A0A3Q0KR61_SCHMA Loading...

Lysophospholipid acyltransferase 7 AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KR61, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 551 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
1M70.1Confident88Confident116 Ų11658.3 Ų58.357%0.57132%0.315SS*.  0131.60-168153.18500108.1D5 M6 L212M1-D5 HydrophobicContact CG-CB 3.44Å; M1-D5 VanDerWaalsContact CG-CB 3.44Å; M1-D5 HydrophobicContact SD-CB 4.13Å; M1-M6 HydrophobicContact CE-CB 4.06Å; M1-M6 HydrophobicContact CE-CG 3.14Å; M1-M6 HydrophobicContact CE-SD 4.42Å; M1-M6 HydrophobicContact CG-CG 4.22Å; M1-M6 HydrophobicContact SD-CG 4.44Å; M1-L212 HydrophobicContact CB-CD2 3.92Å; M1-L212 HydrophobicContact CG-CD2 4.17Å; M1-L212 HydrophobicContact SD-CD2 3.7Å
2T81.6Confident88.5Confident64 Ų6453.9 Ų53.939%0.39329%0.291SS..  trans-73.5155.3177.762.50000110.4D4 D5 M6T2-D4 PolarHBondContact O-N 2.96Å; T2-D5 PolarHBondContact N-OD2 3.49Å; T2-D5 WeakPolarHBondContact O-CB 3.38Å; T2-D5 PolarHBondContact O-N 3.21Å; T2-D5 VanDerWaalsContact O-N 3.13Å; T2-D5 PolarHBondContact OG1-N 2.85Å; T2-D5 PolarHBondContact OG1-OD2 2.9Å; T2-M6 PolarHBondContact O-N 3.13Å
3P87.3Confident89Confident96 Ų9656.6 Ų56.662%0.62330%0.304SS*.Hα-helixtrans-54.7-35.5172.9-26.935.6000112.8M6 I7P3-M6 WeakPolarHBondContact O-CB 3.31Å; P3-M6 PolarHBondContact O-N 2.89Å; P3-I7 WeakPolarHBondContact O-CG1 3.44Å; P3-I7 PolarHBondContact O-N 3.35Å; P3-I7 VanDerWaalsContact O-N 3.08Å
4D86.1Confident89.4Confident63 Ų6358.2 Ų58.234%0.33731%0.312SS..Hα-helixtrans-64.1-43.2176.7-65.9-30.8000112.1T2 M6 I7 Y8T2-D4 PolarHBondContact O-N 2.96Å; D4-M6 VanDerWaalsContact C-N 3.28Å; D4-M6 PolarHBondContact O-N 3.43Å; D4-I7 WeakPolarHBondContact O-CB 3.48Å; D4-I7 PolarHBondContact O-N 3.13Å; D4-I7 VanDerWaalsContact O-N 3.16Å; D4-Y8 HydrophobicContact CB-CE2 4.33Å; D4-Y8 WeakPolarHBondContact O-CD2 3.47Å; D4-Y8 PolarHBondContact O-N 3.1Å
5D87.7Confident89.9Confident10 Ų1054.7 Ų54.75%0.05329%0.293CS..Hα-helixtrans-62-36.6176.3-70.6-36.9000112.3M1 T2 T9 Y211 R250M1-D5 HydrophobicContact CG-CB 3.44Å; M1-D5 VanDerWaalsContact CG-CB 3.44Å; M1-D5 HydrophobicContact SD-CB 4.13Å; T2-D5 PolarHBondContact N-OD2 3.49Å; T2-D5 WeakPolarHBondContact O-CB 3.38Å; T2-D5 PolarHBondContact O-N 3.21Å; T2-D5 VanDerWaalsContact O-N 3.13Å; T2-D5 PolarHBondContact OG1-N 2.85Å; T2-D5 PolarHBondContact OG1-OD2 2.9Å; D5-T9 WeakPolarHBondContact O-CB 3.44Å; D5-T9 PolarHBondContact O-N 3.24Å; D5-T9 PolarHBondContact O-OG1 3.14Å; D5-Y211 PolarHBondContact OD2-OH 3.39Å; D5-R250 IonicContact OD1-CZ 2.93Å; D5-R250 IonicContact OD1-NE 2.75Å; D5-R250 PolarHBondContact OD1-NE 2.94Å; D5-R250 IonicContact OD1-NH2 2.63Å; D5-R250 PolarHBondContact OD1-NH2 3.22Å
6M90.2Very high90.2Very high99 Ų9953 Ų5349%0.48828%0.284SS..Hα-helixtrans-61.3-47.5172.7-72176.872.700111.2M1 T2 P3 D4 Y8 T9 I10M1-M6 HydrophobicContact CE-CB 4.06Å; M1-M6 HydrophobicContact CE-CG 3.14Å; M1-M6 HydrophobicContact CE-SD 4.42Å; M1-M6 HydrophobicContact CG-CG 4.22Å; M1-M6 HydrophobicContact SD-CG 4.44Å; T2-M6 PolarHBondContact O-N 3.13Å; P3-M6 WeakPolarHBondContact O-CB 3.31Å; P3-M6 PolarHBondContact O-N 2.89Å; D4-M6 VanDerWaalsContact C-N 3.28Å; D4-M6 PolarHBondContact O-N 3.43Å; M6-Y8 PolarHBondContact O-N 3.36Å; M6-T9 PolarHBondContact O-N 3.04Å; M6-I10 VanDerWaalsContact O-CG1 3.3Å; M6-I10 WeakPolarHBondContact O-CG1 3.26Å; M6-I10 PolarHBondContact O-N 2.69Å
7I92.2Very high90.5Very high50 Ų5055.5 Ų55.526%0.25630%0.302SS..Hα-helixtrans-59.4-48.6178.5-69165.8000110.6P3 D4 T9 I10 I11 F44 V100P3-I7 WeakPolarHBondContact O-CG1 3.44Å; P3-I7 PolarHBondContact O-N 3.35Å; P3-I7 VanDerWaalsContact O-N 3.08Å; D4-I7 WeakPolarHBondContact O-CB 3.48Å; D4-I7 PolarHBondContact O-N 3.13Å; D4-I7 VanDerWaalsContact O-N 3.16Å; I7-T9 VanDerWaalsContact C-N 3.32Å; I7-T9 PolarHBondContact O-N 3.47Å; I7-I10 PolarHBondContact O-N 3.08Å; I7-I11 HydrophobicContact CG2-CD1 3.74Å; I7-I11 HydrophobicContact CG2-CG1 4.42Å; I7-I11 WeakPolarHBondContact O-CG1 3.39Å; I7-I11 PolarHBondContact O-N 3.19Å; I7-F44 HydrophobicContact CG2-CD1 3.53Å; I7-F44 HydrophobicContact CG2-CE1 3.92Å; I7-F44 HydrophobicContact CG2-CG 4.14Å; I7-V100 HydrophobicContact CG2-CG2 3.93Å
8Y91.8Very high90.7Very high24 Ų2454.1 Ų54.19%0.09429%0.293CS..Hα-helixtrans-62.1-39.3178.2-73.5-61.9000112.8D4 M6 I11 L12 P99 V100 I103D4-Y8 HydrophobicContact CB-CE2 4.33Å; D4-Y8 WeakPolarHBondContact O-CD2 3.47Å; D4-Y8 PolarHBondContact O-N 3.1Å; M6-Y8 PolarHBondContact O-N 3.36Å; Y8-I11 PolarHBondContact O-N 3.34Å; Y8-L12 WeakPolarHBondContact O-CB 3.03Å; Y8-L12 WeakPolarHBondContact O-CG 3.37Å; Y8-L12 PolarHBondContact O-N 3.4Å; Y8-P99 PolarHBondContact OH-O 3.4Å; Y8-V100 HydrophobicContact CE1-CG2 4.28Å; Y8-V100 WeakPolarHBondContact OH-CA 3.44Å; Y8-V100 PolarHBondContact OH-N 3.29Å; Y8-I103 HydrophobicContact CE1-CD1 3.64Å; Y8-I103 HydrophobicContact CE2-CD1 4.24Å; Y8-I103 VanDerWaalsContact CZ-CD1 3.42Å; Y8-I103 WeakPolarHBondContact OH-CD1 3.34Å
9T92Very high90.8Very high37 Ų3751.3 Ų51.323%0.22728%0.278CS..Hα-helixtrans-63.6-44.1177-57.50000110.9D5 M6 I7 L12 I13D5-T9 WeakPolarHBondContact O-CB 3.44Å; D5-T9 PolarHBondContact O-N 3.24Å; D5-T9 PolarHBondContact O-OG1 3.14Å; M6-T9 PolarHBondContact O-N 3.04Å; I7-T9 VanDerWaalsContact C-N 3.32Å; I7-T9 PolarHBondContact O-N 3.47Å; T9-L12 PolarHBondContact O-N 3.3Å; T9-I13 HydrophobicContact CG2-CD1 3.89Å; T9-I13 VanDerWaalsContact O-CG1 3.29Å; T9-I13 WeakPolarHBondContact O-CG1 3.32Å; T9-I13 PolarHBondContact O-N 3.46Å
10I93.8Very high90.8Very high81 Ų8151.8 Ų51.842%0.41528%0.284SS..Hα-helixtrans-61.3-47.3175.5-68.1164.4000110.5M6 I7 L12 I13 L14 F44M6-I10 VanDerWaalsContact O-CG1 3.3Å; M6-I10 WeakPolarHBondContact O-CG1 3.26Å; M6-I10 PolarHBondContact O-N 2.69Å; I7-I10 PolarHBondContact O-N 3.08Å; I10-L12 VanDerWaalsContact C-N 3.32Å; I10-L12 PolarHBondContact O-N 3.44Å; I10-I13 PolarHBondContact O-N 3.21Å; I10-L14 HydrophobicContact CG2-CD1 3.76Å; I10-L14 HydrophobicContact CG2-CG 4.2Å; I10-L14 WeakPolarHBondContact O-CB 2.92Å; I10-L14 VanDerWaalsContact O-CG 3.28Å; I10-L14 WeakPolarHBondContact O-CG 3.23Å; I10-L14 PolarHBondContact O-N 3.06Å; I10-F44 HydrophobicContact CG2-CZ 4.16Å
11I94.9Very high90.8Very high1 Ų153.6 Ų53.61%0.00529%0.293CS..Hα-helixtrans-56.6-45177.4-74169.7000111.3I7 Y8 S15 M40 F44 V100 F169I7-I11 HydrophobicContact CG2-CD1 3.74Å; I7-I11 HydrophobicContact CG2-CG1 4.42Å; I7-I11 WeakPolarHBondContact O-CG1 3.39Å; I7-I11 PolarHBondContact O-N 3.19Å; Y8-I11 PolarHBondContact O-N 3.34Å; I11-S15 VanDerWaalsContact O-CB 3.28Å; I11-S15 WeakPolarHBondContact O-CB 3.4Å; I11-S15 PolarHBondContact O-N 3.31Å; I11-S15 PolarHBondContact O-OG 3.04Å; I11-M40 HydrophobicContact CB-CE 4.27Å; I11-M40 HydrophobicContact CG1-CE 4.37Å; I11-M40 HydrophobicContact CG2-CE 3.83Å; I11-F44 HydrophobicContact CD1-CB 4.32Å; I11-F44 HydrophobicContact CD1-CD1 4.44Å; I11-F44 HydrophobicContact CD1-CD2 3.72Å; I11-F44 HydrophobicContact CD1-CE2 4.12Å; I11-F44 HydrophobicContact CD1-CG 3.92Å; I11-F44 HydrophobicContact CG1-CD2 3.62Å; I11-F44 HydrophobicContact CG1-CE1 4.48Å; I11-F44 HydrophobicContact CG1-CE2 3.5Å; I11-F44 VanDerWaalsContact CG1-CE2 3.5Å; I11-F44 HydrophobicContact CG1-CG 4.21Å; I11-F44 HydrophobicContact CG1-CZ 3.96Å; I11-V100 HydrophobicContact CD1-CG1 4.47Å; I11-F169 HydrophobicContact CD1-CD1 4.02Å; I11-F169 HydrophobicContact CD1-CE1 4.26Å; I11-F169 HydrophobicContact CD1-CG 4.41Å; I11-F169 HydrophobicContact CG2-CB 3.69Å; I11-F169 HydrophobicContact CG2-CD1 4.17Å; I11-F169 HydrophobicContact CG2-CD2 3.46Å; I11-F169 VanDerWaalsContact CG2-CD2 3.46Å; I11-F169 HydrophobicContact CG2-CE2 4.09Å; I11-F169 HydrophobicContact CG2-CG 3.51Å
12L94.3Very high91.8Very high6 Ų648.1 Ų48.13%0.03127%0.266CS..Hα-helixtrans-66-44.1179.6-75.6167.6000112.1Y8 T9 I10 S15 L16 T170 M257Y8-L12 WeakPolarHBondContact O-CB 3.03Å; Y8-L12 WeakPolarHBondContact O-CG 3.37Å; Y8-L12 PolarHBondContact O-N 3.4Å; T9-L12 PolarHBondContact O-N 3.3Å; I10-L12 VanDerWaalsContact C-N 3.32Å; I10-L12 PolarHBondContact O-N 3.44Å; L12-S15 PolarHBondContact O-N 3.23Å; L12-L16 WeakPolarHBondContact O-CB 3.48Å; L12-L16 PolarHBondContact O-N 2.82Å; L12-T170 HydrophobicContact CD1-CG2 4.27Å; L12-T170 HydrophobicContact CD2-CG2 3.93Å; L12-T170 HydrophobicContact CG-CG2 4.24Å; L12-M257 HydrophobicContact CB-CB 4.49Å; L12-M257 HydrophobicContact CD1-CB 4.08Å; L12-M257 HydrophobicContact CD2-CB 4.3Å
13I94.7Very high91.9Very high89 Ų8946.6 Ų46.646%0.45625%0.254SS..Hα-helixtrans-63.8-47.3177.7-67.6167.8000110.5T9 I10 S15 L16 V17T9-I13 HydrophobicContact CG2-CD1 3.89Å; T9-I13 VanDerWaalsContact O-CG1 3.29Å; T9-I13 WeakPolarHBondContact O-CG1 3.32Å; T9-I13 PolarHBondContact O-N 3.46Å; I10-I13 PolarHBondContact O-N 3.21Å; I13-S15 VanDerWaalsContact C-N 3.34Å; I13-S15 PolarHBondContact O-N 2.92Å; I13-L16 WeakPolarHBondContact O-CB 3.36Å; I13-L16 PolarHBondContact O-N 3.4Å; I13-V17 WeakPolarHBondContact O-CG2 3.4Å; I13-V17 PolarHBondContact O-N 2.99Å
14L95.3Very high91.9Very high79 Ų7950.3 Ų50.341%0.41426%0.261SS..Hα-helixtrans-58.8-46.6176.4-71.3175.2000111.1I10 L16 V17 I18 M40I10-L14 HydrophobicContact CG2-CD1 3.76Å; I10-L14 HydrophobicContact CG2-CG 4.2Å; I10-L14 WeakPolarHBondContact O-CB 2.92Å; I10-L14 VanDerWaalsContact O-CG 3.28Å; I10-L14 WeakPolarHBondContact O-CG 3.23Å; I10-L14 PolarHBondContact O-N 3.06Å; L14-L16 VanDerWaalsContact C-N 3.29Å; L14-L16 PolarHBondContact O-N 3.38Å; L14-V17 PolarHBondContact O-N 3.15Å; L14-I18 WeakPolarHBondContact O-CD1 3.43Å; L14-I18 WeakPolarHBondContact O-CG1 3.39Å; L14-I18 PolarHBondContact O-N 3.39Å; L14-M40 HydrophobicContact CB-CE 4.22Å
15S96Very high92Very high5 Ų548.8 Ų48.84%0.03526%0.255CS..Hα-helixtrans-58.9-42177.2-60.10000111.8I11 L12 I13 I18 G19 Y165I11-S15 VanDerWaalsContact O-CB 3.28Å; I11-S15 WeakPolarHBondContact O-CB 3.4Å; I11-S15 PolarHBondContact O-N 3.31Å; I11-S15 PolarHBondContact O-OG 3.04Å; L12-S15 PolarHBondContact O-N 3.23Å; I13-S15 VanDerWaalsContact C-N 3.34Å; I13-S15 PolarHBondContact O-N 2.92Å; S15-I18 PolarHBondContact O-N 3.04Å; S15-G19 PolarHBondContact O-N 3.04Å; S15-Y165 WeakPolarHBondContact O-CE2 3.34Å
