34Å; A8-F296 WeakPolarHBondContact O-CD2 3.38Å; Y9-F296 HydrophobicContact CD2-CE2 4.22Å; G12-F296 VanDerWaalsContact CA-CB 3.46Å; K108-F296 HydrophobicContact CG-CE1 4.09Å; K108-F296 HydrophobicContact CG-CZ 4.4Å; K108-F296 PolarHBondContact NZ-O 2.9Å; H111-F296 HydrophobicContact CB-CE1 4.47Å; H111-F296 AromaticContact CD2-CE1 3.94Å; H111-F296 AromaticContact CE1-CD1 3.51Å; H111-F296 AromaticContact CE1-CE1 3.61Å; H111-F296 AromaticContact CG-CE1 3.75Å; H111-F296 AromaticContact ND1-CD1 3.72Å; H111-F296 AromaticContact ND1-CE1 3.53Å; H111-F296 AromaticContact NE2-CE1 3.82Å; H162-F296 AromaticContact CD2-CE2 3.85Å; I165-F296 HydrophobicContact CD1-CZ 3.9Å; F292-F296 PolarHBondContact O-N 3.5Å; T293-F296 PolarHBondContact O-N 3.31Å; I294-F296 VanDerWaalsContact C-N 3.33Å; I294-F296 PolarHBondContact O-N 3.29Å; F296-V300 HydrophobicContact CD2-CB 4.36Å; F296-V300 HydrophobicContact CD2-CG2 3.75Å; F296-V300 HydrophobicContact CE2-CB 4.26Å; F296-V300 HydrophobicContact CE2-CG1 4.5Å; F296-V300 HydrophobicContact CE2-CG2 3.91Å; F296-V300 WeakPolarHBondContact O-CB 3.43Å; F296-V300 PolarHBondContact O-N 2.83Å; F296-V300 VanDerWaalsContact O-N 3.16Å
297H91.4Very high80.7Confident31 Ų3170.1 Ų70.114%0.14439%0.394CS..Hα-helixtrans-66.2-39.4-178.9-86-79.1000112.2L104 K108 H111 T293 I294L104-H297 VanDerWaalsContact CD2-ND1 3.26Å; L104-H297 WeakPolarHBondContact CD2-ND1 3.23Å; K108-H297 PolarHBondContact NZ-O 2.99Å; K108-H297 PolarHBondContact O-CE1 3.38Å; K108-H297 VanDerWaalsContact O-CE1 3.32Å; H111-H297 AromaticContact CE1-NE2 3.98Å; H111-H297 AromaticContact ND1-CE1 3.99Å; H111-H297 AromaticContact ND1-NE2 3.13Å; H111-H297 PolarHBondContact ND1-NE2 3.2Å; H111-H297 VanDerWaalsContact ND1-NE2 3.13Å; T293-H297 PolarHBondContact O-CD2 3.33Å; T293-H297 VanDerWaalsContact O-CD2 3.23Å; T293-H297 PolarHBondContact O-N 3.41Å; I294-H297 PolarHBondContact O-N 2.86Å
298C90.4Very high78Confident108 Ų10876.2 Ų76.273%0.7341%0.41SS*.Hα-helixtrans-77.6-40.2176.8-66.10000113.5I294I294-C298 WeakPolarHBondContact O-CB 3.47Å; I294-C298 PolarHBondContact O-N 2.94Å; I294-C298 PolarHBondContact O-SG 2.96Å; I294-C298 VanDerWaalsContact O-SG 3.41Å
299G88.3Confident74.7Confident23 Ų2382.7 Ų82.724%0.23744%0.439CS..Hα-helixtrans-86.7-23.7-169.600000115.6S5 I295S5-G299 PolarHBondContact OG-O 3.02Å; I295-G299 WeakPolarHBondContact O-CA 3.41Å; I295-G299 PolarHBondContact O-N 3.47Å
300V87.3Confident71.4Confident5 Ų586.7 Ų86.73%0.0347%0.467CS..  trans-99.5127.7176.7-177.40000109.1A8 K108 L169 F296A8-V300 HydrophobicContact CB-CG2 4Å; K108-V300 WeakPolarHBondContact CE-O 3.42Å; K108-V300 PolarHBondContact NZ-O 3.41Å; L169-V300 HydrophobicContact CD1-CG1 4.3Å; L169-V300 HydrophobicContact CD2-CG1 3.95Å; F296-V300 HydrophobicContact CD2-CB 4.36Å; F296-V300 HydrophobicContact CD2-CG2 3.75Å; F296-V300 HydrophobicContact CE2-CB 4.26Å; F296-V300 HydrophobicContact CE2-CG1 4.5Å; F296-V300 HydrophobicContact CE2-CG2 3.91Å; F296-V300 WeakPolarHBondContact O-CB 3.43Å; F296-V300 PolarHBondContact O-N 2.83Å; F296-V300 VanDerWaalsContact O-N 3.16Å
301R78.8Confident68Low211 Ų21193.2 Ų93.280%0.79649%0.492SS*.  trans-107.9121.2171.7-170.7171178.9170.6-3.1108.3G303R301-G303 PolarHBondContact O-N 3.36Å
302E71.5Confident64.6Low45 Ų4593.6 Ų93.621%0.2150%0.499CS..PPolyproline II helixtrans-68.7126172.5-80.2178.9-161.100109.1G105 Q106 K108G105-E302 WeakPolarHBondContact CA-OE2 3.27Å; Q106-E302 PolarHBondContact N-OE2 3.18Å; K108-E302 WeakPolarHBondContact CA-OE1 3.27Å; K108-E302 WeakPolarHBondContact CB-OE1 3.38Å; K108-E302 HydrophobicContact CD-CG 3.79Å; K108-E302 WeakPolarHBondContact CD-OE1 3.31Å; K108-E302 HydrophobicContact CG-CG 4.32Å; K108-E302 WeakPolarHBondContact CG-OE1 3.45Å; K108-E302 PolarHBondContact N-OE1 2.92Å
303G60.6Low61.4Low64 Ų6498.5 Ų98.566%0.6653%0.525SS*.PPolyproline II helixtrans-64.2154166.600000109.8R301R301-G303 PolarHBondContact O-N 3.36Å
304K53.6Low58.1Low201 Ų201105.7 Ų105.787%0.87456%0.558SS**PPolyproline II helixtrans-57.8134.4167.5-68.2-179.4-179.4177.10107.2K306K304-K306 PolarHBondContact O-N 3.47Å
305P51.5Low54.9Low100 Ų100104.9 Ų104.965%0.64956%0.561SS**PPolyproline II helixtrans-51.6129.617419.9-29.8000107.7A307P305-A307 VanDerWaalsContact C-N 3.32Å; P305-A307 PolarHBondContact O-N 3.42Å
306K46.4Very low51.7Low149 Ų149107.6 Ų107.665%0.64858%0.576SS**  trans-55.4102.4175.1-69.9177.9-178.6171.70106D171 K304D171-K306 IonicContact OD1-NZ 2.82Å; D171-K306 PolarHBondContact OD1-NZ 3.36Å; D171-K306 IonicContact OD2-NZ 3.61Å; D171-K306 PolarHBondContact OD2-NZ 3.26Å; K304-K306 PolarHBondContact O-N 3.47Å
307A35Very low48.6Very low89 Ų89115.3 Ų115.374%0.73661%0.612SS**  trans-61.4145.4-175.500000108.7P305 Q309P305-A307 VanDerWaalsContact C-N 3.32Å; P305-A307 PolarHBondContact O-N 3.42Å; A307-Q309 PolarHBondContact O-N 3.28Å
308H36.4Very low45.6Very low172 Ų172120.2 Ų120.280%0.79664%0.64SS**  trans-32.3112.1164.1-105.9-49.9000109.9S310H308-S310 PolarHBondContact O-N 3.24Å
309Q25.1Very low42.7Very low179 Ų179121.3 Ų121.384%0.83664%0.643SS**  trans-67.677.5138.8-88.9179.4-15.700105A307 F311A307-Q309 PolarHBondContact O-N 3.28Å; Q309-F311 PolarHBondContact O-N 3.35Å
310S24.8Very low39.8Very low84 Ų84125 Ų12559%0.58766%0.663SS**  trans-60.595.4147.143.30000103.7H308 T312H308-S310 PolarHBondContact O-N 3.24Å; S310-T312 PolarHBondContact O-N 3.15Å
311F23.3Very low37Very low184 Ų184132.2 Ų132.281%0.80770%0.701SS**  trans-60.397.5153.9-129.9-90.1000103.6Q309 I313Q309-F311 PolarHBondContact O-N 3.35Å; F311-I313 VanDerWaalsContact C-N 3.25Å; F311-I313 PolarHBondContact O-N 2.96Å
312T24.4Very low34.9Very low109 Ų109130.3 Ų130.367%0.66970%0.701SS**  trans-53.4107.4156.8-270000102.9S310 Q314S310-T312 PolarHBondContact O-N 3.15Å; T312-Q314 PolarHBondContact O-N 2.92Å
313I25.7Very low32.8Very low143 Ų143138.3 Ų138.373%0.73374%0.736SS**  trans-57.9101.3149.7-63.4175.5000101.2F311 S315F311-I313 VanDerWaalsContact C-N 3.25Å; F311-I313 PolarHBondContact O-N 2.96Å; I313-S315 PolarHBondContact O-N 3.04Å
314Q25.2Very low31.5Very low162 Ų162141.6 Ų141.676%0.75774%0.738SS**  trans-55.992.5149.4-84.1177.6-50.200102.9T312 N316T312-Q314 PolarHBondContact O-N 2.92Å; Q314-N316 PolarHBondContact O-N 3.3Å
315S25.7Very low30.3Very low78 Ų78140.1 Ų140.155%0.54573%0.734SS.*  trans-55.8103.4142.343.50000101.8I313 E317I313-S315 PolarHBondContact O-N 3.04Å; S315-E317 PolarHBondContact O-N 3.23Å
316N26.7Very low29.5Very low123 Ų123142.1 Ų142.166%0.65874%0.744SS**  trans-70.364.4165.1-140.929.5000105.5Q314 N318Q314-N316 PolarHBondContact O-N 3.3Å; N316-N318 PolarHBondContact O-N 3.27Å
317E28.6Very low28.7Very low162 Ų162142.3 Ų142.376%0.75775%0.752SS**  trans-77.577.3156.6-84.4179.2139.100104.3S315S315-E317 PolarHBondContact O-N 3.23Å
318N28.1Very low28.7Very low134 Ų134141.7 Ų141.772%0.71775%0.754SS**  trans-170.668.5167.5-87-22.4000108.2N316N316-N318 PolarHBondContact O-N 3.27Å
319T29.4Very low28.5Very low130 Ų130139.8 Ų139.880%0.79876%0.755SS**  trans-141.990147.735.20000106.8
320P28.4Very low28.8Very low101 Ų101137.8 Ų137.866%0.65675%0.75SS**  trans-70.9135.8156.730.3-25.2000108
321D27Very low29.3Very low156 Ų156139.9 Ų139.983%0.83476%0.755SS**  trans50.692.1148.9-48.9-37.3000118
322E35.4Very low29.8Very low171 Ų171136.9 Ų136.980%0.79975%0.747SS**  trans-14575.1149.4-140.8170.7-17400110.7L324E322-L324 HydrophobicContact CG-CD1 4.14Å; E322-L324 HydrophobicContact CG-CG 4.5Å; E322-L324 PolarHBondContact O-N 2.89Å
323F26.6Very low30.2Very low213 Ų213139.1 Ų139.193%0.93476%0.755SS**  trans-66.4102.6148.7-95.4-97.7000107
324L34.3Very low30.6Very low134 Ų134136 Ų13670%0.70276%0.757SS**  trans-136118.7162.1-94.7170.8000111.1E322E322-L324 HydrophobicContact CG-CD1 4.14Å; E322-L324 HydrophobicContact CG-CG 4.5Å; E322-L324 PolarHBondContact O-N 2.89Å
325E28.8Very low30.8Very low169 Ų169137.1 Ų137.179%0.7976%0.76SS**  trans-52.6135.4170.9-59.8173.7137.700111.4
326V34.7Very low31.1Very low142 Ų142138.7 Ų138.786%0.86176%0.761SS**  trans-129.5100.7155.1-178.90000108.3
327N28.5Very low31.2Very low153 Ų153140.2 Ų140.282%0.81877%0.769SS**  trans-58133.6164.3-83.7-38.2000110.4
328G34.9Very low31.5Very low76 Ų76135.9 Ų135.978%0.78477%0.768SS**  trans-168.979.3176.800000111.7
329T33.5Very low31.5Very low132 Ų132136.8 Ų136.881%0.8177%0.773SS**  trans-34.7131.817629.90000118.6
330N30.9Very low31.6Very low137 Ų137136.3 Ų136.373%0.73378%0.775SS**  42.1113.4129.9-78.3-1.3000119.9
331N34.9Very low31.7Very low129 Ų129137.2 Ų137.269%0.6978%0.779SS**  171130.295.4-93.2-24.6000113.5
332N34.8Very low31.7Very low121 Ų121135.7 Ų135.765%0.64778%0.775SS**  trans75.8110.6135.6-61.2-12.8000122
333N31.5Very low31.4Very low156 Ų156133.4 Ų133.483%0.83477%0.772SS**  84.5120.8125.3-60.4-10.4000120.2
334G34.1Very low31.5Very low76 Ų76127.4 Ų127.478%0.78476%0.757SS**  trans130.169158.400000114
335F29.2Very low31.6Very low187 Ų187128.8 Ų128.882%0.8276%0.76SS**  71.694.295.1-144.7-97.3000116
336I32Very low31.6Very low110 Ų110127.9 Ų127.956%0.56476%0.759SS**  76.5124.5123.3-61.8-158.8000122.1
337N30.4Very low31.4Very low155 Ų155130.8 Ų130.883%0.82976%0.76SS**  trans91.3120.9143.4-78.5-11.3000122.3
338G33.8Very low31.4Very low71 Ų71128.5 Ų128.573%0.73276%0.757SS**  trans16349.8155.200000118.2
339N28.6Very low31.1Very low153 Ų153134.1 Ų134.182%0.81876%0.759SS**  trans23.3102.1155.7-63.7-12.5000119.2
340S31Very low30.8Very low121 Ų121140 Ų14085%0.84677%0.767SS**  trans-114.9102.7150.261.10000109.5V342S340-V342 PolarHBondContact O-N 3.38Å
341V29.9Very low30.6Very low119 Ų119142.3 Ų142.372%0.72177%0.77SS**  trans-72.7120.6-177.9172.90000109.6V343V341-V343 HydrophobicContact CG1-CG2 3.87Å; V341-V343 PolarHBondContact O-N 3.01Å
342V27.1Very low30.4Very low124 Ų124145.3 Ų145.375%0.75277%0.772SS**  trans-66.4108.9163.8176.20000108.3S340S340-V342 PolarHBondContact O-N 3.38Å
343V31Very low30.1Very low123 Ų123145.7 Ų145.775%0.74578%0.779SS**  trans-102.584.9168.3-176.80000108.9V341V341-V343 HydrophobicContact CG1-CG2 3.87Å; V341-V343 PolarHBondContact O-N 3.01Å
344S27.7Very low30.5Very low88 Ų88145.3 Ų145.362%0.61577%0.767SS**  trans-95.895152.254.80000107.7
345Q37.1Very low30.4Very low163 Ų163146.3 Ų146.376%0.76276%0.761SS**  trans-141.6123.6166.2-80.9-58.3-33.500111.8
346L29.2Very low30.8Very low150 Ų150145.2 Ų145.279%0.78576%0.764SS**  trans-58.7141.8170.6-66.792.2000111.4
347K29.5Very low31.5Very low202 Ų202145.8 Ų145.888%0.87878%0.777SS**  171.8123.7125.6-96.5165.7179.9177.90112.8
348S28.7Very low32.7Very low106 Ų106146.8 Ų146.874%0.74177%0.774SS**  trans61.788.4132.6175.50000119.7
349K29.1Very low34.2Very low193 Ų193146.7 Ų146.784%0.83976%0.76SS**  173.9119.4116.9-105.6175.1176.5172.50108.7K351K349-K351 VanDerWaalsContact C-N 3.27Å; K349-K351 PolarHBondContact O-N 3.49Å
350R27.5Very low36.3Very low255 Ų255141.5 Ų141.596%0.96273%0.732SS**  trans-6381.3175.8-173.4-175.5-88.8171.9-7.3110.1
351K26Very low38.6Very low186 Ų186137.8 Ų137.881%0.80971%0.705SS**  trans-101.8109.2162.5-95.7-176.2175.7-179.60107.5K349 T353K349-K351 VanDerWaalsContact C-N 3.27Å; K349-K351 PolarHBondContact O-N 3.49Å; K351-T353 VanDerWaalsContact C-N 3.34Å; K351-T353 PolarHBondContact O-N 2.97Å
352R30.8Very low40.9Very low193 Ų193137.7 Ų137.773%0.72869%0.691SS**  trans-77.684.6-178.6-154.5173.3-161.4171.98108.2Y354R352-Y354 HydrophobicContact CB-CE2 4.45Å; R352-Y354 WeakPolarHBondContact CD-OH 3.37Å; R352-Y354 HydrophobicContact CG-CE1 4.43Å; R352-Y354 HydrophobicContact CG-CE2 4.13Å; R352-Y354 PolarHBondContact O-N 3.42Å
353T28.5Very low43.6Very low129 Ų129137.5 Ų137.579%0.79168%0.678SS**  trans-81.1102.6174.7-38.70000107.8K351 S355K351-T353 VanDerWaalsContact C-N 3.34Å; K351-T353 PolarHBondContact O-N 2.97Å; T353-S355 PolarHBondContact O-N 2.95Å
354Y39.6Very low46.2Very low148 Ų148132.1 Ų132.158%0.5865%0.647SS**  trans-70.2115.9174.1-66.3-84000108.7R352R352-Y354 HydrophobicContact CB-CE2 4.45Å; R352-Y354 WeakPolarHBondContact CD-OH 3.37Å; R352-Y354 HydrophobicContact CG-CE1 4.43Å; R352-Y354 HydrophobicContact CG-CE2 4.13Å; R352-Y354 PolarHBondContact O-N 3.42Å
355S33Very low49Very low96 Ų96128 Ų12867%0.67162%0.618SS**  trans-66.5144.2173.757.40000110.8T353 S357T353-S355 PolarHBondContact O-N 2.95Å; S355-S357 VanDerWaalsContact C-N 3.3Å; S355-S357 PolarHBondContact O-N 3.25Å
356L37.2Very low51.6Low165 Ų165123.6 Ų123.686%0.86460%0.596SS**THydrogen-bonded Turntrans-70.767.6-168.2-164.374.7000112.6
357S45.6Very low54.4Low121 Ų121121.7 Ų121.785%0.84659%0.591SS**THydrogen-bonded Turntrans-173.10.1160.9-95.80000116.4S355S355-S357 VanDerWaalsContact C-N 3.3Å; S355-S357 PolarHBondContact O-N 3.25Å
358F55.7Low57.2Low176 Ų176115.2 Ų115.277%0.77257%0.566SS**PPolyproline II helixtrans-86.6127.3179.7-108.8-99000112.4L360F358-L360 PolarHBondContact O-N 3.1Å
359T65.5Low60.1Low69 Ų69115.4 Ų115.442%0.42356%0.564SS.*PPolyproline II helixtrans-51.313117050.10000110.3
360L72.6Confident63.1Low44 Ų44108.4 Ų108.423%0.2353%0.533CS..PPolyproline II helixtrans-61.7128176.8-118.375.5000109.5F358 A364 W365 L368F358-L360 PolarHBondContact O-N 3.1Å; L360-A364 HydrophobicContact CD2-CB 3.87Å; L360-A364 HydrophobicContact CG-CB 3.86Å; L360-W365 HydrophobicContact CD2-CD2 4.39Å; L360-L368 HydrophobicContact CD2-CD1 3.81Å
361P78.8Confident66.1Low44 Ų4496.3 Ų96.329%0.28649%0.487SS..PPolyproline II helixtrans-63.9149.2169.628.4-33000109.4Y363 A364P361-Y363 HydrophobicContact CB-CD1 4.03Å; P361-Y363 HydrophobicContact CB-CE1 3.51Å; P361-Y363 HydrophobicContact CB-CE2 4.29Å; P361-Y363 HydrophobicContact CG-CD2 4.42Å; P361-Y363 HydrophobicContact CG-CE1 3.92Å; P361-Y363 HydrophobicContact CG-CE2 3.77Å; P361-Y363 VanDerWaalsContact CG-CZ 3.48Å; P361-Y363 PolarHBondContact O-N 3.42Å; P361-A364 HydrophobicContact CG-CB 3.79Å; P361-A364 WeakPolarHBondContact O-CB 3.5Å; P361-A364 PolarHBondContact O-N 2.96Å
362W79.4Confident69.3Low116 Ų11692 Ų9244%0.43947%0.466SS..G310 helixtrans-52.6-35.2-17266.8-93.4000113.9F366 T498 F501W362-F366 HydrophobicContact CE3-CE2 4.27Å; W362-F366 HydrophobicContact CZ3-CE2 4.06Å; W362-T498 HydrophobicContact CB-CG2 4.42Å; W362-F501 HydrophobicContact CB-CD1 3.9Å; W362-F501 HydrophobicContact CB-CE1 4.04Å; W362-F501 HydrophobicContact CB-CG 4.32Å; W362-F501 HydrophobicContact CD2-CZ 4.42Å; W362-F501 AromaticContact CE3-CE1 3.9Å; W362-F501 HydrophobicContact CE3-CE1 3.9Å; W362-F501 HydrophobicContact CE3-CE2 4.08Å; W362-F501 AromaticContact CE3-CZ 3.5Å; W362-F501 HydrophobicContact CE3-CZ 3.5Å; W362-F501 VanDerWaalsContact CE3-CZ 3.5Å; W362-F501 HydrophobicContact CZ3-CZ 4.12Å; W362-F501 WeakPolarHBondContact O-CE1 3.1Å
363Y83.8Confident72.4Confident121 Ų12184.5 Ų84.548%0.47544%0.44SS..G310 helixtrans-76-22.1-179.359.3-101000113.2P361 W365 F366P361-Y363 HydrophobicContact CB-CD1 4.03Å; P361-Y363 HydrophobicContact CB-CE1 3.51Å; P361-Y363 HydrophobicContact CB-CE2 4.29Å; P361-Y363 HydrophobicContact CG-CD2 4.42Å; P361-Y363 HydrophobicContact CG-CE1 3.92Å; P361-Y363 HydrophobicContact CG-CE2 3.77Å; P361-Y363 VanDerWaalsContact CG-CZ 3.48Å; P361-Y363 PolarHBondContact O-N 3.42Å; Y363-W365 PolarHBondContact O-N 2.99Å; Y363-F366 WeakPolarHBondContact O-CD2 3.38Å; Y363-F366 PolarHBondContact O-N 3.5Å
364A86.1Confident75.4Confident10 Ų1078.4 Ų78.48%0.08340%0.402CS..G310 helixtrans-70.7-21.7-178.500000112.3L360 P361 F366 T367L360-A364 HydrophobicContact CD2-CB 3.87Å; L360-A364 HydrophobicContact CG-CB 3.86Å; P361-A364 HydrophobicContact CG-CB 3.79Å; P361-A364 WeakPolarHBondContact O-CB 3.5Å; P361-A364 PolarHBondContact O-N 2.96Å; A364-F366 PolarHBondContact O-N 2.8Å; A364-T367 WeakPolarHBondContact O-CB 3.31Å; A364-T367 PolarHBondContact O-N 3.12Å; A364-T367 PolarHBondContact O-OG1 3.09Å
365W86.2Confident78Confident2 Ų271.4 Ų71.41%0.00838%0.375CS..G310 helixtrans-53.7-40174.4-77.7110.5000113.1L360 Y363 T367 L368 F371 L490 Q495 T498 V502L360-W365 HydrophobicContact CD2-CD2 4.39Å; Y363-W365 PolarHBondContact O-N 2.99Å; W365-T367 PolarHBondContact O-N 3.39Å; W365-T367 VanDerWaalsContact O-N 3.1Å; W365-L368 HydrophobicContact CE3-CD1 3.93Å; W365-L368 HydrophobicContact CZ3-CD1 4.19Å; W365-L368 PolarHBondContact O-N 3.02Å; W365-L368 VanDerWaalsContact O-N 3.08Å; W365-F371 HydrophobicContact CB-CD2 4.05Å; W365-F371 HydrophobicContact CB-CE2 4.05Å; W365-F371 HydrophobicContact CB-CG 4.49Å; W365-F371 HydrophobicContact CB-CZ 4.47Å; W365-F371 HydrophobicContact CD2-CD2 4.26Å; W365-F371 AromaticContact CE3-CD2 3.66Å; W365-F371 HydrophobicContact CE3-CD2 3.66Å; W365-F371 HydrophobicContact CE3-CE2 4.33Å; W365-F371 HydrophobicContact CE3-CG 4.45Å; W365-F371 HydrophobicContact CG-CD2 4.47Å; W365-F371 HydrophobicContact CG-CE2 4.46Å; W365-F371 HydrophobicContact CZ3-CD2 4.39Å; W365-L490 HydrophobicContact CH2-CG 4.45Å; W365-L490 HydrophobicContact CZ3-CD1 4.06Å; W365-L490 HydrophobicContact CZ3-CD2 4.46Å; W365-L490 HydrophobicContact CZ3-CG 3.89Å; W365-Q495 HydrophobicContact CZ2-CB 4.17Å; W365-T498 PolarHBondContact NE1-OG1 3.23Å; W365-T498 VanDerWaalsContact NE1-OG1 3.16Å; W365-V502 HydrophobicContact CD2-CG2 3.84Å; W365-V502 HydrophobicContact CG-CG2 4.09Å; W365-V502 HydrophobicContact CH2-CG2 4.4Å; W365-V502 HydrophobicContact CZ2-CG2 3.68Å
366F90Very high80.9Confident70 Ų7069.3 Ų69.331%0.30736%0.36SS..G310 helixtrans-65.1-16.3-179.2-61.1-60000114W362 Y363 A364 F371 W372 F501 I505W362-F366 HydrophobicContact CE3-CE2 4.27Å; W362-F366 HydrophobicContact CZ3-CE2 4.06Å; Y363-F366 WeakPolarHBondContact O-CD2 3.38Å; Y363-F366 PolarHBondContact O-N 3.5Å; A364-F366 PolarHBondContact O-N 2.8Å; F366-F371 AromaticContact CD1-CE1 3.89Å; F366-F371 HydrophobicContact CD1-CE1 3.89Å; F366-F371 HydrophobicContact CE1-CE1 4.03Å; F366-F371 HydrophobicContact CE1-CZ 4.34Å; F366-W372 HydrophobicContact CB-CZ2 4.2Å; F366-W372 AromaticContact CD1-CH2 3.79Å; F366-W372 HydrophobicContact CD1-CH2 3.79Å; F366-W372 AromaticContact CD1-CZ2 3.59Å; F366-W372 HydrophobicContact CD1-CZ2 3.59Å; F366-W372 HydrophobicContact CE1-CH2 4.24Å; F366-W372 HydrophobicContact CE1-CZ2 4.47Å; F366-W372 HydrophobicContact CG-CZ2 4.34Å; F366-W372 PolarHBondContact O-NE1 3.4Å; F366-F501 HydrophobicContact CE2-CE1 4.37Å; F366-F501 HydrophobicContact CE2-CZ 4.12Å; F366-F501 HydrophobicContact CZ-CE1 4.26Å; F366-F501 AromaticContact CZ-CZ 3.97Å; F366-F501 HydrophobicContact CZ-CZ 3.97Å; F366-I505 HydrophobicContact CE1-CG2 4.18Å; F366-I505 HydrophobicContact CZ-CD1 4.11Å; F366-I505 HydrophobicContact CZ-CG1 4.28Å
367T89.4Confident83.6Confident110 Ų11061.4 Ų61.468%0.67532%0.319SS*.G310 helixtrans-84.1-11.9177.968.70000113.2A364 W365A364-T367 WeakPolarHBondContact O-CB 3.31Å; A364-T367 PolarHBondContact O-N 3.12Å; A364-T367 PolarHBondContact O-OG1 3.09Å; W365-T367 PolarHBondContact O-N 3.39Å; W365-T367 VanDerWaalsContact O-N 3.1Å
368L88.1Confident85.9Confident66 Ų6656 Ų5635%0.34628%0.28SS..  trans-89.2120.2-178.4-63.7173.6000110.3L360 W365 R370 F371L360-L368 HydrophobicContact CD2-CD1 3.81Å; W365-L368 HydrophobicContact CE3-CD1 3.93Å; W365-L368 HydrophobicContact CZ3-CD1 4.19Å; W365-L368 PolarHBondContact O-N 3.02Å; W365-L368 VanDerWaalsContact O-N 3.08Å; L368-R370 VanDerWaalsContact C-N 3.29Å; L368-R370 PolarHBondContact O-N 2.86Å; L368-F371 HydrophobicContact CB-CB 4.05Å; L368-F371 VanDerWaalsContact O-CB 3.3Å; L368-F371 WeakPolarHBondContact O-CB 3.35Å; L368-F371 PolarHBondContact O-N 2.89Å; L368-F371 VanDerWaalsContact O-N 3.15Å