16L95Very high91.9Very high28 Ų2849.4 Ų49.415%0.14726%0.264CS..Hα-helixtrans-63.6-44.3-179.6-177.364.7000111.8L12 I13 L14 I18 G19 P20 L197 L201 M257 C260 V261 S264L12-L16 WeakPolarHBondContact O-CB 3.48Å; L12-L16 PolarHBondContact O-N 2.82Å; I13-L16 WeakPolarHBondContact O-CB 3.36Å; I13-L16 PolarHBondContact O-N 3.4Å; L14-L16 VanDerWaalsContact C-N 3.29Å; L14-L16 PolarHBondContact O-N 3.38Å; L16-I18 VanDerWaalsContact C-N 3.32Å; L16-I18 PolarHBondContact O-N 2.82Å; L16-G19 PolarHBondContact O-N 3.05Å; L16-P20 WeakPolarHBondContact O-CD 3.43Å; L16-L197 HydrophobicContact CD1-CD1 4.12Å; L16-L201 HydrophobicContact CD2-CD1 4.22Å; L16-M257 HydrophobicContact CD2-CE 3.99Å; L16-C260 HydrophobicContact CD1-CB 3.72Å; L16-C260 WeakPolarHBondContact CD1-O 3.41Å; L16-V261 HydrophobicContact CB-CG2 4.12Å; L16-S264 PolarHBondContact O-OG 3.03Å
17V94.9Very high91.8Very high96 Ų9654 Ų5458%0.58228%0.281SS*.Hα-helixtrans-68-30.9179.9173.60000112.2I13 L14 P20I13-V17 WeakPolarHBondContact O-CG2 3.4Å; I13-V17 PolarHBondContact O-N 2.99Å; L14-V17 PolarHBondContact O-N 3.15Å; V17-P20 WeakPolarHBondContact O-CD 3.3Å
18I94.7Very high91.8Very high30 Ų3059.9 Ų59.915%0.15430%0.301CS..Hα-helixtrans-73.7-28.4179-68.9167.6000112.1L14 S15 L16 L21 I22 F32 V36 M40 Y165L14-I18 WeakPolarHBondContact O-CD1 3.43Å; L14-I18 WeakPolarHBondContact O-CG1 3.39Å; L14-I18 PolarHBondContact O-N 3.39Å; S15-I18 PolarHBondContact O-N 3.04Å; L16-I18 VanDerWaalsContact C-N 3.32Å; L16-I18 PolarHBondContact O-N 2.82Å; I18-L21 WeakPolarHBondContact O-CB 3.21Å; I18-L21 PolarHBondContact O-N 3.31Å; I18-I22 HydrophobicContact CG2-CD1 3.67Å; I18-I22 HydrophobicContact CG2-CG1 4.06Å; I18-I22 PolarHBondContact O-N 3.39Å; I18-F32 HydrophobicContact CG2-CE1 3.94Å; I18-V36 HydrophobicContact CD1-CG1 3.63Å; I18-V36 HydrophobicContact CG2-CG1 4.35Å; I18-V36 HydrophobicContact CG2-CG2 4.5Å; I18-M40 HydrophobicContact CD1-SD 4.42Å; I18-Y165 HydrophobicContact CG2-CE2 4.47Å
19G92.4Very high91.9Very high0 Ų059.2 Ų59.20%030%0.299CS..Hα-helixtrans-48.3-53.1-177.300000114.9S15 L16 L21 I22 Q23 Y165 S264S15-G19 PolarHBondContact O-N 3.04Å; L16-G19 PolarHBondContact O-N 3.05Å; G19-L21 VanDerWaalsContact C-N 3.27Å; G19-L21 PolarHBondContact O-N 3.2Å; G19-I22 WeakPolarHBondContact O-CB 3.29Å; G19-I22 PolarHBondContact O-N 2.96Å; G19-I22 VanDerWaalsContact O-N 3.13Å; G19-Q23 PolarHBondContact O-N 3.35Å; G19-Y165 WeakPolarHBondContact CA-OH 3.4Å; G19-S264 CarbonylContact C-O 3.58Å
20P90.2Very high92Very high62 Ų6258.1 Ų58.140%0.40329%0.292SS..Hα-helixtrans-60-29.8176.6-27.335.6000114.9L16 V17L16-P20 WeakPolarHBondContact O-CD 3.43Å; V17-P20 WeakPolarHBondContact O-CD 3.3Å
21L91.8Very high92.1Very high90 Ų9060.3 Ų60.347%0.47130%0.295SS..Hα-helixtrans-68.6-39.6176.6-59.3177.4000110.8I18 G19 Q23 K24 C25I18-L21 WeakPolarHBondContact O-CB 3.21Å; I18-L21 PolarHBondContact O-N 3.31Å; G19-L21 VanDerWaalsContact C-N 3.27Å; G19-L21 PolarHBondContact O-N 3.2Å; L21-Q23 VanDerWaalsContact C-N 3.3Å; L21-Q23 PolarHBondContact O-N 3.07Å; L21-K24 WeakPolarHBondContact O-CB 3.36Å; L21-K24 PolarHBondContact O-N 3.29Å; L21-K24 VanDerWaalsContact O-N 3.08Å; L21-C25 PolarHBondContact O-SG 3.39Å
22I90.1Very high92.1Very high0 Ų064.2 Ų64.20%031%0.312CS..Hα-helixtrans-66.8-31.3-179.1-77.9178.9000112.8I18 G19 K24 C25 R29 F32 A33 Y165 F182I18-I22 HydrophobicContact CG2-CD1 3.67Å; I18-I22 HydrophobicContact CG2-CG1 4.06Å; I18-I22 PolarHBondContact O-N 3.39Å; G19-I22 WeakPolarHBondContact O-CB 3.29Å; G19-I22 PolarHBondContact O-N 2.96Å; G19-I22 VanDerWaalsContact O-N 3.13Å; I22-K24 PolarHBondContact O-N 3.18Å; I22-C25 PolarHBondContact O-N 3.01Å; I22-R29 HydrophobicContact CG2-CG 3.48Å; I22-R29 VanDerWaalsContact CG2-CG 3.48Å; I22-F32 HydrophobicContact CD1-CD1 3.8Å; I22-F32 HydrophobicContact CD1-CE1 4.19Å; I22-F32 HydrophobicContact CG1-CD1 3.38Å; I22-F32 HydrophobicContact CG1-CE1 3.74Å; I22-F32 HydrophobicContact CG1-CG 4.42Å; I22-A33 HydrophobicContact CD1-CB 4.03Å; I22-Y165 HydrophobicContact CD1-CD1 3.94Å; I22-Y165 HydrophobicContact CD1-CE1 3.03Å; I22-Y165 WeakPolarHBondContact CD1-OH 3.43Å; I22-F182 HydrophobicContact CG2-CE2 4.39Å; I22-F182 HydrophobicContact CG2-CZ 3.85Å
23Q85.8Confident92.2Very high32 Ų3263.9 Ų63.915%0.1531%0.31CS..Hα-helixtrans-59.5-32173.8-61.1-176.423.900111.9G19 L21 S264 R266G19-Q23 PolarHBondContact O-N 3.35Å; L21-Q23 VanDerWaalsContact C-N 3.3Å; L21-Q23 PolarHBondContact O-N 3.07Å; Q23-S264 PolarHBondContact NE2-O 3.23Å; Q23-R266 HydrophobicContact CG-CG 4.28Å
24K86.1Confident92.3Very high174 Ų17460 Ų6076%0.75729%0.292SS*.THydrogen-bonded Turntrans-82.4-13.2-178-59.5179-178.6178.40113.9L21 I22 G26L21-K24 WeakPolarHBondContact O-CB 3.36Å; L21-K24 PolarHBondContact O-N 3.29Å; L21-K24 VanDerWaalsContact O-N 3.08Å; I22-K24 PolarHBondContact O-N 3.18Å; K24-G26 VanDerWaalsContact C-N 3.26Å; K24-G26 PolarHBondContact O-N 2.71Å
25C88.1Confident92.4Very high31 Ų3159.9 Ų59.921%0.20929%0.294CS..THydrogen-bonded Turntrans-74.6-6.3-173.3-65.30000115L21 I22 K27 Y28 R29L21-C25 PolarHBondContact O-SG 3.39Å; I22-C25 PolarHBondContact O-N 3.01Å; C25-K27 PolarHBondContact O-N 2.86Å; C25-Y28 PolarHBondContact O-N 2.94Å; C25-R29 HydrophobicContact CB-CB 4.27Å
26G86.6Confident92.4Very high24 Ų2460.7 Ų60.725%0.24730%0.299CS..G310 helixtrans55-127.2179.100000112.6K24 Y28 R29 S187K24-G26 VanDerWaalsContact C-N 3.26Å; K24-G26 PolarHBondContact O-N 2.71Å; G26-Y28 PolarHBondContact O-N 3.45Å; G26-R29 VanDerWaalsContact O-CB 3.23Å; G26-R29 WeakPolarHBondContact O-CB 3.31Å; G26-R29 PolarHBondContact O-N 3.08Å; G26-S187 WeakPolarHBondContact CA-OG 3.39Å
27K88.3Confident92.5Very high194 Ų19459.3 Ų59.384%0.84329%0.292SS*.G310 helixtrans-65.7-20.6178.6-63.3-175.4179.2-176.50114C25 R29C25-K27 PolarHBondContact O-N 2.86Å; K27-R29 VanDerWaalsContact C-N 3.3Å
28Y91.8Very high92.6Very high175 Ų17558 Ų5869%0.68628%0.278SS*.G310 helixtrans-87.4-0.4-179.9-57.8-70.6000113.3C25 G26 W31 F32C25-Y28 PolarHBondContact O-N 2.94Å; G26-Y28 PolarHBondContact O-N 3.45Å; Y28-W31 WeakPolarHBondContact O-CB 3.42Å; Y28-W31 PolarHBondContact O-N 3.4Å; Y28-F32 PolarHBondContact O-N 2.87Å
29R92.5Very high92.7Very high10 Ų1061 Ų614%0.03829%0.294CS..Hα-helixtrans-46.6-52.5178.4-174.2-173.9-62.3141.21.7114.5I22 C25 G26 K27 W31 F32 A33 F182 W185 S187I22-R29 HydrophobicContact CG2-CG 3.48Å; I22-R29 VanDerWaalsContact CG2-CG 3.48Å; C25-R29 HydrophobicContact CB-CB 4.27Å; G26-R29 VanDerWaalsContact O-CB 3.23Å; G26-R29 WeakPolarHBondContact O-CB 3.31Å; G26-R29 PolarHBondContact O-N 3.08Å; K27-R29 VanDerWaalsContact C-N 3.3Å; R29-W31 VanDerWaalsContact C-N 3.35Å; R29-W31 PolarHBondContact O-N 2.9Å; R29-F32 PolarHBondContact O-N 3.35Å; R29-A33 WeakPolarHBondContact O-CB 3.38Å; R29-A33 PolarHBondContact O-N 2.95Å; R29-F182 HydrophobicContact CG-CE1 4Å; R29-F182 HydrophobicContact CG-CE2 4.31Å; R29-F182 HydrophobicContact CG-CZ 3.65Å; R29-F182 PolarHBondContact NH1-O 3.35Å; R29-W185 PolarHBondContact NH1-O 3.15Å; R29-S187 PolarHBondContact NH2-OG 3.28Å
30P94.2Very high92.9Very high13 Ų1361.9 Ų61.98%0.08430%0.298CS..Hα-helixtrans-65.9-37.5-177.924.2-34.1000113.1A33 A34 L160 F179 C183P30-A33 PolarHBondContact O-N 3.47Å; P30-A34 WeakPolarHBondContact O-CB 3.18Å; P30-A34 PolarHBondContact O-N 3.24Å; P30-L160 HydrophobicContact CB-CD1 4.11Å; P30-F179 HydrophobicContact CB-CZ 4.13Å; P30-C183 HydrophobicContact CG-CB 4.44Å
31W95.7Very high93.1Very high128 Ų12859 Ų5949%0.48528%0.279SS..Hα-helixtrans-61.2-50175.4-80.5100000111.4Y28 R29 A33 A34 V35 L156 L160Y28-W31 WeakPolarHBondContact O-CB 3.42Å; Y28-W31 PolarHBondContact O-N 3.4Å; R29-W31 VanDerWaalsContact C-N 3.35Å; R29-W31 PolarHBondContact O-N 2.9Å; W31-A33 VanDerWaalsContact C-N 3.34Å; W31-A33 PolarHBondContact O-N 3.28Å; W31-A34 PolarHBondContact O-N 2.93Å; W31-V35 WeakPolarHBondContact O-CB 3.5Å; W31-V35 VanDerWaalsContact O-CG2 3.27Å; W31-V35 WeakPolarHBondContact O-CG2 3.46Å; W31-V35 PolarHBondContact O-N 3.48Å; W31-L156 HydrophobicContact CH2-CD1 3.68Å; W31-L156 HydrophobicContact CH2-CD2 4.36Å; W31-L156 HydrophobicContact CZ2-CD1 3.73Å; W31-L156 HydrophobicContact CZ2-CD2 3.61Å; W31-L156 HydrophobicContact CZ2-CG 4.21Å; W31-L156 HydrophobicContact CZ3-CD1 4.5Å; W31-L160 HydrophobicContact CD2-CD2 4.01Å; W31-L160 HydrophobicContact CE3-CD2 4.02Å; W31-L160 HydrophobicContact CG-CD2 4.35Å
32F95.8Very high93.3Very high82 Ų8260 Ų6036%0.3628%0.28SS..Hα-helixtrans-60.7-45.3178.7-170.1-81.5000111.3I18 I22 Y28 R29 A34 V35 V36I18-F32 HydrophobicContact CG2-CE1 3.94Å; I22-F32 HydrophobicContact CD1-CD1 3.8Å; I22-F32 HydrophobicContact CD1-CE1 4.19Å; I22-F32 HydrophobicContact CG1-CD1 3.38Å; I22-F32 HydrophobicContact CG1-CE1 3.74Å; I22-F32 HydrophobicContact CG1-CG 4.42Å; Y28-F32 PolarHBondContact O-N 2.87Å; R29-F32 PolarHBondContact O-N 3.35Å; F32-A34 VanDerWaalsContact C-N 3.33Å; F32-A34 PolarHBondContact O-N 3.41Å; F32-V35 PolarHBondContact O-N 3.18Å; F32-V36 HydrophobicContact CD1-CG2 3.83Å; F32-V36 HydrophobicContact CE1-CG2 3.56Å; F32-V36 HydrophobicContact CZ-CG2 4.08Å; F32-V36 WeakPolarHBondContact O-CB 3.29Å; F32-V36 VanDerWaalsContact O-CG2 3.29Å; F32-V36 WeakPolarHBondContact O-CG2 3.5Å; F32-V36 PolarHBondContact O-N 3.47Å
33A96.5Very high93.5Very high0 Ų064.5 Ų64.50%031%0.311CS..Hα-helixtrans-62.1-38.6178.900000113I22 R29 P30 W31 G37 Y165I22-A33 HydrophobicContact CD1-CB 4.03Å; R29-A33 WeakPolarHBondContact O-CB 3.38Å; R29-A33 PolarHBondContact O-N 2.95Å; P30-A33 PolarHBondContact O-N 3.47Å; W31-A33 VanDerWaalsContact C-N 3.34Å; W31-A33 PolarHBondContact O-N 3.28Å; A33-G37 PolarHBondContact O-N 2.96Å; A33-G37 VanDerWaalsContact O-N 3.15Å; A33-Y165 HydrophobicContact CB-CD1 4Å; A33-Y165 HydrophobicContact CB-CE1 4.08Å; A33-Y165 WeakPolarHBondContact O-CD1 3.44Å; A33-Y165 PolarHBondContact O-N 3.45Å; A33-Y165 VanDerWaalsContact O-N 3.14Å
34A97.1Very high93.9Very high8 Ų866 Ų667%0.06632%0.317CS..Hα-helixtrans-74.1-42.4178.500000112.6P30 W31 F32 G37 F38 L160 Y163P30-A34 WeakPolarHBondContact O-CB 3.18Å; P30-A34 PolarHBondContact O-N 3.24Å; W31-A34 PolarHBondContact O-N 2.93Å; F32-A34 VanDerWaalsContact C-N 3.33Å; F32-A34 PolarHBondContact O-N 3.41Å; A34-G37 PolarHBondContact O-N 3.35Å; A34-F38 WeakPolarHBondContact O-CB 3.34Å; A34-F38 PolarHBondContact O-N 3.3Å; A34-L160 HydrophobicContact CB-CB 4.32Å; A34-L160 HydrophobicContact CB-CD2 3.53Å; A34-Y163 WeakPolarHBondContact CA-O 3.27Å
35V97.1Very high94.2Very high75 Ų7558.1 Ų58.146%0.45528%0.284SS..Hα-helixtrans-62.6-45.9177170.10000110.5W31 F32 G37 F38 L39W31-V35 WeakPolarHBondContact O-CB 3.5Å; W31-V35 VanDerWaalsContact O-CG2 3.27Å; W31-V35 WeakPolarHBondContact O-CG2 3.46Å; W31-V35 PolarHBondContact O-N 3.48Å; F32-V35 PolarHBondContact O-N 3.18Å; V35-G37 PolarHBondContact O-N 2.95Å; V35-F38 PolarHBondContact O-N 3.45Å; V35-L39 HydrophobicContact CG1-CD1 3.82Å; V35-L39 HydrophobicContact CG1-CG 4.3Å; V35-L39 WeakPolarHBondContact O-CB 3.25Å; V35-L39 VanDerWaalsContact O-CG 3.25Å; V35-L39 WeakPolarHBondContact O-CG 3.4Å; V35-L39 PolarHBondContact O-N 3Å
36V96.7Very high94.4Very high22 Ų2258.1 Ų58.113%0.13329%0.289CS..Hα-helixtrans-58.2-47.8174.6167.20000111I18 F32 F38 L39 M40 Y165I18-V36 HydrophobicContact CD1-CG1 3.63Å; I18-V36 HydrophobicContact CG2-CG1 4.35Å; I18-V36 HydrophobicContact CG2-CG2 4.5Å; F32-V36 HydrophobicContact CD1-CG2 3.83Å; F32-V36 HydrophobicContact CE1-CG2 3.56Å; F32-V36 HydrophobicContact CZ-CG2 4.08Å; F32-V36 WeakPolarHBondContact O-CB 3.29Å; F32-V36 VanDerWaalsContact O-CG2 3.29Å; F32-V36 WeakPolarHBondContact O-CG2 3.5Å; F32-V36 PolarHBondContact O-N 3.47Å; V36-F38 PolarHBondContact O-N 3.3Å; V36-L39 PolarHBondContact O-N 3.26Å; V36-M40 HydrophobicContact CG1-CG 4.23Å; V36-M40 HydrophobicContact CG1-SD 3.7Å; V36-M40 WeakPolarHBondContact O-CB 3.27Å; V36-M40 VanDerWaalsContact O-CG 3.25Å; V36-M40 WeakPolarHBondContact O-CG 3.48Å; V36-M40 PolarHBondContact O-N 3.46Å; V36-Y165 HydrophobicContact CG1-CD1 4.39Å; V36-Y165 HydrophobicContact CG1-CG 4.07Å
37G97.1Very high94.6Very high0 Ų065.1 Ų65.10%032%0.315CS..Hα-helixtrans-64.9-41.1-177.900000112.7A33 A34 V35 F41 Y163 Y165A33-G37 PolarHBondContact O-N 2.96Å; A33-G37 VanDerWaalsContact O-N 3.15Å; A34-G37 PolarHBondContact O-N 3.35Å; V35-G37 PolarHBondContact O-N 2.95Å; G37-F41 VanDerWaalsContact O-CB 3.29Å; G37-F41 WeakPolarHBondContact O-CB 3.15Å; G37-F41 PolarHBondContact O-N 2.98Å; G37-Y163 WeakPolarHBondContact CA-O 3.5Å; G37-Y165 VanDerWaalsContact CA-CB 3.41Å
38F96.7Very high94.8Very high68 Ų6856.4 Ų56.430%0.29828%0.279SS..Hα-helixtrans-63.1-47.4173.9-179.2-97.4000112.1A34 V35 V36 F41 F42 V49 L53 Y163A34-F38 WeakPolarHBondContact O-CB 3.34Å; A34-F38 PolarHBondContact O-N 3.3Å; V35-F38 PolarHBondContact O-N 3.45Å; V36-F38 PolarHBondContact O-N 3.3Å; F38-F41 PolarHBondContact O-N 3.29Å; F38-F42 WeakPolarHBondContact O-CB 3.21Å; F38-F42 PolarHBondContact O-N 3.36Å; F38-V49 HydrophobicContact CD2-CG2 4.43Å; F38-V49 HydrophobicContact CE2-CG2 3.73Å; F38-V49 HydrophobicContact CZ-CG2 4.28Å; F38-L53 HydrophobicContact CE2-CD1 4.25Å; F38-L53 HydrophobicContact CE2-CD2 4.06Å; F38-L53 HydrophobicContact CE2-CG 4.37Å; F38-Y163 HydrophobicContact CB-CD1 4.4Å; F38-Y163 HydrophobicContact CB-CG 4.38Å; F38-Y163 HydrophobicContact CD2-CD1 4.11Å; F38-Y163 HydrophobicContact CD2-CD2 4.48Å; F38-Y163 HydrophobicContact CD2-CE1 4.02Å; F38-Y163 HydrophobicContact CD2-CE2 4.36Å; F38-Y163 HydrophobicContact CD2-CG 4.36Å
39L96.5Very high95Very high93 Ų9348.6 Ų48.649%0.48725%0.25SC..Hα-helixtrans-63.5-44.6178.9-71.5175.7000111.7V35 V36 F41 F42 C43V35-L39 HydrophobicContact CG1-CD1 3.82Å; V35-L39 HydrophobicContact CG1-CG 4.3Å; V35-L39 WeakPolarHBondContact O-CB 3.25Å; V35-L39 VanDerWaalsContact O-CG 3.25Å; V35-L39 WeakPolarHBondContact O-CG 3.4Å; V35-L39 PolarHBondContact O-N 3Å; V36-L39 PolarHBondContact O-N 3.26Å; L39-F41 VanDerWaalsContact C-N 3.3Å; L39-F41 PolarHBondContact O-N 3.07Å; L39-F42 PolarHBondContact O-N 3Å; L39-C43 WeakPolarHBondContact O-CB 3.37Å; L39-C43 PolarHBondContact O-N 2.96Å; L39-C43 PolarHBondContact O-SG 2.69Å
40M95.4Very high95.1Very high18 Ų1852.4 Ų52.49%0.08926%0.264CS..Hα-helixtrans-58.4-45.7173.9-73178.570.400110.7I11 L14 I18 V36 C43 F44 F169I11-M40 HydrophobicContact CB-CE 4.27Å; I11-M40 HydrophobicContact CG1-CE 4.37Å; I11-M40 HydrophobicContact CG2-CE 3.83Å; L14-M40 HydrophobicContact CB-CE 4.22Å; I18-M40 HydrophobicContact CD1-SD 4.42Å; V36-M40 HydrophobicContact CG1-CG 4.23Å; V36-M40 HydrophobicContact CG1-SD 3.7Å; V36-M40 WeakPolarHBondContact O-CB 3.27Å; V36-M40 VanDerWaalsContact O-CG 3.25Å; V36-M40 WeakPolarHBondContact O-CG 3.48Å; V36-M40 PolarHBondContact O-N 3.46Å; M40-C43 PolarHBondContact O-N 3.13Å; M40-F44 WeakPolarHBondContact O-CD2 3.16Å; M40-F44 PolarHBondContact O-N 3.23Å; M40-F44 VanDerWaalsContact O-N 3.09Å; M40-F169 HydrophobicContact CB-CE2 3.95Å; M40-F169 HydrophobicContact CB-CZ 3.76Å; M40-F169 HydrophobicContact CE-CE2 4.12Å; M40-F169 HydrophobicContact SD-CE2 4.49Å
41F96.2Very high95.1Very high2 Ų251.8 Ų51.81%0.00926%0.26CS..Hα-helixtrans-65.5-44.2-179.2-179-136.7000111.8G37 F38 L39 C43 F44 A45 V49 S52 V100 A101 V104 Y163 F169G37-F41 VanDerWaalsContact O-CB 3.29Å; G37-F41 WeakPolarHBondContact O-CB 3.15Å; G37-F41 PolarHBondContact O-N 2.98Å; F38-F41 PolarHBondContact O-N 3.29Å; L39-F41 VanDerWaalsContact C-N 3.3Å; L39-F41 PolarHBondContact O-N 3.07Å; F41-C43 PolarHBondContact O-N 3.5Å; F41-F44 PolarHBondContact O-N 3.13Å; F41-A45 HydrophobicContact CD2-CB 3.56Å; F41-A45 HydrophobicContact CE2-CB 3.16Å; F41-A45 HydrophobicContact CZ-CB 3.88Å; F41-A45 VanDerWaalsContact O-CB 3.25Å; F41-A45 WeakPolarHBondContact O-CB 3.38Å; F41-A45 PolarHBondContact O-N 3.47Å; F41-V49 HydrophobicContact CD1-CB 4.29Å; F41-V49 HydrophobicContact CD1-CG2 3.68Å; F41-V49 HydrophobicContact CE1-CB 3.99Å; F41-V49 HydrophobicContact CE1-CG2 3.71Å; F41-S52 WeakPolarHBondContact CE1-OG 3.39Å; F41-V100 HydrophobicContact CD2-CG1 4.33Å; F41-A101 HydrophobicContact CE2-CB 4.3Å; F41-A101 HydrophobicContact CZ-CB 4.38Å; F41-V104 HydrophobicContact CD1-CG1 4.01Å; F41-V104 HydrophobicContact CD2-CB 4.07Å; F41-V104 HydrophobicContact CD2-CG1 4.15Å; F41-V104 HydrophobicContact CD2-CG2 3.6Å; F41-V104 HydrophobicContact CE1-CB 4.49Å; F41-V104 HydrophobicContact CE1-CG1 3.84Å; F41-V104 HydrophobicContact CE2-CB 3.73Å; F41-V104 HydrophobicContact CE2-CG1 3.95Å; F41-V104 HydrophobicContact CE2-CG2 3.72Å; F41-V104 HydrophobicContact CG-CG1 4.19Å; F41-V104 HydrophobicContact CG-CG2 4.2Å; F41-V104 HydrophobicContact CZ-CB 3.98Å; F41-V104 HydrophobicContact CZ-CG1 3.81Å; F41-V104 HydrophobicContact CZ-CG2 4.43Å; F41-Y163 HydrophobicContact CD1-CE1 4.25Å; F41-F169 HydrophobicContact CB-CE1 4.21Å; F41-F169 HydrophobicContact CB-CZ 3.98Å; F41-F169 HydrophobicContact CD2-CE1 4.21Å
42F95.5Very high95.2Very high110 Ų11045.8 Ų45.848%0.48224%0.238SC..Hα-helixtrans-57.7-46.3174.8-178.1-100.1000111.9F38 L39 F44 G46 V49F38-F42 WeakPolarHBondContact O-CB 3.21Å; F38-F42 PolarHBondContact O-N 3.36Å; L39-F42 PolarHBondContact O-N 3Å; F42-F44 PolarHBondContact O-N 3.27Å; F42-G46 VanDerWaalsContact O-CA 3.27Å; F42-G46 WeakPolarHBondContact O-CA 3.37Å; F42-G46 PolarHBondContact O-N 3.06Å; F42-V49 HydrophobicContact CD2-CG1 4.05Å
43C94.7Very high95.2Very high96 Ų9644.9 Ų44.965%0.64924%0.236SC*.Hα-helixtrans-62.5-41.6179.6-71.10000113.1L39 M40 F41L39-C43 WeakPolarHBondContact O-CB 3.37Å; L39-C43 PolarHBondContact O-N 2.96Å; L39-C43 PolarHBondContact O-SG 2.69Å; M40-C43 PolarHBondContact O-N 3.13Å; F41-C43 PolarHBondContact O-N 3.5Å
44F93.3Very high95.3Very high64 Ų6448 Ų4828%0.28125%0.252SS..Hα-helixtrans-92.5-24.6-174.1-71.8-69.4000114.6I7 I10 I11 M40 F41 F42 V100I7-F44 HydrophobicContact CG2-CD1 3.53Å; I7-F44 HydrophobicContact CG2-CE1 3.92Å; I7-F44 HydrophobicContact CG2-CG 4.14Å; I10-F44 HydrophobicContact CG2-CZ 4.16Å; I11-F44 HydrophobicContact CD1-CB 4.32Å; I11-F44 HydrophobicContact CD1-CD1 4.44Å; I11-F44 HydrophobicContact CD1-CD2 3.72Å; I11-F44 HydrophobicContact CD1-CE2 4.12Å; I11-F44 HydrophobicContact CD1-CG 3.92Å; I11-F44 HydrophobicContact CG1-CD2 3.62Å; I11-F44 HydrophobicContact CG1-CE1 4.48Å; I11-F44 HydrophobicContact CG1-CE2 3.5Å; I11-F44 VanDerWaalsContact CG1-CE2 3.5Å; I11-F44 HydrophobicContact CG1-CG 4.21Å; I11-F44 HydrophobicContact CG1-CZ 3.96Å; M40-F44 WeakPolarHBondContact O-CD2 3.16Å; M40-F44 PolarHBondContact O-N 3.23Å; M40-F44 VanDerWaalsContact O-N 3.09Å; F41-F44 PolarHBondContact O-N 3.13Å; F42-F44 PolarHBondContact O-N 3.27Å; F44-V100 HydrophobicContact CB-CG1 4.03Å; F44-V100 HydrophobicContact CB-CG2 4.47Å
45A92.7Very high95.3Very high8 Ų847.6 Ų47.67%0.06625%0.249CC..Hα-helixtrans-105.3-13.2179.500000113.8F41 Q47 A48 V100 A101F41-A45 HydrophobicContact CD2-CB 3.56Å; F41-A45 HydrophobicContact CE2-CB 3.16Å; F41-A45 HydrophobicContact CZ-CB 3.88Å; F41-A45 VanDerWaalsContact O-CB 3.25Å; F41-A45 WeakPolarHBondContact O-CB 3.38Å; F41-A45 PolarHBondContact O-N 3.47Å; A45-Q47 PolarHBondContact O-N 3.5Å; A45-A48 HydrophobicContact CB-CB 4.39Å; A45-A48 WeakPolarHBondContact O-CB 3.48Å; A45-A48 PolarHBondContact O-N 3.1Å; A45-V100 HydrophobicContact CB-CG1 4.46Å; A45-A101 HydrophobicContact CB-CB 4.21Å
46G91.4Very high95.4Very high30 Ų3044.2 Ų44.231%0.30923%0.229SC..G310 helixtrans57.4-130.8-179.700000112F42 A48 V49F42-G46 VanDerWaalsContact O-CA 3.27Å; F42-G46 WeakPolarHBondContact O-CA 3.37Å; F42-G46 PolarHBondContact O-N 3.06Å; G46-A48 PolarHBondContact O-N 3.43Å; G46-A48 VanDerWaalsContact O-N 3.15Å; G46-V49 WeakPolarHBondContact O-CG1 3.34Å; G46-V49 PolarHBondContact O-N 3.42Å
47Q91.4Very high95.4Very high172 Ų17246.5 Ų46.580%0.80425%0.246SC*.G310 helixtrans-60.8-25.6-177.8-67.3-178.8-11.600113.1A45 V49 W50A45-Q47 PolarHBondContact O-N 3.5Å; Q47-V49 PolarHBondContact O-N 2.94Å; Q47-W50 PolarHBondContact O-N 3.24Å