369P90.2Very high87.8Confident110 Ų11047.8 Ų47.871%0.71424%0.244SC*.Hα-helixtrans-62.9-36.1178.123.2-32.8000112.4F371 W372 L373P369-F371 PolarHBondContact O-N 3.25Å; P369-W372 PolarHBondContact O-N 3.45Å; P369-L373 PolarHBondContact O-N 3.19Å
370R90.3Very high89.3Confident46 Ų4645.3 Ų45.317%0.17423%0.228CC..Hα-helixtrans-60.1-33.3176.3-174.8176.2167.3-166.1-7.7112.6L368 W372 L373 S374 L490 T559L368-R370 VanDerWaalsContact C-N 3.29Å; L368-R370 PolarHBondContact O-N 2.86Å; R370-W372 VanDerWaalsContact C-N 3.32Å; R370-W372 PolarHBondContact O-N 2.97Å; R370-L373 PolarHBondContact O-N 3.42Å; R370-S374 WeakPolarHBondContact O-CB 3.49Å; R370-S374 PolarHBondContact O-N 3.47Å; R370-S374 PolarHBondContact O-OG 3.42Å; R370-L490 HydrophobicContact CG-CD1 4.23Å; R370-T559 PolarHBondContact NH1-OG1 3.38Å
371F91.9Very high90.3Very high0 Ų043.4 Ų43.40%022%0.218CC..Hα-helixtrans-58.5-45.3178.1172-93.3000111.7W365 F366 L368 P369 C375 L490 V502 I505W365-F371 HydrophobicContact CB-CD2 4.05Å; W365-F371 HydrophobicContact CB-CE2 4.05Å; W365-F371 HydrophobicContact CB-CG 4.49Å; W365-F371 HydrophobicContact CB-CZ 4.47Å; W365-F371 HydrophobicContact CD2-CD2 4.26Å; W365-F371 AromaticContact CE3-CD2 3.66Å; W365-F371 HydrophobicContact CE3-CD2 3.66Å; W365-F371 HydrophobicContact CE3-CE2 4.33Å; W365-F371 HydrophobicContact CE3-CG 4.45Å; W365-F371 HydrophobicContact CG-CD2 4.47Å; W365-F371 HydrophobicContact CG-CE2 4.46Å; W365-F371 HydrophobicContact CZ3-CD2 4.39Å; F366-F371 AromaticContact CD1-CE1 3.89Å; F366-F371 HydrophobicContact CD1-CE1 3.89Å; F366-F371 HydrophobicContact CE1-CE1 4.03Å; F366-F371 HydrophobicContact CE1-CZ 4.34Å; L368-F371 HydrophobicContact CB-CB 4.05Å; L368-F371 VanDerWaalsContact O-CB 3.3Å; L368-F371 WeakPolarHBondContact O-CB 3.35Å; L368-F371 PolarHBondContact O-N 2.89Å; L368-F371 VanDerWaalsContact O-N 3.15Å; P369-F371 PolarHBondContact O-N 3.25Å; F371-C375 PolarHBondContact O-N 3.33Å; F371-C375 PolarHBondContact O-SG 3.35Å; F371-L490 HydrophobicContact CD2-CD2 3.81Å; F371-V502 HydrophobicContact CE2-CG1 4.14Å; F371-I505 HydrophobicContact CE1-CG2 4.13Å; F371-I505 HydrophobicContact CZ-CB 4.22Å; F371-I505 HydrophobicContact CZ-CG2 3.67Å
372W93.7Very high91Very high97 Ų9743.6 Ų43.637%0.36721%0.213SC..Hα-helixtrans-66.8-42.1178.6-63.6106.8000112.3F366 P369 R370 C375 S376 F509F366-W372 HydrophobicContact CB-CZ2 4.2Å; F366-W372 AromaticContact CD1-CH2 3.79Å; F366-W372 HydrophobicContact CD1-CH2 3.79Å; F366-W372 AromaticContact CD1-CZ2 3.59Å; F366-W372 HydrophobicContact CD1-CZ2 3.59Å; F366-W372 HydrophobicContact CE1-CH2 4.24Å; F366-W372 HydrophobicContact CE1-CZ2 4.47Å; F366-W372 HydrophobicContact CG-CZ2 4.34Å; F366-W372 PolarHBondContact O-NE1 3.4Å; P369-W372 PolarHBondContact O-N 3.45Å; R370-W372 VanDerWaalsContact C-N 3.32Å; R370-W372 PolarHBondContact O-N 2.97Å; W372-C375 PolarHBondContact O-N 2.81Å; W372-S376 WeakPolarHBondContact O-CB 3.43Å; W372-S376 PolarHBondContact O-N 2.98Å; W372-S376 PolarHBondContact O-OG 2.94Å; W372-S376 VanDerWaalsContact O-OG 3.09Å; W372-F509 HydrophobicContact CE3-CE2 4.49Å; W372-F509 HydrophobicContact CE3-CZ 4.35Å; W372-F509 HydrophobicContact CH2-CE2 4.47Å; W372-F509 HydrophobicContact CH2-CZ 4.34Å; W372-F509 HydrophobicContact CZ3-CE1 4.36Å; W372-F509 AromaticContact CZ3-CE2 3.66Å; W372-F509 HydrophobicContact CZ3-CE2 3.66Å; W372-F509 AromaticContact CZ3-CZ 3.48Å; W372-F509 HydrophobicContact CZ3-CZ 3.48Å; W372-F509 VanDerWaalsContact CZ3-CZ 3.48Å
373L94.2Very high91.8Very high35 Ų3538.2 Ų38.218%0.18319%0.193CC..Hα-helixtrans-60.7-47.3176.1177.963.6000111.9P369 R370 C375 S376 T377 L548 I551 D552 I555P369-L373 PolarHBondContact O-N 3.19Å; R370-L373 PolarHBondContact O-N 3.42Å; L373-C375 PolarHBondContact O-N 3.05Å; L373-S376 PolarHBondContact O-N 3.43Å; L373-T377 WeakPolarHBondContact O-CB 3.49Å; L373-T377 PolarHBondContact O-N 2.92Å; L373-T377 PolarHBondContact O-OG1 3.26Å; L373-L548 HydrophobicContact CD1-CD2 4.07Å; L373-I551 HydrophobicContact CD2-CG2 4.06Å; L373-D552 HydrophobicContact CD2-CB 4.12Å; L373-D552 HydrophobicContact CG-CB 4.28Å; L373-I555 HydrophobicContact CD2-CD1 3.48Å; L373-I555 VanDerWaalsContact CD2-CD1 3.48Å
374S92.6Very high92.4Very high0 Ų032.4 Ų32.40%017%0.17CC..Hα-helixtrans-64-39.7179.5-58.80000111.8R370 F378 D552R370-S374 WeakPolarHBondContact O-CB 3.49Å; R370-S374 PolarHBondContact O-N 3.47Å; R370-S374 PolarHBondContact O-OG 3.42Å; S374-F378 WeakPolarHBondContact O-CB 3.35Å; S374-F378 PolarHBondContact O-N 2.96Å; S374-D552 PolarHBondContact OG-OD1 3.26Å
375C94.3Very high92.8Very high1 Ų133 Ų331%0.00717%0.173CC..Hα-helixtrans-66-41.9175.8-690000112.4F371 W372 L373 F378 S379F371-C375 PolarHBondContact O-N 3.33Å; F371-C375 PolarHBondContact O-SG 3.35Å; W372-C375 PolarHBondContact O-N 2.81Å; L373-C375 PolarHBondContact O-N 3.05Å; C375-F378 PolarHBondContact O-N 3.34Å; C375-S379 WeakPolarHBondContact O-CB 3.25Å; C375-S379 PolarHBondContact O-N 3.29Å; C375-S379 PolarHBondContact O-OG 3.03Å
376S94.4Very high93.2Very high52 Ų5234.3 Ų34.336%0.36418%0.181SC..Hα-helixtrans-64.5-44.9175.9-64.70000111.7W372 L373 F378 S379 I380W372-S376 WeakPolarHBondContact O-CB 3.43Å; W372-S376 PolarHBondContact O-N 2.98Å; W372-S376 PolarHBondContact O-OG 2.94Å; W372-S376 VanDerWaalsContact O-OG 3.09Å; L373-S376 PolarHBondContact O-N 3.43Å; S376-F378 PolarHBondContact O-N 3.17Å; S376-S379 PolarHBondContact O-N 3.33Å; S376-I380 WeakPolarHBondContact O-CD1 3.27Å; S376-I380 WeakPolarHBondContact O-CG1 3.48Å; S376-I380 PolarHBondContact O-N 3.47Å
377T93.6Very high93.4Very high0 Ų031 Ų310%017%0.166CC..Hα-helixtrans-57.8-49.8175.5-57.20000111.2L373 S379 I380 M381 V486 L548 A549L373-T377 WeakPolarHBondContact O-CB 3.49Å; L373-T377 PolarHBondContact O-N 2.92Å; L373-T377 PolarHBondContact O-OG1 3.26Å; T377-S379 VanDerWaalsContact C-N 3.32Å; T377-S379 PolarHBondContact O-N 3.48Å; T377-I380 PolarHBondContact O-N 3.09Å; T377-M381 HydrophobicContact CG2-CG 4.5Å; T377-M381 HydrophobicContact CG2-SD 4.1Å; T377-M381 WeakPolarHBondContact O-CB 3.46Å; T377-M381 WeakPolarHBondContact O-CG 3.16Å; T377-M381 PolarHBondContact O-N 3.42Å; T377-V486 HydrophobicContact CG2-CG1 4.4Å; T377-V486 HydrophobicContact CG2-CG2 4.17Å; T377-L548 HydrophobicContact CG2-CB 4.28Å; T377-L548 WeakPolarHBondContact OG1-CB 3.27Å; T377-A549 HydrophobicContact CG2-CB 3.68Å
378F94.2Very high93.7Very high8 Ų825.7 Ų25.74%0.03513%0.134CC..Hα-helixtrans-55.2-47.2176.5171.2-98.7000111.9S374 C375 S376 R382 A483 I487 A506 D510S374-F378 WeakPolarHBondContact O-CB 3.35Å; S374-F378 PolarHBondContact O-N 2.96Å; C375-F378 PolarHBondContact O-N 3.34Å; S376-F378 PolarHBondContact O-N 3.17Å; F378-R382 HydrophobicContact CE2-CG 4.43Å; F378-R382 WeakPolarHBondContact O-CB 3.47Å; F378-R382 VanDerWaalsContact O-CG 3.28Å; F378-R382 WeakPolarHBondContact O-CG 3.28Å; F378-R382 PolarHBondContact O-N 3.44Å; F378-R382 VanDerWaalsContact O-N 3.14Å; F378-A483 HydrophobicContact CD2-CB 3.94Å; F378-A483 WeakPolarHBondContact CD2-O 3.42Å; F378-I487 HydrophobicContact CB-CD1 3.88Å; F378-I487 HydrophobicContact CB-CG1 3.88Å; F378-I487 HydrophobicContact CD2-CG1 3.64Å; F378-I487 HydrophobicContact CE2-CG1 4.28Å; F378-I487 HydrophobicContact CG-CD1 4.2Å; F378-I487 HydrophobicContact CG-CG1 3.8Å; F378-A506 HydrophobicContact CD1-CB 4.18Å; F378-A506 HydrophobicContact CE1-CB 4.31Å; F378-A506 WeakPolarHBondContact CE1-O 3.32Å; F378-D510 HydrophobicContact CD1-CB 4.02Å; F378-D510 HydrophobicContact CE1-CB 3.64Å
379S95.3Very high94Very high2 Ų224.7 Ų24.71%0.01413%0.131CC..Hα-helixtrans-67.4-45.6-176-55.30000112.1C375 S376 T377 R382 L383 D510C375-S379 WeakPolarHBondContact O-CB 3.25Å; C375-S379 PolarHBondContact O-N 3.29Å; C375-S379 PolarHBondContact O-OG 3.03Å; S376-S379 PolarHBondContact O-N 3.33Å; T377-S379 VanDerWaalsContact C-N 3.32Å; T377-S379 PolarHBondContact O-N 3.48Å; S379-R382 PolarHBondContact O-N 3.18Å; S379-L383 WeakPolarHBondContact O-CB 3.35Å; S379-L383 PolarHBondContact O-N 3.29Å; S379-D510 WeakPolarHBondContact OG-CA 3.39Å; S379-D510 PolarHBondContact OG-N 3.47Å; S379-D510 VanDerWaalsContact OG-N 3.17Å
380I96.2Very high94.2Very high18 Ų1819.7 Ų19.79%0.09210%0.098CC..Hα-helixtrans-71.5-41.3-176.8-68.9157.5000111.6S376 T377 R382 L383 S384 L513 F544 L548S376-I380 WeakPolarHBondContact O-CD1 3.27Å; S376-I380 WeakPolarHBondContact O-CG1 3.48Å; S376-I380 PolarHBondContact O-N 3.47Å; T377-I380 PolarHBondContact O-N 3.09Å; I380-R382 VanDerWaalsContact C-N 3.34Å; I380-R382 PolarHBondContact O-N 3.43Å; I380-L383 WeakPolarHBondContact O-CB 3.36Å; I380-L383 PolarHBondContact O-N 3.16Å; I380-S384 PolarHBondContact O-N 3.46Å; I380-L513 HydrophobicContact CG1-CD2 4Å; I380-F544 HydrophobicContact CD1-CD1 3.69Å; I380-F544 HydrophobicContact CD1-CE1 3.36Å; I380-F544 HydrophobicContact CD1-CZ 4.39Å; I380-F544 HydrophobicContact CG1-CD1 4.34Å; I380-F544 HydrophobicContact CG1-CE1 4.37Å; I380-F544 HydrophobicContact CG2-CB 4.5Å; I380-F544 HydrophobicContact CG2-CD1 3.79Å; I380-L548 HydrophobicContact CD1-CD1 3.25Å; I380-L548 HydrophobicContact CG1-CD1 4.5Å
381M93.9Very high94.4Very high4 Ų417.5 Ų17.52%0.029%0.089CC..Hα-helixtrans-61.6-43.7175.6-74.9-171.713500111.4T377 V385 R482 A483 A549T377-M381 HydrophobicContact CG2-CG 4.5Å; T377-M381 HydrophobicContact CG2-SD 4.1Å; T377-M381 WeakPolarHBondContact O-CB 3.46Å; T377-M381 WeakPolarHBondContact O-CG 3.16Å; T377-M381 PolarHBondContact O-N 3.42Å; M381-V385 PolarHBondContact O-N 2.8Å; M381-R482 HydrophobicContact CE-CB 4.26Å; M381-R482 HydrophobicContact SD-CB 4.22Å; M381-A483 HydrophobicContact CB-CB 3.96Å; M381-A483 HydrophobicContact SD-CB 4.43Å; M381-A549 HydrophobicContact CE-CB 3.39Å; M381-A549 HydrophobicContact SD-CB 3.91Å
382R93.9Very high94.4Very high48 Ų4817.8 Ų17.818%0.1819%0.091CC..Hα-helixtrans-69.6-34.3176.7-74178.660.775.410.7112.8F378 S379 I380 V385 T386 A483 D510F378-R382 HydrophobicContact CE2-CG 4.43Å; F378-R382 WeakPolarHBondContact O-CB 3.47Å; F378-R382 VanDerWaalsContact O-CG 3.28Å; F378-R382 WeakPolarHBondContact O-CG 3.28Å; F378-R382 PolarHBondContact O-N 3.44Å; F378-R382 VanDerWaalsContact O-N 3.14Å; S379-R382 PolarHBondContact O-N 3.18Å; I380-R382 VanDerWaalsContact C-N 3.34Å; I380-R382 PolarHBondContact O-N 3.43Å; R382-V385 PolarHBondContact O-N 2.95Å; R382-T386 WeakPolarHBondContact O-CB 3.4Å; R382-T386 PolarHBondContact O-N 2.86Å; R382-T386 PolarHBondContact O-OG1 3.19Å; R382-A483 HydrophobicContact CG-CB 3.89Å; R382-D510 WeakPolarHBondContact CB-OD1 3.31Å; R382-D510 IonicContact CZ-OD2 3.61Å; R382-D510 IonicContact NE-OD1 3.53Å; R382-D510 IonicContact NE-OD2 3.33Å; R382-D510 PolarHBondContact NE-OD2 2.93Å; R382-D510 IonicContact NH2-OD2 2.97Å
383L95.8Very high94.3Very high2 Ų213.1 Ų13.11%0.017%0.073CC..Hα-helixtrans-60.6-48.1174.3179.360.4000111.3S379 I380 V385 T386 V387 L513 T514 F517 L541S379-L383 WeakPolarHBondContact O-CB 3.35Å; S379-L383 PolarHBondContact O-N 3.29Å; I380-L383 WeakPolarHBondContact O-CB 3.36Å; I380-L383 PolarHBondContact O-N 3.16Å; L383-V385 VanDerWaalsContact C-N 3.34Å; L383-V385 PolarHBondContact O-N 2.92Å; L383-T386 PolarHBondContact O-N 2.84Å; L383-T386 VanDerWaalsContact O-N 3.16Å; L383-V387 HydrophobicContact CD1-CG2 3.87Å; L383-V387 HydrophobicContact CG-CG2 4.3Å; L383-V387 WeakPolarHBondContact O-CG2 3.49Å; L383-V387 PolarHBondContact O-N 3.5Å; L383-L513 HydrophobicContact CD2-CD2 4.2Å; L383-L513 HydrophobicContact CD2-CG 4.12Å; L383-T514 HydrophobicContact CD1-CG2 4.23Å; L383-F517 HydrophobicContact CD1-CB 4.1Å; L383-F517 HydrophobicContact CD1-CD1 4.16Å; L383-F517 HydrophobicContact CD1-CG 4.32Å; L383-F517 HydrophobicContact CD2-CB 4Å; L383-F517 HydrophobicContact CD2-CD1 4Å; L383-F517 HydrophobicContact CD2-CD2 4.03Å; L383-F517 HydrophobicContact CD2-CE1 4.47Å; L383-F517 HydrophobicContact CD2-CG 3.75Å; L383-F517 HydrophobicContact CG-CD1 4.34Å; L383-F517 HydrophobicContact CG-CG 4.49Å; L383-L541 HydrophobicContact CD2-CD1 4.17Å; L383-L541 HydrophobicContact CD2-CD2 3.86Å; L383-L541 HydrophobicContact CG-CD1 3.93Å; L383-L541 HydrophobicContact CG-CD2 4.42Å
384S95.6Very high94.2Very high0 Ų011.5 Ų11.50%07%0.065CC..Hα-helixtrans-54.1-49.7176.6179.40000111.6I380 T386 V387 S388 V538 A542I380-S384 PolarHBondContact O-N 3.46Å; S384-T386 PolarHBondContact O-N 3.38Å; S384-V387 PolarHBondContact O-N 2.92Å; S384-S388 PolarHBondContact O-N 2.96Å; S384-V538 PolarHBondContact OG-O 3.41Å; S384-A542 PolarHBondContact OG-N 3.48Å
385V94.7Very high94.2Very high22 Ų2211.6 Ų11.613%0.1337%0.065CC..Hα-helixtrans-61.8-45.8177.1176.50000111.1M381 R382 L383 V387 S388 V389 N476 N479M381-V385 PolarHBondContact O-N 2.8Å; R382-V385 PolarHBondContact O-N 2.95Å; L383-V385 VanDerWaalsContact C-N 3.34Å; L383-V385 PolarHBondContact O-N 2.92Å; V385-V387 PolarHBondContact O-N 3.36Å; V385-S388 PolarHBondContact O-N 2.9Å; V385-S388 PolarHBondContact O-OG 3.37Å; V385-V389 WeakPolarHBondContact O-CG2 3.37Å; V385-V389 PolarHBondContact O-N 3.2Å; V385-V389 VanDerWaalsContact O-N 3.12Å; V385-N476 HydrophobicContact CG1-CB 4.02Å; V385-N476 HydrophobicContact CG2-CB 4.23Å; V385-N479 HydrophobicContact CG2-CB 4.08Å
386T94.4Very high94Very high29 Ų2911.7 Ų11.718%0.1787%0.065CC..Hα-helixtrans-63.3-44.7-177.8-56.90000111.8R382 L383 S384 S388 V389 M390 T514 I518R382-T386 WeakPolarHBondContact O-CB 3.4Å; R382-T386 PolarHBondContact O-N 2.86Å; R382-T386 PolarHBondContact O-OG1 3.19Å; L383-T386 PolarHBondContact O-N 2.84Å; L383-T386 VanDerWaalsContact O-N 3.16Å; S384-T386 PolarHBondContact O-N 3.38Å; T386-S388 VanDerWaalsContact C-N 3.35Å; T386-V389 PolarHBondContact O-N 3.26Å; T386-M390 HydrophobicContact CG2-CE 4.34Å; T386-M390 WeakPolarHBondContact O-CB 3.39Å; T386-M390 PolarHBondContact O-N 3.45Å; T386-T514 HydrophobicContact CG2-CG2 3.97Å; T386-I518 HydrophobicContact CG2-CD1 4.44Å
387V95.7Very high93.7Very high0 Ų09.8 Ų9.80%05%0.051CC..Hα-helixtrans-62.5-43.6176.9173.40000110.4L383 S384 V385 V389 M390 Y391 F517 I521 I533 I537 V538 L541L383-V387 HydrophobicContact CD1-CG2 3.87Å; L383-V387 HydrophobicContact CG-CG2 4.3Å; L383-V387 WeakPolarHBondContact O-CG2 3.49Å; L383-V387 PolarHBondContact O-N 3.5Å; S384-V387 PolarHBondContact O-N 2.92Å; V385-V387 PolarHBondContact O-N 3.36Å; V387-V389 PolarHBondContact O-N 3.2Å; V387-M390 PolarHBondContact O-N 3.33Å; V387-Y391 HydrophobicContact CG1-CD2 3.84Å; V387-Y391 HydrophobicContact CG1-CE2 4.31Å; V387-Y391 WeakPolarHBondContact O-CD2 3.34Å; V387-Y391 PolarHBondContact O-N 3.1Å; V387-F517 HydrophobicContact CG2-CD1 4.23Å; V387-F517 HydrophobicContact CG2-CE1 4.44Å; V387-I521 HydrophobicContact CG1-CD1 4.14Å; V387-I521 HydrophobicContact CG2-CD1 4.25Å; V387-I533 HydrophobicContact CG1-CG2 4.08Å; V387-I537 HydrophobicContact CG1-CG2 4.39Å; V387-V538 HydrophobicContact CB-CG2 4.37Å; V387-V538 HydrophobicContact CG1-CG2 3.78Å; V387-L541 HydrophobicContact CG2-CD1 4.18Å
388S95.2Very high93.3Very high0 Ų013.2 Ų13.20%07%0.07CC..Hα-helixtrans-59.7-44.2-179.975.10000112.6S384 V385 T386 M392 N476 Q534S384-S388 PolarHBondContact O-N 2.96Å; V385-S388 PolarHBondContact O-N 2.9Å; V385-S388 PolarHBondContact O-OG 3.37Å; T386-S388 VanDerWaalsContact C-N 3.35Å; S388-M392 WeakPolarHBondContact O-CB 3.3Å; S388-M392 PolarHBondContact O-N 2.71Å; S388-N476 PolarHBondContact OG-ND2 2.95Å; S388-N476 PolarHBondContact OG-OD1 3.23Å; S388-Q534 PolarHBondContact O-NE2 3.17Å
389V93.6Very high93Very high45 Ų4513.7 Ų13.727%0.2737%0.074SC..Hα-helixtrans-75.2-43.6-179.4-178.20000110.8C24 V385 T386 V387 Y391 M392C24-V389 HydrophobicContact CB-CG1 3.78Å; V385-V389 WeakPolarHBondContact O-CG2 3.37Å; V385-V389 PolarHBondContact O-N 3.2Å; V385-V389 VanDerWaalsContact O-N 3.12Å; T386-V389 PolarHBondContact O-N 3.26Å; V387-V389 PolarHBondContact O-N 3.2Å; V389-Y391 PolarHBondContact O-N 3.47Å; V389-M392 WeakPolarHBondContact O-CB 3.35Å; V389-M392 PolarHBondContact O-N 3.03Å
390M94.4Very high92.6Very high4 Ų413.7 Ų13.72%0.027%0.074CC..Hα-helixtrans-67-38.1-174.5-172.4177.3-69.200113.3C24 I28 L46 T386 V387 I518C24-M390 VanDerWaalsContact O-CA 3.31Å; C24-M390 WeakPolarHBondContact O-CA 3.48Å; I28-M390 HydrophobicContact CD1-CG 3.73Å; I28-M390 HydrophobicContact CD1-SD 4.24Å; I28-M390 HydrophobicContact CG1-CG 4.21Å; L46-M390 HydrophobicContact CD1-CE 4.46Å; L46-M390 HydrophobicContact CD2-CE 3.88Å; L46-M390 HydrophobicContact CD2-SD 3.76Å; T386-M390 HydrophobicContact CG2-CE 4.34Å; T386-M390 WeakPolarHBondContact O-CB 3.39Å; T386-M390 PolarHBondContact O-N 3.45Å; V387-M390 PolarHBondContact O-N 3.33Å; M390-I518 HydrophobicContact CE-CD1 3.91Å; M390-I518 HydrophobicContact SD-CD1 3.73Å; M390-I518 HydrophobicContact SD-CG2 4.2Å
391Y94.8Very high92Very high0 Ų019.6 Ų19.60%010%0.099CC..THydrogen-bonded Turntrans-924.6178.6-71.8-81000113I28 V387 V389 F395 I518 I521 Q522 Y530 I533 Q534I28-Y391 HydrophobicContact CD1-CD1 3.72Å; I28-Y391 HydrophobicContact CD1-CE1 3.56Å; I28-Y391 HydrophobicContact CD1-CE2 4.49Å; I28-Y391 HydrophobicContact CD1-CG 4.29Å; V387-Y391 HydrophobicContact CG1-CD2 3.84Å; V387-Y391 HydrophobicContact CG1-CE2 4.31Å; V387-Y391 WeakPolarHBondContact O-CD2 3.34Å; V387-Y391 PolarHBondContact O-N 3.1Å; V389-Y391 PolarHBondContact O-N 3.47Å; Y391-F395 VanDerWaalsContact O-CB 3.23Å; Y391-F395 WeakPolarHBondContact O-CB 3.49Å; Y391-F395 PolarHBondContact O-N 3.35Å; Y391-F395 VanDerWaalsContact O-N 3.11Å; Y391-I518 HydrophobicContact CE2-CG2 4.47Å; Y391-I521 HydrophobicContact CE1-CG2 3.96Å; Y391-I521 HydrophobicContact CE2-CD1 3.92Å; Y391-I521 HydrophobicContact CE2-CG2 4.09Å; Y391-I521 VanDerWaalsContact CZ-CG2 3.5Å; Y391-I521 WeakPolarHBondContact OH-CB 3.36Å; Y391-I521 WeakPolarHBondContact OH-CG2 3.43Å; Y391-Q522 WeakPolarHBondContact OH-CG 3.05Å; Y391-Q522 PolarHBondContact OH-NE2 2.82Å; Y391-Y530 AromaticContact CD1-CD1 3.87Å; Y391-Y530 HydrophobicContact CD1-CD1 3.87Å; Y391-Y530 AromaticContact CD1-CE1 4Å; Y391-Y530 HydrophobicContact CD1-CE1 4Å; Y391-Y530 HydrophobicContact CE1-CD1 4.45Å; Y391-Y530 HydrophobicContact CE1-CE1 4.23Å; Y391-I533 HydrophobicContact CD1-CD1 4.05Å; Y391-I533 HydrophobicContact CD1-CG2 4.31Å; Y391-I533 HydrophobicContact CD2-CG2 3.96Å; Y391-I533 HydrophobicContact CE1-CD1 4.04Å; Y391-I533 HydrophobicContact CE2-CG2 4.45Å; Y391-I533 HydrophobicContact CG-CG2 3.86Å; Y391-Q534 PolarHBondContact O-NE2 3.35Å
392M92.9Very high91.5Very high6 Ų620.4 Ų20.43%0.0310%0.103CC..Hα-helixtrans-64.1-50.4179.4-178.259.878.300109.9S388 V389 F395 L396 V410 P411 F448 L472 Q534S388-M392 WeakPolarHBondContact O-CB 3.3Å; S388-M392 PolarHBondContact O-N 2.71Å; V389-M392 WeakPolarHBondContact O-CB 3.35Å; V389-M392 PolarHBondContact O-N 3.03Å; M392-F395 WeakPolarHBondContact O-CB 3.28Å; M392-F395 PolarHBondContact O-N 3.49Å; M392-F395 VanDerWaalsContact O-N 3.15Å; M392-F395 HydrophobicContact SD-CD1 4.24Å; M392-L396 HydrophobicContact CG-CD1 4.02Å; M392-L396 HydrophobicContact CG-CG 4.46Å; M392-L396 WeakPolarHBondContact O-CG 3.29Å; M392-L396 PolarHBondContact O-N 3.29Å; M392-L396 HydrophobicContact SD-CD1 4.27Å; M392-L396 HydrophobicContact SD-CD2 4.43Å; M392-L396 HydrophobicContact SD-CG 4.24Å; M392-V410 HydrophobicContact SD-CG1 4.35Å; M392-P411 HydrophobicContact CG-CG 4.1Å; M392-F448 HydrophobicContact CE-CE2 4.09Å; M392-F448 HydrophobicContact CE-CZ 3.86Å; M392-L472 HydrophobicContact CE-CD2 3.15Å; M392-Q534 VanDerWaalsContact N-NE2 3.1Å
393S91.7Very high90.9Very high0 Ų020.2 Ų20.20%011%0.105CC..Hα-helixtrans-59.4-51.7-178.7-59.20000113I25 I29 F395 L396 L397 M407I25-S393 WeakPolarHBondContact CG2-OG 3.05Å; I25-S393 WeakPolarHBondContact O-CB 3.22Å; I25-S393 PolarHBondContact O-OG 3.26Å; I29-S393 VanDerWaalsContact CD1-CB 3.43Å; S393-F395 VanDerWaalsContact C-N 3.29Å; S393-F395 PolarHBondContact O-N 2.88Å; S393-L396 PolarHBondContact O-N 3.14Å; S393-L397 PolarHBondContact O-N 3.14Å; S393-M407 WeakPolarHBondContact OG-CG 3.15Å
394P91.5Very high90.3Very high1 Ų121.3 Ų21.31%0.00611%0.11CC..Hα-helixtrans-60.4-33173.2-25.834.2000114.6I28 I29 N398 Y530I28-P394 HydrophobicContact CB-CG 4.08Å; I28-P394 HydrophobicContact CD1-CG 4.2Å; I28-P394 HydrophobicContact CG2-CG 3.8Å; I29-P394 HydrophobicContact CG1-CG 4.23Å; P394-N398 VanDerWaalsContact O-CB 3.27Å; P394-N398 WeakPolarHBondContact O-CB 3.37Å; P394-N398 PolarHBondContact O-N 3.48Å; P394-Y530 HydrophobicContact CB-CD1 3.44Å; P394-Y530 VanDerWaalsContact CB-CD1 3.44Å; P394-Y530 HydrophobicContact CB-CD2 4.28Å; P394-Y530 HydrophobicContact CB-CE1 3.38Å; P394-Y530 HydrophobicContact CB-CE2 4.26Å; P394-Y530 HydrophobicContact CB-CG 3.88Å; P394-Y530 HydrophobicContact CG-CD1 4.42Å; P394-Y530 HydrophobicContact CG-CE1 4.14Å
395F92.4Very high89.6Confident2 Ų222.4 Ų22.41%0.00912%0.117CC..Iπ-helixtrans-63.8-46.8176.2166.6-110.8000111.7Y391 M392 S393 S399 L400 A452 L455 R531 Q534Y391-F395 VanDerWaalsContact O-CB 3.23Å; Y391-F395 WeakPolarHBondContact O-CB 3.49Å; Y391-F395 PolarHBondContact O-N 3.35Å; Y391-F395 VanDerWaalsContact O-N 3.11Å; M392-F395 WeakPolarHBondContact O-CB 3.28Å; M392-F395 PolarHBondContact O-N 3.49Å; M392-F395 VanDerWaalsContact O-N 3.15Å; M392-F395 HydrophobicContact SD-CD1 4.24Å; S393-F395 VanDerWaalsContact C-N 3.29Å; S393-F395 PolarHBondContact O-N 2.88Å; F395-S399 WeakPolarHBondContact O-CA 3.46Å; F395-S399 WeakPolarHBondContact O-CB 3.41Å; F395-S399 PolarHBondContact O-N 3Å; F395-L400 HydrophobicContact CE1-CD1 3.86Å; F395-L400 HydrophobicContact CE1-CG 4.29Å; F395-L400 HydrophobicContact CE2-CG 4.44Å; F395-L400 HydrophobicContact CZ-CD1 4.01Å; F395-L400 HydrophobicContact CZ-CD2 4.3Å; F395-L400 HydrophobicContact CZ-CG 4.08Å; F395-L400 PolarHBondContact O-N 3.47Å; F395-L400 VanDerWaalsContact O-N 3.17Å; F395-A452 HydrophobicContact CZ-CB 4.38Å; F395-L455 HydrophobicContact CZ-CD1 4.44Å; F395-R531 HydrophobicContact CD2-CB 4.22Å; F395-R531 HydrophobicContact CE2-CB 3.89Å; F395-R531 HydrophobicContact CE2-CG 4.05Å; F395-Q534 HydrophobicContact CB-CG 3.72Å; F395-Q534 HydrophobicContact CD1-CG 4.14Å; F395-Q534 HydrophobicContact CD2-CB 4.38Å; F395-Q534 HydrophobicContact CD2-CG 4.1Å; F395-Q534 HydrophobicContact CG-CB 4.41Å; F395-Q534 HydrophobicContact CG-CG 3.72Å
396L90.8Very high89.2Confident2 Ų222.1 Ų22.11%0.0112%0.117CC..Iπ-helixtrans-64.3-43.1178.5-62.2171.2000111.9M392 S393 L400 K401 M402 V410 I465M392-L396 HydrophobicContact CG-CD1 4.02Å; M392-L396 HydrophobicContact CG-CG 4.46Å; M392-L396 WeakPolarHBondContact O-CG 3.29Å; M392-L396 PolarHBondContact O-N 3.29Å; M392-L396 HydrophobicContact SD-CD1 4.27Å; M392-L396 HydrophobicContact SD-CD2 4.43Å; M392-L396 HydrophobicContact SD-CG 4.24Å; S393-L396 PolarHBondContact O-N 3.14Å; L396-L400 HydrophobicContact CD2-CD1 3.91Å; L396-L400 CarbonylContact O-C 3.54Å; L396-L400 WeakPolarHBondContact O-CB 2.95Å; L396-K401 PolarHBondContact O-N 3.3Å; L396-M402 HydrophobicContact CB-SD 4.48Å; L396-M402 HydrophobicContact CD2-SD 3.96Å; L396-M402 PolarHBondContact O-N 3.07Å; L396-M402 VanDerWaalsContact O-N 3.15Å; L396-V410 HydrophobicContact CD1-CB 3.55Å; L396-V410 HydrophobicContact CD1-CG1 3.82Å; L396-V410 HydrophobicContact CD1-CG2 3.95Å; L396-V410 HydrophobicContact CD2-CB 4.44Å; L396-V410 HydrophobicContact CD2-CG1 4.18Å; L396-V410 HydrophobicContact CD2-CG2 4.25Å; L396-I465 HydrophobicContact CD2-CG2 4.21Å
397L86.9Confident88.8Confident13 Ų1320.9 Ų20.97%0.06811%0.109CC..Iπ-helixtrans-74.3-50.3-176.8-158.865.8000112.2I29 Y268 S393 K401 M402I29-L397 HydrophobicContact CD1-CD2 4.39Å; Y268-L397 WeakPolarHBondContact O-CD1 3.48Å; S393-L397 PolarHBondContact O-N 3.14Å; L397-K401 VanDerWaalsContact O-CA 3.27Å; L397-K401 WeakPolarHBondContact O-CA 3.47Å; L397-K401 PolarHBondContact O-N 2.84Å; L397-M402 WeakPolarHBondContact CD1-O 3.42Å
398N86Confident88.4Confident72 Ų7220.9 Ų20.939%0.38511%0.109SC..Iπ-helixtrans-93-31.4-169-63.7-18.2000113.1P394 Y530P394-N398 VanDerWaalsContact O-CB 3.27Å; P394-N398 WeakPolarHBondContact O-CB 3.37Å; P394-N398 PolarHBondContact O-N 3.48Å; N398-Y530 HydrophobicContact CB-CD2 3.74Å; N398-Y530 HydrophobicContact CB-CE2 3.96Å; N398-Y530 WeakPolarHBondContact ND2-CE2 3.43Å
399S87.5Confident88.1Confident17 Ų1721.5 Ų21.512%0.11911%0.113CC..Iπ-helixtrans-96.2-40.4-178.7-540000112.9F395 S457 R531F395-S399 WeakPolarHBondContact O-CA 3.46Å; F395-S399 WeakPolarHBondContact O-CB 3.41Å; F395-S399 PolarHBondContact O-N 3Å; S399-S457 PolarHBondContact O-OG 2.99Å; S399-R531 PolarHBondContact OG-N 3.47Å
400L86.6Confident88.1Confident2 Ų219.4 Ų19.41%0.0110%0.101CC..SBendtrans-94-9.9178.1-59.8-175.3000113.5F395 L396 M402 L455 S457 I465F395-L400 HydrophobicContact CE1-CD1 3.86Å; F395-L400 HydrophobicContact CE1-CG 4.29Å; F395-L400 HydrophobicContact CE2-CG 4.44Å; F395-L400 HydrophobicContact CZ-CD1 4.01Å; F395-L400 HydrophobicContact CZ-CD2 4.3Å; F395-L400 HydrophobicContact CZ-CG 4.08Å; F395-L400 PolarHBondContact O-N 3.47Å; F395-L400 VanDerWaalsContact O-N 3.17Å; L396-L400 HydrophobicContact CD2-CD1 3.91Å; L396-L400 CarbonylContact O-C 3.54Å; L396-L400 WeakPolarHBondContact O-CB 2.95Å; L400-M402 HydrophobicContact CB-CG 3.89Å; L400-M402 HydrophobicContact CB-SD 4.44Å; L400-M402 HydrophobicContact CD1-SD 4.41Å; L400-M402 PolarHBondContact O-N 3.5Å; L400-L455 HydrophobicContact CD1-CD1 4.29Å; L400-L455 HydrophobicContact CD2-CB 3.93Å; L400-S457 WeakPolarHBondContact O-CA 3.39Å; L400-S457 WeakPolarHBondContact O-CB 3.36Å; L400-I465 HydrophobicContact CD1-CD1 3.95Å; L400-I465 HydrophobicContact CD1-CG1 4.16Å
401K84.4Confident88Confident143 Ų14319.6 Ų19.662%0.62210%0.102SC*.  trans54.138.3179.6-60.8-175.8178.2-1800113.2Y268 L396 L397Y268-K401 WeakPolarHBondContact CD1-O 3.28Å; Y268-K401 WeakPolarHBondContact CE1-O 3.22Å; L396-K401 PolarHBondContact O-N 3.3Å; L397-K401 VanDerWaalsContact O-CA 3.27Å; L397-K401 WeakPolarHBondContact O-CA 3.47Å; L397-K401 PolarHBondContact O-N 2.84Å
402M82.6Confident87.9Confident20 Ų2021 Ų2110%0.09911%0.11CC..  trans-81.1157.8178.7-61.2-173.683.700112L396 L397 L400 S406 L462 I465L396-M402 HydrophobicContact CB-SD 4.48Å; L396-M402 HydrophobicContact CD2-SD 3.96Å; L396-M402 PolarHBondContact O-N 3.07Å; L396-M402 VanDerWaalsContact O-N 3.15Å; L397-M402 WeakPolarHBondContact CD1-O 3.42Å; L400-M402 HydrophobicContact CB-CG 3.89Å; L400-M402 HydrophobicContact CB-SD 4.44Å; L400-M402 HydrophobicContact CD1-SD 4.41Å; L400-M402 PolarHBondContact O-N 3.5Å; M402-S406 WeakPolarHBondContact CE-OG 3.36Å; M402-L462 HydrophobicContact CE-CD1 3.71Å; M402-I465 HydrophobicContact CE-CD1 3.86Å; M402-I465 HydrophobicContact SD-CD1 3.77Å; M402-I465 HydrophobicContact SD-CG2 4.36Å
403N81.5Confident87.9Confident44 Ų4422.6 Ų22.624%0.23512%0.119CC..  trans-58.9154.9174.9-60.319.3000111.8E267 Y268 S405 S406E267-N403 PolarHBondContact OE1-ND2 3.47Å; Y268-N403 VanDerWaalsContact CE1-OD1 3.3Å; Y268-N403 WeakPolarHBondContact CE1-OD1 3.3Å; N403-S405 PolarHBondContact O-N 3.36Å; N403-S405 VanDerWaalsContact O-N 3.08Å; N403-S406 VanDerWaalsContact O-CB 3.31Å; N403-S406 WeakPolarHBondContact O-CB 3.43Å; N403-S406 PolarHBondContact O-N 3.39Å; N403-S406 PolarHBondContact O-OG 3.29Å
404K82.8Confident88Confident26 Ų2623.1 Ų23.111%0.11312%0.122CC..THydrogen-bonded Turntrans-50.2-37.2178.9-62.6177.7-167.6-165.70114S266 E267 N269 I270 D274 S406 M407S266-K404 WeakPolarHBondContact O-CE 3.37Å; S266-K404 PolarHBondContact O-NZ 3.3Å; E267-K404 WeakPolarHBondContact O-CG 3.47Å; N269-K404 WeakPolarHBondContact O-CE 3.42Å; N269-K404 PolarHBondContact O-NZ 2.92Å; I270-K404 HydrophobicContact CG1-CD 4.21Å; I270-K404 HydrophobicContact CG1-CG 4.11Å; D274-K404 IonicContact OD1-NZ 3.99Å; D274-K404 IonicContact OD2-NZ 3.25Å; D274-K404 PolarHBondContact OD2-NZ 3.15Å; K404-S406 VanDerWaalsContact C-N 3.26Å; K404-S406 PolarHBondContact O-N 3.28Å; K404-M407 WeakPolarHBondContact O-CB 3.48Å; K404-M407 PolarHBondContact O-N 2.94Å
405S82Confident87.9Confident22 Ų2223.9 Ų23.915%0.15413%0.127CC..THydrogen-bonded Turntrans-63-31.5-179-169.90000112.6Y199 N403 M407 V408 S409Y199-S405 WeakPolarHBondContact CE2-OG 3.34Å; N403-S405 PolarHBondContact O-N 3.36Å; N403-S405 VanDerWaalsContact O-N 3.08Å; S405-M407 PolarHBondContact O-N 2.78Å; S405-V408 PolarHBondContact O-N 2.99Å; S405-S409 PolarHBondContact O-N 2.98Å; S405-S409 VanDerWaalsContact O-N 3.08Å
406S85.1Confident87.9Confident17 Ų1727.5 Ų27.512%0.11915%0.146CC..Hα-helixtrans-65.6-26.6179.6-560000113.4M402 N403 K404 V408 S409 V410M402-S406 WeakPolarHBondContact CE-OG 3.36Å; N403-S406 VanDerWaalsContact O-CB 3.31Å; N403-S406 WeakPolarHBondContact O-CB 3.43Å; N403-S406 PolarHBondContact O-N 3.39Å; N403-S406 PolarHBondContact O-OG 3.29Å; K404-S406 VanDerWaalsContact C-N 3.26Å; K404-S406 PolarHBondContact O-N 3.28Å; S406-V408 PolarHBondContact O-N 3.47Å; S406-V408 VanDerWaalsContact O-N 3.14Å; S406-S409 WeakPolarHBondContact CA-OG 3.47Å; S406-V410 WeakPolarHBondContact O-CB 3.41Å; S406-V410 WeakPolarHBondContact O-CG2 3.28Å; S406-V410 PolarHBondContact O-N 3.22Å; S406-V410 VanDerWaalsContact O-N 3.15Å
407M85.8Confident88.1Confident2 Ų228 Ų281%0.0115%0.15CC..Hα-helixtrans-56.4-27.2172.5-178.5-177.14700112.4I25 F26 I29 F202 I270 S393 K404 S405 P411I25-M407 HydrophobicContact CG2-CG 4.35Å; F26-M407 HydrophobicContact CD1-CE 3.78Å; F26-M407 HydrophobicContact CD1-SD 3.79Å; F26-M407 HydrophobicContact CE1-CE 3.38Å; F26-M407 HydrophobicContact CE1-CG 4.4Å; F26-M407 HydrophobicContact CE1-SD 3.81Å; I29-M407 HydrophobicContact CD1-CG 4.2Å; I29-M407 HydrophobicContact CD1-SD 3.32Å; I29-M407 WeakPolarHBondContact CD1-SD 3.41Å; F202-M407 HydrophobicContact CE2-CE 3.91Å; F202-M407 HydrophobicContact CZ-CE 3.93Å; I270-M407 HydrophobicContact CD1-CE 3.22Å; I270-M407 HydrophobicContact CD1-SD 3.69Å; S393-M407 WeakPolarHBondContact OG-CG 3.15Å; K404-M407 WeakPolarHBondContact O-CB 3.48Å; K404-M407 PolarHBondContact O-N 2.94Å; S405-M407 PolarHBondContact O-N 2.78Å; M407-P411 WeakPolarHBondContact O-CD 3.4Å; M407-P411 WeakPolarHBondContact O-CG 3.35Å
408V88.4Confident88.2Confident0 Ų028.7 Ų28.70%016%0.155CC..Hα-helixtrans-105.3-40.4-177.8-171.10000111F26 L195 T198 F202 S405 S406 V410 L412F26-V408 HydrophobicContact CE1-CG2 4.02Å; F26-V408 HydrophobicContact CZ-CG2 3.9Å; L195-V408 HydrophobicContact CB-CG1 4.32Å; L195-V408 HydrophobicContact CD2-CG1 3.68Å; L195-V408 WeakPolarHBondContact O-CG1 3.43Å; T198-V408 HydrophobicContact CG2-CG2 4.15Å; F202-V408 HydrophobicContact CD2-CG2 3.89Å; F202-V408 HydrophobicContact CE2-CG2 4Å; S405-V408 PolarHBondContact O-N 2.99Å; S406-V408 PolarHBondContact O-N 3.47Å; S406-V408 VanDerWaalsContact O-N 3.14Å; V408-V410 PolarHBondContact O-N 3.44Å; V408-L412 WeakPolarHBondContact O-CB 3.48Å; V408-L412 PolarHBondContact O-N 2.81Å
409S89Confident88.3Confident13 Ų1327.1 Ų27.19%0.09115%0.147CC..Hα-helixtrans-64.4-37.7-178.672.60000112.9S405 S406 L412 V413 Y466S405-S409 PolarHBondContact O-N 2.98Å; S405-S409 VanDerWaalsContact O-N 3.08Å; S406-S409 WeakPolarHBondContact CA-OG 3.47Å; S409-L412 WeakPolarHBondContact O-CB 3.2Å; S409-L412 PolarHBondContact O-N 2.95Å; S409-V413 PolarHBondContact O-N 3.05Å; S409-V413 VanDerWaalsContact O-N 3.13Å; S409-Y466 PolarHBondContact OG-OH 3.24Å
410V92.4Very high88.5Confident2 Ų232 Ų321%0.01217%0.17CC..Hα-helixtrans-70.6-50.1-179.2174.30000111.3M392 L396 S406 V408 L412 V413 T414 I465 Y466 A469M392-V410 HydrophobicContact SD-CG1 4.35Å; L396-V410 HydrophobicContact CD1-CB 3.55Å; L396-V410 HydrophobicContact CD1-CG1 3.82Å; L396-V410 HydrophobicContact CD1-CG2 3.95Å; L396-V410 HydrophobicContact CD2-CB 4.44Å; L396-V410 HydrophobicContact CD2-CG1 4.18Å; L396-V410 HydrophobicContact CD2-CG2 4.25Å; S406-V410 WeakPolarHBondContact O-CB 3.41Å; S406-V410 WeakPolarHBondContact O-CG2 3.28Å; S406-V410 PolarHBondContact O-N 3.22Å; S406-V410 VanDerWaalsContact O-N 3.15Å; V408-V410 PolarHBondContact O-N 3.44Å; V410-L412 PolarHBondContact O-N 3.28Å; V410-V413 PolarHBondContact O-N 3.46Å; V410-V413 VanDerWaalsContact O-N 3.12Å; V410-T414 PolarHBondContact O-N 3.47Å; V410-T414 PolarHBondContact O-OG1 3.28Å; V410-I465 HydrophobicContact CG1-CG2 4.36Å; V410-I465 HydrophobicContact CG2-CG2 3.88Å; V410-Y466 HydrophobicContact CG2-CD1 4.27Å; V410-Y466 HydrophobicContact CG2-CE1 3.86Å; V410-A469 HydrophobicContact CG1-CB 3.61Å
411P92.3Very high88.5Confident8 Ų832.5 Ų32.55%0.05217%0.174CC..Hα-helixtrans-60.6-27.3170.5-28.438.4000114.4L195 M392 M407 T414 T415L195-P411 HydrophobicContact CD1-CB 4.22Å; L195-P411 HydrophobicContact CD2-CB 3.91Å; M392-P411 HydrophobicContact CG-CG 4.1Å; M407-P411 WeakPolarHBondContact O-CD 3.4Å; M407-P411 WeakPolarHBondContact O-CG 3.35Å; P411-T414 PolarHBondContact O-N 3.45Å; P411-T415 WeakPolarHBondContact O-CB 3.42Å; P411-T415 PolarHBondContact O-N 3.05Å; P411-T415 PolarHBondContact O-OG1 3.32Å
412L92.6Very high88.5Confident30 Ų3026.6 Ų26.616%0.15715%0.151CC..Hα-helixtrans-61-49.2171.7-175.370.9000110.2M192 L195 V408 S409 V410 T414 T415 I416M192-L412 HydrophobicContact SD-CD1 3.48Å; M192-L412 WeakPolarHBondContact SD-CD1 3.2Å; M192-L412 HydrophobicContact SD-CG 4.43Å; L195-L412 HydrophobicContact CB-CB 4.3Å; L195-L412 HydrophobicContact CB-CD1 3.66Å; V408-L412 WeakPolarHBondContact O-CB 3.48Å; V408-L412 PolarHBondContact O-N 2.81Å; S409-L412 WeakPolarHBondContact O-CB 3.2Å; S409-L412 PolarHBondContact O-N 2.95Å; V410-L412 PolarHBondContact O-N 3.28Å; L412-T414 VanDerWaalsContact C-N 3.35Å; L412-T414 PolarHBondContact O-N 3.06Å; L412-T415 PolarHBondContact O-N 3.06Å; L412-T415 VanDerWaalsContact O-N 3.09Å; L412-I416 WeakPolarHBondContact O-CG1 3.28Å; L412-I416 PolarHBondContact O-N 3.36Å
413V93.7Very high88.4Confident39 Ų3929.4 Ų29.424%0.23617%0.169CC..Hα-helixtrans-60.4-42.5175.3174.50000112S409 V410 T415 I416 S417 Y466 A469 A470S409-V413 PolarHBondContact O-N 3.05Å; S409-V413 VanDerWaalsContact O-N 3.13Å; V410-V413 PolarHBondContact O-N 3.46Å; V410-V413 VanDerWaalsContact O-N 3.12Å; V413-T415 VanDerWaalsContact C-N 3.29Å; V413-T415 PolarHBondContact O-N 3.13Å; V413-I416 PolarHBondContact O-N 2.96Å; V413-I416 VanDerWaalsContact O-N 3.09Å; V413-S417 PolarHBondContact O-N 3.16Å; V413-S417 PolarHBondContact O-OG 2.98Å; V413-Y466 HydrophobicContact CB-CD1 4.16Å; V413-Y466 HydrophobicContact CG2-CD1 3.59Å; V413-Y466 HydrophobicContact CG2-CE1 3.99Å; V413-A469 HydrophobicContact CG1-CB 4.4Å; V413-A470 HydrophobicContact CG1-CB 4.13Å
414T92.8Very high88.3Confident10 Ų1028.4 Ų28.46%0.06117%0.169CC..Hα-helixtrans-57.6-42.7173-62.70000111.7V410 P411 L412 I416 S417 C418 A469V410-T414 PolarHBondContact O-N 3.47Å; V410-T414 PolarHBondContact O-OG1 3.28Å; P411-T414 PolarHBondContact O-N 3.45Å; L412-T414 VanDerWaalsContact C-N 3.35Å; L412-T414 PolarHBondContact O-N 3.06Å; T414-I416 VanDerWaalsContact C-N 3.28Å; T414-I416 PolarHBondContact O-N 3.26Å; T414-S417 PolarHBondContact O-OG 3.46Å; T414-C418 WeakPolarHBondContact O-CB 3.31Å; T414-C418 PolarHBondContact O-N 3.42Å; T414-C418 PolarHBondContact O-SG 2.61Å; T414-A469 WeakPolarHBondContact CA-O 3.17Å; T414-A469 PolarHBondContact OG1-O 3.44Å
415T90.5Very high88Confident17 Ų1727.5 Ų27.510%0.10417%0.166CC..Hα-helixtrans-68.9-30.5178.7-50.80000110.8D191 M192 L195 P411 L412 V413 C418 L419D191-T415 HydrophobicContact CB-CG2 3.62Å; M192-T415 VanDerWaalsContact CE-CB 3.43Å; M192-T415 HydrophobicContact CE-CG2 3.56Å; M192-T415 VanDerWaalsContact CE-O 3.3Å; M192-T415 WeakPolarHBondContact CE-O 3.48Å; M192-T415 HydrophobicContact CG-CG2 3.93Å; M192-T415 HydrophobicContact SD-CG2 4.23Å; L195-T415 VanDerWaalsContact CD1-OG1 3.25Å; L195-T415 WeakPolarHBondContact CD1-OG1 3.22Å; P411-T415 WeakPolarHBondContact O-CB 3.42Å; P411-T415 PolarHBondContact O-N 3.05Å; P411-T415 PolarHBondContact O-OG1 3.32Å; L412-T415 PolarHBondContact O-N 3.06Å; L412-T415 VanDerWaalsContact O-N 3.09Å; V413-T415 VanDerWaalsContact C-N 3.29Å; V413-T415 PolarHBondContact O-N 3.13Å; T415-C418 WeakPolarHBondContact O-CB 3.26Å; T415-C418 PolarHBondContact O-N 3.32Å; T415-L419 PolarHBondContact O-N 2.98Å
416I93Very high87.5Confident79 Ų7930.3 Ų30.341%0.40518%0.176SC..Hα-helixtrans-69.9-47.8-178.1-68.3172000107.5M192 L412 V413 T414 C418 L419 I420M192-I416 HydrophobicContact CE-CB 3.65Å; M192-I416 HydrophobicContact CE-CD1 4.46Å; M192-I416 HydrophobicContact CE-CG1 3.12Å; M192-I416 HydrophobicContact SD-CG1 3.89Å; L412-I416 WeakPolarHBondContact O-CG1 3.28Å; L412-I416 PolarHBondContact O-N 3.36Å; V413-I416 PolarHBondContact O-N 2.96Å; V413-I416 VanDerWaalsContact O-N 3.09Å; T414-I416 VanDerWaalsContact C-N 3.28Å; T414-I416 PolarHBondContact O-N 3.26Å; I416-C418 VanDerWaalsContact C-N 3.28Å; I416-C418 PolarHBondContact O-N 3.45Å; I416-L419 PolarHBondContact O-N 3.18Å; I416-I420 HydrophobicContact CG2-CD1 3.84Å; I416-I420 WeakPolarHBondContact O-CG1 3.08Å; I416-I420 PolarHBondContact O-N 3.47Å
417S93.3Very high87.2Confident13 Ų1338.1 Ų38.19%0.09120%0.203CC..Hα-helixtrans-64.1-35.1175.470.50000111.9V413 T414 A421 A470 G473V413-S417 PolarHBondContact O-N 3.16Å; V413-S417 PolarHBondContact O-OG 2.98Å; T414-S417 PolarHBondContact O-OG 3.46Å; S417-A421 WeakPolarHBondContact O-CB 3.46Å; S417-A421 PolarHBondContact O-N 3.47Å; S417-A470 WeakPolarHBondContact CB-O 3.48Å; S417-A470 WeakPolarHBondContact OG-CA 3.37Å; S417-A470 PolarHBondContact OG-O 2.88Å; S417-G473 VanDerWaalsContact OG-CA 3.28Å; S417-G473 WeakPolarHBondContact OG-CA 3.44Å
418C90.4Very high86.5Confident27 Ų2740.7 Ų40.718%0.18222%0.217CC..Hα-helixtrans-59.3-48.5171.8-73.80000112.5T414 T415 I416 I420 A421 S422 G473 T477T414-C418 WeakPolarHBondContact O-CB 3.31Å; T414-C418 PolarHBondContact O-N 3.42Å; T414-C418 PolarHBondContact O-SG 2.61Å; T415-C418 WeakPolarHBondContact O-CB 3.26Å; T415-C418 PolarHBondContact O-N 3.32Å; I416-C418 VanDerWaalsContact C-N 3.28Å; I416-C418 PolarHBondContact O-N 3.45Å; C418-I420 PolarHBondContact O-N 3.47Å; C418-A421 PolarHBondContact O-N 3.32Å; C418-S422 WeakPolarHBondContact O-CB 3.49Å; C418-S422 PolarHBondContact O-N 3.48Å; C418-G473 VanDerWaalsContact SG-C 3.59Å; C418-G473 WeakPolarHBondContact SG-CA 3.38Å; C418-G473 PolarHBondContact SG-O 3.39Å; C418-T477 WeakPolarHBondContact CA-OG1 3.37Å; C418-T477 WeakPolarHBondContact CB-OG1 3.41Å; C418-T477 PolarHBondContact O-OG1 3.06Å; C418-T477 PolarHBondContact SG-OG1 3.26Å