48A93.2Very high95.4Very high10 Ų1048.6 Ų48.68%0.08326%0.258CS..G310 helixtrans-62.3-10.7-178.500000113.8A45 G46 W50 H51 A101A45-A48 HydrophobicContact CB-CB 4.39Å; A45-A48 WeakPolarHBondContact O-CB 3.48Å; A45-A48 PolarHBondContact O-N 3.1Å; G46-A48 PolarHBondContact O-N 3.43Å; G46-A48 VanDerWaalsContact O-N 3.15Å; A48-W50 PolarHBondContact O-N 3.27Å; A48-H51 PolarHBondContact O-N 3.21Å; A48-A101 HydrophobicContact CB-CB 3.67Å
49V94.8Very high95.5Very high12 Ų1245.4 Ų45.47%0.07324%0.244CC..Hα-helixtrans-53-31.7172.371.50000113.5F38 F41 F42 G46 Q47 H51 S52 L53F38-V49 HydrophobicContact CD2-CG2 4.43Å; F38-V49 HydrophobicContact CE2-CG2 3.73Å; F38-V49 HydrophobicContact CZ-CG2 4.28Å; F41-V49 HydrophobicContact CD1-CB 4.29Å; F41-V49 HydrophobicContact CD1-CG2 3.68Å; F41-V49 HydrophobicContact CE1-CB 3.99Å; F41-V49 HydrophobicContact CE1-CG2 3.71Å; F42-V49 HydrophobicContact CD2-CG1 4.05Å; G46-V49 WeakPolarHBondContact O-CG1 3.34Å; G46-V49 PolarHBondContact O-N 3.42Å; Q47-V49 PolarHBondContact O-N 2.94Å; V49-H51 PolarHBondContact O-N 2.9Å; V49-H51 VanDerWaalsContact O-N 3.16Å; V49-S52 PolarHBondContact O-N 3.39Å; V49-S52 VanDerWaalsContact O-N 3.16Å; V49-S52 PolarHBondContact O-OG 3.41Å; V49-L53 HydrophobicContact CG1-CD1 4.46Å; V49-L53 HydrophobicContact CG2-CD1 4.24Å; V49-L53 HydrophobicContact CG2-CG 4.45Å; V49-L53 PolarHBondContact O-N 2.81Å
50W94.2Very high95.5Very high89 Ų8941.7 Ų41.734%0.33723%0.226SC..Hα-helixtrans-60.7-30.2-175.680.1-104.9000112Q47 A48 S52 L53 L54 Y82 F85 F94Q47-W50 PolarHBondContact O-N 3.24Å; A48-W50 PolarHBondContact O-N 3.27Å; W50-S52 PolarHBondContact O-N 3.08Å; W50-L53 PolarHBondContact O-N 2.99Å; W50-L54 HydrophobicContact CE3-CB 4.24Å; W50-L54 HydrophobicContact CE3-CD2 4.38Å; W50-L54 HydrophobicContact CZ3-CB 4.34Å; W50-L54 HydrophobicContact CZ3-CD2 3.69Å; W50-L54 WeakPolarHBondContact O-CB 3.41Å; W50-L54 PolarHBondContact O-N 2.91Å; W50-Y82 WeakPolarHBondContact CZ3-OH 3.39Å; W50-F85 HydrophobicContact CH2-CE1 4.46Å; W50-F94 HydrophobicContact CH2-CE1 4.22Å; W50-F94 AromaticContact CZ2-CD1 3.88Å; W50-F94 HydrophobicContact CZ2-CD1 3.88Å; W50-F94 AromaticContact CZ2-CE1 3.83Å; W50-F94 HydrophobicContact CZ2-CE1 3.83Å
51H95.9Very high95.6Very high1 Ų145.4 Ų45.41%0.00525%0.245CC..Hα-helixtrans-64.1-41.7179.6-72.3-78.3000112.5A48 V49 T55 Y82 F86A48-H51 PolarHBondContact O-N 3.21Å; V49-H51 PolarHBondContact O-N 2.9Å; V49-H51 VanDerWaalsContact O-N 3.16Å; H51-T55 PolarHBondContact O-N 3.24Å; H51-T55 VanDerWaalsContact O-N 3.07Å; H51-T55 PolarHBondContact O-OG1 2.9Å; H51-Y82 WeakPolarHBondContact CA-OH 3.38Å; H51-Y82 HydrophobicContact CB-CE1 4.11Å; H51-Y82 AromaticContact ND1-CZ 3.83Å; H51-Y82 PolarHBondContact ND1-OH 2.93Å; H51-Y82 WeakPolarHBondContact O-CE1 3.46Å; H51-F86 HydrophobicContact CB-CD2 3.62Å; H51-F86 HydrophobicContact CB-CE2 3.73Å; H51-F86 AromaticContact CD2-CD2 3.9Å; H51-F86 AromaticContact CD2-CE2 3.77Å; H51-F86 AromaticContact CG-CD2 3.5Å; H51-F86 AromaticContact CG-CE2 3.72Å; H51-F86 AromaticContact ND1-CD2 3.67Å
52S96.6Very high95.6Very high1 Ų145.8 Ų45.81%0.00725%0.249CC..Hα-helixtrans-73.9-35.8179.182.80000111F41 V49 W50 T55 L56 Y163F41-S52 WeakPolarHBondContact CE1-OG 3.39Å; V49-S52 PolarHBondContact O-N 3.39Å; V49-S52 VanDerWaalsContact O-N 3.16Å; V49-S52 PolarHBondContact O-OG 3.41Å; W50-S52 PolarHBondContact O-N 3.08Å; S52-T55 PolarHBondContact O-N 2.94Å; S52-L56 WeakPolarHBondContact O-CB 3.29Å; S52-L56 PolarHBondContact O-N 2.88Å; S52-Y163 WeakPolarHBondContact OG-CE1 3.49Å; S52-Y163 PolarHBondContact OG-OH 3.45Å
53L97.1Very high95.7Very high63 Ų6342.1 Ų42.133%0.3323%0.233SC..Hα-helixtrans-61.5-44.9173.5-75.5169.7000111.5F38 V49 W50 L56 S57 Y163F38-L53 HydrophobicContact CE2-CD1 4.25Å; F38-L53 HydrophobicContact CE2-CD2 4.06Å; F38-L53 HydrophobicContact CE2-CG 4.37Å; V49-L53 HydrophobicContact CG1-CD1 4.46Å; V49-L53 HydrophobicContact CG2-CD1 4.24Å; V49-L53 HydrophobicContact CG2-CG 4.45Å; V49-L53 PolarHBondContact O-N 2.81Å; W50-L53 PolarHBondContact O-N 2.99Å; L53-L56 PolarHBondContact O-N 3.38Å; L53-S57 VanDerWaalsContact O-CB 3.26Å; L53-S57 WeakPolarHBondContact O-CB 3.39Å; L53-S57 PolarHBondContact O-N 2.97Å; L53-S57 PolarHBondContact O-OG 3.34Å; L53-Y163 WeakPolarHBondContact CA-OH 3.37Å; L53-Y163 HydrophobicContact CD2-CE2 3.96Å; L53-Y163 VanDerWaalsContact CD2-OH 3.25Å; L53-Y163 WeakPolarHBondContact CD2-OH 3.44Å; L53-Y163 WeakPolarHBondContact CG-OH 3.4Å; L53-Y163 PolarHBondContact N-OH 3.47Å; L53-Y163 VanDerWaalsContact N-OH 3.12Å
54L97.2Very high95.7Very high65 Ų6542.7 Ų42.734%0.3423%0.228SC..Hα-helixtrans-63.4-46177-179.461.3000111W50 L56 S57 V58 W78 Y82W50-L54 HydrophobicContact CE3-CB 4.24Å; W50-L54 HydrophobicContact CE3-CD2 4.38Å; W50-L54 HydrophobicContact CZ3-CB 4.34Å; W50-L54 HydrophobicContact CZ3-CD2 3.69Å; W50-L54 WeakPolarHBondContact O-CB 3.41Å; W50-L54 PolarHBondContact O-N 2.91Å; L54-L56 VanDerWaalsContact C-N 3.33Å; L54-L56 PolarHBondContact O-N 2.71Å; L54-S57 PolarHBondContact O-N 3.49Å; L54-V58 HydrophobicContact CD1-CG2 3.84Å; L54-V58 HydrophobicContact CG-CG2 4.44Å; L54-V58 WeakPolarHBondContact O-CG2 3.49Å; L54-V58 PolarHBondContact O-N 2.81Å; L54-W78 HydrophobicContact CG-CH2 4.47Å; L54-W78 HydrophobicContact CG-CZ2 4.37Å; L54-Y82 HydrophobicContact CD2-CE2 3.57Å; L54-Y82 HydrophobicContact CG-CE2 4.27Å
55T98.1Very high95.9Very high0 Ų045.3 Ų45.30%024%0.244CC..Hα-helixtrans-55.8-49.4178.1-56.20000111.1H51 S52 F59 W78 Y82 Q105 L108 L112H51-T55 PolarHBondContact O-N 3.24Å; H51-T55 VanDerWaalsContact O-N 3.07Å; H51-T55 PolarHBondContact O-OG1 2.9Å; S52-T55 PolarHBondContact O-N 2.94Å; T55-F59 VanDerWaalsContact O-CB 3.3Å; T55-F59 WeakPolarHBondContact O-CB 3.49Å; T55-F59 PolarHBondContact O-N 2.82Å; T55-W78 PolarHBondContact O-NE1 3.3Å; T55-Y82 WeakPolarHBondContact OG1-CD1 3.31Å; T55-Y82 WeakPolarHBondContact OG1-CE1 3.45Å; T55-Q105 PolarHBondContact OG1-NE2 3.47Å; T55-L108 HydrophobicContact CG2-CD2 4.34Å; T55-L112 HydrophobicContact CG2-CD1 3.91Å
56L98Very high96Very high4 Ų449.5 Ų49.52%0.02126%0.261CS..Hα-helixtrans-66.6-42.1179.6177.162.6000112.4S52 L53 L54 F59 T60 L112 I158 M159 A162 Y163S52-L56 WeakPolarHBondContact O-CB 3.29Å; S52-L56 PolarHBondContact O-N 2.88Å; L53-L56 PolarHBondContact O-N 3.38Å; L54-L56 VanDerWaalsContact C-N 3.33Å; L54-L56 PolarHBondContact O-N 2.71Å; L56-F59 PolarHBondContact O-N 2.62Å; L56-T60 VanDerWaalsContact O-CB 3.31Å; L56-T60 WeakPolarHBondContact O-CB 3.32Å; L56-T60 PolarHBondContact O-N 3.38Å; L56-T60 PolarHBondContact O-OG1 2.98Å; L56-L112 HydrophobicContact CD1-CD2 3.93Å; L56-I158 HydrophobicContact CD1-CG2 4.03Å; L56-M159 HydrophobicContact CD2-CB 4.3Å; L56-M159 HydrophobicContact CD2-CG 4.09Å; L56-M159 HydrophobicContact CG-CG 4.44Å; L56-A162 HydrophobicContact CD1-CB 3.6Å; L56-A162 HydrophobicContact CD2-CB 3.81Å; L56-A162 HydrophobicContact CG-CB 4.28Å; L56-Y163 HydrophobicContact CD2-CD2 3.86Å; L56-Y163 HydrophobicContact CD2-CE2 3.38Å
57S97.5Very high96.2Very high70 Ų7051.3 Ų51.349%0.4927%0.268SS..Hα-helixtrans-65-46.2-177.3-59.90000111.1L53 L54 T60 L61L53-S57 VanDerWaalsContact O-CB 3.26Å; L53-S57 WeakPolarHBondContact O-CB 3.39Å; L53-S57 PolarHBondContact O-N 2.97Å; L53-S57 PolarHBondContact O-OG 3.34Å; L54-S57 PolarHBondContact O-N 3.49Å; S57-T60 PolarHBondContact O-N 3.19Å; S57-L61 WeakPolarHBondContact O-CB 3.17Å; S57-L61 PolarHBondContact O-N 3.26Å
58V97.7Very high96.4Very high44 Ų4446.2 Ų46.227%0.26724%0.244SC..Hα-helixtrans-68.7-37.8177.4175.50000111.1L54 L61 A62 W78L54-V58 HydrophobicContact CD1-CG2 3.84Å; L54-V58 HydrophobicContact CG-CG2 4.44Å; L54-V58 WeakPolarHBondContact O-CG2 3.49Å; L54-V58 PolarHBondContact O-N 2.81Å; V58-L61 PolarHBondContact O-N 3.4Å; V58-A62 WeakPolarHBondContact O-CB 3.39Å; V58-A62 PolarHBondContact O-N 2.82Å; V58-W78 HydrophobicContact CB-CD2 4.14Å; V58-W78 HydrophobicContact CB-CH2 3.99Å; V58-W78 HydrophobicContact CB-CZ2 3.33Å; V58-W78 HydrophobicContact CG1-CD2 3.55Å; V58-W78 HydrophobicContact CG1-CE3 3.89Å; V58-W78 HydrophobicContact CG1-CG 4.1Å; V58-W78 HydrophobicContact CG1-CH2 3.94Å; V58-W78 HydrophobicContact CG1-CZ2 3.6Å; V58-W78 HydrophobicContact CG1-CZ3 4.07Å; V58-W78 HydrophobicContact CG2-CH2 3.79Å; V58-W78 HydrophobicContact CG2-CZ2 3.5Å
59F98.3Very high96.4Very high1 Ų151.9 Ų51.90%0.00426%0.263CS..Hα-helixtrans-61.5-44.3172.5177.2-88.7000111.9T55 L56 L61 A62 F63 A75 L112 I158T55-F59 VanDerWaalsContact O-CB 3.3Å; T55-F59 WeakPolarHBondContact O-CB 3.49Å; T55-F59 PolarHBondContact O-N 2.82Å; L56-F59 PolarHBondContact O-N 2.62Å; F59-L61 VanDerWaalsContact C-N 3.33Å; F59-L61 PolarHBondContact O-N 2.94Å; F59-A62 PolarHBondContact O-N 3.42Å; F59-F63 WeakPolarHBondContact O-CB 3.34Å; F59-F63 PolarHBondContact O-N 2.99Å; F59-A75 HydrophobicContact CD2-CB 3.99Å; F59-A75 HydrophobicContact CE2-CB 3.6Å; F59-L112 HydrophobicContact CB-CD1 3.99Å; F59-L112 HydrophobicContact CD1-CB 4.43Å; F59-L112 HydrophobicContact CD1-CD1 4.48Å; F59-L112 HydrophobicContact CD1-CD2 3.75Å; F59-L112 HydrophobicContact CD1-CG 4.43Å; F59-L112 HydrophobicContact CD2-CB 3.83Å; F59-L112 HydrophobicContact CD2-CD1 4.44Å; F59-L112 HydrophobicContact CE1-CB 4.46Å; F59-L112 HydrophobicContact CE1-CD2 3.93Å; F59-L112 HydrophobicContact CE2-CB 3.85Å; F59-L112 WeakPolarHBondContact CE2-O 3.19Å; F59-L112 HydrophobicContact CG-CB 4.12Å; F59-L112 HydrophobicContact CG-CD1 4.06Å; F59-L112 HydrophobicContact CG-CD2 4.13Å; F59-L112 HydrophobicContact CG-CG 4.32Å; F59-L112 HydrophobicContact CZ-CB 4.18Å; F59-L112 HydrophobicContact CZ-CD2 4.45Å; F59-L112 VanDerWaalsContact CZ-O 3.24Å; F59-L112 WeakPolarHBondContact CZ-O 3.34Å; F59-I158 HydrophobicContact CD1-CG2 3.95Å; F59-I158 HydrophobicContact CE1-CD1 4.24Å; F59-I158 HydrophobicContact CE1-CG2 3.75Å
60T97.1Very high96.5Very high15 Ų1555.7 Ų55.79%0.09228%0.279CS..Hα-helixtrans-65.1-39.3179.3-56.10000110.9L56 S57 F63 I64 P155L56-T60 VanDerWaalsContact O-CB 3.31Å; L56-T60 WeakPolarHBondContact O-CB 3.32Å; L56-T60 PolarHBondContact O-N 3.38Å; L56-T60 PolarHBondContact O-OG1 2.98Å; S57-T60 PolarHBondContact O-N 3.19Å; T60-F63 WeakPolarHBondContact O-CB 3.34Å; T60-F63 PolarHBondContact O-N 3.44Å; T60-I64 HydrophobicContact CG2-CD1 4.31Å; T60-I64 VanDerWaalsContact O-CG1 3.32Å; T60-I64 WeakPolarHBondContact O-CG1 3.29Å; T60-I64 PolarHBondContact O-N 2.82Å; T60-I64 VanDerWaalsContact O-N 3.1Å; T60-P155 HydrophobicContact CG2-CB 3.73Å
61L96.7Very high96.6Very high97 Ų9751.5 Ų51.551%0.50826%0.263SS..Hα-helixtrans-62.8-45.8171.9-177.862.6000111.3S57 V58 F59 F63 I64 L65S57-L61 WeakPolarHBondContact O-CB 3.17Å; S57-L61 PolarHBondContact O-N 3.26Å; V58-L61 PolarHBondContact O-N 3.4Å; F59-L61 VanDerWaalsContact C-N 3.33Å; F59-L61 PolarHBondContact O-N 2.94Å; L61-F63 VanDerWaalsContact C-N 3.3Å; L61-F63 PolarHBondContact O-N 3.47Å; L61-I64 PolarHBondContact O-N 3.39Å; L61-I64 VanDerWaalsContact O-N 3.13Å; L61-L65 HydrophobicContact CD1-CD1 3.72Å; L61-L65 HydrophobicContact CD1-CG 4Å; L61-L65 HydrophobicContact CD2-CD1 4.4Å; L61-L65 HydrophobicContact CG-CD1 3.75Å; L61-L65 HydrophobicContact CG-CG 4.32Å; L61-L65 WeakPolarHBondContact O-CB 3.43Å; L61-L65 VanDerWaalsContact O-CG 3.31Å; L61-L65 WeakPolarHBondContact O-CG 3.26Å; L61-L65 PolarHBondContact O-N 3.04Å
62A96.9Very high96.6Very high10 Ų1052.6 Ų52.68%0.08327%0.268CS..Hα-helixtrans-61.5-39.1176.700000112V58 F59 I64 L65 F66 V74V58-A62 WeakPolarHBondContact O-CB 3.39Å; V58-A62 PolarHBondContact O-N 2.82Å; F59-A62 PolarHBondContact O-N 3.42Å; A62-I64 VanDerWaalsContact C-N 3.31Å; A62-I64 PolarHBondContact O-N 3.3Å; A62-L65 PolarHBondContact O-N 2.86Å; A62-F66 HydrophobicContact CB-CD2 4.11Å; A62-F66 HydrophobicContact CB-CE2 4.49Å; A62-F66 WeakPolarHBondContact O-CB 3.2Å; A62-F66 WeakPolarHBondContact O-CD2 3.18Å; A62-F66 PolarHBondContact O-N 2.81Å; A62-V74 HydrophobicContact CB-CG1 4Å
63F96.7Very high96.6Very high33 Ų3359.7 Ų59.715%0.14530%0.296CS..Hα-helixtrans-60.2-38173.7168.9-113.4000112.8F59 T60 L61 L71 I119 P153 P155 I158F59-F63 WeakPolarHBondContact O-CB 3.34Å; F59-F63 PolarHBondContact O-N 2.99Å; T60-F63 WeakPolarHBondContact O-CB 3.34Å; T60-F63 PolarHBondContact O-N 3.44Å; L61-F63 VanDerWaalsContact C-N 3.3Å; L61-F63 PolarHBondContact O-N 3.47Å; F63-L71 HydrophobicContact CB-CD1 4.29Å; F63-L71 HydrophobicContact CB-CD2 4.46Å; F63-L71 HydrophobicContact CD2-CD2 3.69Å; F63-I119 HydrophobicContact CD2-CD1 3.84Å; F63-I119 HydrophobicContact CE2-CD1 3.68Å; F63-I119 HydrophobicContact CE2-CG1 4.48Å; F63-I119 HydrophobicContact CE2-CG2 4.37Å; F63-P153 HydrophobicContact CE2-CG 4.5Å; F63-P153 HydrophobicContact CZ-CG 4.2Å; F63-P153 VanDerWaalsContact CZ-O 3.29Å; F63-P153 WeakPolarHBondContact CZ-O 3.5Å; F63-P155 HydrophobicContact CD1-CG 4.38Å; F63-P155 HydrophobicContact CE1-CG 4.14Å; F63-I158 HydrophobicContact CB-CD1 4.36Å; F63-I158 HydrophobicContact CD1-CD1 3.41Å; F63-I158 VanDerWaalsContact CD1-CD1 3.41Å; F63-I158 HydrophobicContact CD2-CD1 4.14Å; F63-I158 HydrophobicContact CE1-CD1 3.6Å; F63-I158 HydrophobicContact CE2-CD1 4.32Å; F63-I158 HydrophobicContact CG-CD1 3.69Å; F63-I158 HydrophobicContact CZ-CD1 4.07Å
64I95.8Very high96.6Very high107 Ų10758.5 Ų58.555%0.54929%0.291SS..Hα-helixtrans-75.2-37.2178.2-66.4163.9000111.6T60 L61 A62 P155T60-I64 HydrophobicContact CG2-CD1 4.31Å; T60-I64 VanDerWaalsContact O-CG1 3.32Å; T60-I64 WeakPolarHBondContact O-CG1 3.29Å; T60-I64 PolarHBondContact O-N 2.82Å; T60-I64 VanDerWaalsContact O-N 3.1Å; L61-I64 PolarHBondContact O-N 3.39Å; L61-I64 VanDerWaalsContact O-N 3.13Å; A62-I64 VanDerWaalsContact C-N 3.31Å; A62-I64 PolarHBondContact O-N 3.3Å; I64-P155 HydrophobicContact CD1-CG 4.08Å; I64-P155 HydrophobicContact CG1-CG 4.11Å
65L95.9Very high96.6Very high119 Ų11955.5 Ų55.562%0.62328%0.276SS*.Hα-helixtrans-89.2-35.4-171.4-65.4179.6000114.3L61 A62L61-L65 HydrophobicContact CD1-CD1 3.72Å; L61-L65 HydrophobicContact CD1-CG 4Å; L61-L65 HydrophobicContact CD2-CD1 4.4Å; L61-L65 HydrophobicContact CG-CD1 3.75Å; L61-L65 HydrophobicContact CG-CG 4.32Å; L61-L65 WeakPolarHBondContact O-CB 3.43Å; L61-L65 VanDerWaalsContact O-CG 3.31Å; L61-L65 WeakPolarHBondContact O-CG 3.26Å; L61-L65 PolarHBondContact O-N 3.04Å; A62-L65 PolarHBondContact O-N 2.86Å
66F95.8Very high96.6Very high96 Ų9657 Ų5742%0.42129%0.285SS..SBendtrans-96.3143.4-172.9-73-92.2000112.4A62 V74A62-F66 HydrophobicContact CB-CD2 4.11Å; A62-F66 HydrophobicContact CB-CE2 4.49Å; A62-F66 WeakPolarHBondContact O-CB 3.2Å; A62-F66 WeakPolarHBondContact O-CD2 3.18Å; A62-F66 PolarHBondContact O-N 2.81Å; F66-V74 HydrophobicContact CD1-CG2 3.86Å; F66-V74 HydrophobicContact CD2-CG1 4.29Å; F66-V74 HydrophobicContact CD2-CG2 4.42Å; F66-V74 HydrophobicContact CE1-CG2 4Å; F66-V74 HydrophobicContact CE2-CG1 4.18Å; F66-V74 HydrophobicContact CG-CG2 4.08Å; F66-V74 HydrophobicContact CZ-CG2 4.34Å
67P96.1Very high96.6Very high68 Ų6862.1 Ų62.144%0.44232%0.316SS..  trans-59.3141.5172.3-24.134.2000112.6R69 F70 L71P67-R69 HydrophobicContact CB-CG 4.06Å; P67-R69 PolarHBondContact O-N 2.88Å; P67-F70 PolarHBondContact O-N 3.38Å; P67-L71 PolarHBondContact O-N 2.94Å
68E94.6Very high96.7Very high66 Ų6662 Ų6231%0.30831%0.305SS..Hα-helixtrans-50.5-36.4-178.6-62.7176.6169.100113F70 L71 I119 W123E68-F70 PolarHBondContact O-N 2.91Å; E68-L71 PolarHBondContact O-N 3.34Å; E68-I119 HydrophobicContact CB-CG2 3.95Å; E68-I119 HydrophobicContact CG-CG2 3.76Å; E68-W123 HydrophobicContact CB-CB 3.82Å; E68-W123 HydrophobicContact CB-CG 3.98Å; E68-W123 WeakPolarHBondContact OE2-CB 3.33Å
69R94.3Very high96.7Very high128 Ų12859.9 Ų59.948%0.48329%0.292SS..Hα-helixtrans-59.7-27.8177.867.6176.7177.51790.8114.8P67 H72 W123P67-R69 HydrophobicContact CB-CG 4.06Å; P67-R69 PolarHBondContact O-N 2.88Å; R69-H72 PolarHBondContact O-CE1 3.36Å; R69-W123 HydrophobicContact CB-CD2 3.95Å; R69-W123 HydrophobicContact CB-CE3 3.82Å; R69-W123 HydrophobicContact CB-CH2 3.67Å; R69-W123 HydrophobicContact CB-CZ2 3.76Å; R69-W123 HydrophobicContact CB-CZ3 3.69Å; R69-W123 HydrophobicContact CG-CZ2 4.37Å
70F95.3Very high96.7Very high93 Ų9360.8 Ų60.841%0.40830%0.296SS..Hα-helixtrans-112.6-9.6-176.1-65.3-51.9000113.7P67 E68 H72 Y73 V74P67-F70 PolarHBondContact O-N 3.38Å; E68-F70 PolarHBondContact O-N 2.91Å; F70-H72 PolarHBondContact O-N 3.41Å; F70-H72 VanDerWaalsContact O-N 3.15Å; F70-Y73 HydrophobicContact CD1-CD2 4.15Å; F70-Y73 HydrophobicContact CD1-CE2 4.31Å; F70-Y73 PolarHBondContact O-N 3.08Å; F70-V74 PolarHBondContact O-N 3.26Å
71L96.6Very high96.7Very high0 Ų062 Ų620%031%0.312CS..Hα-helixtrans-52.7-40.8-174.9-179.362.9000113F63 P67 E68 Y73 V74 A75 I119F63-L71 HydrophobicContact CB-CD1 4.29Å; F63-L71 HydrophobicContact CB-CD2 4.46Å; F63-L71 HydrophobicContact CD2-CD2 3.69Å; P67-L71 PolarHBondContact O-N 2.94Å; E68-L71 PolarHBondContact O-N 3.34Å; L71-Y73 VanDerWaalsContact C-N 3.35Å; L71-Y73 PolarHBondContact O-N 3.15Å; L71-V74 PolarHBondContact O-N 3Å; L71-A75 VanDerWaalsContact O-CB 3.29Å; L71-A75 WeakPolarHBondContact O-CB 3.34Å; L71-A75 PolarHBondContact O-N 3.31Å; L71-I119 HydrophobicContact CD2-CB 4.27Å; L71-I119 HydrophobicContact CD2-CD1 3.84Å; L71-I119 HydrophobicContact CD2-CG2 4.02Å
72H95.9Very high96.7Very high24 Ų2458 Ų5811%0.11129%0.29CS..Hα-helixtrans-65.5-33.5-178.562.7-83.7000113.5R69 F70 V76 S116 F117R69-H72 PolarHBondContact O-CE1 3.36Å; F70-H72 PolarHBondContact O-N 3.41Å; F70-H72 VanDerWaalsContact O-N 3.15Å; H72-V76 WeakPolarHBondContact O-CB 3.24Å; H72-V76 WeakPolarHBondContact O-CG2 3.33Å; H72-V76 PolarHBondContact O-N 3.47Å; H72-S116 WeakPolarHBondContact CA-OG 3.28Å; H72-F117 HydrophobicContact CB-CD1 3.78Å; H72-F117 HydrophobicContact CB-CD2 4.27Å; H72-F117 HydrophobicContact CB-CE1 3.86Å; H72-F117 HydrophobicContact CB-CE2 4.32Å; H72-F117 HydrophobicContact CB-CG 4Å; H72-F117 HydrophobicContact CB-CZ 4.13Å; H72-F117 AromaticContact CD2-CD1 3.96Å; H72-F117 AromaticContact CD2-CE1 3.39Å; H72-F117 WeakPolarHBondContact CD2-CE1 3.44Å; H72-F117 AromaticContact CD2-CZ 3.94Å; H72-F117 AromaticContact CG-CD1 3.93Å; H72-F117 AromaticContact CG-CE1 3.8Å
73Y96.7Very high96.8Very high150 Ų15057.5 Ų57.559%0.58829%0.286SS*.Hα-helixtrans-66.1-45.5173.3-63.2-67.7000111.1F70 L71 V76 V77F70-Y73 HydrophobicContact CD1-CD2 4.15Å; F70-Y73 HydrophobicContact CD1-CE2 4.31Å; F70-Y73 PolarHBondContact O-N 3.08Å; L71-Y73 VanDerWaalsContact C-N 3.35Å; L71-Y73 PolarHBondContact O-N 3.15Å; Y73-V76 PolarHBondContact O-N 3.45Å; Y73-V77 WeakPolarHBondContact O-CG2 3.19Å; Y73-V77 PolarHBondContact O-N 3.27Å; Y73-V77 VanDerWaalsContact O-N 3.1Å
74V97.4Very high96.7Very high39 Ų3956.2 Ų56.224%0.23628%0.282CS..Hα-helixtrans-63.1-44.9178.4-178.90000110.6A62 F66 F70 L71 V77 W78A62-V74 HydrophobicContact CB-CG1 4Å; F66-V74 HydrophobicContact CD1-CG2 3.86Å; F66-V74 HydrophobicContact CD2-CG1 4.29Å; F66-V74 HydrophobicContact CD2-CG2 4.42Å; F66-V74 HydrophobicContact CE1-CG2 4Å; F66-V74 HydrophobicContact CE2-CG1 4.18Å; F66-V74 HydrophobicContact CG-CG2 4.08Å; F66-V74 HydrophobicContact CZ-CG2 4.34Å; F70-V74 PolarHBondContact O-N 3.26Å; L71-V74 PolarHBondContact O-N 3Å; V74-V77 PolarHBondContact O-N 2.87Å; V74-W78 WeakPolarHBondContact O-CB 3.46Å; V74-W78 PolarHBondContact O-N 2.94Å
75A98Very high96.8Very high1 Ų154 Ų541%0.00827%0.269CS..Hα-helixtrans-62.4-43.8178.400000112.6F59 L71 W78 C79 S116F59-A75 HydrophobicContact CD2-CB 3.99Å; F59-A75 HydrophobicContact CE2-CB 3.6Å; L71-A75 VanDerWaalsContact O-CB 3.29Å; L71-A75 WeakPolarHBondContact O-CB 3.34Å; L71-A75 PolarHBondContact O-N 3.31Å; A75-W78 PolarHBondContact O-N 3.5Å; A75-C79 WeakPolarHBondContact O-CB 3.44Å; A75-C79 PolarHBondContact O-N 2.95Å; A75-C79 PolarHBondContact O-SG 3.5Å; A75-C79 VanDerWaalsContact O-SG 3.34Å; A75-S116 WeakPolarHBondContact CB-OG 3.41Å
76V97.8Very high96.8Very high33 Ų3348.4 Ų48.420%0.224%0.24CC..Hα-helixtrans-61.3-48.1176.9168.10000110.5H72 Y73 F80 I113 F117 F383H72-V76 WeakPolarHBondContact O-CB 3.24Å; H72-V76 WeakPolarHBondContact O-CG2 3.33Å; H72-V76 PolarHBondContact O-N 3.47Å; Y73-V76 PolarHBondContact O-N 3.45Å; V76-F80 HydrophobicContact CG1-CD2 3.88Å; V76-F80 HydrophobicContact CG1-CE2 4.33Å; V76-F80 WeakPolarHBondContact O-CB 3.31Å; V76-F80 PolarHBondContact O-N 3.48Å; V76-I113 HydrophobicContact CG2-CD1 4.42Å; V76-I113 HydrophobicContact CG2-CG1 4.41Å; V76-I113 HydrophobicContact CG2-CG2 3.78Å; V76-F117 HydrophobicContact CG2-CE2 3.94Å; V76-F117 HydrophobicContact CG2-CZ 4.28Å; V76-F383 HydrophobicContact CG2-CZ 4.19Å