419L88.8Confident85.6Confident39 Ų3942.3 Ų42.320%0.20423%0.225CC..Hα-helixtrans-62.8-45.1-178.9-176.363.4000111F185 T415 I416 S422F185-L419 HydrophobicContact CD2-CD1 3.67Å; F185-L419 HydrophobicContact CE2-CD1 3.94Å; F185-L419 HydrophobicContact CG-CD1 4.46Å; T415-L419 PolarHBondContact O-N 2.98Å; I416-L419 PolarHBondContact O-N 3.18Å; L419-S422 PolarHBondContact O-N 3.3Å; L419-S422 PolarHBondContact O-OG 3.05Å
420I90.3Very high84.8Confident119 Ų11950.3 Ų50.361%0.6126%0.258SS*.Hα-helixtrans-62.6-46.7176-64.7167.7000110.5I416 C418 S422 V423 G424I416-I420 HydrophobicContact CG2-CD1 3.84Å; I416-I420 WeakPolarHBondContact O-CG1 3.08Å; I416-I420 PolarHBondContact O-N 3.47Å; C418-I420 PolarHBondContact O-N 3.47Å; I420-S422 VanDerWaalsContact C-N 3.28Å; I420-S422 PolarHBondContact O-N 2.94Å; I420-V423 PolarHBondContact O-N 3.35Å; I420-G424 PolarHBondContact O-N 2.8Å
421A87.6Confident83.9Confident12 Ų1257.3 Ų57.310%0.09930%0.295CS..Hα-helixtrans-59.9-38.2178.300000111.6S417 C418 V423 G424 V425 I474 T477S417-A421 WeakPolarHBondContact O-CB 3.46Å; S417-A421 PolarHBondContact O-N 3.47Å; C418-A421 PolarHBondContact O-N 3.32Å; A421-V423 VanDerWaalsContact C-N 3.26Å; A421-V423 PolarHBondContact O-N 3.25Å; A421-G424 CarbonylContact O-C 3.58Å; A421-G424 WeakPolarHBondContact O-CA 3.48Å; A421-G424 PolarHBondContact O-N 3.02Å; A421-V425 VanDerWaalsContact O-CG2 3.24Å; A421-V425 WeakPolarHBondContact O-CG2 3.48Å; A421-V425 PolarHBondContact O-N 3.22Å; A421-I474 HydrophobicContact CB-CB 4.44Å; A421-I474 HydrophobicContact CB-CG1 4.31Å; A421-I474 HydrophobicContact CB-CG2 4.33Å; A421-T477 HydrophobicContact CB-CG2 4.08Å
422S82.8Confident82.7Confident19 Ų1960.9 Ų60.913%0.13331%0.313CS..Hα-helixtrans-59.6-35.1-179.378.20000113.2C418 L419 I420C418-S422 WeakPolarHBondContact O-CB 3.49Å; C418-S422 PolarHBondContact O-N 3.48Å; L419-S422 PolarHBondContact O-N 3.3Å; L419-S422 PolarHBondContact O-OG 3.05Å; I420-S422 VanDerWaalsContact C-N 3.28Å; I420-S422 PolarHBondContact O-N 2.94Å
423V82.1Confident81.5Confident79 Ų7961 Ų6148%0.47932%0.322SS..Hα-helixtrans-73.6-38.8174.5-178.70000110.7I420 A421I420-V423 PolarHBondContact O-N 3.35Å; A421-V423 VanDerWaalsContact C-N 3.26Å; A421-V423 PolarHBondContact O-N 3.25Å
424G79.3Confident80.3Confident23 Ų2363.2 Ų63.224%0.23733%0.332CS..Hα-helixtrans-69.4-35178.600000114.2I420 A421 Q426 R427 I428I420-G424 PolarHBondContact O-N 2.8Å; A421-G424 CarbonylContact O-C 3.58Å; A421-G424 WeakPolarHBondContact O-CA 3.48Å; A421-G424 PolarHBondContact O-N 3.02Å; G424-Q426 PolarHBondContact O-N 3.42Å; G424-Q426 VanDerWaalsContact O-N 3.15Å; G424-R427 WeakPolarHBondContact O-CB 3.39Å; G424-R427 PolarHBondContact O-N 3.29Å; G424-I428 WeakPolarHBondContact O-CG1 3.36Å; G424-I428 PolarHBondContact O-N 3.19Å
425V75.4Confident79.1Confident7 Ų769.4 Ų69.44%0.04236%0.356CS..Hα-helixtrans-56.2-36-174.8164.70000112.3A421 R427 I428 N429 I478 V481A421-V425 VanDerWaalsContact O-CG2 3.24Å; A421-V425 WeakPolarHBondContact O-CG2 3.48Å; A421-V425 PolarHBondContact O-N 3.22Å; V425-R427 VanDerWaalsContact C-N 3.33Å; V425-R427 PolarHBondContact O-N 2.94Å; V425-I428 PolarHBondContact O-N 3.46Å; V425-N429 WeakPolarHBondContact CG1-ND2 3.19Å; V425-N429 VanDerWaalsContact O-CB 3.3Å; V425-N429 WeakPolarHBondContact O-CB 3.46Å; V425-N429 PolarHBondContact O-N 2.99Å; V425-N429 PolarHBondContact O-ND2 3.02Å; V425-N429 PolarHBondContact O-OD1 3.38Å; V425-I478 HydrophobicContact CG2-CG1 3.86Å; V425-V481 HydrophobicContact CG1-CG1 4.05Å
426Q72.8Confident78.5Confident81 Ų8171.8 Ų71.838%0.37937%0.367SS..Hα-helixtrans-63.1-40177.1-63.4-17419.500112.6S181 G424 K430S181-Q426 PolarHBondContact OG-NE2 3.39Å; G424-Q426 PolarHBondContact O-N 3.42Å; G424-Q426 VanDerWaalsContact O-N 3.15Å; Q426-K430 WeakPolarHBondContact O-CG 3.4Å; Q426-K430 PolarHBondContact O-N 2.88Å
427R77.6Confident77.9Confident181 Ų18168.1 Ų68.168%0.68335%0.348SS*.Hα-helixtrans-71.7-45178-64.3-177.6179.7160.8-0.4110.4G424 V425 N429 K430 L431G424-R427 WeakPolarHBondContact O-CB 3.39Å; G424-R427 PolarHBondContact O-N 3.29Å; V425-R427 VanDerWaalsContact C-N 3.33Å; V425-R427 PolarHBondContact O-N 2.94Å; R427-N429 VanDerWaalsContact C-N 3.31Å; R427-N429 PolarHBondContact O-N 3.48Å; R427-K430 PolarHBondContact O-N 2.87Å; R427-L431 WeakPolarHBondContact O-CB 3.49Å; R427-L431 VanDerWaalsContact O-CG 3.28Å; R427-L431 WeakPolarHBondContact O-CG 3.47Å; R427-L431 PolarHBondContact O-N 3.41Å
428I71.6Confident77.4Confident57 Ų5767.5 Ų67.529%0.29234%0.344SS..Hα-helixtrans-56.1-47.6176.6-66.4171.4000110.1G424 V425 K430 L431 L432G424-I428 WeakPolarHBondContact O-CG1 3.36Å; G424-I428 PolarHBondContact O-N 3.19Å; V425-I428 PolarHBondContact O-N 3.46Å; I428-K430 VanDerWaalsContact C-N 3.32Å; I428-K430 PolarHBondContact O-N 2.96Å; I428-L431 PolarHBondContact O-N 2.65Å; I428-L432 HydrophobicContact CG2-CD1 3.91Å; I428-L432 WeakPolarHBondContact O-CB 3.45Å; I428-L432 PolarHBondContact O-N 3.27Å
429N69Low77.4Confident33 Ų3369.3 Ų69.318%0.17636%0.355CS..Hα-helixtrans-65.8-34.1-179.3-66.2-4.6000112.7V425 R427 G433 R482V425-N429 WeakPolarHBondContact CG1-ND2 3.19Å; V425-N429 VanDerWaalsContact O-CB 3.3Å; V425-N429 WeakPolarHBondContact O-CB 3.46Å; V425-N429 PolarHBondContact O-N 2.99Å; V425-N429 PolarHBondContact O-ND2 3.02Å; V425-N429 PolarHBondContact O-OD1 3.38Å; R427-N429 VanDerWaalsContact C-N 3.31Å; R427-N429 PolarHBondContact O-N 3.48Å; N429-G433 WeakPolarHBondContact O-CA 3.46Å; N429-G433 PolarHBondContact O-N 2.82Å; N429-R482 PolarHBondContact OD1-NH2 3.36Å
430K72.8Confident77.4Confident182 Ų18268.8 Ų68.879%0.79135%0.353SS*.Hα-helixtrans-70.9-37174.6-76.8-177.7177.9-172.50112.6Q426 R427 I428Q426-K430 WeakPolarHBondContact O-CG 3.4Å; Q426-K430 PolarHBondContact O-N 2.88Å; R427-K430 PolarHBondContact O-N 2.87Å; I428-K430 VanDerWaalsContact C-N 3.32Å; I428-K430 PolarHBondContact O-N 2.96Å
431L72.7Confident77.5Confident149 Ų14963.1 Ų63.178%0.7832%0.324SS*.Hα-helixtrans-82.3-44.1-175.2-70168.2000113R427 I428R427-L431 WeakPolarHBondContact O-CB 3.49Å; R427-L431 VanDerWaalsContact O-CG 3.28Å; R427-L431 WeakPolarHBondContact O-CG 3.47Å; R427-L431 PolarHBondContact O-N 3.41Å; I428-L431 PolarHBondContact O-N 2.65Å
432L68.2Low77.8Confident82 Ų8263.3 Ų63.343%0.42932%0.324SS..Hα-helixtrans-99.9-0.1-172.6-67.2167.3000113.1I428 I436I428-L432 HydrophobicContact CG2-CD1 3.91Å; I428-L432 WeakPolarHBondContact O-CB 3.45Å; I428-L432 PolarHBondContact O-N 3.27Å; L432-I436 HydrophobicContact CB-CB 4.04Å; L432-I436 HydrophobicContact CB-CD1 4.22Å; L432-I436 HydrophobicContact CB-CG2 4.09Å; L432-I436 HydrophobicContact CD1-CG2 4.3Å; L432-I436 HydrophobicContact CD2-CD1 4.28Å; L432-I436 WeakPolarHBondContact O-CB 3.21Å; L432-I436 VanDerWaalsContact O-CD1 3.27Å; L432-I436 WeakPolarHBondContact O-CD1 3.4Å; L432-I436 WeakPolarHBondContact O-CG1 3.35Å
433G68Low78.5Confident33 Ų3367.6 Ų67.634%0.3434%0.344SS..Hα-helixtrans69.8174.8-174.500000113.4N429N429-G433 WeakPolarHBondContact O-CA 3.46Å; N429-G433 PolarHBondContact O-N 2.82Å
434N66.7Low79.1Confident86 Ų8667.4 Ų67.446%0.4634%0.337SS..Hα-helixtrans-73.3-29.8-175.1-78.2-29.7000113.6R482N434-R482 PolarHBondContact O-NH1 3.42Å; N434-R482 PolarHBondContact OD1-NH1 3.49Å
435Y68.9Low79.9Confident140 Ų14066.3 Ų66.355%0.54933%0.326SS..Hα-helixtrans-65.5-43.5-175.8-178.2-98.8000112.9G437 S438Y435-G437 VanDerWaalsContact C-N 3.27Å; Y435-G437 PolarHBondContact O-N 3.49Å; Y435-S438 PolarHBondContact O-OG 3.48Å
436I77.4Confident80.9Confident66 Ų6668.9 Ų68.934%0.33834%0.339SS..Hα-helixtrans-73.8-21.9-172.1-61.4-177.9000111.9L432 S438 V439 V440L432-I436 HydrophobicContact CB-CB 4.04Å; L432-I436 HydrophobicContact CB-CD1 4.22Å; L432-I436 HydrophobicContact CB-CG2 4.09Å; L432-I436 HydrophobicContact CD1-CG2 4.3Å; L432-I436 HydrophobicContact CD2-CD1 4.28Å; L432-I436 WeakPolarHBondContact O-CB 3.21Å; L432-I436 VanDerWaalsContact O-CD1 3.27Å; L432-I436 WeakPolarHBondContact O-CD1 3.4Å; L432-I436 WeakPolarHBondContact O-CG1 3.35Å; I436-S438 VanDerWaalsContact C-N 3.33Å; I436-S438 PolarHBondContact O-N 3.48Å; I436-V439 PolarHBondContact O-N 3.01Å; I436-V440 HydrophobicContact CG2-CG2 3.68Å; I436-V440 WeakPolarHBondContact O-CG2 3.44Å; I436-V440 PolarHBondContact O-N 3.14Å
437G79.5Confident82Confident2 Ų266.3 Ų66.32%0.02134%0.335CS..Hα-helixtrans-63.5-32.9-174.900000114.7Y435 G441 I478Y435-G437 VanDerWaalsContact C-N 3.27Å; Y435-G437 PolarHBondContact O-N 3.49Å; G437-G441 PolarHBondContact O-N 3.09Å; G437-I478 WeakPolarHBondContact O-CG2 3.45Å
438S82.7Confident82.9Confident1 Ų157.8 Ų57.81%0.00730%0.302CS..Hα-helixtrans-69.2-42.7175.454.40000111.4Y435 I436 V440 G441 V442 T550Y435-S438 PolarHBondContact O-OG 3.48Å; I436-S438 VanDerWaalsContact C-N 3.33Å; I436-S438 PolarHBondContact O-N 3.48Å; S438-V440 PolarHBondContact O-N 3.43Å; S438-G441 PolarHBondContact O-N 3.4Å; S438-V442 WeakPolarHBondContact O-CG2 3.35Å; S438-V442 PolarHBondContact O-N 2.9Å; S438-V442 VanDerWaalsContact O-N 3.15Å; S438-T550 VanDerWaalsContact OG-CG2 3.26Å; S438-T550 WeakPolarHBondContact OG-CG2 3.25Å
439V90.4Very high84.1Confident65 Ų6555.3 Ų55.339%0.39429%0.29SS..Hα-helixtrans-62.1-45.7178.6-179.30000110.5I436 G441 V442 L443 T550I436-V439 PolarHBondContact O-N 3.01Å; V439-G441 PolarHBondContact O-N 3.44Å; V439-V442 PolarHBondContact O-N 3.4Å; V439-L443 HydrophobicContact CG1-CD1 4.12Å; V439-L443 HydrophobicContact CG1-CG 4.4Å; V439-L443 WeakPolarHBondContact O-CG 3.42Å; V439-L443 PolarHBondContact O-N 3.43Å; V439-T550 HydrophobicContact CG2-CG2 4.31Å
440V90.7Very high85.4Confident28 Ų2857.7 Ų57.717%0.1731%0.306CS..Hα-helixtrans-60.4-45.9178.9175.80000111.2I436 S438 V442 L443 F444 I478I436-V440 HydrophobicContact CG2-CG2 3.68Å; I436-V440 WeakPolarHBondContact O-CG2 3.44Å; I436-V440 PolarHBondContact O-N 3.14Å; S438-V440 PolarHBondContact O-N 3.43Å; V440-V442 VanDerWaalsContact C-N 3.33Å; V440-V442 PolarHBondContact O-N 3.41Å; V440-L443 PolarHBondContact O-N 2.94Å; V440-F444 HydrophobicContact CG1-CD2 3.83Å; V440-F444 HydrophobicContact CG1-CE2 3.68Å; V440-F444 VanDerWaalsContact O-CD2 3.31Å; V440-F444 WeakPolarHBondContact O-CD2 3.49Å; V440-F444 PolarHBondContact O-N 3.07Å; V440-F444 VanDerWaalsContact O-N 3.16Å; V440-I478 HydrophobicContact CG1-CD1 3.84Å
441G91.8Very high86.4Confident0 Ų051.5 Ų51.50%028%0.281CS..Hα-helixtrans-59.1-42.6178.400000113G437 S438 V439 T445 N479G437-G441 PolarHBondContact O-N 3.09Å; S438-G441 PolarHBondContact O-N 3.4Å; V439-G441 PolarHBondContact O-N 3.44Å; G441-T445 PolarHBondContact O-N 3.24Å; G441-T445 PolarHBondContact O-OG1 3.12Å; G441-N479 WeakPolarHBondContact CA-OD1 3.22Å
442V94.6Very high87.4Confident16 Ų1644.4 Ų44.410%0.09724%0.244CC..Hα-helixtrans-65.4-42.2176.1176.10000112S438 V439 V440 F444 T445 L446 A542 V543S438-V442 WeakPolarHBondContact O-CG2 3.35Å; S438-V442 PolarHBondContact O-N 2.9Å; S438-V442 VanDerWaalsContact O-N 3.15Å; V439-V442 PolarHBondContact O-N 3.4Å; V440-V442 VanDerWaalsContact C-N 3.33Å; V440-V442 PolarHBondContact O-N 3.41Å; V442-F444 PolarHBondContact O-N 3.42Å; V442-T445 PolarHBondContact O-N 3.38Å; V442-L446 HydrophobicContact CG1-CD1 3.85Å; V442-L446 HydrophobicContact CG1-CG 4.07Å; V442-L446 WeakPolarHBondContact O-CB 3.22Å; V442-L446 WeakPolarHBondContact O-CG 3.42Å; V442-L446 PolarHBondContact O-N 2.98Å; V442-A542 VanDerWaalsContact CG2-O 3.27Å; V442-A542 WeakPolarHBondContact CG2-O 3.35Å; V442-V543 HydrophobicContact CG1-CG2 3.85Å
443L95.4Very high88.5Confident108 Ų10846.2 Ų46.257%0.56525%0.246SC*.Hα-helixtrans-60-43.4179.1-72.3173.5000112.3V439 V440 L446 G447V439-L443 HydrophobicContact CG1-CD1 4.12Å; V439-L443 HydrophobicContact CG1-CG 4.4Å; V439-L443 WeakPolarHBondContact O-CG 3.42Å; V439-L443 PolarHBondContact O-N 3.43Å; V440-L443 PolarHBondContact O-N 2.94Å; L443-L446 PolarHBondContact O-N 3.1Å; L443-G447 PolarHBondContact O-N 3.17Å
444F96Very high89.6Confident76 Ų7651.8 Ų51.833%0.33326%0.261SS..Hα-helixtrans-63.7-43.8175.1-82.6-79.3000111.7V440 V442 L446 G447 F448 I471 I474 I478V440-F444 HydrophobicContact CG1-CD2 3.83Å; V440-F444 HydrophobicContact CG1-CE2 3.68Å; V440-F444 VanDerWaalsContact O-CD2 3.31Å; V440-F444 WeakPolarHBondContact O-CD2 3.49Å; V440-F444 PolarHBondContact O-N 3.07Å; V440-F444 VanDerWaalsContact O-N 3.16Å; V442-F444 PolarHBondContact O-N 3.42Å; F444-L446 PolarHBondContact O-N 3.49Å; F444-G447 PolarHBondContact O-N 3.43Å; F444-F448 PolarHBondContact O-N 2.82Å; F444-I471 HydrophobicContact CD1-CG2 4.2Å; F444-I471 WeakPolarHBondContact O-CG2 3.32Å; F444-I474 HydrophobicContact CD1-CB 4.09Å; F444-I474 HydrophobicContact CD1-CD1 4.46Å; F444-I474 HydrophobicContact CD1-CG2 3.9Å; F444-I474 HydrophobicContact CD2-CG2 3.93Å; F444-I474 HydrophobicContact CE1-CB 4.39Å; F444-I474 HydrophobicContact CE1-CD1 4.11Å; F444-I474 HydrophobicContact CE1-CG2 3.95Å; F444-I474 HydrophobicContact CE2-CG2 3.99Å; F444-I474 HydrophobicContact CG-CB 4.34Å; F444-I474 HydrophobicContact CG-CG2 3.91Å; F444-I474 HydrophobicContact CZ-CG2 4.01Å; F444-I478 HydrophobicContact CD2-CD1 4.29Å
445T95.6Very high90.8Very high0 Ų048 Ų480%024%0.24CC..Hα-helixtrans-64.4-39.4177.3-57.70000112.3G441 V442 F448 C449 N479 V538 A542G441-T445 PolarHBondContact O-N 3.24Å; G441-T445 PolarHBondContact O-OG1 3.12Å; V442-T445 PolarHBondContact O-N 3.38Å; T445-F448 WeakPolarHBondContact O-CB 3.38Å; T445-F448 PolarHBondContact O-N 2.85Å; T445-C449 PolarHBondContact O-N 3.08Å; T445-C449 PolarHBondContact O-SG 3.37Å; T445-N479 PolarHBondContact OG1-ND2 3.17Å; T445-V538 HydrophobicContact CG2-CG1 3.89Å; T445-A542 HydrophobicContact CG2-CB 3.68Å
446L96.8Very high91.4Very high61 Ų6147 Ų4732%0.31924%0.239SC..Hα-helixtrans-66.3-39.7174.6-72.1178.9000112V442 L443 F444 F448 C449 T450 V543V442-L446 HydrophobicContact CG1-CD1 3.85Å; V442-L446 HydrophobicContact CG1-CG 4.07Å; V442-L446 WeakPolarHBondContact O-CB 3.22Å; V442-L446 WeakPolarHBondContact O-CG 3.42Å; V442-L446 PolarHBondContact O-N 2.98Å; L443-L446 PolarHBondContact O-N 3.1Å; F444-L446 PolarHBondContact O-N 3.49Å; L446-F448 VanDerWaalsContact C-N 3.3Å; L446-F448 PolarHBondContact O-N 3.15Å; L446-C449 WeakPolarHBondContact O-CB 3.36Å; L446-C449 PolarHBondContact O-N 3.03Å; L446-T450 PolarHBondContact O-N 3.19Å; L446-T450 PolarHBondContact O-OG1 3.29Å; L446-T450 VanDerWaalsContact O-OG1 3.11Å; L446-V543 HydrophobicContact CD1-CG2 3.95Å; L446-V543 HydrophobicContact CD2-CG2 3.89Å; L446-V543 HydrophobicContact CG-CG2 4.24Å
447G96.4Very high91.2Very high27 Ų2746.1 Ų46.128%0.27824%0.239SC..Hα-helixtrans-56.8-43.2173.300000112.2L443 F444 T450 I451L443-G447 PolarHBondContact O-N 3.17Å; F444-G447 PolarHBondContact O-N 3.43Å; G447-T450 PolarHBondContact O-N 2.71Å; G447-I451 VanDerWaalsContact O-CG1 3.32Å; G447-I451 WeakPolarHBondContact O-CG1 3.3Å; G447-I451 PolarHBondContact O-N 3.44Å; G447-I451 VanDerWaalsContact O-N 3.08Å
448F96.8Very high90.3Very high1 Ų149.6 Ų49.60%0.00426%0.257CS..Hα-helixtrans-60.2-48.4170.4165.2-100.4000111.9M392 F444 T445 L446 T450 I451 A452 S468 I471 L472M392-F448 HydrophobicContact CE-CE2 4.09Å; M392-F448 HydrophobicContact CE-CZ 3.86Å; F444-F448 PolarHBondContact O-N 2.82Å; T445-F448 WeakPolarHBondContact O-CB 3.38Å; T445-F448 PolarHBondContact O-N 2.85Å; L446-F448 VanDerWaalsContact C-N 3.3Å; L446-F448 PolarHBondContact O-N 3.15Å; F448-T450 VanDerWaalsContact C-N 3.29Å; F448-T450 PolarHBondContact O-N 2.88Å; F448-I451 PolarHBondContact O-N 3.3Å; F448-A452 HydrophobicContact CE1-CB 4.35Å; F448-A452 HydrophobicContact CE2-CB 4.19Å; F448-A452 HydrophobicContact CZ-CB 4.08Å; F448-A452 WeakPolarHBondContact O-CB 3.27Å; F448-A452 PolarHBondContact O-N 3.15Å; F448-S468 WeakPolarHBondContact CD2-O 3.38Å; F448-I471 HydrophobicContact CB-CG2 4.16Å; F448-L472 HydrophobicContact CB-CB 4.04Å; F448-L472 HydrophobicContact CB-CD1 4.34Å; F448-L472 HydrophobicContact CD1-CB 4.34Å; F448-L472 HydrophobicContact CD1-CD1 3.72Å; F448-L472 HydrophobicContact CD1-CD2 4.24Å; F448-L472 HydrophobicContact CD1-CG 4.31Å; F448-L472 HydrophobicContact CD2-CB 3.76Å; F448-L472 HydrophobicContact CD2-CD2 4.29Å; F448-L472 HydrophobicContact CD2-CG 4.44Å; F448-L472 HydrophobicContact CE1-CD1 4.18Å; F448-L472 HydrophobicContact CE1-CD2 3.99Å; F448-L472 HydrophobicContact CE2-CB 4.29Å; F448-L472 HydrophobicContact CE2-CD2 4.05Å; F448-L472 HydrophobicContact CG-CB 3.77Å; F448-L472 HydrophobicContact CG-CD1 3.98Å; F448-L472 HydrophobicContact CG-CD2 4.37Å; F448-L472 HydrophobicContact CG-CG 4.24Å; F448-L472 HydrophobicContact CZ-CD2 3.89Å
449C96.3Very high89.5Confident6 Ų656.3 Ų56.34%0.04129%0.293CS..Hα-helixtrans-59.3-40.3-179.1-63.30000111.8T445 L446 Y453 V535T445-C449 PolarHBondContact O-N 3.08Å; T445-C449 PolarHBondContact O-SG 3.37Å; L446-C449 WeakPolarHBondContact O-CB 3.36Å; L446-C449 PolarHBondContact O-N 3.03Å; C449-Y453 PolarHBondContact O-N 3.17Å; C449-Y453 VanDerWaalsContact O-N 3.15Å; C449-V535 HydrophobicContact CB-CG1 4.46Å
450T95.1Very high88.5Confident83 Ų8361.3 Ų61.351%0.50931%0.312SS..Hα-helixtrans-64.8-47.6176.4-56.40000111.5L446 G447 F448 Y453 F454L446-T450 PolarHBondContact O-N 3.19Å; L446-T450 PolarHBondContact O-OG1 3.29Å; L446-T450 VanDerWaalsContact O-OG1 3.11Å; G447-T450 PolarHBondContact O-N 2.71Å; F448-T450 VanDerWaalsContact C-N 3.29Å; F448-T450 PolarHBondContact O-N 2.88Å; T450-Y453 WeakPolarHBondContact O-CB 3.36Å; T450-Y453 PolarHBondContact O-N 3.44Å; T450-F454 HydrophobicContact CG2-CE2 4.22Å; T450-F454 WeakPolarHBondContact O-CD2 3.44Å
451I94.3Very high88Confident52 Ų5262.6 Ų62.627%0.26732%0.318SS..Hα-helixtrans-64.3-44.2178.3-63.4164.8000110.2G447 F448 Y453 F454 L455 I471G447-I451 VanDerWaalsContact O-CG1 3.32Å; G447-I451 WeakPolarHBondContact O-CG1 3.3Å; G447-I451 PolarHBondContact O-N 3.44Å; G447-I451 VanDerWaalsContact O-N 3.08Å; F448-I451 PolarHBondContact O-N 3.3Å; I451-Y453 PolarHBondContact O-N 2.91Å; I451-F454 PolarHBondContact O-N 3.36Å; I451-L455 HydrophobicContact CG2-CD2 4.38Å; I451-L455 HydrophobicContact CG2-CG 4.41Å; I451-L455 WeakPolarHBondContact O-CG 3.49Å; I451-L455 PolarHBondContact O-N 2.9Å; I451-I471 HydrophobicContact CD1-CD1 3.58Å
452A92.8Very high87.8Confident0 Ų065.7 Ų65.70%033%0.334CS..Hα-helixtrans-61-27.4-178.900000113.7F395 F448 V535F395-A452 HydrophobicContact CZ-CB 4.38Å; F448-A452 HydrophobicContact CE1-CB 4.35Å; F448-A452 HydrophobicContact CE2-CB 4.19Å; F448-A452 HydrophobicContact CZ-CB 4.08Å; F448-A452 WeakPolarHBondContact O-CB 3.27Å; F448-A452 PolarHBondContact O-N 3.15Å; A452-V535 HydrophobicContact CB-CG2 4.04Å
453Y92.8Very high87.6Confident119 Ų11971.5 Ų71.547%0.46736%0.364SS..Hα-helixtrans-65.2-39.8172.8-178.1-99.7000112.4C449 T450 I451 V535 Y536C449-Y453 PolarHBondContact O-N 3.17Å; C449-Y453 VanDerWaalsContact O-N 3.15Å; T450-Y453 WeakPolarHBondContact O-CB 3.36Å; T450-Y453 PolarHBondContact O-N 3.44Å; I451-Y453 PolarHBondContact O-N 2.91Å; Y453-V535 HydrophobicContact CD2-CG1 4.34Å; Y453-Y536 WeakPolarHBondContact CE2-OH 3.48Å
454F91.4Very high87.4Confident150 Ų15067.9 Ų67.966%0.65835%0.35SS*.Hα-helixtrans-88.5-5.4-177.3-65.6-71000114.3T450 I451 K456T450-F454 HydrophobicContact CG2-CE2 4.22Å; T450-F454 WeakPolarHBondContact O-CD2 3.44Å; I451-F454 PolarHBondContact O-N 3.36Å; F454-K456 PolarHBondContact O-N 2.95Å