77V98Very high96.7Very high111 Ų11145.4 Ų45.467%0.67323%0.225SC*.Hα-helixtrans-62.4-47.1178.91730000111.1Y73 V74 G81Y73-V77 WeakPolarHBondContact O-CG2 3.19Å; Y73-V77 PolarHBondContact O-N 3.27Å; Y73-V77 VanDerWaalsContact O-N 3.1Å; V74-V77 PolarHBondContact O-N 2.87Å; V77-G81 WeakPolarHBondContact O-CA 3.33Å; V77-G81 PolarHBondContact O-N 3.3Å
78W98.1Very high96.6Very high67 Ų6743.9 Ų43.925%0.25422%0.215SC..Hα-helixtrans-65.9-55.7-179.7171.6-114.4000112.4L54 T55 V58 V74 A75 G81 Y82L54-W78 HydrophobicContact CG-CH2 4.47Å; L54-W78 HydrophobicContact CG-CZ2 4.37Å; T55-W78 PolarHBondContact O-NE1 3.3Å; V58-W78 HydrophobicContact CB-CD2 4.14Å; V58-W78 HydrophobicContact CB-CH2 3.99Å; V58-W78 HydrophobicContact CB-CZ2 3.33Å; V58-W78 HydrophobicContact CG1-CD2 3.55Å; V58-W78 HydrophobicContact CG1-CE3 3.89Å; V58-W78 HydrophobicContact CG1-CG 4.1Å; V58-W78 HydrophobicContact CG1-CH2 3.94Å; V58-W78 HydrophobicContact CG1-CZ2 3.6Å; V58-W78 HydrophobicContact CG1-CZ3 4.07Å; V58-W78 HydrophobicContact CG2-CH2 3.79Å; V58-W78 HydrophobicContact CG2-CZ2 3.5Å; V74-W78 WeakPolarHBondContact O-CB 3.46Å; V74-W78 PolarHBondContact O-N 2.94Å; A75-W78 PolarHBondContact O-N 3.5Å; W78-G81 PolarHBondContact O-N 3.12Å; W78-Y82 AromaticContact CH2-CD2 3.73Å; W78-Y82 HydrophobicContact CH2-CD2 3.73Å; W78-Y82 HydrophobicContact CH2-CE2 4.38Å; W78-Y82 HydrophobicContact CH2-CG 4.32Å; W78-Y82 HydrophobicContact CZ2-CD2 4.03Å; W78-Y82 HydrophobicContact CZ2-CG 4.24Å; W78-Y82 HydrophobicContact CZ3-CD2 4.33Å; W78-Y82 WeakPolarHBondContact O-CB 3.04Å; W78-Y82 PolarHBondContact O-N 3.46Å
79C98.3Very high96.6Very high0 Ų040.7 Ų40.70%020%0.2CC..Hα-helixtrans-67.7-42-172.8-65.70000111.7A75 L83 T109 I113A75-C79 WeakPolarHBondContact O-CB 3.44Å; A75-C79 PolarHBondContact O-N 2.95Å; A75-C79 PolarHBondContact O-SG 3.5Å; A75-C79 VanDerWaalsContact O-SG 3.34Å; C79-L83 VanDerWaalsContact O-CB 3.24Å; C79-L83 WeakPolarHBondContact O-CB 3.33Å; C79-L83 PolarHBondContact O-N 2.67Å; C79-T109 HydrophobicContact CB-CG2 4.03Å; C79-I113 HydrophobicContact CB-CD1 3.9Å; C79-I113 HydrophobicContact CB-CG1 3.78Å
80F98.2Very high96.5Very high19 Ų1937.9 Ų37.98%0.08319%0.192CC..Hα-helixtrans-73.4-40.7174.4-78.5-43.7000112.8V76 Y82 L83 G84 T109 I113 W378 F383 V401 Y404 W405V76-F80 HydrophobicContact CG1-CD2 3.88Å; V76-F80 HydrophobicContact CG1-CE2 4.33Å; V76-F80 WeakPolarHBondContact O-CB 3.31Å; V76-F80 PolarHBondContact O-N 3.48Å; F80-Y82 VanDerWaalsContact C-N 3.32Å; F80-Y82 PolarHBondContact O-N 3.23Å; F80-L83 HydrophobicContact CD1-CD2 4.22Å; F80-L83 PolarHBondContact O-N 3.33Å; F80-G84 PolarHBondContact O-N 2.95Å; F80-T109 HydrophobicContact CD1-CG2 3.9Å; F80-T109 HydrophobicContact CE1-CG2 3.94Å; F80-I113 HydrophobicContact CD1-CD1 4.41Å; F80-I113 HydrophobicContact CD2-CD1 3.98Å; F80-I113 HydrophobicContact CE1-CD1 4.3Å; F80-I113 HydrophobicContact CE2-CD1 3.87Å; F80-I113 HydrophobicContact CG-CD1 4.25Å; F80-I113 HydrophobicContact CZ-CD1 4.04Å; F80-W378 HydrophobicContact CE2-CH2 4.48Å; F80-W378 AromaticContact CZ-CH2 3.89Å; F80-W378 HydrophobicContact CZ-CH2 3.89Å; F80-F383 HydrophobicContact CE2-CE1 4.16Å; F80-F383 AromaticContact CE2-CZ 3.71Å; F80-F383 HydrophobicContact CE2-CZ 3.71Å; F80-F383 HydrophobicContact CZ-CZ 4.35Å; F80-V401 HydrophobicContact CE2-CG1 4.06Å; F80-V401 HydrophobicContact CZ-CG1 3.84Å; F80-Y404 HydrophobicContact CB-CD1 4.31Å; F80-Y404 HydrophobicContact CB-CE1 3.75Å; F80-Y404 AromaticContact CD1-CD1 3.87Å; F80-Y404 HydrophobicContact CD1-CD1 3.87Å; F80-Y404 HydrophobicContact CD1-CE1 4Å; F80-Y404 HydrophobicContact CE1-CD1 4.42Å; F80-Y404 HydrophobicContact CG-CD1 4.19Å; F80-Y404 HydrophobicContact CG-CE1 4.11Å; F80-Y404 WeakPolarHBondContact O-CE1 3.32Å; F80-Y404 PolarHBondContact O-OH 2.96Å; F80-Y404 VanDerWaalsContact O-OH 3.14Å; F80-W405 HydrophobicContact CE1-CB 4.05Å
81G97.5Very high96.4Very high41 Ų4142.1 Ų42.142%0.42321%0.207SC..Hα-helixtrans-59-44.9176.400000111.8V77 W78 G84 F85V77-G81 WeakPolarHBondContact O-CA 3.33Å; V77-G81 PolarHBondContact O-N 3.3Å; W78-G81 PolarHBondContact O-N 3.12Å; G81-G84 PolarHBondContact O-N 3.24Å; G81-F85 PolarHBondContact O-N 3.39Å
82Y97.8Very high96.3Very high12 Ų1248.6 Ų48.65%0.04724%0.235CC..Hα-helixtrans-69.6-35.6175.9-167-93.4000112.6W50 H51 L54 T55 W78 F80 G84 F85 F86W50-Y82 WeakPolarHBondContact CZ3-OH 3.39Å; H51-Y82 WeakPolarHBondContact CA-OH 3.38Å; H51-Y82 HydrophobicContact CB-CE1 4.11Å; H51-Y82 AromaticContact ND1-CZ 3.83Å; H51-Y82 PolarHBondContact ND1-OH 2.93Å; H51-Y82 WeakPolarHBondContact O-CE1 3.46Å; L54-Y82 HydrophobicContact CD2-CE2 3.57Å; L54-Y82 HydrophobicContact CG-CE2 4.27Å; T55-Y82 WeakPolarHBondContact OG1-CD1 3.31Å; T55-Y82 WeakPolarHBondContact OG1-CE1 3.45Å; W78-Y82 AromaticContact CH2-CD2 3.73Å; W78-Y82 HydrophobicContact CH2-CD2 3.73Å; W78-Y82 HydrophobicContact CH2-CE2 4.38Å; W78-Y82 HydrophobicContact CH2-CG 4.32Å; W78-Y82 HydrophobicContact CZ2-CD2 4.03Å; W78-Y82 HydrophobicContact CZ2-CG 4.24Å; W78-Y82 HydrophobicContact CZ3-CD2 4.33Å; W78-Y82 WeakPolarHBondContact O-CB 3.04Å; W78-Y82 PolarHBondContact O-N 3.46Å; F80-Y82 VanDerWaalsContact C-N 3.32Å; F80-Y82 PolarHBondContact O-N 3.23Å; Y82-G84 VanDerWaalsContact C-N 3.29Å; Y82-G84 PolarHBondContact O-N 3.34Å; Y82-F85 HydrophobicContact CD2-CD1 4.08Å; Y82-F85 AromaticContact CE2-CD1 3.72Å; Y82-F85 HydrophobicContact CE2-CD1 3.72Å; Y82-F85 HydrophobicContact CE2-CE1 4.1Å; Y82-F85 PolarHBondContact O-N 3.37Å; Y82-F86 HydrophobicContact CE1-CB 4.46Å; Y82-F86 WeakPolarHBondContact O-CB 3.47Å; Y82-F86 PolarHBondContact O-N 2.95Å
83L97.3Very high96.1Very high0 Ų050.9 Ų50.90%027%0.265CS..Hα-helixtrans-61.8-38.5172.5-176.666.4000111.7C79 F80 F86 R87 Q105 T109C79-L83 VanDerWaalsContact O-CB 3.24Å; C79-L83 WeakPolarHBondContact O-CB 3.33Å; C79-L83 PolarHBondContact O-N 2.67Å; F80-L83 HydrophobicContact CD1-CD2 4.22Å; F80-L83 PolarHBondContact O-N 3.33Å; L83-F86 HydrophobicContact CD1-CD1 4.42Å; L83-R87 WeakPolarHBondContact O-CG 3.43Å; L83-R87 PolarHBondContact O-N 3.12Å; L83-Q105 HydrophobicContact CD1-CB 4.48Å; L83-Q105 HydrophobicContact CD1-CG 3.76Å; L83-T109 HydrophobicContact CD2-CG2 4.17Å
84G96.5Very high95.8Very high7 Ų748 Ų487%0.07226%0.256CS..Hα-helixtrans-60.1-54.1171.300000111.4F80 G81 Y82 F86 R87 T88F80-G84 PolarHBondContact O-N 2.95Å; G81-G84 PolarHBondContact O-N 3.24Å; Y82-G84 VanDerWaalsContact C-N 3.29Å; Y82-G84 PolarHBondContact O-N 3.34Å; G84-F86 VanDerWaalsContact C-N 3.34Å; G84-F86 PolarHBondContact O-N 3.2Å; G84-R87 PolarHBondContact O-N 3.16Å; G84-R87 VanDerWaalsContact O-N 3.17Å; G84-T88 PolarHBondContact O-N 3.45Å; G84-T88 PolarHBondContact O-OG1 3.21Å; G84-T88 VanDerWaalsContact O-OG1 3.05Å
85F96.2Very high95.5Very high61 Ų6150 Ų5027%0.26827%0.271SS..Hα-helixtrans-54.2-48.7175.4168.8-103.1000111.9W50 G81 Y82 R87 T88 C89 F92 F94W50-F85 HydrophobicContact CH2-CE1 4.46Å; G81-F85 PolarHBondContact O-N 3.39Å; Y82-F85 HydrophobicContact CD2-CD1 4.08Å; Y82-F85 AromaticContact CE2-CD1 3.72Å; Y82-F85 HydrophobicContact CE2-CD1 3.72Å; Y82-F85 HydrophobicContact CE2-CE1 4.1Å; Y82-F85 PolarHBondContact O-N 3.37Å; F85-R87 PolarHBondContact O-N 3.16Å; F85-T88 WeakPolarHBondContact CA-OG1 3.32Å; F85-T88 CarbonylContact O-C 3.59Å; F85-T88 VanDerWaalsContact O-C 3.31Å; F85-T88 WeakPolarHBondContact O-CA 3.4Å; F85-T88 PolarHBondContact O-N 3Å; F85-T88 PolarHBondContact O-OG1 3.41Å; F85-T88 VanDerWaalsContact O-OG1 3.07Å; F85-C89 HydrophobicContact CE1-CB 4.15Å; F85-C89 HydrophobicContact CE2-CB 4.28Å; F85-C89 HydrophobicContact CZ-CB 3.97Å; F85-C89 WeakPolarHBondContact O-CA 3.44Å; F85-C89 WeakPolarHBondContact O-CB 3.39Å; F85-C89 PolarHBondContact O-N 3.19Å; F85-F92 HydrophobicContact CD2-CD2 4.19Å; F85-F92 HydrophobicContact CD2-CE2 4.25Å; F85-F92 AromaticContact CE2-CD2 3.94Å; F85-F92 HydrophobicContact CE2-CD2 3.94Å; F85-F92 HydrophobicContact CE2-CE2 4.43Å; F85-F92 HydrophobicContact CE2-CG 4.29Å; F85-F94 HydrophobicContact CE2-CE2 4.46Å; F85-F94 HydrophobicContact CZ-CD2 4.11Å; F85-F94 AromaticContact CZ-CE2 3.84Å; F85-F94 HydrophobicContact CZ-CE2 3.84Å; F85-F94 HydrophobicContact CZ-CZ 4.47Å
86F96.1Very high95.1Very high1 Ų157.3 Ų57.30%0.00431%0.305CS..Hα-helixtrans-54.4-36.5180172.4-94000112.5H51 Y82 L83 G84 C89 V97 A101 N102 Q105H51-F86 HydrophobicContact CB-CD2 3.62Å; H51-F86 HydrophobicContact CB-CE2 3.73Å; H51-F86 AromaticContact CD2-CD2 3.9Å; H51-F86 AromaticContact CD2-CE2 3.77Å; H51-F86 AromaticContact CG-CD2 3.5Å; H51-F86 AromaticContact CG-CE2 3.72Å; H51-F86 AromaticContact ND1-CD2 3.67Å; Y82-F86 HydrophobicContact CE1-CB 4.46Å; Y82-F86 WeakPolarHBondContact O-CB 3.47Å; Y82-F86 PolarHBondContact O-N 2.95Å; L83-F86 HydrophobicContact CD1-CD1 4.42Å; G84-F86 VanDerWaalsContact C-N 3.34Å; G84-F86 PolarHBondContact O-N 3.2Å; F86-C89 PolarHBondContact O-SG 3.23Å; F86-V97 HydrophobicContact CD1-CG1 4.29Å; F86-V97 HydrophobicContact CD1-CG2 4.45Å; F86-V97 HydrophobicContact CD2-CG1 3.82Å; F86-V97 HydrophobicContact CE1-CB 3.91Å; F86-V97 HydrophobicContact CE1-CG1 3.88Å; F86-V97 HydrophobicContact CE1-CG2 3.75Å; F86-V97 HydrophobicContact CE2-CB 4Å; F86-V97 HydrophobicContact CE2-CG1 3.41Å; F86-V97 VanDerWaalsContact CE2-CG1 3.41Å; F86-V97 HydrophobicContact CG-CG1 4.25Å; F86-V97 HydrophobicContact CZ-CB 3.52Å; F86-V97 HydrophobicContact CZ-CG1 3.44Å; F86-V97 VanDerWaalsContact CZ-CG1 3.44Å; F86-V97 HydrophobicContact CZ-CG2 3.92Å; F86-V97 WeakPolarHBondContact O-CG1 3.45Å; F86-A101 HydrophobicContact CZ-CB 4.06Å; F86-N102 HydrophobicContact CE1-CB 4.04Å; F86-N102 HydrophobicContact CZ-CB 4.48Å; F86-Q105 HydrophobicContact CD1-CB 4.23Å; F86-Q105 HydrophobicContact CD1-CG 3.89Å; F86-Q105 HydrophobicContact CD2-CG 4.14Å; F86-Q105 HydrophobicContact CE1-CB 3.94Å; F86-Q105 HydrophobicContact CE1-CG 4.11Å; F86-Q105 HydrophobicContact CE2-CB 4.29Å; F86-Q105 HydrophobicContact CE2-CG 4.32Å; F86-Q105 HydrophobicContact CG-CG 3.91Å; F86-Q105 HydrophobicContact CZ-CB 3.95Å; F86-Q105 HydrophobicContact CZ-CG 4.3Å
87R93.9Very high94.7Very high32 Ų3257.1 Ų57.112%0.12131%0.305CS..Hα-helixtrans-79.2-24.8177.1-70179.3175.6140.2-0.7113.4L83 G84 F85 H90 L106 Y404 W405 H406 G407 L408L83-R87 WeakPolarHBondContact O-CG 3.43Å; L83-R87 PolarHBondContact O-N 3.12Å; G84-R87 PolarHBondContact O-N 3.16Å; G84-R87 VanDerWaalsContact O-N 3.17Å; F85-R87 PolarHBondContact O-N 3.16Å; R87-H90 PolarHBondContact O-CE1 3.28Å; R87-H90 PolarHBondContact O-ND1 3.18Å; R87-L106 VanDerWaalsContact NH2-CD1 3.27Å; R87-Y404 PolarHBondContact NH1-O 3.48Å; R87-W405 VanDerWaalsContact CZ-O 3.22Å; R87-W405 PolarHBondContact NH1-O 3.27Å; R87-W405 PolarHBondContact NH2-O 2.78Å; R87-H406 VanDerWaalsContact CZ-O 3.26Å; R87-H406 PolarHBondContact NH2-O 3.17Å; R87-G407 VanDerWaalsContact NH1-CA 3.31Å; R87-L408 HydrophobicContact CB-CD1 4.34Å
88T94.9Very high94.4Very high36 Ų3654.2 Ų54.222%0.22129%0.287CS..Hα-helixtrans-102.11.917954.70000113.9G84 F85 H90 Y91 F92 L408G84-T88 PolarHBondContact O-N 3.45Å; G84-T88 PolarHBondContact O-OG1 3.21Å; G84-T88 VanDerWaalsContact O-OG1 3.05Å; F85-T88 WeakPolarHBondContact CA-OG1 3.32Å; F85-T88 CarbonylContact O-C 3.59Å; F85-T88 VanDerWaalsContact O-C 3.31Å; F85-T88 WeakPolarHBondContact O-CA 3.4Å; F85-T88 PolarHBondContact O-N 3Å; F85-T88 PolarHBondContact O-OG1 3.41Å; F85-T88 VanDerWaalsContact O-OG1 3.07Å; T88-H90 PolarHBondContact O-N 2.93Å; T88-Y91 HydrophobicContact CG2-CD2 4.23Å; T88-Y91 HydrophobicContact CG2-CE2 4.45Å; T88-Y91 WeakPolarHBondContact O-CB 3.42Å; T88-Y91 PolarHBondContact O-N 3.06Å; T88-F92 VanDerWaalsContact O-CD2 3.31Å; T88-F92 WeakPolarHBondContact O-CD2 3.4Å; T88-L408 HydrophobicContact CG2-CD1 3.6Å
89C93.8Very high94.1Very high0 Ų053.7 Ų53.70%029%0.292CS..G310 helixtrans-61.1-27.8-168.865.60000112.5F85 F86 Y91 F92 G93 F94F85-C89 HydrophobicContact CE1-CB 4.15Å; F85-C89 HydrophobicContact CE2-CB 4.28Å; F85-C89 HydrophobicContact CZ-CB 3.97Å; F85-C89 WeakPolarHBondContact O-CA 3.44Å; F85-C89 WeakPolarHBondContact O-CB 3.39Å; F85-C89 PolarHBondContact O-N 3.19Å; F86-C89 PolarHBondContact O-SG 3.23Å; C89-Y91 VanDerWaalsContact C-N 3.27Å; C89-Y91 PolarHBondContact O-N 2.99Å; C89-F92 CarbonylContact O-C 3.53Å; C89-F92 WeakPolarHBondContact O-CA 3.34Å; C89-F92 WeakPolarHBondContact O-CB 3.46Å; C89-F92 PolarHBondContact O-N 2.88Å; C89-G93 PolarHBondContact O-N 3.42Å; C89-F94 HydrophobicContact CB-CB 3.96Å; C89-F94 HydrophobicContact CB-CD2 4.16Å; C89-F94 HydrophobicContact CB-CG 4.29Å; C89-F94 WeakPolarHBondContact O-CB 3.48Å; C89-F94 WeakPolarHBondContact O-CD2 3.22Å; C89-F94 PolarHBondContact O-N 3.01Å
90H92.9Very high93.9Very high69 Ų6953.9 Ų53.932%0.31929%0.294SS..G310 helixtrans-64.1-28.3175.866.4-80.5000113.8R87 T88 F92 G93 F94R87-H90 PolarHBondContact O-CE1 3.28Å; R87-H90 PolarHBondContact O-ND1 3.18Å; T88-H90 PolarHBondContact O-N 2.93Å; H90-F92 PolarHBondContact O-N 3.48Å; H90-G93 PolarHBondContact O-N 3.29Å; H90-F94 VanDerWaalsContact CA-O 3.27Å; H90-F94 WeakPolarHBondContact CA-O 3.43Å
91Y93.6Very high93.8Very high181 Ų18153 Ų5371%0.7129%0.29SS*.G310 helixtrans-70.2-16.8170.6-61.3-57.7000112.9T88 C89T88-Y91 HydrophobicContact CG2-CD2 4.23Å; T88-Y91 HydrophobicContact CG2-CE2 4.45Å; T88-Y91 WeakPolarHBondContact O-CB 3.42Å; T88-Y91 PolarHBondContact O-N 3.06Å; C89-Y91 VanDerWaalsContact C-N 3.27Å; C89-Y91 PolarHBondContact O-N 2.99Å
92F93.5Very high93.7Very high136 Ų13653.1 Ų53.160%0.59628%0.281SS*.G310 helixtrans-100.514.4175.4-57.5-85.4000112.5F85 T88 C89 H90 F94F85-F92 HydrophobicContact CD2-CD2 4.19Å; F85-F92 HydrophobicContact CD2-CE2 4.25Å; F85-F92 AromaticContact CE2-CD2 3.94Å; F85-F92 HydrophobicContact CE2-CD2 3.94Å; F85-F92 HydrophobicContact CE2-CE2 4.43Å; F85-F92 HydrophobicContact CE2-CG 4.29Å; T88-F92 VanDerWaalsContact O-CD2 3.31Å; T88-F92 WeakPolarHBondContact O-CD2 3.4Å; C89-F92 CarbonylContact O-C 3.53Å; C89-F92 WeakPolarHBondContact O-CA 3.34Å; C89-F92 WeakPolarHBondContact O-CB 3.46Å; C89-F92 PolarHBondContact O-N 2.88Å; H90-F92 PolarHBondContact O-N 3.48Å; F92-F94 HydrophobicContact CB-CD2 4.14Å; F92-F94 HydrophobicContact CB-CE2 4.33Å
93G92Very high93.5Very high72 Ų7254.7 Ų54.774%0.74229%0.289SS*.THydrogen-bonded Turntrans86.35.1176.500000115.6C89 H90C89-G93 PolarHBondContact O-N 3.42Å; H90-G93 PolarHBondContact O-N 3.29Å
94F91Very high93.5Very high89 Ų8954.7 Ų54.739%0.3929%0.289SS..PPolyproline II helixtrans-79163.2171.3-65.7-89.2000111.4W50 F85 C89 H90 F92W50-F94 HydrophobicContact CH2-CE1 4.22Å; W50-F94 AromaticContact CZ2-CD1 3.88Å; W50-F94 HydrophobicContact CZ2-CD1 3.88Å; W50-F94 AromaticContact CZ2-CE1 3.83Å; W50-F94 HydrophobicContact CZ2-CE1 3.83Å; F85-F94 HydrophobicContact CE2-CE2 4.46Å; F85-F94 HydrophobicContact CZ-CD2 4.11Å; F85-F94 AromaticContact CZ-CE2 3.84Å; F85-F94 HydrophobicContact CZ-CE2 3.84Å; F85-F94 HydrophobicContact CZ-CZ 4.47Å; C89-F94 HydrophobicContact CB-CB 3.96Å; C89-F94 HydrophobicContact CB-CD2 4.16Å; C89-F94 HydrophobicContact CB-CG 4.29Å; C89-F94 WeakPolarHBondContact O-CB 3.48Å; C89-F94 WeakPolarHBondContact O-CD2 3.22Å; C89-F94 PolarHBondContact O-N 3.01Å; H90-F94 VanDerWaalsContact CA-O 3.27Å; H90-F94 WeakPolarHBondContact CA-O 3.43Å; F92-F94 HydrophobicContact CB-CD2 4.14Å; F92-F94 HydrophobicContact CB-CE2 4.33Å
95S90Very high93.5Very high81 Ų8154.4 Ų54.457%0.56629%0.286SS*.PPolyproline II helixtrans-63.5145.617155.40000111.2V97S95-V97 PolarHBondContact O-N 3.46Å
96Q89.4Confident93.5Very high155 Ų15552.6 Ų52.672%0.72428%0.279SS*.PPolyproline II helixtrans-60.1137.1169.7-172.1173.8-2.400110.2
97V90Very high93.6Very high30 Ų3053.1 Ų53.118%0.18228%0.282CS..PPolyproline II helixtrans-71.2138.3-176.1-62.30000111F86 S95F86-V97 HydrophobicContact CD1-CG1 4.29Å; F86-V97 HydrophobicContact CD1-CG2 4.45Å; F86-V97 HydrophobicContact CD2-CG1 3.82Å; F86-V97 HydrophobicContact CE1-CB 3.91Å; F86-V97 HydrophobicContact CE1-CG1 3.88Å; F86-V97 HydrophobicContact CE1-CG2 3.75Å; F86-V97 HydrophobicContact CE2-CB 4Å; F86-V97 HydrophobicContact CE2-CG1 3.41Å; F86-V97 VanDerWaalsContact CE2-CG1 3.41Å; F86-V97 HydrophobicContact CG-CG1 4.25Å; F86-V97 HydrophobicContact CZ-CB 3.52Å; F86-V97 HydrophobicContact CZ-CG1 3.44Å; F86-V97 VanDerWaalsContact CZ-CG1 3.44Å; F86-V97 HydrophobicContact CZ-CG2 3.92Å; F86-V97 WeakPolarHBondContact O-CG1 3.45Å; S95-V97 PolarHBondContact O-N 3.46Å
98T91.8Very high93.7Very high50 Ų5051.7 Ų51.731%0.30728%0.277SS..PPolyproline II helixtrans-71.5153.9176.366.90000110.7V100 A101 N102T98-V100 VanDerWaalsContact C-N 3.25Å; T98-V100 PolarHBondContact O-N 3.15Å; T98-A101 PolarHBondContact O-N 2.96Å; T98-A101 VanDerWaalsContact O-N 3.13Å; T98-A101 WeakPolarHBondContact OG1-CB 3.36Å; T98-A101 PolarHBondContact OG1-N 2.89Å; T98-N102 PolarHBondContact O-N 3.44Å
99P92Very high93.9Very high55 Ų5550 Ų5036%0.35727%0.266SS..Hα-helixtrans-54.4-41.9176.4-28.936.9000112.8Y8 N102 I103Y8-P99 PolarHBondContact OH-O 3.4Å; P99-N102 PolarHBondContact O-N 2.97Å; P99-I103 PolarHBondContact O-N 3.43Å
100V93.8Very high94.1Very high5 Ų550 Ų503%0.0327%0.267CS..Hα-helixtrans-62.7-45.2178179.30000111I7 Y8 I11 F41 F44 A45 T98 N102 I103 V104 F169I7-V100 HydrophobicContact CG2-CG2 3.93Å; Y8-V100 HydrophobicContact CE1-CG2 4.28Å; Y8-V100 WeakPolarHBondContact OH-CA 3.44Å; Y8-V100 PolarHBondContact OH-N 3.29Å; I11-V100 HydrophobicContact CD1-CG1 4.47Å; F41-V100 HydrophobicContact CD2-CG1 4.33Å; F44-V100 HydrophobicContact CB-CG1 4.03Å; F44-V100 HydrophobicContact CB-CG2 4.47Å; A45-V100 HydrophobicContact CB-CG1 4.46Å; T98-V100 VanDerWaalsContact C-N 3.25Å; T98-V100 PolarHBondContact O-N 3.15Å; V100-N102 VanDerWaalsContact C-N 3.3Å; V100-N102 PolarHBondContact O-N 3.44Å; V100-I103 PolarHBondContact O-N 2.98Å; V100-V104 WeakPolarHBondContact O-CG2 3.46Å; V100-V104 PolarHBondContact O-N 3.38Å; V100-V104 VanDerWaalsContact O-N 3.08Å; V100-F169 HydrophobicContact CG1-CD1 3.97Å; V100-F169 HydrophobicContact CG1-CE1 3.89Å
101A95.6Very high94.3Very high1 Ų146.9 Ų46.91%0.00825%0.252CS..Hα-helixtrans-60.2-40.6174.900000112.1F41 A45 A48 F86 T98 V104 Q105F41-A101 HydrophobicContact CE2-CB 4.3Å; F41-A101 HydrophobicContact CZ-CB 4.38Å; A45-A101 HydrophobicContact CB-CB 4.21Å; A48-A101 HydrophobicContact CB-CB 3.67Å; F86-A101 HydrophobicContact CZ-CB 4.06Å; T98-A101 PolarHBondContact O-N 2.96Å; T98-A101 VanDerWaalsContact O-N 3.13Å; T98-A101 WeakPolarHBondContact OG1-CB 3.36Å; T98-A101 PolarHBondContact OG1-N 2.89Å; A101-V104 PolarHBondContact O-N 3.14Å; A101-Q105 VanDerWaalsContact O-CB 3.27Å; A101-Q105 WeakPolarHBondContact O-CB 3.41Å; A101-Q105 PolarHBondContact O-N 2.99Å
102N95.1Very high94.5Very high42 Ų4238.3 Ų38.323%0.22522%0.218CC..Hα-helixtrans-63.4-43.6178.3179.960.2000112.5F86 T98 P99 V100 Q105 L106F86-N102 HydrophobicContact CE1-CB 4.04Å; F86-N102 HydrophobicContact CZ-CB 4.48Å; T98-N102 PolarHBondContact O-N 3.44Å; P99-N102 PolarHBondContact O-N 2.97Å; V100-N102 VanDerWaalsContact C-N 3.3Å; V100-N102 PolarHBondContact O-N 3.44Å; N102-Q105 PolarHBondContact O-N 3.45Å; N102-L106 WeakPolarHBondContact O-CB 3.29Å; N102-L106 PolarHBondContact O-N 3.24Å
103I94.6Very high94.8Very high45 Ų4531.8 Ų31.823%0.23119%0.19CC..Hα-helixtrans-68.8-40.5178.5-60.4-172.8000111.9Y8 P99 V100 Q105 L106 L107 F169Y8-I103 HydrophobicContact CE1-CD1 3.64Å; Y8-I103 HydrophobicContact CE2-CD1 4.24Å; Y8-I103 VanDerWaalsContact CZ-CD1 3.42Å; Y8-I103 WeakPolarHBondContact OH-CD1 3.34Å; P99-I103 PolarHBondContact O-N 3.43Å; V100-I103 PolarHBondContact O-N 2.98Å; I103-Q105 VanDerWaalsContact C-N 3.35Å; I103-Q105 PolarHBondContact O-N 3.2Å; I103-L106 WeakPolarHBondContact O-CB 3.42Å; I103-L106 PolarHBondContact O-N 3.46Å; I103-L107 HydrophobicContact CG2-CD1 3.64Å; I103-L107 HydrophobicContact CG2-CG 4.38Å; I103-L107 PolarHBondContact O-N 3.24Å; I103-F169 WeakPolarHBondContact CG2-O 3.4Å