455L90.2Very high87.3Confident6 Ų664.6 Ų64.63%0.03134%0.336CS..  trans-67.2118.1178.8-72.2175.6000112F395 L400 I451 N461 A464 I465 R531F395-L455 HydrophobicContact CZ-CD1 4.44Å; L400-L455 HydrophobicContact CD1-CD1 4.29Å; L400-L455 HydrophobicContact CD2-CB 3.93Å; I451-L455 HydrophobicContact CG2-CD2 4.38Å; I451-L455 HydrophobicContact CG2-CG 4.41Å; I451-L455 WeakPolarHBondContact O-CG 3.49Å; I451-L455 PolarHBondContact O-N 2.9Å; L455-N461 HydrophobicContact CD2-CB 4.5Å; L455-A464 HydrophobicContact CD2-CB 3.79Å; L455-I465 HydrophobicContact CD1-CG1 4.13Å; L455-I465 HydrophobicContact CD2-CG1 3.78Å; L455-R531 PolarHBondContact O-NH2 3.44Å
456K82.9Confident87.2Confident119 Ų11967.8 Ų67.852%0.51735%0.348SS..  trans-93.1153173.9-165.2-178.4176.7-127.40111.5F454 D458F454-K456 PolarHBondContact O-N 2.95Å; K456-D458 WeakPolarHBondContact CE-OD2 3.49Å; K456-D458 IonicContact NZ-OD2 2.71Å; K456-D458 PolarHBondContact NZ-OD2 3.36Å; K456-D458 PolarHBondContact O-N 3.4Å
457S72Confident87.1Confident48 Ų4868.1 Ų68.134%0.33635%0.352SS..SBendtrans-76.127.1-171.7-47.90000116.1S399 L400S399-S457 PolarHBondContact O-OG 2.99Å; L400-S457 WeakPolarHBondContact O-CA 3.39Å; L400-S457 WeakPolarHBondContact O-CB 3.36Å
458D61.9Low87Confident76 Ų7667 Ų6741%0.40634%0.34SS..SBendtrans-123.4152.3-177.1-64.7-40.8000111.2K456 E460 N461K456-D458 WeakPolarHBondContact CE-OD2 3.49Å; K456-D458 IonicContact NZ-OD2 2.71Å; K456-D458 PolarHBondContact NZ-OD2 3.36Å; K456-D458 PolarHBondContact O-N 3.4Å; D458-E460 PolarHBondContact O-N 3.02Å; D458-N461 PolarHBondContact O-N 3.5Å
459D64.5Low86.9Confident142 Ų14267 Ų6776%0.75934%0.34SS*.G310 helixtrans-54.6-20.3178.7-75.6-33.2000113.8N461 L462D459-N461 PolarHBondContact O-N 3.16Å; D459-N461 VanDerWaalsContact O-N 3.09Å; D459-L462 WeakPolarHBondContact O-CB 3.16Å; D459-L462 PolarHBondContact O-N 3.31Å; D459-L462 VanDerWaalsContact O-N 3.14Å
460E70.2Confident86.9Confident170 Ų17068 Ų6879%0.79435%0.35SS*.G310 helixtrans-56.7-26.4178.6-63.2-170.8160.200113.3D458D458-E460 PolarHBondContact O-N 3.02Å
461N81Confident87Confident55 Ų5566 Ų6629%0.29434%0.335SS..G310 helixtrans-106.518.2-178.3-68.9-51.6000114.2L455 D458 D459 L463 A464 I465L455-N461 HydrophobicContact CD2-CB 4.5Å; D458-N461 PolarHBondContact O-N 3.5Å; D459-N461 PolarHBondContact O-N 3.16Å; D459-N461 VanDerWaalsContact O-N 3.09Å; N461-L463 VanDerWaalsContact C-N 3.28Å; N461-L463 PolarHBondContact O-N 2.95Å; N461-A464 HydrophobicContact CB-CB 4.36Å; N461-A464 WeakPolarHBondContact O-CB 3.43Å; N461-A464 PolarHBondContact O-N 3.04Å; N461-I465 WeakPolarHBondContact O-CG1 3.47Å; N461-I465 PolarHBondContact O-N 2.86Å
462L86.9Confident87.1Confident65 Ų6563.5 Ų63.534%0.3432%0.322SS..Hα-helixtrans-55.2-41.8-177.2-172.865.7000112.8M402 D459 A464 I465 Y466M402-L462 HydrophobicContact CE-CD1 3.71Å; D459-L462 WeakPolarHBondContact O-CB 3.16Å; D459-L462 PolarHBondContact O-N 3.31Å; D459-L462 VanDerWaalsContact O-N 3.14Å; L462-A464 PolarHBondContact O-N 3.46Å; L462-I465 PolarHBondContact O-N 3.48Å; L462-Y466 HydrophobicContact CD1-CD2 4.07Å; L462-Y466 HydrophobicContact CD1-CE2 3.47Å; L462-Y466 VanDerWaalsContact CD1-CE2 3.47Å; L462-Y466 HydrophobicContact CD2-CE2 4.1Å; L462-Y466 HydrophobicContact CG-CD2 3.91Å; L462-Y466 HydrophobicContact CG-CE2 3.57Å; L462-Y466 VanDerWaalsContact O-CD2 3.22Å; L462-Y466 WeakPolarHBondContact O-CD2 3.48Å; L462-Y466 PolarHBondContact O-N 2.73Å; L462-Y466 VanDerWaalsContact O-N 3.14Å
463L90.1Very high87.1Confident137 Ų13763.5 Ų63.572%0.71732%0.322SS*.Hα-helixtrans-61.2-43.4175.8-178.964.4000111.5N461 I465 Y466 V467N461-L463 VanDerWaalsContact C-N 3.28Å; N461-L463 PolarHBondContact O-N 2.95Å; L463-I465 VanDerWaalsContact C-N 3.32Å; L463-I465 PolarHBondContact O-N 3.48Å; L463-Y466 PolarHBondContact O-N 3Å; L463-V467 HydrophobicContact CD1-CG2 4.18Å; L463-V467 HydrophobicContact CG-CG2 4.29Å; L463-V467 WeakPolarHBondContact O-CB 3.29Å; L463-V467 VanDerWaalsContact O-CG2 3.24Å; L463-V467 WeakPolarHBondContact O-CG2 3.5Å; L463-V467 PolarHBondContact O-N 3.05Å
464A92.3Very high87.2Confident33 Ų3360.2 Ų60.227%0.27331%0.313SS..Hα-helixtrans-64.2-37.2178.700000111.8L455 N461 L462 S468L455-A464 HydrophobicContact CD2-CB 3.79Å; N461-A464 HydrophobicContact CB-CB 4.36Å; N461-A464 WeakPolarHBondContact O-CB 3.43Å; N461-A464 PolarHBondContact O-N 3.04Å; L462-A464 PolarHBondContact O-N 3.46Å; A464-S468 VanDerWaalsContact O-CB 3.28Å; A464-S468 WeakPolarHBondContact O-CB 3.44Å; A464-S468 PolarHBondContact O-N 3.48Å; A464-S468 PolarHBondContact O-OG 3.39Å
465I92.5Very high87.3Confident7 Ų753.1 Ų53.14%0.03628%0.281CS..Hα-helixtrans-60.3-52.4174.8-62170.6000109.9L396 L400 M402 V410 L455 N461 L462 L463 V467 S468 A469L396-I465 HydrophobicContact CD2-CG2 4.21Å; L400-I465 HydrophobicContact CD1-CD1 3.95Å; L400-I465 HydrophobicContact CD1-CG1 4.16Å; M402-I465 HydrophobicContact CE-CD1 3.86Å; M402-I465 HydrophobicContact SD-CD1 3.77Å; M402-I465 HydrophobicContact SD-CG2 4.36Å; V410-I465 HydrophobicContact CG1-CG2 4.36Å; V410-I465 HydrophobicContact CG2-CG2 3.88Å; L455-I465 HydrophobicContact CD1-CG1 4.13Å; L455-I465 HydrophobicContact CD2-CG1 3.78Å; N461-I465 WeakPolarHBondContact O-CG1 3.47Å; N461-I465 PolarHBondContact O-N 2.86Å; L462-I465 PolarHBondContact O-N 3.48Å; L463-I465 VanDerWaalsContact C-N 3.32Å; L463-I465 PolarHBondContact O-N 3.48Å; I465-V467 PolarHBondContact O-N 2.8Å; I465-S468 PolarHBondContact O-N 3.23Å; I465-S468 PolarHBondContact O-OG 3.29Å; I465-A469 WeakPolarHBondContact O-CB 3.46Å; I465-A469 PolarHBondContact O-N 2.93Å
466Y93.6Very high87.4Confident66 Ų6653 Ų5326%0.25928%0.281SS..Hα-helixtrans-66.4-37.5-179.7-73.1-61.8000113.4S409 V410 V413 L462 L463 A469 A470S409-Y466 PolarHBondContact OG-OH 3.24Å; V410-Y466 HydrophobicContact CG2-CD1 4.27Å; V410-Y466 HydrophobicContact CG2-CE1 3.86Å; V413-Y466 HydrophobicContact CB-CD1 4.16Å; V413-Y466 HydrophobicContact CG2-CD1 3.59Å; V413-Y466 HydrophobicContact CG2-CE1 3.99Å; L462-Y466 HydrophobicContact CD1-CD2 4.07Å; L462-Y466 HydrophobicContact CD1-CE2 3.47Å; L462-Y466 VanDerWaalsContact CD1-CE2 3.47Å; L462-Y466 HydrophobicContact CD2-CE2 4.1Å; L462-Y466 HydrophobicContact CG-CD2 3.91Å; L462-Y466 HydrophobicContact CG-CE2 3.57Å; L462-Y466 VanDerWaalsContact O-CD2 3.22Å; L462-Y466 WeakPolarHBondContact O-CD2 3.48Å; L462-Y466 PolarHBondContact O-N 2.73Å; L462-Y466 VanDerWaalsContact O-N 3.14Å; L463-Y466 PolarHBondContact O-N 3Å; Y466-A469 PolarHBondContact O-N 2.96Å; Y466-A470 PolarHBondContact O-N 2.9Å
467V94.8Very high87.8Confident68 Ų6848.1 Ų48.141%0.41226%0.261SS..Hα-helixtrans-63.4-43.8174169.70000110.8L463 I465 A469 A470 I471L463-V467 HydrophobicContact CD1-CG2 4.18Å; L463-V467 HydrophobicContact CG-CG2 4.29Å; L463-V467 WeakPolarHBondContact O-CB 3.29Å; L463-V467 VanDerWaalsContact O-CG2 3.24Å; L463-V467 WeakPolarHBondContact O-CG2 3.5Å; L463-V467 PolarHBondContact O-N 3.05Å; I465-V467 PolarHBondContact O-N 2.8Å; V467-A469 VanDerWaalsContact C-N 3.32Å; V467-A469 PolarHBondContact O-N 2.9Å; V467-A470 PolarHBondContact O-N 3.01Å; V467-I471 HydrophobicContact CG1-CD1 3.97Å; V467-I471 WeakPolarHBondContact O-CG1 3.36Å; V467-I471 PolarHBondContact O-N 3.41Å
468S94.5Very high88.6Confident3 Ų346 Ų462%0.02125%0.246CC..Hα-helixtrans-61.8-40.6176.2800000111.7F448 A464 I465 A470 I471 L472F448-S468 WeakPolarHBondContact CD2-O 3.38Å; A464-S468 VanDerWaalsContact O-CB 3.28Å; A464-S468 WeakPolarHBondContact O-CB 3.44Å; A464-S468 PolarHBondContact O-N 3.48Å; A464-S468 PolarHBondContact O-OG 3.39Å; I465-S468 PolarHBondContact O-N 3.23Å; I465-S468 PolarHBondContact O-OG 3.29Å; S468-A470 VanDerWaalsContact C-N 3.35Å; S468-A470 PolarHBondContact O-N 3.35Å; S468-I471 PolarHBondContact O-N 3.34Å; S468-L472 PolarHBondContact O-N 2.95Å
469A94.9Very high89.9Confident1 Ų142.5 Ų42.51%0.00823%0.227CC..Hα-helixtrans-64.6-38.4177.400000112.3V410 V413 T414 I465 Y466 V467 L472 G473V410-A469 HydrophobicContact CG1-CB 3.61Å; V413-A469 HydrophobicContact CG1-CB 4.4Å; T414-A469 WeakPolarHBondContact CA-O 3.17Å; T414-A469 PolarHBondContact OG1-O 3.44Å; I465-A469 WeakPolarHBondContact O-CB 3.46Å; I465-A469 PolarHBondContact O-N 2.93Å; Y466-A469 PolarHBondContact O-N 2.96Å; V467-A469 VanDerWaalsContact C-N 3.32Å; V467-A469 PolarHBondContact O-N 2.9Å; A469-L472 PolarHBondContact O-N 3.47Å; A469-G473 PolarHBondContact O-N 3.44Å; A469-G473 VanDerWaalsContact O-N 3.12Å
470A96.2Very high91Very high29 Ų2936.8 Ų36.824%0.2420%0.198CC..Hα-helixtrans-64.3-47.3174.200000111.3V413 S417 Y466 V467 S468 L472 G473 I474V413-A470 HydrophobicContact CG1-CB 4.13Å; S417-A470 WeakPolarHBondContact CB-O 3.48Å; S417-A470 WeakPolarHBondContact OG-CA 3.37Å; S417-A470 PolarHBondContact OG-O 2.88Å; Y466-A470 PolarHBondContact O-N 2.9Å; V467-A470 PolarHBondContact O-N 3.01Å; S468-A470 VanDerWaalsContact C-N 3.35Å; S468-A470 PolarHBondContact O-N 3.35Å; A470-L472 VanDerWaalsContact C-N 3.33Å; A470-L472 PolarHBondContact O-N 2.92Å; A470-G473 PolarHBondContact O-N 3Å; A470-I474 WeakPolarHBondContact O-CG1 3.41Å; A470-I474 PolarHBondContact O-N 2.71Å
471I96.7Very high91.7Very high39 Ų3929.7 Ų29.720%0.217%0.167CC..Hα-helixtrans-57.4-45.8176-72.3168.6000111F444 F448 I451 V467 S468 G473 I474 G475F444-I471 HydrophobicContact CD1-CG2 4.2Å; F444-I471 WeakPolarHBondContact O-CG2 3.32Å; F448-I471 HydrophobicContact CB-CG2 4.16Å; I451-I471 HydrophobicContact CD1-CD1 3.58Å; V467-I471 HydrophobicContact CG1-CD1 3.97Å; V467-I471 WeakPolarHBondContact O-CG1 3.36Å; V467-I471 PolarHBondContact O-N 3.41Å; S468-I471 PolarHBondContact O-N 3.34Å; I471-G473 VanDerWaalsContact C-N 3.35Å; I471-G473 PolarHBondContact O-N 3.38Å; I471-I474 PolarHBondContact O-N 3.29Å; I471-G475 PolarHBondContact O-N 3.11Å; I471-G475 VanDerWaalsContact O-N 3.12Å
472L96.1Very high92Very high0 Ų027.5 Ų27.50%015%0.154CC..Hα-helixtrans-59.7-43.7178179.662.3000112.1M392 F448 S468 A469 A470 I474 G475 N476M392-L472 HydrophobicContact CE-CD2 3.15Å; F448-L472 HydrophobicContact CB-CB 4.04Å; F448-L472 HydrophobicContact CB-CD1 4.34Å; F448-L472 HydrophobicContact CD1-CB 4.34Å; F448-L472 HydrophobicContact CD1-CD1 3.72Å; F448-L472 HydrophobicContact CD1-CD2 4.24Å; F448-L472 HydrophobicContact CD1-CG 4.31Å; F448-L472 HydrophobicContact CD2-CB 3.76Å; F448-L472 HydrophobicContact CD2-CD2 4.29Å; F448-L472 HydrophobicContact CD2-CG 4.44Å; F448-L472 HydrophobicContact CE1-CD1 4.18Å; F448-L472 HydrophobicContact CE1-CD2 3.99Å; F448-L472 HydrophobicContact CE2-CB 4.29Å; F448-L472 HydrophobicContact CE2-CD2 4.05Å; F448-L472 HydrophobicContact CG-CB 3.77Å; F448-L472 HydrophobicContact CG-CD1 3.98Å; F448-L472 HydrophobicContact CG-CD2 4.37Å; F448-L472 HydrophobicContact CG-CG 4.24Å; F448-L472 HydrophobicContact CZ-CD2 3.89Å; S468-L472 PolarHBondContact O-N 2.95Å; A469-L472 PolarHBondContact O-N 3.47Å; A470-L472 VanDerWaalsContact C-N 3.33Å; A470-L472 PolarHBondContact O-N 2.92Å; L472-I474 VanDerWaalsContact C-N 3.31Å; L472-I474 PolarHBondContact O-N 2.91Å; L472-G475 PolarHBondContact O-N 3.18Å; L472-N476 WeakPolarHBondContact O-CB 3.48Å; L472-N476 PolarHBondContact O-N 3.36Å
473G94.3Very high92Very high0 Ų024.4 Ų24.40%014%0.138CC..Hα-helixtrans-64.4-35.2-179.500000113.4S417 C418 A469 A470 I471 T477S417-G473 VanDerWaalsContact OG-CA 3.28Å; S417-G473 WeakPolarHBondContact OG-CA 3.44Å; C418-G473 VanDerWaalsContact SG-C 3.59Å; C418-G473 WeakPolarHBondContact SG-CA 3.38Å; C418-G473 PolarHBondContact SG-O 3.39Å; A469-G473 PolarHBondContact O-N 3.44Å; A469-G473 VanDerWaalsContact O-N 3.12Å; A470-G473 PolarHBondContact O-N 3Å; I471-G473 VanDerWaalsContact C-N 3.35Å; I471-G473 PolarHBondContact O-N 3.38Å; G473-T477 WeakPolarHBondContact O-CB 3.46Å; G473-T477 PolarHBondContact O-N 3.26Å; G473-T477 PolarHBondContact O-OG1 3.15Å
474I93.8Very high91.8Very high51 Ų5118.7 Ų18.726%0.26211%0.108SC..Hα-helixtrans-62.6-51.5172.5-61169.5000110A421 F444 A470 I471 L472 N476 T477 I478A421-I474 HydrophobicContact CB-CB 4.44Å; A421-I474 HydrophobicContact CB-CG1 4.31Å; A421-I474 HydrophobicContact CB-CG2 4.33Å; F444-I474 HydrophobicContact CD1-CB 4.09Å; F444-I474 HydrophobicContact CD1-CD1 4.46Å; F444-I474 HydrophobicContact CD1-CG2 3.9Å; F444-I474 HydrophobicContact CD2-CG2 3.93Å; F444-I474 HydrophobicContact CE1-CB 4.39Å; F444-I474 HydrophobicContact CE1-CD1 4.11Å; F444-I474 HydrophobicContact CE1-CG2 3.95Å; F444-I474 HydrophobicContact CE2-CG2 3.99Å; F444-I474 HydrophobicContact CG-CB 4.34Å; F444-I474 HydrophobicContact CG-CG2 3.91Å; F444-I474 HydrophobicContact CZ-CG2 4.01Å; A470-I474 WeakPolarHBondContact O-CG1 3.41Å; A470-I474 PolarHBondContact O-N 2.71Å; I471-I474 PolarHBondContact O-N 3.29Å; L472-I474 VanDerWaalsContact C-N 3.31Å; L472-I474 PolarHBondContact O-N 2.91Å; I474-N476 PolarHBondContact O-N 3.37Å; I474-T477 PolarHBondContact O-N 3.02Å; I474-I478 HydrophobicContact CG2-CD1 3.99Å; I474-I478 WeakPolarHBondContact O-CG1 3.44Å; I474-I478 PolarHBondContact O-N 3.09Å; I474-I478 VanDerWaalsContact O-N 3.16Å
475G93.9Very high91.3Very high0 Ų019.1 Ų19.10%011%0.107CC..Hα-helixtrans-59.6-46.7179.100000112.8I471 L472 T477 I478 N479I471-G475 PolarHBondContact O-N 3.11Å; I471-G475 VanDerWaalsContact O-N 3.12Å; L472-G475 PolarHBondContact O-N 3.18Å; G475-T477 VanDerWaalsContact C-N 3.34Å; G475-T477 PolarHBondContact O-N 2.82Å; G475-I478 PolarHBondContact O-N 3.13Å; G475-N479 WeakPolarHBondContact O-CB 3.49Å; G475-N479 PolarHBondContact O-N 3.38Å; G475-N479 PolarHBondContact O-ND2 3.25Å
476N92.6Very high91Very high4 Ų419 Ų192%0.02111%0.107CC..Hα-helixtrans-60.8-40.8179.1-80.9-7.1000112.7V385 S388 L472 I474 S480V385-N476 HydrophobicContact CG1-CB 4.02Å; V385-N476 HydrophobicContact CG2-CB 4.23Å; S388-N476 PolarHBondContact OG-ND2 2.95Å; S388-N476 PolarHBondContact OG-OD1 3.23Å; L472-N476 WeakPolarHBondContact O-CB 3.48Å; L472-N476 PolarHBondContact O-N 3.36Å; I474-N476 PolarHBondContact O-N 3.37Å; N476-S480 WeakPolarHBondContact O-CB 3.41Å; N476-S480 PolarHBondContact O-N 3.08Å
477T90.1Very high90.8Very high16 Ų1615.9 Ų15.910%0.09810%0.095CC..Hα-helixtrans-65.3-45.8178.1-620000111.5C418 A421 G473 I474 G475 S480 V481C418-T477 WeakPolarHBondContact CA-OG1 3.37Å; C418-T477 WeakPolarHBondContact CB-OG1 3.41Å; C418-T477 PolarHBondContact O-OG1 3.06Å; C418-T477 PolarHBondContact SG-OG1 3.26Å; A421-T477 HydrophobicContact CB-CG2 4.08Å; G473-T477 WeakPolarHBondContact O-CB 3.46Å; G473-T477 PolarHBondContact O-N 3.26Å; G473-T477 PolarHBondContact O-OG1 3.15Å; I474-T477 PolarHBondContact O-N 3.02Å; G475-T477 VanDerWaalsContact C-N 3.34Å; G475-T477 PolarHBondContact O-N 2.82Å; T477-S480 PolarHBondContact O-N 3.06Å; T477-V481 HydrophobicContact CG2-CG2 4.44Å; T477-V481 WeakPolarHBondContact O-CB 3.41Å; T477-V481 VanDerWaalsContact O-CG2 3.27Å; T477-V481 WeakPolarHBondContact O-CG2 3.16Å; T477-V481 PolarHBondContact O-N 3.09Å
478I89Confident90.2Very high4 Ų415.2 Ų15.22%0.0219%0.091CC..Hα-helixtrans-62-49.8178.6-64.3171.3000110.2V425 G437 V440 F444 I474 G475 S480 V481 R482V425-I478 HydrophobicContact CG2-CG1 3.86Å; G437-I478 WeakPolarHBondContact O-CG2 3.45Å; V440-I478 HydrophobicContact CG1-CD1 3.84Å; F444-I478 HydrophobicContact CD2-CD1 4.29Å; I474-I478 HydrophobicContact CG2-CD1 3.99Å; I474-I478 WeakPolarHBondContact O-CG1 3.44Å; I474-I478 PolarHBondContact O-N 3.09Å; I474-I478 VanDerWaalsContact O-N 3.16Å; G475-I478 PolarHBondContact O-N 3.13Å; I478-S480 PolarHBondContact O-N 3.4Å; I478-V481 PolarHBondContact O-N 2.94Å; I478-R482 HydrophobicContact CG2-CG 4.36Å; I478-R482 WeakPolarHBondContact O-CB 3.48Å; I478-R482 WeakPolarHBondContact O-CG 3.26Å; I478-R482 PolarHBondContact O-N 3.02Å
479N90.5Very high89.6Confident2 Ų216.8 Ų16.81%0.01110%0.1CC..Hα-helixtrans-61.5-42.3179.8-69.7-23.5000112.1V385 G441 T445 G475 R482 A483V385-N479 HydrophobicContact CG2-CB 4.08Å; G441-N479 WeakPolarHBondContact CA-OD1 3.22Å; T445-N479 PolarHBondContact OG1-ND2 3.17Å; G475-N479 WeakPolarHBondContact O-CB 3.49Å; G475-N479 PolarHBondContact O-N 3.38Å; G475-N479 PolarHBondContact O-ND2 3.25Å; N479-R482 PolarHBondContact O-N 3.03Å; N479-A483 PolarHBondContact O-N 2.94Å
480S87.6Confident89.1Confident22 Ų2217.6 Ų17.615%0.15411%0.105CC..Hα-helixtrans-68.1-40.2179.5-174.90000113.2Y184 N476 T477 I478 L484Y184-S480 PolarHBondContact OH-O 3.29Å; N476-S480 WeakPolarHBondContact O-CB 3.41Å; N476-S480 PolarHBondContact O-N 3.08Å; T477-S480 PolarHBondContact O-N 3.06Å; I478-S480 PolarHBondContact O-N 3.4Å; S480-L484 PolarHBondContact O-N 3.05Å
481V84.5Confident88.5Confident22 Ų2216.7 Ų16.713%0.13310%0.095CC..Hα-helixtrans-66-42174.6172.10000110.3Y184 V425 T477 I478 A483 L484 V485Y184-V481 HydrophobicContact CD2-CG2 4.22Å; Y184-V481 HydrophobicContact CE2-CG2 4.12Å; V425-V481 HydrophobicContact CG1-CG1 4.05Å; T477-V481 HydrophobicContact CG2-CG2 4.44Å; T477-V481 WeakPolarHBondContact O-CB 3.41Å; T477-V481 VanDerWaalsContact O-CG2 3.27Å; T477-V481 WeakPolarHBondContact O-CG2 3.16Å; T477-V481 PolarHBondContact O-N 3.09Å; I478-V481 PolarHBondContact O-N 2.94Å; V481-A483 PolarHBondContact O-N 3.44Å; V481-L484 PolarHBondContact O-N 3.03Å; V481-V485 HydrophobicContact CG1-CG2 4.39Å; V481-V485 WeakPolarHBondContact O-CG2 3.28Å; V481-V485 PolarHBondContact O-N 3.02Å; V481-V485 VanDerWaalsContact O-N 3.1Å
482R86.2Confident87.5Confident8 Ų816.2 Ų16.23%0.0310%0.101CC..Hα-helixtrans-62.7-40.9178.9-71.6-70169.2179.15112.6M381 N429 N434 I478 N479 L484 V485 V486M381-R482 HydrophobicContact CE-CB 4.26Å; M381-R482 HydrophobicContact SD-CB 4.22Å; N429-R482 PolarHBondContact OD1-NH2 3.36Å; N434-R482 PolarHBondContact O-NH1 3.42Å; N434-R482 PolarHBondContact OD1-NH1 3.49Å; I478-R482 HydrophobicContact CG2-CG 4.36Å; I478-R482 WeakPolarHBondContact O-CB 3.48Å; I478-R482 WeakPolarHBondContact O-CG 3.26Å; I478-R482 PolarHBondContact O-N 3.02Å; N479-R482 PolarHBondContact O-N 3.03Å; R482-L484 VanDerWaalsContact C-N 3.3Å; R482-L484 PolarHBondContact O-N 3.32Å; R482-V485 PolarHBondContact O-N 3.06Å; R482-V486 WeakPolarHBondContact O-CG2 3.42Å; R482-V486 PolarHBondContact O-N 2.86Å; R482-V486 VanDerWaalsContact O-N 3.14Å
483A88.7Confident86.4Confident0 Ų020 Ų200%012%0.124CC..Hα-helixtrans-53.9-46.6173.500000111.7F378 M381 R382 N479 V481 V486F378-A483 HydrophobicContact CD2-CB 3.94Å; F378-A483 WeakPolarHBondContact CD2-O 3.42Å; M381-A483 HydrophobicContact CB-CB 3.96Å; M381-A483 HydrophobicContact SD-CB 4.43Å; R382-A483 HydrophobicContact CG-CB 3.89Å; N479-A483 PolarHBondContact O-N 2.94Å; V481-A483 PolarHBondContact O-N 3.44Å; A483-V486 PolarHBondContact O-N 2.93Å
484L84Confident85.2Confident17 Ų1728.1 Ų28.19%0.08916%0.159CC..Hα-helixtrans-67.6-38.1179.7-173.273.7000113.1L163 Y184 S480 V481 R482 V486 I487 T488L163-L484 HydrophobicContact CD2-CD1 4.47Å; Y184-L484 HydrophobicContact CE2-CD2 3.66Å; Y184-L484 WeakPolarHBondContact OH-CB 3.02Å; S480-L484 PolarHBondContact O-N 3.05Å; V481-L484 PolarHBondContact O-N 3.03Å; R482-L484 VanDerWaalsContact C-N 3.3Å; R482-L484 PolarHBondContact O-N 3.32Å; L484-V486 VanDerWaalsContact C-N 3.3Å; L484-V486 PolarHBondContact O-N 3.34Å; L484-I487 PolarHBondContact O-N 3.19Å; L484-T488 PolarHBondContact O-N 2.77Å; L484-T488 PolarHBondContact O-OG1 3.3Å
485V82.9Confident84.3Confident43 Ų4327.6 Ų27.626%0.26116%0.155SC..Hα-helixtrans-60.3-43179.2171.50000110.4V481 R482 I487 T488 T489V481-V485 HydrophobicContact CG1-CG2 4.39Å; V481-V485 WeakPolarHBondContact O-CG2 3.28Å; V481-V485 PolarHBondContact O-N 3.02Å; V481-V485 VanDerWaalsContact O-N 3.1Å; R482-V485 PolarHBondContact O-N 3.06Å; V485-I487 VanDerWaalsContact C-N 3.31Å; V485-I487 PolarHBondContact O-N 2.87Å; V485-T488 PolarHBondContact O-N 2.91Å; V485-T488 VanDerWaalsContact O-N 3.08Å; V485-T489 HydrophobicContact CG1-CG2 3.95Å; V485-T489 WeakPolarHBondContact O-CG2 3.03Å; V485-T489 PolarHBondContact O-N 3.37Å; V485-T489 PolarHBondContact O-OG1 2.99Å
486V86.8Confident83.5Confident5 Ų528.5 Ų28.53%0.0316%0.161CC..Hα-helixtrans-54.8-43.3177.5167.70000112.3T377 R482 A483 L484 T489 L490T377-V486 HydrophobicContact CG2-CG1 4.4Å; T377-V486 HydrophobicContact CG2-CG2 4.17Å; R482-V486 WeakPolarHBondContact O-CG2 3.42Å; R482-V486 PolarHBondContact O-N 2.86Å; R482-V486 VanDerWaalsContact O-N 3.14Å; A483-V486 PolarHBondContact O-N 2.93Å; L484-V486 VanDerWaalsContact C-N 3.3Å; L484-V486 PolarHBondContact O-N 3.34Å; V486-T489 PolarHBondContact O-OG1 2.93Å; V486-L490 WeakPolarHBondContact O-CB 3.1Å; V486-L490 PolarHBondContact O-N 3.28Å
487I88.7Confident82.7Confident0 Ų034 Ų340%019%0.186CC..Hα-helixtrans-72.6-36.7177.3-60.4-57.9000111.9F378 L484 V485 L490 I491 V502 A506F378-I487 HydrophobicContact CB-CD1 3.88Å; F378-I487 HydrophobicContact CB-CG1 3.88Å; F378-I487 HydrophobicContact CD2-CG1 3.64Å; F378-I487 HydrophobicContact CE2-CG1 4.28Å; F378-I487 HydrophobicContact CG-CD1 4.2Å; F378-I487 HydrophobicContact CG-CG1 3.8Å; L484-I487 PolarHBondContact O-N 3.19Å; V485-I487 VanDerWaalsContact C-N 3.31Å; V485-I487 PolarHBondContact O-N 2.87Å; I487-L490 WeakPolarHBondContact O-CB 3.4Å; I487-L490 PolarHBondContact O-N 2.95Å; I487-I491 HydrophobicContact CG2-CD1 4.08Å; I487-I491 WeakPolarHBondContact O-CG1 3.41Å; I487-I491 PolarHBondContact O-N 3Å; I487-I491 VanDerWaalsContact O-N 3.14Å; I487-V502 HydrophobicContact CG2-CG1 4.43Å; I487-A506 HydrophobicContact CD1-CB 3.74Å; I487-A506 HydrophobicContact CG1-CB 4.16Å
488T81.2Confident82.4Confident53 Ų5334.1 Ų34.133%0.32519%0.187SC..Hα-helixtrans-70.1-39.1-178.2-53.30000111.5L484 V485 L490 I491 G492L484-T488 PolarHBondContact O-N 2.77Å; L484-T488 PolarHBondContact O-OG1 3.3Å; V485-T488 PolarHBondContact O-N 2.91Å; V485-T488 VanDerWaalsContact O-N 3.08Å; T488-L490 VanDerWaalsContact C-N 3.32Å; T488-I491 PolarHBondContact O-N 3.45Å; T488-G492 PolarHBondContact O-N 3.14Å
489T82.5Confident82.1Confident37 Ų3734 Ų3423%0.22719%0.186CC..Hα-helixtrans-69.4-31.2175.7580000111.9V485 V486V485-T489 HydrophobicContact CG1-CG2 3.95Å; V485-T489 WeakPolarHBondContact O-CG2 3.03Å; V485-T489 PolarHBondContact O-N 3.37Å; V485-T489 PolarHBondContact O-OG1 2.99Å; V486-T489 PolarHBondContact O-OG1 2.93Å
490L84.9Confident81.9Confident18 Ų1833.9 Ų33.99%0.09419%0.185CC..Hα-helixtrans-63.9-45.9172.717770.5000112.4W365 R370 F371 V486 I487 T488W365-L490 HydrophobicContact CH2-CG 4.45Å; W365-L490 HydrophobicContact CZ3-CD1 4.06Å; W365-L490 HydrophobicContact CZ3-CD2 4.46Å; W365-L490 HydrophobicContact CZ3-CG 3.89Å; R370-L490 HydrophobicContact CG-CD1 4.23Å; F371-L490 HydrophobicContact CD2-CD2 3.81Å; V486-L490 WeakPolarHBondContact O-CB 3.1Å; V486-L490 PolarHBondContact O-N 3.28Å; I487-L490 WeakPolarHBondContact O-CB 3.4Å; I487-L490 PolarHBondContact O-N 2.95Å; T488-L490 VanDerWaalsContact C-N 3.32Å
491I84.2Confident81.9Confident9 Ų933.6 Ų33.65%0.04618%0.181CC..Hα-helixtrans-68.7-41.8178.1-63165.6000110.8I487 T488 Q495 A499 V502I487-I491 HydrophobicContact CG2-CD1 4.08Å; I487-I491 WeakPolarHBondContact O-CG1 3.41Å; I487-I491 PolarHBondContact O-N 3Å; I487-I491 VanDerWaalsContact O-N 3.14Å; T488-I491 PolarHBondContact O-N 3.45Å; I491-Q495 HydrophobicContact CG2-CB 4.4Å; I491-A499 HydrophobicContact CD1-CB 4.27Å; I491-A499 HydrophobicContact CG2-CB 4.14Å; I491-V502 HydrophobicContact CD1-CB 4.1Å; I491-V502 HydrophobicContact CD1-CG1 3.85Å; I491-V502 HydrophobicContact CG1-CB 4.08Å; I491-V502 HydrophobicContact CG1-CG1 3.65Å
492G75.5Confident82.1Confident30 Ų3032.5 Ų32.531%0.30918%0.175SC..THydrogen-bonded Turntrans63.1-168.4-176.400000113.6T488T488-G492 PolarHBondContact O-N 3.14Å
493V71.7Confident82.3Confident80 Ų8032.6 Ų32.649%0.48518%0.176SC..THydrogen-bonded Turntrans-83.9-21.5-177.4-64.80000113.7
494K69.5Low82.4Confident170 Ų17032.6 Ų32.674%0.73918%0.176SC*.THydrogen-bonded Turntrans-85.6-19.8-171.2-63.1-175.4-179.8178.90114.1
495Q76.3Confident82.8Confident39 Ų3932.6 Ų32.618%0.18218%0.176CC..  trans-115.441.1-168.3-62.6174.5-1200113.2W365 I491 H497 T498W365-Q495 HydrophobicContact CZ2-CB 4.17Å; I491-Q495 HydrophobicContact CG2-CB 4.4Å; Q495-H497 VanDerWaalsContact C-N 3.25Å; Q495-H497 PolarHBondContact O-N 3.12Å; Q495-T498 PolarHBondContact O-N 3.37Å
496V75.4Confident83.3Confident19 Ų1930.6 Ų30.612%0.11516%0.163CC..G310 helixtrans-59.7-33.7179.9171.70000113N167 T498 A499N167-V496 HydrophobicContact CB-CB 4.19Å; N167-V496 HydrophobicContact CB-CG1 3.44Å; N167-V496 VanDerWaalsContact CB-CG1 3.44Å; N167-V496 HydrophobicContact CB-CG2 4.02Å; V496-T498 VanDerWaalsContact C-N 3.3Å; V496-T498 PolarHBondContact O-N 3.32Å; V496-A499 VanDerWaalsContact O-CB 3.27Å; V496-A499 WeakPolarHBondContact O-CB 3.46Å; V496-A499 PolarHBondContact O-N 2.95Å
497H76.1Confident83.5Confident119 Ų11930.4 Ų30.455%0.55116%0.162SC*.G310 helixtrans-68.6-22.2-174.5-64.6-70.7000114.9Q495Q495-H497 VanDerWaalsContact C-N 3.25Å; Q495-H497 PolarHBondContact O-N 3.12Å
498T83.6Confident83.8Confident20 Ų2033.1 Ų33.112%0.12317%0.174CC..G310 helixtrans-110.19.8177.1550000112.2W362 W365 Q495 V496 A500 F501 V502W362-T498 HydrophobicContact CB-CG2 4.42Å; W365-T498 PolarHBondContact NE1-OG1 3.23Å; W365-T498 VanDerWaalsContact NE1-OG1 3.16Å; Q495-T498 PolarHBondContact O-N 3.37Å; V496-T498 VanDerWaalsContact C-N 3.3Å; V496-T498 PolarHBondContact O-N 3.32Å; T498-A500 PolarHBondContact O-N 2.98Å; T498-F501 PolarHBondContact O-N 3.2Å; T498-V502 WeakPolarHBondContact O-CG2 3.2Å; T498-V502 PolarHBondContact O-N 3.08Å
499A83.8Confident84.4Confident0 Ų034 Ų340%017%0.174CC..Hα-helixtrans-64-39.1-173.800000112.8N167 I491 V496 F501 V502 H503N167-A499 VanDerWaalsContact ND2-CB 3.31Å; N167-A499 WeakPolarHBondContact ND2-CB 3.46Å; I491-A499 HydrophobicContact CD1-CB 4.27Å; I491-A499 HydrophobicContact CG2-CB 4.14Å; V496-A499 VanDerWaalsContact O-CB 3.27Å; V496-A499 WeakPolarHBondContact O-CB 3.46Å; V496-A499 PolarHBondContact O-N 2.95Å; A499-F501 VanDerWaalsContact C-N 3.35Å; A499-V502 PolarHBondContact O-N 3.34Å; A499-H503 WeakPolarHBondContact O-CB 3.21Å; A499-H503 PolarHBondContact O-CD2 3.39Å; A499-H503 PolarHBondContact O-N 3.05Å
500A85.4Confident85Confident0 Ų032.2 Ų32.20%016%0.163CC..Hα-helixtrans-66-40.9178.900000111D65 I160 S164 T498 G504D65-A500 WeakPolarHBondContact OD1-CB 3.27Å; D65-A500 WeakPolarHBondContact OD2-CB 3.46Å; I160-A500 HydrophobicContact CG2-CB 4.24Å; S164-A500 VanDerWaalsContact CB-CB 3.46Å; T498-A500 PolarHBondContact O-N 2.98Å; A500-G504 PolarHBondContact O-N 3.44Å
501F88Confident85.5Confident16 Ų1632 Ų327%0.0716%0.161CC..Hα-helixtrans-60.6-48172.8179.2-99.9000112.8D65 W362 F366 T498 A499 G504 I505D65-F501 PolarHBondContact OD2-N 3.11Å; W362-F501 HydrophobicContact CB-CD1 3.9Å; W362-F501 HydrophobicContact CB-CE1 4.04Å; W362-F501 HydrophobicContact CB-CG 4.32Å; W362-F501 HydrophobicContact CD2-CZ 4.42Å; W362-F501 AromaticContact CE3-CE1 3.9Å; W362-F501 HydrophobicContact CE3-CE1 3.9Å; W362-F501 HydrophobicContact CE3-CE2 4.08Å; W362-F501 AromaticContact CE3-CZ 3.5Å; W362-F501 HydrophobicContact CE3-CZ 3.5Å; W362-F501 VanDerWaalsContact CE3-CZ 3.5Å; W362-F501 HydrophobicContact CZ3-CZ 4.12Å; W362-F501 WeakPolarHBondContact O-CE1 3.1Å; F366-F501 HydrophobicContact CE2-CE1 4.37Å; F366-F501 HydrophobicContact CE2-CZ 4.12Å; F366-F501 HydrophobicContact CZ-CE1 4.26Å; F366-F501 AromaticContact CZ-CZ 3.97Å; F366-F501 HydrophobicContact CZ-CZ 3.97Å; T498-F501 PolarHBondContact O-N 3.2Å; A499-F501 VanDerWaalsContact C-N 3.35Å; F501-G504 CarbonylContact O-C 3.6Å; F501-G504 WeakPolarHBondContact O-CA 3.19Å; F501-G504 PolarHBondContact O-N 2.66Å; F501-I505 HydrophobicContact CD1-CG1 4.43Å; F501-I505 HydrophobicContact CE1-CG1 3.9Å; F501-I505 HydrophobicContact CE2-CD1 4.19Å; F501-I505 HydrophobicContact CE2-CG1 4.01Å; F501-I505 HydrophobicContact CZ-CD1 3.98Å; F501-I505 HydrophobicContact CZ-CG1 3.66Å; F501-I505 PolarHBondContact O-N 3.3Å
502V88.6Confident86Confident0 Ų034 Ų340%017%0.171CC..Hα-helixtrans-61.8-46.2179.2172.50000111.4W365 F371 I487 I491 T498 A499 G504 I505 A506W365-V502 HydrophobicContact CD2-CG2 3.84Å; W365-V502 HydrophobicContact CG-CG2 4.09Å; W365-V502 HydrophobicContact CH2-CG2 4.4Å; W365-V502 HydrophobicContact CZ2-CG2 3.68Å; F371-V502 HydrophobicContact CE2-CG1 4.14Å; I487-V502 HydrophobicContact CG2-CG1 4.43Å; I491-V502 HydrophobicContact CD1-CB 4.1Å; I491-V502 HydrophobicContact CD1-CG1 3.85Å; I491-V502 HydrophobicContact CG1-CB 4.08Å; I491-V502 HydrophobicContact CG1-CG1 3.65Å; T498-V502 WeakPolarHBondContact O-CG2 3.2Å; T498-V502 PolarHBondContact O-N 3.08Å; A499-V502 PolarHBondContact O-N 3.34Å; V502-G504 VanDerWaalsContact C-N 3.25Å; V502-G504 PolarHBondContact O-N 3.01Å; V502-I505 PolarHBondContact O-N 3.31Å; V502-A506 WeakPolarHBondContact O-CB 3.28Å; V502-A506 PolarHBondContact O-N 3.09Å
503H89.8Confident87Confident10 Ų1035.7 Ų35.75%0.04617%0.173CC..Hα-helixtrans-60.6-36.6172.7-80.8-65.2000112.1A499 S507A499-H503 WeakPolarHBondContact O-CB 3.21Å; A499-H503 PolarHBondContact O-CD2 3.39Å; A499-H503 PolarHBondContact O-N 3.05Å; H503-S507 VanDerWaalsContact O-CB 3.25Å; H503-S507 WeakPolarHBondContact O-CB 3.37Å; H503-S507 PolarHBondContact O-N 3.48Å; H503-S507 PolarHBondContact O-OG 3.34Å
504G91.8Very high88.2Confident0 Ų032.1 Ų32.10%015%0.151CC..Hα-helixtrans-62.2-44.7176.300000113T57 A500 F501 V502 F508T57-G504 WeakPolarHBondContact CB-O 3.07Å; T57-G504 PolarHBondContact OG1-O 3.4Å; A500-G504 PolarHBondContact O-N 3.44Å; F501-G504 CarbonylContact O-C 3.6Å; F501-G504 WeakPolarHBondContact O-CA 3.19Å; F501-G504 PolarHBondContact O-N 2.66Å; V502-G504 VanDerWaalsContact C-N 3.25Å; V502-G504 PolarHBondContact O-N 3.01Å; G504-F508 PolarHBondContact O-N 2.95Å
505I92.8Very high89.4Confident17 Ų1724 Ų249%0.08712%0.116CC..Hα-helixtrans-71.9-44177.3-64.7-69.5000111.7P58 F366 F371 F501 V502 S507 F508 F509P58-I505 HydrophobicContact CB-CD1 3.76Å; P58-I505 HydrophobicContact CB-CG1 4.41Å; F366-I505 HydrophobicContact CE1-CG2 4.18Å; F366-I505 HydrophobicContact CZ-CD1 4.11Å; F366-I505 HydrophobicContact CZ-CG1 4.28Å; F371-I505 HydrophobicContact CE1-CG2 4.13Å; F371-I505 HydrophobicContact CZ-CB 4.22Å; F371-I505 HydrophobicContact CZ-CG2 3.67Å; F501-I505 HydrophobicContact CD1-CG1 4.43Å; F501-I505 HydrophobicContact CE1-CG1 3.9Å; F501-I505 HydrophobicContact CE2-CD1 4.19Å; F501-I505 HydrophobicContact CE2-CG1 4.01Å; F501-I505 HydrophobicContact CZ-CD1 3.98Å; F501-I505 HydrophobicContact CZ-CG1 3.66Å; F501-I505 PolarHBondContact O-N 3.3Å; V502-I505 PolarHBondContact O-N 3.31Å; I505-S507 PolarHBondContact O-N 3.07Å; I505-F508 WeakPolarHBondContact O-CB 3.46Å; I505-F508 PolarHBondContact O-N 3.19Å; I505-F508 VanDerWaalsContact O-N 3.08Å; I505-F509 HydrophobicContact CG2-CD2 4.07Å; I505-F509 HydrophobicContact CG2-CE2 4.1Å; I505-F509 WeakPolarHBondContact O-CD2 3.48Å; I505-F509 PolarHBondContact O-N 3.15Å; I505-F509 VanDerWaalsContact O-N 3.12Å
506A91.9Very high90.4Very high0 Ų025.5 Ų25.50%013%0.128CC..Hα-helixtrans-58.2-40.4175.100000111.3F378 I487 V502 D510F378-A506 HydrophobicContact CD1-CB 4.18Å; F378-A506 HydrophobicContact CE1-CB 4.31Å; F378-A506 WeakPolarHBondContact CE1-O 3.32Å; I487-A506 HydrophobicContact CD1-CB 3.74Å; I487-A506 HydrophobicContact CG1-CB 4.16Å; V502-A506 WeakPolarHBondContact O-CB 3.28Å; V502-A506 PolarHBondContact O-N 3.09Å; A506-D510 PolarHBondContact O-N 3.16Å; A506-D510 VanDerWaalsContact O-N 3.15Å
507S92.8Very high91.4Very high1 Ų127.5 Ų27.51%0.00714%0.135CC..Hα-helixtrans-69.2-36.2174.8-56.40000112.5Q159 H503 I505 F509 D510 K511Q159-S507 PolarHBondContact NE2-OG 3.41Å; H503-S507 VanDerWaalsContact O-CB 3.25Å; H503-S507 WeakPolarHBondContact O-CB 3.37Å; H503-S507 PolarHBondContact O-N 3.48Å; H503-S507 PolarHBondContact O-OG 3.34Å; I505-S507 PolarHBondContact O-N 3.07Å; S507-F509 VanDerWaalsContact C-N 3.33Å; S507-F509 PolarHBondContact O-N 3.12Å; S507-D510 PolarHBondContact O-N 3.14Å; S507-K511 WeakPolarHBondContact O-CB 3.47Å; S507-K511 WeakPolarHBondContact O-CG 3.4Å; S507-K511 PolarHBondContact O-N 3.08Å
508F94.6Very high92.3Very high57 Ų5721.9 Ų21.925%0.2511%0.109CC..Hα-helixtrans-56.8-48.9175163.2-97.4000110.8G54 L55 T57 G504 I505 K511 I512G54-F508 VanDerWaalsContact O-CD2 3.3Å; G54-F508 WeakPolarHBondContact O-CD2 3.1Å; L55-F508 HydrophobicContact CD2-CE2 4.37Å; T57-F508 PolarHBondContact OG1-N 3.47Å; G504-F508 PolarHBondContact O-N 2.95Å; I505-F508 WeakPolarHBondContact O-CB 3.46Å; I505-F508 PolarHBondContact O-N 3.19Å; I505-F508 VanDerWaalsContact O-N 3.08Å; F508-K511 PolarHBondContact O-N 3.34Å; F508-I512 HydrophobicContact CD2-CG1 3.92Å; F508-I512 HydrophobicContact CE2-CD1 4.17Å; F508-I512 HydrophobicContact CE2-CG1 3.64Å; F508-I512 HydrophobicContact CZ-CG1 3.98Å; F508-I512 VanDerWaalsContact O-CG1 3.31Å; F508-I512 WeakPolarHBondContact O-CG1 3.25Å; F508-I512 PolarHBondContact O-N 3.48Å
509F93.1Very high93Very high71 Ų7122.3 Ų22.331%0.31111%0.109SC..Hα-helixtrans-60.9-46.6176.9-85.5-81.9000112.4W372 I505 S507 K511 L513W372-F509 HydrophobicContact CE3-CE2 4.49Å; W372-F509 HydrophobicContact CE3-CZ 4.35Å; W372-F509 HydrophobicContact CH2-CE2 4.47Å; W372-F509 HydrophobicContact CH2-CZ 4.34Å; W372-F509 HydrophobicContact CZ3-CE1 4.36Å; W372-F509 AromaticContact CZ3-CE2 3.66Å; W372-F509 HydrophobicContact CZ3-CE2 3.66Å; W372-F509 AromaticContact CZ3-CZ 3.48Å; W372-F509 HydrophobicContact CZ3-CZ 3.48Å; W372-F509 VanDerWaalsContact CZ3-CZ 3.48Å; I505-F509 HydrophobicContact CG2-CD2 4.07Å; I505-F509 HydrophobicContact CG2-CE2 4.1Å; I505-F509 WeakPolarHBondContact O-CD2 3.48Å; I505-F509 PolarHBondContact O-N 3.15Å; I505-F509 VanDerWaalsContact O-N 3.12Å; S507-F509 VanDerWaalsContact C-N 3.33Å; S507-F509 PolarHBondContact O-N 3.12Å; F509-K511 VanDerWaalsContact C-N 3.34Å; F509-K511 PolarHBondContact O-N 2.93Å; F509-L513 WeakPolarHBondContact O-CB 3.29Å; F509-L513 PolarHBondContact O-N 2.92Å
510D95.2Very high93.6Very high1 Ų125.5 Ų25.51%0.00513%0.131CC..Hα-helixtrans-55.4-47.8176.6175.444.8000111.8F378 S379 R382 A506 S507 T514F378-D510 HydrophobicContact CD1-CB 4.02Å; F378-D510 HydrophobicContact CE1-CB 3.64Å; S379-D510 WeakPolarHBondContact OG-CA 3.39Å; S379-D510 PolarHBondContact OG-N 3.47Å; S379-D510 VanDerWaalsContact OG-N 3.17Å; R382-D510 WeakPolarHBondContact CB-OD1 3.31Å; R382-D510 IonicContact CZ-OD2 3.61Å; R382-D510 IonicContact NE-OD1 3.53Å; R382-D510 IonicContact NE-OD2 3.33Å; R382-D510 PolarHBondContact NE-OD2 2.93Å; R382-D510 IonicContact NH2-OD2 2.97Å; A506-D510 PolarHBondContact O-N 3.16Å; A506-D510 VanDerWaalsContact O-N 3.15Å; S507-D510 PolarHBondContact O-N 3.14Å; D510-T514 WeakPolarHBondContact O-CB 3.38Å; D510-T514 PolarHBondContact O-N 3.26Å; D510-T514 PolarHBondContact O-OG1 2.89Å
511K95.2Very high94.1Very high14 Ų1425.9 Ų25.96%0.06113%0.133CC..Hα-helixtrans-70.8-46.3-175.8-63-66.9169.8-175.80112.5Q50 N53 S507 F508 F509 T514 G515Q50-K511 WeakPolarHBondContact CB-O 3.36Å; N53-K511 HydrophobicContact CB-CB 4.47Å; N53-K511 HydrophobicContact CB-CD 4.22Å; N53-K511 HydrophobicContact CB-CG 4.22Å; S507-K511 WeakPolarHBondContact O-CB 3.47Å; S507-K511 WeakPolarHBondContact O-CG 3.4Å; S507-K511 PolarHBondContact O-N 3.08Å; F508-K511 PolarHBondContact O-N 3.34Å; F509-K511 VanDerWaalsContact C-N 3.34Å; F509-K511 PolarHBondContact O-N 2.93Å; K511-T514 PolarHBondContact O-N 2.99Å; K511-G515 PolarHBondContact O-N 3.42Å
512I95.5Very high94.4Very high49 Ų4925.2 Ų25.225%0.25113%0.13SC..Hα-helixtrans-62.5-47177.5-63.7-59.6000110.4I51 F508 T514 G515 V516I51-I512 HydrophobicContact CB-CD1 4.37Å; I51-I512 HydrophobicContact CG1-CD1 4.05Å; F508-I512 HydrophobicContact CD2-CG1 3.92Å; F508-I512 HydrophobicContact CE2-CD1 4.17Å; F508-I512 HydrophobicContact CE2-CG1 3.64Å; F508-I512 HydrophobicContact CZ-CG1 3.98Å; F508-I512 VanDerWaalsContact O-CG1 3.31Å; F508-I512 WeakPolarHBondContact O-CG1 3.25Å; F508-I512 PolarHBondContact O-N 3.48Å; I512-T514 VanDerWaalsContact C-N 3.34Å; I512-T514 PolarHBondContact O-N 3.38Å; I512-G515 PolarHBondContact O-N 2.9Å; I512-V516 HydrophobicContact CG2-CG2 4.46Å; I512-V516 WeakPolarHBondContact O-CG2 2.94Å; I512-V516 PolarHBondContact O-N 3.18Å
513L96.1Very high94.7Very high67 Ų6729.9 Ų29.935%0.35116%0.155SC..Hα-helixtrans-60.6-45.1178.1-175.265000111.2I380 L383 F509 V516 F517I380-L513 HydrophobicContact CG1-CD2 4Å; L383-L513 HydrophobicContact CD2-CD2 4.2Å; L383-L513 HydrophobicContact CD2-CG 4.12Å; F509-L513 WeakPolarHBondContact O-CB 3.29Å; F509-L513 PolarHBondContact O-N 2.92Å; L513-V516 PolarHBondContact O-N 2.86Å; L513-F517 WeakPolarHBondContact O-CB 3.38Å; L513-F517 PolarHBondContact O-N 3.03Å
514T95.8Very high95Very high4 Ų432.2 Ų32.23%0.02517%0.171CC..Hα-helixtrans-61.7-45.3177.8-63.20000112.7L383 T386 D510 K511 I512 I518L383-T514 HydrophobicContact CD1-CG2 4.23Å; T386-T514 HydrophobicContact CG2-CG2 3.97Å; D510-T514 WeakPolarHBondContact O-CB 3.38Å; D510-T514 PolarHBondContact O-N 3.26Å; D510-T514 PolarHBondContact O-OG1 2.89Å; K511-T514 PolarHBondContact O-N 2.99Å; I512-T514 VanDerWaalsContact C-N 3.34Å; I512-T514 PolarHBondContact O-N 3.38Å; T514-I518 HydrophobicContact CG2-CD1 3.53Å; T514-I518 HydrophobicContact CG2-CG1 4.42Å; T514-I518 WeakPolarHBondContact O-CB 3.42Å; T514-I518 WeakPolarHBondContact O-CD1 3.45Å; T514-I518 VanDerWaalsContact O-CG1 3.26Å; T514-I518 WeakPolarHBondContact O-CG1 3.44Å; T514-I518 PolarHBondContact O-N 3.48Å
515G96Very high94.9Very high0 Ų033 Ų330%018%0.176CC..Hα-helixtrans-62.4-48.2178.300000112.7L47 K511 I512 Q519L47-G515 VanDerWaalsContact CD1-C 3.46Å; K511-G515 PolarHBondContact O-N 3.42Å; I512-G515 PolarHBondContact O-N 2.9Å; G515-Q519 WeakPolarHBondContact O-CB 3.3Å; G515-Q519 PolarHBondContact O-N 3.18Å
516V97.3Very high94.5Very high70 Ų7037.5 Ų37.542%0.42421%0.207SC..Hα-helixtrans-63.8-46.3179.9173.10000110.4L47 I512 L513 I518 Q519 C520L47-V516 HydrophobicContact CD1-CG2 4.02Å; I512-V516 HydrophobicContact CG2-CG2 4.46Å; I512-V516 WeakPolarHBondContact O-CG2 2.94Å; I512-V516 PolarHBondContact O-N 3.18Å; L513-V516 PolarHBondContact O-N 2.86Å; V516-I518 PolarHBondContact O-N 3.21Å; V516-Q519 PolarHBondContact O-N 2.64Å; V516-C520 PolarHBondContact O-N 3.41Å; V516-C520 PolarHBondContact O-SG 3.4Å
517F96.5Very high94.3Very high62 Ų6246.3 Ų46.327%0.27225%0.248SC..Hα-helixtrans-65.3-43-177-161.2-92.7000112.3L383 V387 L513 Q519 C520 I521 I537 L541L383-F517 HydrophobicContact CD1-CB 4.1Å; L383-F517 HydrophobicContact CD1-CD1 4.16Å; L383-F517 HydrophobicContact CD1-CG 4.32Å; L383-F517 HydrophobicContact CD2-CB 4Å; L383-F517 HydrophobicContact CD2-CD1 4Å; L383-F517 HydrophobicContact CD2-CD2 4.03Å; L383-F517 HydrophobicContact CD2-CE1 4.47Å; L383-F517 HydrophobicContact CD2-CG 3.75Å; L383-F517 HydrophobicContact CG-CD1 4.34Å; L383-F517 HydrophobicContact CG-CG 4.49Å; V387-F517 HydrophobicContact CG2-CD1 4.23Å; V387-F517 HydrophobicContact CG2-CE1 4.44Å; L513-F517 WeakPolarHBondContact O-CB 3.38Å; L513-F517 PolarHBondContact O-N 3.03Å; F517-Q519 VanDerWaalsContact C-N 3.33Å; F517-Q519 PolarHBondContact O-N 2.68Å; F517-C520 PolarHBondContact O-N 2.9Å; F517-I521 HydrophobicContact CD1-CD1 3.65Å; F517-I521 HydrophobicContact CD1-CG1 4.19Å; F517-I521 HydrophobicContact CE1-CD1 3.66Å; F517-I521 HydrophobicContact CE1-CG1 4.16Å; F517-I521 WeakPolarHBondContact O-CG1 3.43Å; F517-I521 PolarHBondContact O-N 3.25Å; F517-I537 HydrophobicContact CE1-CG2 3.53Å; F517-I537 HydrophobicContact CZ-CG2 3.81Å; F517-L541 HydrophobicContact CD1-CD1 4.37Å; F517-L541 HydrophobicContact CE1-CD1 3.62Å; F517-L541 HydrophobicContact CE1-CD2 4.38Å; F517-L541 HydrophobicContact CE1-CG 4.35Å; F517-L541 HydrophobicContact CE2-CD2 4.21Å; F517-L541 HydrophobicContact CZ-CD1 3.92Å; F517-L541 HydrophobicContact CZ-CD2 3.89Å; F517-L541 HydrophobicContact CZ-CG 4.13Å
518I95.6Very high94.1Very high1 Ų148.4 Ų48.41%0.00526%0.258CS..Hα-helixtrans-65.8-38.4176.3-66.4166.3000110.8L46 T386 M390 Y391 T514 V516 C520 I521 Q522L46-I518 HydrophobicContact CD2-CB 3.97Å; L46-I518 HydrophobicContact CD2-CD1 3.64Å; L46-I518 HydrophobicContact CD2-CG1 4.4Å; L46-I518 HydrophobicContact CD2-CG2 3.44Å; L46-I518 VanDerWaalsContact CD2-CG2 3.44Å; T386-I518 HydrophobicContact CG2-CD1 4.44Å; M390-I518 HydrophobicContact CE-CD1 3.91Å; M390-I518 HydrophobicContact SD-CD1 3.73Å; M390-I518 HydrophobicContact SD-CG2 4.2Å; Y391-I518 HydrophobicContact CE2-CG2 4.47Å; T514-I518 HydrophobicContact CG2-CD1 3.53Å; T514-I518 HydrophobicContact CG2-CG1 4.42Å; T514-I518 WeakPolarHBondContact O-CB 3.42Å; T514-I518 WeakPolarHBondContact O-CD1 3.45Å; T514-I518 VanDerWaalsContact O-CG1 3.26Å; T514-I518 WeakPolarHBondContact O-CG1 3.44Å; T514-I518 PolarHBondContact O-N 3.48Å; V516-I518 PolarHBondContact O-N 3.21Å; I518-C520 PolarHBondContact O-N 2.91Å; I518-I521 PolarHBondContact O-N 3.31Å; I518-Q522 HydrophobicContact CG2-CG 4.23Å; I518-Q522 WeakPolarHBondContact O-CB 3.46Å; I518-Q522 WeakPolarHBondContact O-CG 3.43Å; I518-Q522 PolarHBondContact O-N 2.88Å
519Q96.9Very high93.9Very high28 Ų2849 Ų4913%0.13127%0.267CS..Hα-helixtrans-62.2-42.8174.2176.1584.500112S40 G43 L47 G515 V516 F517 I521 Q522 L523S40-Q519 PolarHBondContact O-NE2 3.43Å; S40-Q519 PolarHBondContact O-OE1 3.3Å; G43-Q519 PolarHBondContact O-OE1 3.39Å; L47-Q519 HydrophobicContact CB-CB 4.3Å; L47-Q519 HydrophobicContact CD2-CB 4.21Å; L47-Q519 HydrophobicContact CD2-CG 4.12Å; G515-Q519 WeakPolarHBondContact O-CB 3.3Å; G515-Q519 PolarHBondContact O-N 3.18Å; V516-Q519 PolarHBondContact O-N 2.64Å; F517-Q519 VanDerWaalsContact C-N 3.33Å; F517-Q519 PolarHBondContact O-N 2.68Å; Q519-I521 VanDerWaalsContact C-N 3.34Å; Q519-I521 PolarHBondContact O-N 2.88Å; Q519-Q522 PolarHBondContact O-N 3.33Å; Q519-L523 HydrophobicContact CG-CD1 4.11Å; Q519-L523 VanDerWaalsContact O-CG 3.31Å; Q519-L523 WeakPolarHBondContact O-CG 3.38Å; Q519-L523 PolarHBondContact O-N 3.24Å
520C96.4Very high93.9Very high68 Ų6846.6 Ų46.646%0.45926%0.256SS..Hα-helixtrans-60-44174.5-69.20000111.7V516 F517 I518 L523 C524V516-C520 PolarHBondContact O-N 3.41Å; V516-C520 PolarHBondContact O-SG 3.4Å; F517-C520 PolarHBondContact O-N 2.9Å; I518-C520 PolarHBondContact O-N 2.91Å; C520-L523 PolarHBondContact O-N 3.49Å; C520-C524 PolarHBondContact O-N 2.82Å; C520-C524 PolarHBondContact O-SG 2.71Å; C520-C524 VanDerWaalsContact O-SG 3.33Å
521I96Very high93.8Very high8 Ų849.8 Ų49.84%0.04127%0.268CS..Hα-helixtrans-59.9-49.5175.3-65.1167.4000110.3V387 Y391 F517 I518 Q519 L523 C524 V525 I533 I537V387-I521 HydrophobicContact CG1-CD1 4.14Å; V387-I521 HydrophobicContact CG2-CD1 4.25Å; Y391-I521 HydrophobicContact CE1-CG2 3.96Å; Y391-I521 HydrophobicContact CE2-CD1 3.92Å; Y391-I521 HydrophobicContact CE2-CG2 4.09Å; Y391-I521 VanDerWaalsContact CZ-CG2 3.5Å; Y391-I521 WeakPolarHBondContact OH-CB 3.36Å; Y391-I521 WeakPolarHBondContact OH-CG2 3.43Å; F517-I521 HydrophobicContact CD1-CD1 3.65Å; F517-I521 HydrophobicContact CD1-CG1 4.19Å; F517-I521 HydrophobicContact CE1-CD1 3.66Å; F517-I521 HydrophobicContact CE1-CG1 4.16Å; F517-I521 WeakPolarHBondContact O-CG1 3.43Å; F517-I521 PolarHBondContact O-N 3.25Å; I518-I521 PolarHBondContact O-N 3.31Å; Q519-I521 VanDerWaalsContact C-N 3.34Å; Q519-I521 PolarHBondContact O-N 2.88Å; I521-L523 VanDerWaalsContact C-N 3.3Å; I521-L523 PolarHBondContact O-N 3.4Å; I521-C524 CarbonylContact O-C 3.53Å; I521-C524 WeakPolarHBondContact O-CA 3.46Å; I521-C524 WeakPolarHBondContact O-CB 3.31Å; I521-C524 PolarHBondContact O-N 2.8Å; I521-V525 HydrophobicContact CG2-CG2 4.45Å; I521-V525 WeakPolarHBondContact O-CG2 3.22Å; I521-V525 PolarHBondContact O-N 3.39Å; I521-I533 HydrophobicContact CG2-CD1 3.49Å; I521-I533 VanDerWaalsContact CG2-CD1 3.49Å; I521-I533 HydrophobicContact CG2-CG1 3.99Å; I521-I533 HydrophobicContact CG2-CG2 4.33Å; I521-I537 HydrophobicContact CD1-CD1 4.42Å; I521-I537 HydrophobicContact CD1-CG2 4.26Å; I521-I537 HydrophobicContact CG1-CD1 4.1Å
522Q95.3Very high93.7Very high2 Ų253 Ų531%0.00928%0.283CS..Hα-helixtrans-63.6-32.1-176.6-75.8-62.9-7.300113.8S39 Y391 I518 Q519 C524S39-Q522 WeakPolarHBondContact O-CB 3.46Å; Y391-Q522 WeakPolarHBondContact OH-CG 3.05Å; Y391-Q522 PolarHBondContact OH-NE2 2.82Å; I518-Q522 HydrophobicContact CG2-CG 4.23Å; I518-Q522 WeakPolarHBondContact O-CB 3.46Å; I518-Q522 WeakPolarHBondContact O-CG 3.43Å; I518-Q522 PolarHBondContact O-N 2.88Å; Q519-Q522 PolarHBondContact O-N 3.33Å; Q522-C524 VanDerWaalsContact C-N 3.26Å; Q522-C524 PolarHBondContact O-N 3.45Å
523L95.2Very high93.7Very high98 Ų9850.7 Ų50.751%0.51327%0.271SS..Hα-helixtrans-67.2-28.5171.2-72168.9000112.5Q519 C520 I521Q519-L523 HydrophobicContact CG-CD1 4.11Å; Q519-L523 VanDerWaalsContact O-CG 3.31Å; Q519-L523 WeakPolarHBondContact O-CG 3.38Å; Q519-L523 PolarHBondContact O-N 3.24Å; C520-L523 PolarHBondContact O-N 3.49Å; I521-L523 VanDerWaalsContact C-N 3.3Å; I521-L523 PolarHBondContact O-N 3.4Å
524C94.5Very high93.6Very high58 Ų5847.5 Ų47.539%0.39226%0.255SS..Hα-helixtrans-92.2-12.3179.9-63.90000113.9C520 I521 Q522 P526 Q527 L528C520-C524 PolarHBondContact O-N 2.82Å; C520-C524 PolarHBondContact O-SG 2.71Å; C520-C524 VanDerWaalsContact O-SG 3.33Å; I521-C524 CarbonylContact O-C 3.53Å; I521-C524 WeakPolarHBondContact O-CA 3.46Å; I521-C524 WeakPolarHBondContact O-CB 3.31Å; I521-C524 PolarHBondContact O-N 2.8Å; Q522-C524 VanDerWaalsContact C-N 3.26Å; Q522-C524 PolarHBondContact O-N 3.45Å; C524-P526 VanDerWaalsContact C-N 3.29Å; C524-Q527 CarbonylContact O-C 3.21Å; C524-Q527 WeakPolarHBondContact O-CA 3.48Å; C524-Q527 PolarHBondContact O-N 2.88Å; C524-L528 HydrophobicContact CB-CB 4.43Å; C524-L528 WeakPolarHBondContact O-CB 3.34Å; C524-L528 PolarHBondContact O-N 2.86Å
525V90.1Very high93.6Very high18 Ų1848 Ų4811%0.10926%0.258CS..THydrogen-bonded Turntrans-50.6-37.2-179.7167.40000114.2I521 Q527 L528 Y530 I533I521-V525 HydrophobicContact CG2-CG2 4.45Å; I521-V525 WeakPolarHBondContact O-CG2 3.22Å; I521-V525 PolarHBondContact O-N 3.39Å; V525-Q527 PolarHBondContact O-N 3.27Å; V525-Q527 VanDerWaalsContact O-N 3.11Å; V525-L528 PolarHBondContact O-N 3.38Å; V525-L528 VanDerWaalsContact O-N 3.16Å; V525-Y530 HydrophobicContact CG1-CE1 4.4Å; V525-Y530 HydrophobicContact CG1-CE2 4.34Å; V525-Y530 HydrophobicContact CG2-CE1 4.39Å; V525-I533 HydrophobicContact CG2-CD1 4.26Å
526P84.3Confident93.5Very high111 Ų11153.6 Ų53.672%0.72128%0.279SS*.THydrogen-bonded Turntrans-58.7-25.9175.1-26.135.8000114.2C524C524-P526 VanDerWaalsContact C-N 3.29Å
527Q87.4Confident93.5Very high184 Ų18452 Ų5286%0.8627%0.268SS*.THydrogen-bonded Turntrans-104.8-17.6178.5-62.1175.4-11.300112.3C524 V525C524-Q527 CarbonylContact O-C 3.21Å; C524-Q527 WeakPolarHBondContact O-CA 3.48Å; C524-Q527 PolarHBondContact O-N 2.88Å; V525-Q527 PolarHBondContact O-N 3.27Å; V525-Q527 VanDerWaalsContact O-N 3.11Å
528L88.4Confident93.5Very high45 Ų4549.1 Ų49.124%0.23626%0.255CS..SBendtrans-116.3116.5-169.1-17169.7000110.6C524 V525 H532 I533 I537C524-L528 HydrophobicContact CB-CB 4.43Å; C524-L528 WeakPolarHBondContact O-CB 3.34Å; C524-L528 PolarHBondContact O-N 2.86Å; V525-L528 PolarHBondContact O-N 3.38Å; V525-L528 VanDerWaalsContact O-N 3.16Å; L528-H532 HydrophobicContact CD1-CB 3.63Å; L528-H532 HydrophobicContact CG-CB 4.31Å; L528-I533 HydrophobicContact CD2-CD1 4.04Å; L528-I533 HydrophobicContact CD2-CG1 3.42Å; L528-I533 VanDerWaalsContact CD2-CG1 3.42Å; L528-I533 HydrophobicContact CG-CD1 4.47Å; L528-I533 HydrophobicContact CG-CG1 3.91Å; L528-I537 HydrophobicContact CD2-CD1 3.85Å
529T91.5Very high93.5Very high70 Ų7049.3 Ų49.343%0.42926%0.258SS..  trans-71148.3174.773.20000110.8R531 H532 I533T529-R531 PolarHBondContact O-N 3.42Å; T529-R531 VanDerWaalsContact O-N 3.14Å; T529-H532 WeakPolarHBondContact O-CB 3.46Å; T529-H532 PolarHBondContact O-N 2.99Å; T529-H532 PolarHBondContact OG1-N 2.92Å; T529-H532 PolarHBondContact OG1-ND1 3.31Å; T529-I533 PolarHBondContact O-N 3.31Å
530Y92.2Very high93.5Very high20 Ų2051.6 Ų51.68%0.07828%0.277CS..Hα-helixtrans-58.7-27.8176.6-61.1-81.5000114.5E32 Y391 P394 N398 V525 H532 I533 Q534E32-Y530 PolarHBondContact OE2-OH 3.29Å; Y391-Y530 AromaticContact CD1-CD1 3.87Å; Y391-Y530 HydrophobicContact CD1-CD1 3.87Å; Y391-Y530 AromaticContact CD1-CE1 4Å; Y391-Y530 HydrophobicContact CD1-CE1 4Å; Y391-Y530 HydrophobicContact CE1-CD1 4.45Å; Y391-Y530 HydrophobicContact CE1-CE1 4.23Å; P394-Y530 HydrophobicContact CB-CD1 3.44Å; P394-Y530 VanDerWaalsContact CB-CD1 3.44Å; P394-Y530 HydrophobicContact CB-CD2 4.28Å; P394-Y530 HydrophobicContact CB-CE1 3.38Å; P394-Y530 HydrophobicContact CB-CE2 4.26Å; P394-Y530 HydrophobicContact CB-CG 3.88Å; P394-Y530 HydrophobicContact CG-CD1 4.42Å; P394-Y530 HydrophobicContact CG-CE1 4.14Å; N398-Y530 HydrophobicContact CB-CD2 3.74Å; N398-Y530 HydrophobicContact CB-CE2 3.96Å; N398-Y530 WeakPolarHBondContact ND2-CE2 3.43Å; V525-Y530 HydrophobicContact CG1-CE1 4.4Å; V525-Y530 HydrophobicContact CG1-CE2 4.34Å; V525-Y530 HydrophobicContact CG2-CE1 4.39Å; Y530-H532 PolarHBondContact O-N 3.23Å; Y530-I533 HydrophobicContact CD1-CD1 3.95Å; Y530-I533 WeakPolarHBondContact O-CB 3.49Å; Y530-I533 PolarHBondContact O-N 3.43Å; Y530-Q534 PolarHBondContact O-N 3.29Å; Y530-Q534 VanDerWaalsContact O-N 3.07Å
531R93.1Very high93.6Very high69 Ų6949.2 Ų49.226%0.2626%0.26SS..Hα-helixtrans-58.7-45.1170.7-177178.9-74.6127.7-3.5112.2F395 S399 L455 T529 I533 Q534 V535F395-R531 HydrophobicContact CD2-CB 4.22Å; F395-R531 HydrophobicContact CE2-CB 3.89Å; F395-R531 HydrophobicContact CE2-CG 4.05Å; S399-R531 PolarHBondContact OG-N 3.47Å; L455-R531 PolarHBondContact O-NH2 3.44Å; T529-R531 PolarHBondContact O-N 3.42Å; T529-R531 VanDerWaalsContact O-N 3.14Å; R531-I533 VanDerWaalsContact C-N 3.3Å; R531-I533 PolarHBondContact O-N 3.37Å; R531-Q534 PolarHBondContact O-N 2.88Å; R531-V535 HydrophobicContact CG-CG2 4.29Å; R531-V535 WeakPolarHBondContact O-CG2 3.46Å; R531-V535 PolarHBondContact O-N 3.41Å
532H93.5Very high93.5Very high82 Ų8249 Ų4938%0.3826%0.259SS..Hα-helixtrans-64.5-34.9178.4-72.788.7000112L528 T529 Y530 Y536L528-H532 HydrophobicContact CD1-CB 3.63Å; L528-H532 HydrophobicContact CG-CB 4.31Å; T529-H532 WeakPolarHBondContact O-CB 3.46Å; T529-H532 PolarHBondContact O-N 2.99Å; T529-H532 PolarHBondContact OG1-N 2.92Å; T529-H532 PolarHBondContact OG1-ND1 3.31Å; Y530-H532 PolarHBondContact O-N 3.23Å; H532-Y536 HydrophobicContact CB-CD2 4.1Å; H532-Y536 AromaticContact CD2-CD2 3.57Å; H532-Y536 AromaticContact CD2-CE2 3.35Å; H532-Y536 WeakPolarHBondContact CD2-CE2 3.42Å; H532-Y536 WeakPolarHBondContact O-CB 3.49Å; H532-Y536 PolarHBondContact O-N 3.29Å
533I95.2Very high93.6Very high0 Ų051.5 Ų51.50%027%0.274CS..Iπ-helixtrans-62.4-49.9174-59.9170.8000110.1V387 Y391 I521 V525 L528 T529 Y530 R531 V535 I537 V538V387-I533 HydrophobicContact CG1-CG2 4.08Å; Y391-I533 HydrophobicContact CD1-CD1 4.05Å; Y391-I533 HydrophobicContact CD1-CG2 4.31Å; Y391-I533 HydrophobicContact CD2-CG2 3.96Å; Y391-I533 HydrophobicContact CE1-CD1 4.04Å; Y391-I533 HydrophobicContact CE2-CG2 4.45Å; Y391-I533 HydrophobicContact CG-CG2 3.86Å; I521-I533 HydrophobicContact CG2-CD1 3.49Å; I521-I533 VanDerWaalsContact CG2-CD1 3.49Å; I521-I533 HydrophobicContact CG2-CG1 3.99Å; I521-I533 HydrophobicContact CG2-CG2 4.33Å; V525-I533 HydrophobicContact CG2-CD1 4.26Å; L528-I533 HydrophobicContact CD2-CD1 4.04Å; L528-I533 HydrophobicContact CD2-CG1 3.42Å; L528-I533 VanDerWaalsContact CD2-CG1 3.42Å; L528-I533 HydrophobicContact CG-CD1 4.47Å; L528-I533 HydrophobicContact CG-CG1 3.91Å; T529-I533 PolarHBondContact O-N 3.31Å; Y530-I533 HydrophobicContact CD1-CD1 3.95Å; Y530-I533 WeakPolarHBondContact O-CB 3.49Å; Y530-I533 PolarHBondContact O-N 3.43Å; R531-I533 VanDerWaalsContact C-N 3.3Å; R531-I533 PolarHBondContact O-N 3.37Å; I533-V535 PolarHBondContact O-N 2.69Å; I533-I537 HydrophobicContact CB-CD1 4.49Å; I533-I537 HydrophobicContact CG1-CD1 4.26Å; I533-I537 HydrophobicContact CG2-CD1 4.42Å; I533-I537 WeakPolarHBondContact O-CB 3.48Å; I533-I537 PolarHBondContact O-N 3.01Å; I533-V538 PolarHBondContact O-N 3.17Å
534Q94.4Very high93.7Very high0 Ų052 Ų520%027%0.273CS..Iπ-helixtrans-68-34.7-177.8-74.9-65.6-1200114S388 Y391 M392 F395 Y530 R531 V538S388-Q534 PolarHBondContact O-NE2 3.17Å; Y391-Q534 PolarHBondContact O-NE2 3.35Å; M392-Q534 VanDerWaalsContact N-NE2 3.1Å; F395-Q534 HydrophobicContact CB-CG 3.72Å; F395-Q534 HydrophobicContact CD1-CG 4.14Å; F395-Q534 HydrophobicContact CD2-CB 4.38Å; F395-Q534 HydrophobicContact CD2-CG 4.1Å; F395-Q534 HydrophobicContact CG-CB 4.41Å; F395-Q534 HydrophobicContact CG-CG 3.72Å; Y530-Q534 PolarHBondContact O-N 3.29Å; Y530-Q534 VanDerWaalsContact O-N 3.07Å; R531-Q534 PolarHBondContact O-N 2.88Å; Q534-V538 WeakPolarHBondContact O-CB 3.36Å
535V95.2Very high93.7Very high15 Ų1549.3 Ų49.39%0.09125%0.254CS..Iπ-helixtrans-86.5-57.6-177176.10000111.3C449 A452 Y453 R531 I533 G539C449-V535 HydrophobicContact CB-CG1 4.46Å; A452-V535 HydrophobicContact CB-CG2 4.04Å; Y453-V535 HydrophobicContact CD2-CG1 4.34Å; R531-V535 HydrophobicContact CG-CG2 4.29Å; R531-V535 WeakPolarHBondContact O-CG2 3.46Å; R531-V535 PolarHBondContact O-N 3.41Å; I533-V535 PolarHBondContact O-N 2.69Å; V535-G539 PolarHBondContact O-N 2.99Å
536Y95.7Very high93.9Very high116 Ų11648.7 Ų48.746%0.45525%0.252SS..Iπ-helixtrans-85.6-45.5-169.1-62.6-70.8000112.4Y453 H532 S540Y453-Y536 WeakPolarHBondContact CE2-OH 3.48Å; H532-Y536 HydrophobicContact CB-CD2 4.1Å; H532-Y536 AromaticContact CD2-CD2 3.57Å; H532-Y536 AromaticContact CD2-CE2 3.35Å; H532-Y536 WeakPolarHBondContact CD2-CE2 3.42Å; H532-Y536 WeakPolarHBondContact O-CB 3.49Å; H532-Y536 PolarHBondContact O-N 3.29Å; Y536-S540 WeakPolarHBondContact O-CB 3.3Å; Y536-S540 PolarHBondContact O-N 3.15Å; Y536-S540 PolarHBondContact O-OG 3.35Å
537I96.5Very high94.3Very high38 Ų3847.4 Ų47.420%0.19524%0.238CC..Iπ-helixtrans-71.7-50.4-175.6-61.1-176.2000110.4V387 F517 I521 L528 I533 G539 S540 L541V387-I537 HydrophobicContact CG1-CG2 4.39Å; F517-I537 HydrophobicContact CE1-CG2 3.53Å; F517-I537 HydrophobicContact CZ-CG2 3.81Å; I521-I537 HydrophobicContact CD1-CD1 4.42Å; I521-I537 HydrophobicContact CD1-CG2 4.26Å; I521-I537 HydrophobicContact CG1-CD1 4.1Å; L528-I537 HydrophobicContact CD2-CD1 3.85Å; I533-I537 HydrophobicContact CB-CD1 4.49Å; I533-I537 HydrophobicContact CG1-CD1 4.26Å; I533-I537 HydrophobicContact CG2-CD1 4.42Å; I533-I537 WeakPolarHBondContact O-CB 3.48Å; I533-I537 PolarHBondContact O-N 3.01Å; I537-G539 PolarHBondContact O-N 3.24Å; I537-S540 PolarHBondContact O-N 3.24Å; I537-L541 HydrophobicContact CG2-CD1 3.98Å; I537-L541 HydrophobicContact CG2-CG 4.45Å; I537-L541 WeakPolarHBondContact O-CB 3.43Å; I537-L541 VanDerWaalsContact O-CG 3.31Å; I537-L541 WeakPolarHBondContact O-CG 3.42Å; I537-L541 PolarHBondContact O-N 2.94Å
538V96.7Very high94.7Very high0 Ų039.8 Ų39.80%020%0.203CC..Hα-helixtrans-60.6-46.3178.51750000111.1S384 V387 T445 I533 Q534 L541 A542S384-V538 PolarHBondContact OG-O 3.41Å; V387-V538 HydrophobicContact CB-CG2 4.37Å; V387-V538 HydrophobicContact CG1-CG2 3.78Å; T445-V538 HydrophobicContact CG2-CG1 3.89Å; I533-V538 PolarHBondContact O-N 3.17Å; Q534-V538 WeakPolarHBondContact O-CB 3.36Å; V538-L541 PolarHBondContact O-N 3.44Å; V538-A542 WeakPolarHBondContact O-CB 3.15Å; V538-A542 PolarHBondContact O-N 3.2Å
539G96.1Very high94.8Very high5 Ų537.7 Ų37.75%0.05219%0.192CC..Hα-helixtrans-60-45.917800000112.8V535 I537 A542 V543V535-G539 PolarHBondContact O-N 2.99Å; I537-G539 PolarHBondContact O-N 3.24Å; G539-A542 PolarHBondContact O-N 3.39Å; G539-V543 WeakPolarHBondContact O-CG2 3.21Å; G539-V543 PolarHBondContact O-N 3.31Å
540S96.8Very high94.8Very high77 Ų7735.8 Ų35.854%0.53818%0.18SC..Hα-helixtrans-63.8-43.8178.6-58.30000112.2Y536 I537 A542 V543 F544Y536-S540 WeakPolarHBondContact O-CB 3.3Å; Y536-S540 PolarHBondContact O-N 3.15Å; Y536-S540 PolarHBondContact O-OG 3.35Å; I537-S540 PolarHBondContact O-N 3.24Å; S540-A542 VanDerWaalsContact C-N 3.34Å; S540-A542 PolarHBondContact O-N 3.24Å; S540-V543 PolarHBondContact O-N 3.03Å; S540-F544 WeakPolarHBondContact O-CB 3.48Å; S540-F544 PolarHBondContact O-N 3.41Å
541L97.1Very high94.7Very high18 Ų1838.4 Ų38.49%0.09420%0.195CC..Hα-helixtrans-64.3-38.9176.5-72.2173.3000112.2L383 V387 F517 I537 V538 G545L383-L541 HydrophobicContact CD2-CD1 4.17Å; L383-L541 HydrophobicContact CD2-CD2 3.86Å; L383-L541 HydrophobicContact CG-CD1 3.93Å; L383-L541 HydrophobicContact CG-CD2 4.42Å; V387-L541 HydrophobicContact CG2-CD1 4.18Å; F517-L541 HydrophobicContact CD1-CD1 4.37Å; F517-L541 HydrophobicContact CE1-CD1 3.62Å; F517-L541 HydrophobicContact CE1-CD2 4.38Å; F517-L541 HydrophobicContact CE1-CG 4.35Å; F517-L541 HydrophobicContact CE2-CD2 4.21Å; F517-L541 HydrophobicContact CZ-CD1 3.92Å; F517-L541 HydrophobicContact CZ-CD2 3.89Å; F517-L541 HydrophobicContact CZ-CG 4.13Å; I537-L541 HydrophobicContact CG2-CD1 3.98Å; I537-L541 HydrophobicContact CG2-CG 4.45Å; I537-L541 WeakPolarHBondContact O-CB 3.43Å; I537-L541 VanDerWaalsContact O-CG 3.31Å; I537-L541 WeakPolarHBondContact O-CG 3.42Å; I537-L541 PolarHBondContact O-N 2.94Å; V538-L541 PolarHBondContact O-N 3.44Å; L541-G545 PolarHBondContact O-N 3.08Å
542A95.7Very high94.6Very high3 Ų335.1 Ų35.13%0.02518%0.183CC..Hα-helixtrans-63.7-48.5177.800000111S384 V442 T445 V538 G539 S540 G545 G546S384-A542 PolarHBondContact OG-N 3.48Å; V442-A542 VanDerWaalsContact CG2-O 3.27Å; V442-A542 WeakPolarHBondContact CG2-O 3.35Å; T445-A542 HydrophobicContact CG2-CB 3.68Å; V538-A542 WeakPolarHBondContact O-CB 3.15Å; V538-A542 PolarHBondContact O-N 3.2Å; G539-A542 PolarHBondContact O-N 3.39Å; S540-A542 VanDerWaalsContact C-N 3.34Å; S540-A542 PolarHBondContact O-N 3.24Å; A542-G545 PolarHBondContact O-N 2.97Å; A542-G546 PolarHBondContact O-N 3.38Å
543V96.6Very high94.3Very high54 Ų5432.5 Ų32.533%0.32717%0.171SC..Hα-helixtrans-60.3-48.7177.2172.40000110.8V442 L446 G539 S540 G545 G546 I547V442-V543 HydrophobicContact CG1-CG2 3.85Å; L446-V543 HydrophobicContact CD1-CG2 3.95Å; L446-V543 HydrophobicContact CD2-CG2 3.89Å; L446-V543 HydrophobicContact CG-CG2 4.24Å; G539-V543 WeakPolarHBondContact O-CG2 3.21Å; G539-V543 PolarHBondContact O-N 3.31Å; S540-V543 PolarHBondContact O-N 3.03Å; V543-G545 PolarHBondContact O-N 3.24Å; V543-G546 PolarHBondContact O-N 3.3Å; V543-I547 HydrophobicContact CG1-CD1 3.81Å; V543-I547 HydrophobicContact CG1-CG1 4.48Å; V543-I547 VanDerWaalsContact O-CG1 3.31Å; V543-I547 WeakPolarHBondContact O-CG1 3.39Å; V543-I547 PolarHBondContact O-N 2.88Å
544F96.4Very high94Very high110 Ų11038.1 Ų38.148%0.48220%0.196SC..Hα-helixtrans-62.3-44.7-179.8-172.3-123.9000112.2I380 S540 G546 I547 L548I380-F544 HydrophobicContact CD1-CD1 3.69Å; I380-F544 HydrophobicContact CD1-CE1 3.36Å; I380-F544 HydrophobicContact CD1-CZ 4.39Å; I380-F544 HydrophobicContact CG1-CD1 4.34Å; I380-F544 HydrophobicContact CG1-CE1 4.37Å; I380-F544 HydrophobicContact CG2-CB 4.5Å; I380-F544 HydrophobicContact CG2-CD1 3.79Å; S540-F544 WeakPolarHBondContact O-CB 3.48Å; S540-F544 PolarHBondContact O-N 3.41Å; F544-G546 VanDerWaalsContact C-N 3.34Å; F544-G546 PolarHBondContact O-N 3.09Å; F544-I547 PolarHBondContact O-N 3.22Å; F544-L548 HydrophobicContact CD1-CD1 4.34Å; F544-L548 HydrophobicContact CE1-CD1 3.98Å; F544-L548 HydrophobicContact CZ-CD1 4.11Å; F544-L548 WeakPolarHBondContact O-CG 3.27Å; F544-L548 PolarHBondContact O-N 3.14Å
545G95Very high93.6Very high0 Ų040.8 Ų40.80%021%0.209CC..Hα-helixtrans-63.1-38.5174.800000112.9L541 A542 V543 L548 A549L541-G545 PolarHBondContact O-N 3.08Å; A542-G545 PolarHBondContact O-N 2.97Å; V543-G545 PolarHBondContact O-N 3.24Å; G545-L548 PolarHBondContact O-N 3.09Å; G545-A549 WeakPolarHBondContact O-CB 3.42Å; G545-A549 PolarHBondContact O-N 3.31Å
546G93.3Very high93.1Very high6 Ų643.5 Ų43.56%0.06222%0.219CC..Hα-helixtrans-62.6-43.9174.800000113.2A542 V543 F544 A549 T550A542-G546 PolarHBondContact O-N 3.38Å; V543-G546 PolarHBondContact O-N 3.3Å; F544-G546 VanDerWaalsContact C-N 3.34Å; F544-G546 PolarHBondContact O-N 3.09Å; G546-A549 PolarHBondContact O-N 3.13Å; G546-T550 WeakPolarHBondContact O-CG2 3.43Å; G546-T550 PolarHBondContact O-N 2.79Å; G546-T550 PolarHBondContact O-OG1 2.74Å
547I94.3Very high92.4Very high84 Ų8440.7 Ų40.743%0.43122%0.216SC..Hα-helixtrans-62.6-45.3175.9-67.3164.8000110.7V543 F544 A549 T550 I551V543-I547 HydrophobicContact CG1-CD1 3.81Å; V543-I547 HydrophobicContact CG1-CG1 4.48Å; V543-I547 VanDerWaalsContact O-CG1 3.31Å; V543-I547 WeakPolarHBondContact O-CG1 3.39Å; V543-I547 PolarHBondContact O-N 2.88Å; F544-I547 PolarHBondContact O-N 3.22Å; I547-A549 VanDerWaalsContact C-N 3.29Å; I547-A549 PolarHBondContact O-N 2.72Å; I547-T550 PolarHBondContact O-N 2.63Å; I547-T550 PolarHBondContact O-OG1 3.16Å; I547-I551 HydrophobicContact CG2-CD1 3.9Å; I547-I551 VanDerWaalsContact O-CG1 3.28Å; I547-I551 WeakPolarHBondContact O-CG1 3.44Å; I547-I551 PolarHBondContact O-N 3.08Å
548L94.6Very high91.7Very high24 Ų2443.8 Ų43.813%0.12623%0.23CC..Hα-helixtrans-62.9-38.3176.9-69.9176.3000112L373 T377 I380 F544 G545 I551 D552L373-L548 HydrophobicContact CD1-CD2 4.07Å; T377-L548 HydrophobicContact CG2-CB 4.28Å; T377-L548 WeakPolarHBondContact OG1-CB 3.27Å; I380-L548 HydrophobicContact CD1-CD1 3.25Å; I380-L548 HydrophobicContact CG1-CD1 4.5Å; F544-L548 HydrophobicContact CD1-CD1 4.34Å; F544-L548 HydrophobicContact CE1-CD1 3.98Å; F544-L548 HydrophobicContact CZ-CD1 4.11Å; F544-L548 WeakPolarHBondContact O-CG 3.27Å; F544-L548 PolarHBondContact O-N 3.14Å; G545-L548 PolarHBondContact O-N 3.09Å; L548-I551 PolarHBondContact O-N 3.36Å; L548-D552 WeakPolarHBondContact O-CB 3.42Å; L548-D552 PolarHBondContact O-N 3.05Å
549A91.6Very high90.7Very high1 Ų146.3 Ų46.31%0.00825%0.245CC..Hα-helixtrans-67.2-37.1176.400000113T377 M381 G545 G546 I547 N553T377-A549 HydrophobicContact CG2-CB 3.68Å; M381-A549 HydrophobicContact CE-CB 3.39Å; M381-A549 HydrophobicContact SD-CB 3.91Å; G545-A549 WeakPolarHBondContact O-CB 3.42Å; G545-A549 PolarHBondContact O-N 3.31Å; G546-A549 PolarHBondContact O-N 3.13Å; I547-A549 VanDerWaalsContact C-N 3.29Å; I547-A549 PolarHBondContact O-N 2.72Å; A549-N553 WeakPolarHBondContact O-CB 3.3Å; A549-N553 PolarHBondContact O-N 3.18Å; A549-N553 PolarHBondContact O-ND2 3.47Å
550T90.2Very high89.6Confident30 Ų3050 Ų5018%0.18426%0.263CS..Hα-helixtrans-66.6-39.3174.653.60000111.2S438 V439 G546 I547 N553 F554S438-T550 VanDerWaalsContact OG-CG2 3.26Å; S438-T550 WeakPolarHBondContact OG-CG2 3.25Å; V439-T550 HydrophobicContact CG2-CG2 4.31Å; G546-T550 WeakPolarHBondContact O-CG2 3.43Å; G546-T550 PolarHBondContact O-N 2.79Å; G546-T550 PolarHBondContact O-OG1 2.74Å; I547-T550 PolarHBondContact O-N 2.63Å; I547-T550 PolarHBondContact O-OG1 3.16Å; T550-N553 PolarHBondContact O-N 3.1Å; T550-F554 WeakPolarHBondContact O-CB 3.44Å; T550-F554 PolarHBondContact O-N 3.46Å
551I91.8Very high88.3Confident74 Ų7452.4 Ų52.438%0.37927%0.266SS..Hα-helixtrans-64-46.2175-63.5165.9000111.3L373 I547 L548 N553 F554 I555L373-I551 HydrophobicContact CD2-CG2 4.06Å; I547-I551 HydrophobicContact CG2-CD1 3.9Å; I547-I551 VanDerWaalsContact O-CG1 3.28Å; I547-I551 WeakPolarHBondContact O-CG1 3.44Å; I547-I551 PolarHBondContact O-N 3.08Å; L548-I551 PolarHBondContact O-N 3.36Å; I551-N553 VanDerWaalsContact C-N 3.34Å; I551-N553 PolarHBondContact O-N 3.43Å; I551-F554 PolarHBondContact O-N 3.32Å; I551-I555 HydrophobicContact CG2-CD1 3.88Å; I551-I555 WeakPolarHBondContact O-CG1 3.27Å; I551-I555 PolarHBondContact O-N 2.66Å
552D90.7Very high86.8Confident1 Ų153.8 Ų53.81%0.00528%0.277CS..Hα-helixtrans-60.3-43.1178-177.189.8000111.8L373 S374 L548 I555 Y556L373-D552 HydrophobicContact CD2-CB 4.12Å; L373-D552 HydrophobicContact CG-CB 4.28Å; S374-D552 PolarHBondContact OG-OD1 3.26Å; L548-D552 WeakPolarHBondContact O-CB 3.42Å; L548-D552 PolarHBondContact O-N 3.05Å; D552-I555 PolarHBondContact O-N 3.45Å; D552-Y556 WeakPolarHBondContact O-CB 3.31Å; D552-Y556 PolarHBondContact O-N 3.33Å
553N86.3Confident85.1Confident26 Ų2657.3 Ų57.314%0.13930%0.298CS..Hα-helixtrans-65.7-39.1175.8-80.9-74000112.5A549 T550 I551 Y556 S557A549-N553 WeakPolarHBondContact O-CB 3.3Å; A549-N553 PolarHBondContact O-N 3.18Å; A549-N553 PolarHBondContact O-ND2 3.47Å; T550-N553 PolarHBondContact O-N 3.1Å; I551-N553 VanDerWaalsContact C-N 3.34Å; I551-N553 PolarHBondContact O-N 3.43Å; N553-Y556 PolarHBondContact O-N 3.08Å; N553-S557 PolarHBondContact O-N 3.4Å
554F88.1Confident83.1Confident118 Ų11859.3 Ų59.352%0.51831%0.307SS..Hα-helixtrans-61-49.7176.8-179.2-97.5000111.1T550 I551 Y556 S557 E558T550-F554 WeakPolarHBondContact O-CB 3.44Å; T550-F554 PolarHBondContact O-N 3.46Å; I551-F554 PolarHBondContact O-N 3.32Å; F554-Y556 VanDerWaalsContact C-N 3.27Å; F554-Y556 PolarHBondContact O-N 3.46Å; F554-S557 WeakPolarHBondContact O-CB 3.22Å; F554-S557 PolarHBondContact O-N 3.34Å; F554-S557 VanDerWaalsContact O-N 3.14Å; F554-E558 HydrophobicContact CE1-CG 4.3Å; F554-E558 WeakPolarHBondContact CE1-OE1 3.5Å; F554-E558 HydrophobicContact CZ-CG 4.4Å; F554-E558 VanDerWaalsContact CZ-OE1 3.28Å; F554-E558 WeakPolarHBondContact CZ-OE1 3.25Å; F554-E558 PolarHBondContact O-N 3.2Å; F554-E558 VanDerWaalsContact O-N 3.16Å
555I87.6Confident80.8Confident56 Ų5657.1 Ų57.129%0.28731%0.309SS..Hα-helixtrans-61.1-38.8176.3-67166.5000110.9L373 I551 D552 T559L373-I555 HydrophobicContact CD2-CD1 3.48Å; L373-I555 VanDerWaalsContact CD2-CD1 3.48Å; I551-I555 HydrophobicContact CG2-CD1 3.88Å; I551-I555 WeakPolarHBondContact O-CG1 3.27Å; I551-I555 PolarHBondContact O-N 2.66Å; D552-I555 PolarHBondContact O-N 3.45Å; I555-T559 WeakPolarHBondContact O-CG2 3.44Å; I555-T559 PolarHBondContact O-N 3.19Å; I555-T559 VanDerWaalsContact O-N 3.15Å; I555-T559 PolarHBondContact O-OG1 3.47Å
556Y83.8Confident78.5Confident72 Ų7265.8 Ų65.828%0.28234%0.342SS..Hα-helixtrans-62.1-44.9175.7177-126000112.3D552 N553 F554 E558 T559 L560D552-Y556 WeakPolarHBondContact O-CB 3.31Å; D552-Y556 PolarHBondContact O-N 3.33Å; N553-Y556 PolarHBondContact O-N 3.08Å; F554-Y556 VanDerWaalsContact C-N 3.27Å; F554-Y556 PolarHBondContact O-N 3.46Å; Y556-E558 PolarHBondContact O-N 2.95Å; Y556-T559 PolarHBondContact O-N 2.82Å; Y556-T559 PolarHBondContact O-OG1 3.04Å; Y556-L560 PolarHBondContact O-N 3.13Å; Y556-L560 VanDerWaalsContact O-N 3.08Å
557S81.3Confident75.9Confident57 Ų5769.3 Ų69.340%0.39937%0.365SS..Hα-helixtrans-58.1-48.5179.3-160.90000111.6N553 F554 T559 L560 E561N553-S557 PolarHBondContact O-N 3.4Å; F554-S557 WeakPolarHBondContact O-CB 3.22Å; F554-S557 PolarHBondContact O-N 3.34Å; F554-S557 VanDerWaalsContact O-N 3.14Å; S557-T559 VanDerWaalsContact C-N 3.3Å; S557-T559 PolarHBondContact O-N 3.32Å; S557-L560 WeakPolarHBondContact O-CB 3.49Å; S557-L560 PolarHBondContact O-N 2.92Å; S557-L560 VanDerWaalsContact O-N 3.12Å; S557-E561 PolarHBondContact O-N 2.98Å; S557-E561 VanDerWaalsContact O-N 3.07Å
558E81Confident73.4Confident103 Ų10370.3 Ų70.348%0.48137%0.371SS..Hα-helixtrans-60.4-39.5177.4-70.3-172.3159.600112.2F554 Y556 L560 S562F554-E558 HydrophobicContact CE1-CG 4.3Å; F554-E558 WeakPolarHBondContact CE1-OE1 3.5Å; F554-E558 HydrophobicContact CZ-CG 4.4Å; F554-E558 VanDerWaalsContact CZ-OE1 3.28Å; F554-E558 WeakPolarHBondContact CZ-OE1 3.25Å; F554-E558 PolarHBondContact O-N 3.2Å; F554-E558 VanDerWaalsContact O-N 3.16Å; Y556-E558 PolarHBondContact O-N 2.95Å; E558-L560 VanDerWaalsContact C-N 3.3Å; E558-L560 PolarHBondContact O-N 2.9Å; E558-S562 WeakPolarHBondContact O-CB 3.27Å; E558-S562 PolarHBondContact O-N 2.7Å
559T77.2Confident70.8Confident53 Ų5373.2 Ų73.233%0.32539%0.391SS..Hα-helixtrans-65.4-34.4177.958.70000112.7R370 I555 Y556 S557 S562 T563R370-T559 PolarHBondContact NH1-OG1 3.38Å; I555-T559 WeakPolarHBondContact O-CG2 3.44Å; I555-T559 PolarHBondContact O-N 3.19Å; I555-T559 VanDerWaalsContact O-N 3.15Å; I555-T559 PolarHBondContact O-OG1 3.47Å; Y556-T559 PolarHBondContact O-N 2.82Å; Y556-T559 PolarHBondContact O-OG1 3.04Å; S557-T559 VanDerWaalsContact C-N 3.3Å; S557-T559 PolarHBondContact O-N 3.32Å; T559-S562 PolarHBondContact O-OG 3.42Å; T559-T563 PolarHBondContact O-N 3.04Å; T559-T563 PolarHBondContact O-OG1 2.68Å
560L71.4Confident68.3Low83 Ų8377.8 Ų77.844%0.43542%0.422SS..Hα-helixtrans-69.2-49.8178.2-159.479.1000110.7Y556 S557 E558 S562 T563 D564Y556-L560 PolarHBondContact O-N 3.13Å; Y556-L560 VanDerWaalsContact O-N 3.08Å; S557-L560 WeakPolarHBondContact O-CB 3.49Å; S557-L560 PolarHBondContact O-N 2.92Å; S557-L560 VanDerWaalsContact O-N 3.12Å; E558-L560 VanDerWaalsContact C-N 3.3Å; E558-L560 PolarHBondContact O-N 2.9Å; L560-S562 VanDerWaalsContact C-N 3.29Å; L560-S562 PolarHBondContact O-N 3.25Å; L560-T563 WeakPolarHBondContact O-CB 3.37Å; L560-T563 PolarHBondContact O-N 2.85Å; L560-D564 PolarHBondContact O-N 2.97Å; L560-D564 VanDerWaalsContact O-N 3.08Å
561E70.8Confident65.9Low127 Ų12784.2 Ų84.259%0.59345%0.447SS*.Hα-helixtrans-58-40.5177.5-71.6177.6-177.300111.9S557 T563 D564 A565S557-E561 PolarHBondContact O-N 2.98Å; S557-E561 VanDerWaalsContact O-N 3.07Å; E561-T563 PolarHBondContact O-N 3.49Å; E561-D564 PolarHBondContact O-N 2.88Å; E561-A565 VanDerWaalsContact O-CB 3.25Å; E561-A565 WeakPolarHBondContact O-CB 3.49Å; E561-A565 PolarHBondContact O-N 2.88Å
562S65.2Low63.6Low47 Ų4785.7 Ų85.733%0.32946%0.455SS..Hα-helixtrans-66.1-21.6177.2830000114.2E558 T559 L560 R566E558-S562 WeakPolarHBondContact O-CB 3.27Å; E558-S562 PolarHBondContact O-N 2.7Å; T559-S562 PolarHBondContact O-OG 3.42Å; L560-S562 VanDerWaalsContact C-N 3.29Å; L560-S562 PolarHBondContact O-N 3.25Å; S562-R566 PolarHBondContact O-NE 2.87Å; S562-R566 PolarHBondContact OG-NH2 2.9Å
563T60.1Low60.9Low77 Ų7795.7 Ų95.747%0.47249%0.492SS..Hα-helixtrans-86.6-44.7179.6-54.50000109.9T559 L560 E561 R566 C567T559-T563 PolarHBondContact O-N 3.04Å; T559-T563 PolarHBondContact O-OG1 2.68Å; L560-T563 WeakPolarHBondContact O-CB 3.37Å; L560-T563 PolarHBondContact O-N 2.85Å; E561-T563 PolarHBondContact O-N 3.49Å; T563-R566 PolarHBondContact O-N 3.13Å; T563-C567 PolarHBondContact O-N 2.9Å
564D54.1Low58.5Low96 Ų96104.8 Ų104.851%0.51353%0.525SS..Hα-helixtrans-66.9-38.5177.1-71.7-21.5000111.8L560 E561 R566 C567 L568L560-D564 PolarHBondContact O-N 2.97Å; L560-D564 VanDerWaalsContact O-N 3.08Å; E561-D564 PolarHBondContact O-N 2.88Å; D564-R566 PolarHBondContact O-N 3.29Å; D564-C567 PolarHBondContact O-N 3.32Å; D564-L568 PolarHBondContact O-N 3.02Å; D564-L568 VanDerWaalsContact O-N 3.17Å
565A48.7Very low56.2Low64 Ų64103.8 Ų103.853%0.52953%0.529SS..Hα-helixtrans-62.1-27.5174.300000113.2E561 P569E561-A565 VanDerWaalsContact O-CB 3.25Å; E561-A565 WeakPolarHBondContact O-CB 3.49Å; E561-A565 PolarHBondContact O-N 2.88Å; A565-P569 VanDerWaalsContact O-CD 3.27Å; A565-P569 WeakPolarHBondContact O-CD 3.36Å
566R46.7Very low53.8Low183 Ų183106 Ų10669%0.69155%0.545SS*.Hα-helixtrans-78.4-19.2174.1-86.3-178.3-87.7-155.4-5.3113.4S562 T563 D564S562-R566 PolarHBondContact O-NE 2.87Å; S562-R566 PolarHBondContact OG-NH2 2.9Å; T563-R566 PolarHBondContact O-N 3.13Å; D564-R566 PolarHBondContact O-N 3.29Å
567C39.3Very low51.6Low80 Ų80107 Ų10754%0.54156%0.563SS.*Hα-helixtrans-87.5-26.6175.6-73.60000113.1T563 D564 C570 F571T563-C567 PolarHBondContact O-N 2.9Å; D564-C567 PolarHBondContact O-N 3.32Å; C567-C570 PolarHBondContact O-N 3.24Å; C567-F571 PolarHBondContact O-N 2.84Å
568L41.7Very low49.4Very low105 Ų105109.3 Ų109.355%0.5558%0.578SS.*Hα-helixtrans-56.5-39.6179.5-10985.2000115.3D564 C570 F571 I572D564-L568 PolarHBondContact O-N 3.02Å; D564-L568 VanDerWaalsContact O-N 3.17Å; L568-C570 VanDerWaalsContact C-N 3.29Å; L568-C570 PolarHBondContact O-N 2.93Å; L568-F571 PolarHBondContact O-N 2.78Å; L568-I572 PolarHBondContact O-N 2.8Å
569P39.7Very low47.3Very low85 Ų85109.7 Ų109.755%0.55259%0.593SS**Hα-helixtrans-69.9-22.3179.7-18.230.3000113.9A565A565-P569 VanDerWaalsContact O-CD 3.27Å; A565-P569 WeakPolarHBondContact O-CD 3.36Å
570C39.1Very low45.3Very low96 Ų96112.2 Ų112.265%0.64961%0.612SS**Hα-helixtrans-83-24.1176.9-83.10000113C567 L568C567-C570 PolarHBondContact O-N 3.24Å; L568-C570 VanDerWaalsContact C-N 3.29Å; L568-C570 PolarHBondContact O-N 2.93Å
571F39.1Very low44Very low165 Ų165113.8 Ų113.872%0.72463%0.628SS**Hα-helixtrans-82.3-35.9178.3-125.2-91.5000112.1C567 L568 R573 R574 T575C567-F571 PolarHBondContact O-N 2.84Å; L568-F571 PolarHBondContact O-N 2.78Å; F571-R573 VanDerWaalsContact C-N 3.32Å; F571-R573 PolarHBondContact O-N 2.77Å; F571-R574 PolarHBondContact O-N 3.39Å; F571-T575 PolarHBondContact O-OG1 3.17Å
572I43.3Very low42.5Very low105 Ų105113.3 Ų113.354%0.53864%0.635SS.*Hα-helixtrans-74.2-23.7178.4-63172.9000112L568 T575 T576L568-I572 PolarHBondContact O-N 2.8Å; I572-T575 PolarHBondContact O-OG1 3.44Å; I572-T576 PolarHBondContact O-OG1 2.95Å
573R34.8Very low41.1Very low211 Ų211117.5 Ų117.580%0.79666%0.661SS**THydrogen-bonded Turntrans-82.3-10.6177.8-143.1176.2-156.2-166.65114.5F571F571-R573 VanDerWaalsContact C-N 3.32Å; F571-R573 PolarHBondContact O-N 2.77Å
574R34.9Very low40.1Very low218 Ų218119 Ų11982%0.82368%0.675SS**THydrogen-bonded Turntrans-98.5-14.5173.7-97.9-176.7-171.41693.5114F571F571-R574 PolarHBondContact O-N 3.39Å
575T40.5Very low39.2Very low97 Ų97123.8 Ų123.860%0.59569%0.691SS**SBendtrans-1001.617752.20000113.5F571 I572F571-T575 PolarHBondContact O-OG1 3.17Å; I572-T575 PolarHBondContact O-OG1 3.44Å
576T37.7Very low38.4Very low101 Ų101131.2 Ų131.262%0.6271%0.712SS**SBendtrans-111.47.217945.30000114.1I572I572-T576 PolarHBondContact O-OG1 2.95Å
577S36.2Very low37.9Very low95 Ų95131.4 Ų131.466%0.66472%0.721SS**  trans-107.953.3170.6680000111.7
578S35.6Very low37.5Very low104 Ų104130.7 Ų130.773%0.72773%0.728SS**  trans-13758.2163.4590000109.2S580S578-S580 PolarHBondContact O-N 3.31Å
579S37.9Very low37.1Very low112 Ų112132 Ų13278%0.78374%0.735SS**  trans-73.4101.1163.553.60000108.1
580S35.7Very low36.9Very low105 Ų105135.3 Ų135.373%0.73474%0.743SS**PPolyproline II helixtrans-50.4134.2164.745.80000111.3S578S578-S580 PolarHBondContact O-N 3.31Å
581P43.5Very low36.6Very low117 Ų117135.8 Ų135.876%0.7674%0.743SS**PPolyproline II helixtrans-74.4149.8170.731.5-30.9000110.2
582P39.8Very low36.2Very low116 Ų116136 Ų13675%0.75374%0.744SS**PPolyproline II helixtrans-75.2149.8-179.332.8-32.8000110.5S584P582-S584 PolarHBondContact O-N 3.31Å
583P34.9Very low35.7Very low135 Ų135136.5 Ų136.588%0.87775%0.748SS**PPolyproline II helixtrans-83.8121-178.432.5-29.2000110.1
584S38.6Very low35.7Very low109 Ų109134.2 Ų134.276%0.76275%0.746SS**  trans-129103.5163.561.40000110.4P582P582-S584 PolarHBondContact O-N 3.31Å
585K34.6Very low35.7Very low196 Ų196128.9 Ų128.985%0.85274%0.737SS**  trans27.9113.1145.7-63.9178.5177.91790117.3
586F33.3Very low35.4Very low221 Ų221129 Ų12997%0.96974%0.742SS**  trans-145.1133.5140.4-115.8-86.1000109.8
587Q35.3Very low35.3Very low186 Ų186130.5 Ų130.587%0.86975%0.746SS**  trans-120.7135.7-169.4179.8171.90.300108
588G31.7Very low35.3Very low66 Ų66131.4 Ų131.468%0.6874%0.744SS**  trans73.6138.6171.500000113.4
589D32.8Very low35.2Very low131 Ų131133 Ų13370%0.70174%0.744SS**  cis-166.6150.214.8-114-38.6000106.8
590Q34.6Very low35.1Very low155 Ų155139.3 Ų139.372%0.72475%0.751SS**  trans51131.9137.4-62.417435.300118.5
591T33.3Very low35.1Very low107 Ų107140.3 Ų140.366%0.65675%0.752SS**  cis173.9157.42212.30000106.8
592F31.6Very low34.9Very low168 Ų168142.7 Ų142.774%0.73776%0.759SS**  trans83.9102.2145.7-88.9-121.6000121.2
593N33Very low34.8Very low116 Ų116140 Ų14062%0.6275%0.753SS**  94.3133.3109.5-8011.1000123
594H34Very low34.9Very low163 Ų163141.7 Ų141.776%0.75575%0.754SS**  trans76.3139.9153.3-90.5-96.7000118.2
595V35.2Very low34.5Very low106 Ų106142.8 Ų142.864%0.64276%0.76SS**  cis176.6141-18.2127.40000103.9
596S34.9Very low34.5Very low99 Ų99145.3 Ų145.369%0.69276%0.764SS**  trans48.7139.2153.5-60.10000119.9
597N35.3Very low34.8Very low134 Ų134144.7 Ų144.772%0.71779%0.786SS**  cis-174.7152.845.7-133.38.9000110.8
598D35.7Very low34.8Very low114 Ų114142.7 Ų142.761%0.6178%0.781SS**  trans70.9105.8143.2-77.3-41.8000124
599N34.4Very low34.9Very low138 Ų138146.7 Ų146.774%0.73879%0.787SS**  55.2107.9112.4-77.2-35000120.2
600R35.7Very low35.1Very low244 Ų244147.6 Ų147.692%0.92179%0.791SS**  175.9138.5105.4-97.5172.4179.4172.51.2113.8
601T35.7Very low35.1Very low125 Ų125147.1 Ų147.177%0.76780%0.795SS**  trans-58.6139.5174.446.50000116.1
602N38.1Very low35.2Very low167 Ų167149.6 Ų149.689%0.89380%0.804SS**  trans-179.4123.4142.9-90.2-20.1000106
603G37.3Very low35.4Very low61 Ų61148.4 Ų148.463%0.62981%0.809SS**  cis9383.639.500000109.7
604N36.7Very low35.6Very low170 Ų170150.7 Ų150.791%0.90982%0.822SS**  trans167.8108.7140.7-89.7-19.6000113
605C30.9Very low35.7Very low131 Ų131149.8 Ų149.889%0.88583%0.827SS**  trans-101123.8151.1-75.50000108.6
606R35Very low35.8Very low249 Ų249153.4 Ų153.494%0.9484%0.843SS**  trans-161.7116.3152.8-106-179.7-172.2-170.22108.4
607C39.9Very low35.9Very low209 Ų209158.4 Ų158.4100%1.41286%0.856SS**  trans-89.70156.6-730000109

Retrieved 607 of 607 residues in 1040.8 ms (Link to these results)

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