104V96.6Very high95.1Very high0 Ų028.4 Ų28.40%015%0.154CC..Hα-helixtrans-61.8-45.2176170.80000110.7F41 V100 A101 L106 L107 L108 L168 F169F41-V104 HydrophobicContact CD1-CG1 4.01Å; F41-V104 HydrophobicContact CD2-CB 4.07Å; F41-V104 HydrophobicContact CD2-CG1 4.15Å; F41-V104 HydrophobicContact CD2-CG2 3.6Å; F41-V104 HydrophobicContact CE1-CB 4.49Å; F41-V104 HydrophobicContact CE1-CG1 3.84Å; F41-V104 HydrophobicContact CE2-CB 3.73Å; F41-V104 HydrophobicContact CE2-CG1 3.95Å; F41-V104 HydrophobicContact CE2-CG2 3.72Å; F41-V104 HydrophobicContact CG-CG1 4.19Å; F41-V104 HydrophobicContact CG-CG2 4.2Å; F41-V104 HydrophobicContact CZ-CB 3.98Å; F41-V104 HydrophobicContact CZ-CG1 3.81Å; F41-V104 HydrophobicContact CZ-CG2 4.43Å; V100-V104 WeakPolarHBondContact O-CG2 3.46Å; V100-V104 PolarHBondContact O-N 3.38Å; V100-V104 VanDerWaalsContact O-N 3.08Å; A101-V104 PolarHBondContact O-N 3.14Å; V104-L106 VanDerWaalsContact C-N 3.32Å; V104-L106 PolarHBondContact O-N 3.23Å; V104-L107 PolarHBondContact O-N 3.15Å; V104-L108 WeakPolarHBondContact O-CB 3.45Å; V104-L108 PolarHBondContact O-N 3.41Å; V104-L168 HydrophobicContact CG1-CD1 3.9Å; V104-L168 HydrophobicContact CG1-CG 4.35Å; V104-L168 HydrophobicContact CG2-CG 4.17Å; V104-F169 HydrophobicContact CG2-CD1 3.69Å; V104-F169 HydrophobicContact CG2-CE1 3.74Å
105Q97.3Very high95.4Very high2 Ų224.1 Ų24.11%0.00914%0.136CC..Hα-helixtrans-63-39177-170.964.431.800111.9T55 L83 F86 A101 N102 I103 T109T55-Q105 PolarHBondContact OG1-NE2 3.47Å; L83-Q105 HydrophobicContact CD1-CB 4.48Å; L83-Q105 HydrophobicContact CD1-CG 3.76Å; F86-Q105 HydrophobicContact CD1-CB 4.23Å; F86-Q105 HydrophobicContact CD1-CG 3.89Å; F86-Q105 HydrophobicContact CD2-CG 4.14Å; F86-Q105 HydrophobicContact CE1-CB 3.94Å; F86-Q105 HydrophobicContact CE1-CG 4.11Å; F86-Q105 HydrophobicContact CE2-CB 4.29Å; F86-Q105 HydrophobicContact CE2-CG 4.32Å; F86-Q105 HydrophobicContact CG-CG 3.91Å; F86-Q105 HydrophobicContact CZ-CB 3.95Å; F86-Q105 HydrophobicContact CZ-CG 4.3Å; A101-Q105 VanDerWaalsContact O-CB 3.27Å; A101-Q105 WeakPolarHBondContact O-CB 3.41Å; A101-Q105 PolarHBondContact O-N 2.99Å; N102-Q105 PolarHBondContact O-N 3.45Å; I103-Q105 VanDerWaalsContact C-N 3.35Å; I103-Q105 PolarHBondContact O-N 3.2Å; Q105-T109 WeakPolarHBondContact O-CB 3.26Å; Q105-T109 PolarHBondContact O-N 3.27Å; Q105-T109 PolarHBondContact O-OG1 3.47Å
106L96.7Very high95.8Very high23 Ų2320.3 Ų20.312%0.1211%0.109CC..Hα-helixtrans-60.8-47.4176.8-175.279000112R87 N102 I103 V104 T109 L110 W405R87-L106 VanDerWaalsContact NH2-CD1 3.27Å; N102-L106 WeakPolarHBondContact O-CB 3.29Å; N102-L106 PolarHBondContact O-N 3.24Å; I103-L106 WeakPolarHBondContact O-CB 3.42Å; I103-L106 PolarHBondContact O-N 3.46Å; V104-L106 VanDerWaalsContact C-N 3.32Å; V104-L106 PolarHBondContact O-N 3.23Å; L106-T109 WeakPolarHBondContact O-CB 3.21Å; L106-L110 PolarHBondContact O-N 2.91Å; L106-W405 HydrophobicContact CD1-CD2 3.83Å; L106-W405 HydrophobicContact CD1-CG 3.91Å; L106-W405 HydrophobicContact CD1-CZ2 3.85Å; L106-W405 WeakPolarHBondContact CD1-O 3.43Å; L106-W405 HydrophobicContact CD2-CH2 4.08Å; L106-W405 HydrophobicContact CD2-CZ2 3.56Å; L106-W405 HydrophobicContact CG-CD2 4.36Å; L106-W405 VanDerWaalsContact CG-CE2 3.42Å; L106-W405 HydrophobicContact CG-CH2 4.39Å; L106-W405 HydrophobicContact CG-CZ2 3.43Å; L106-W405 VanDerWaalsContact CG-CZ2 3.43Å; L106-W405 VanDerWaalsContact CG-NE1 3.34Å; L106-W405 PolarHBondContact O-NE1 2.79Å
107L96.9Very high96.2Very high12 Ų1213.4 Ų13.46%0.0638%0.076CC..Hα-helixtrans-75-38.5-179.6-72.4161.2000111.9I103 V104 T109 L110 R111 G167 L168 G171I103-L107 HydrophobicContact CG2-CD1 3.64Å; I103-L107 HydrophobicContact CG2-CG 4.38Å; I103-L107 PolarHBondContact O-N 3.24Å; V104-L107 PolarHBondContact O-N 3.15Å; L107-T109 VanDerWaalsContact C-N 3.28Å; L107-T109 PolarHBondContact O-N 2.92Å; L107-L110 WeakPolarHBondContact O-CB 3.27Å; L107-L110 PolarHBondContact O-N 3.45Å; L107-L110 VanDerWaalsContact O-N 3.16Å; L107-R111 WeakPolarHBondContact O-CG 3.41Å; L107-R111 PolarHBondContact O-N 2.82Å; L107-G167 WeakPolarHBondContact CD1-O 3.23Å; L107-L168 WeakPolarHBondContact CD1-O 3.38Å; L107-G171 VanDerWaalsContact CD1-N 3.35Å
108L97.5Very high96.6Very high2 Ų213 Ų131%0.017%0.072CC..Hα-helixtrans-59.3-41.5173.7-177.864.3000111T55 V104 L110 R111 L112 A162T55-L108 HydrophobicContact CG2-CD2 4.34Å; V104-L108 WeakPolarHBondContact O-CB 3.45Å; V104-L108 PolarHBondContact O-N 3.41Å; L108-L110 VanDerWaalsContact C-N 3.34Å; L108-L110 PolarHBondContact O-N 3.35Å; L108-R111 PolarHBondContact O-N 3.43Å; L108-L112 HydrophobicContact CD1-CD1 3.89Å; L108-L112 HydrophobicContact CD1-CD2 4.2Å; L108-L112 HydrophobicContact CD1-CG 3.85Å; L108-L112 HydrophobicContact CD2-CD1 4.37Å; L108-L112 HydrophobicContact CG-CD1 3.83Å; L108-L112 HydrophobicContact CG-CG 4.14Å; L108-L112 WeakPolarHBondContact O-CG 3.41Å; L108-L112 PolarHBondContact O-N 3.42Å; L108-A162 HydrophobicContact CD1-CB 3.56Å
109T98Very high96.8Very high0 Ų010.7 Ų10.70%06%0.058CC..Hα-helixtrans-56.6-46.8174.6-60.90000111.3C79 F80 L83 Q105 L106 L107 I113C79-T109 HydrophobicContact CB-CG2 4.03Å; F80-T109 HydrophobicContact CD1-CG2 3.9Å; F80-T109 HydrophobicContact CE1-CG2 3.94Å; L83-T109 HydrophobicContact CD2-CG2 4.17Å; Q105-T109 WeakPolarHBondContact O-CB 3.26Å; Q105-T109 PolarHBondContact O-N 3.27Å; Q105-T109 PolarHBondContact O-OG1 3.47Å; L106-T109 WeakPolarHBondContact O-CB 3.21Å; L107-T109 VanDerWaalsContact C-N 3.28Å; L107-T109 PolarHBondContact O-N 2.92Å; T109-I113 HydrophobicContact CG2-CD1 3.8Å; T109-I113 WeakPolarHBondContact O-CB 3.25Å; T109-I113 WeakPolarHBondContact O-CG1 3.39Å; T109-I113 PolarHBondContact O-N 3.28Å; T109-I113 VanDerWaalsContact O-N 3.12Å
110L97.7Very high97.1Very high1 Ų18.4 Ų8.41%0.0055%0.045CC..Hα-helixtrans-62.6-45.3176.7-65.6-177.9000112.1L106 L107 L108 G114 Y173 V375 W378 W405L106-L110 PolarHBondContact O-N 2.91Å; L107-L110 WeakPolarHBondContact O-CB 3.27Å; L107-L110 PolarHBondContact O-N 3.45Å; L107-L110 VanDerWaalsContact O-N 3.16Å; L108-L110 VanDerWaalsContact C-N 3.34Å; L108-L110 PolarHBondContact O-N 3.35Å; L110-G114 WeakPolarHBondContact O-CA 3.28Å; L110-G114 PolarHBondContact O-N 3.18Å; L110-Y173 HydrophobicContact CB-CD2 3.92Å; L110-Y173 HydrophobicContact CB-CE2 4.41Å; L110-V375 HydrophobicContact CD1-CG2 3.78Å; L110-W378 HydrophobicContact CD2-CD2 3.65Å; L110-W378 HydrophobicContact CD2-CE3 3.77Å; L110-W378 HydrophobicContact CD2-CG 4.28Å; L110-W378 HydrophobicContact CD2-CH2 3.72Å; L110-W378 HydrophobicContact CD2-CZ2 3.6Å; L110-W378 HydrophobicContact CD2-CZ3 3.82Å; L110-W378 PolarHBondContact O-NE1 3.38Å; L110-W405 HydrophobicContact CD1-CH2 4.13Å; L110-W405 HydrophobicContact CD1-CZ2 3.38Å; L110-W405 HydrophobicContact CD2-CD2 4.26Å; L110-W405 HydrophobicContact CD2-CG 4.39Å; L110-W405 HydrophobicContact CD2-CZ2 4.25Å; L110-W405 HydrophobicContact CG-CZ2 3.91Å
111R97.8Very high97.2Very high3 Ų39 Ų91%0.0115%0.048CC..Hα-helixtrans-58.9-51.9179.7-75.4-166-178.6172.98.2112L107 L108 G114 A115 Y161 C164 I166 G167 Y174L107-R111 WeakPolarHBondContact O-CG 3.41Å; L107-R111 PolarHBondContact O-N 2.82Å; L108-R111 PolarHBondContact O-N 3.43Å; R111-G114 PolarHBondContact O-N 3.15Å; R111-A115 VanDerWaalsContact O-CB 3.28Å; R111-A115 WeakPolarHBondContact O-CB 3.27Å; R111-A115 PolarHBondContact O-N 2.95Å; R111-Y161 HydrophobicContact CB-CD1 4.31Å; R111-Y161 HydrophobicContact CB-CE1 3.51Å; R111-Y161 HydrophobicContact CG-CE1 3.92Å; R111-Y161 HydrophobicContact CG-CE2 4.28Å; R111-Y161 WeakPolarHBondContact CG-OH 3.27Å; R111-Y161 PolarHBondContact NH1-O 3.2Å; R111-C164 PolarHBondContact NH1-O 3.41Å; R111-I166 PolarHBondContact NH2-O 3.23Å; R111-G167 PolarHBondContact NH2-O 2.9Å; R111-Y174 PolarHBondContact NH1-OH 3.18Å; R111-Y174 PolarHBondContact NH2-OH 3.34Å; R111-Y174 VanDerWaalsContact NH2-OH 3.13Å
112L98.3Very high97.3Very high0 Ų09.2 Ų9.20%05%0.049CC..Hα-helixtrans-69.8-43.2-175-63.1-179000112T55 L56 F59 L108 A115 S116 I158T55-L112 HydrophobicContact CG2-CD1 3.91Å; L56-L112 HydrophobicContact CD1-CD2 3.93Å; F59-L112 HydrophobicContact CB-CD1 3.99Å; F59-L112 HydrophobicContact CD1-CB 4.43Å; F59-L112 HydrophobicContact CD1-CD1 4.48Å; F59-L112 HydrophobicContact CD1-CD2 3.75Å; F59-L112 HydrophobicContact CD1-CG 4.43Å; F59-L112 HydrophobicContact CD2-CB 3.83Å; F59-L112 HydrophobicContact CD2-CD1 4.44Å; F59-L112 HydrophobicContact CE1-CB 4.46Å; F59-L112 HydrophobicContact CE1-CD2 3.93Å; F59-L112 HydrophobicContact CE2-CB 3.85Å; F59-L112 WeakPolarHBondContact CE2-O 3.19Å; F59-L112 HydrophobicContact CG-CB 4.12Å; F59-L112 HydrophobicContact CG-CD1 4.06Å; F59-L112 HydrophobicContact CG-CD2 4.13Å; F59-L112 HydrophobicContact CG-CG 4.32Å; F59-L112 HydrophobicContact CZ-CB 4.18Å; F59-L112 HydrophobicContact CZ-CD2 4.45Å; F59-L112 VanDerWaalsContact CZ-O 3.24Å; F59-L112 WeakPolarHBondContact CZ-O 3.34Å; L108-L112 HydrophobicContact CD1-CD1 3.89Å; L108-L112 HydrophobicContact CD1-CD2 4.2Å; L108-L112 HydrophobicContact CD1-CG 3.85Å; L108-L112 HydrophobicContact CD2-CD1 4.37Å; L108-L112 HydrophobicContact CG-CD1 3.83Å; L108-L112 HydrophobicContact CG-CG 4.14Å; L108-L112 WeakPolarHBondContact O-CG 3.41Å; L108-L112 PolarHBondContact O-N 3.42Å; L112-A115 PolarHBondContact O-N 3.25Å; L112-S116 PolarHBondContact O-N 2.93Å; L112-I158 HydrophobicContact CD2-CG2 4.09Å
113I98.4Very high97.3Very high0 Ų011.5 Ų11.50%06%0.055CC..Hα-helixtrans-63-45.7173.7-67.1174.4000110V76 C79 F80 T109 A115 S116 F117 W378 F383V76-I113 HydrophobicContact CG2-CD1 4.42Å; V76-I113 HydrophobicContact CG2-CG1 4.41Å; V76-I113 HydrophobicContact CG2-CG2 3.78Å; C79-I113 HydrophobicContact CB-CD1 3.9Å; C79-I113 HydrophobicContact CB-CG1 3.78Å; F80-I113 HydrophobicContact CD1-CD1 4.41Å; F80-I113 HydrophobicContact CD2-CD1 3.98Å; F80-I113 HydrophobicContact CE1-CD1 4.3Å; F80-I113 HydrophobicContact CE2-CD1 3.87Å; F80-I113 HydrophobicContact CG-CD1 4.25Å; F80-I113 HydrophobicContact CZ-CD1 4.04Å; T109-I113 HydrophobicContact CG2-CD1 3.8Å; T109-I113 WeakPolarHBondContact O-CB 3.25Å; T109-I113 WeakPolarHBondContact O-CG1 3.39Å; T109-I113 PolarHBondContact O-N 3.28Å; T109-I113 VanDerWaalsContact O-N 3.12Å; I113-A115 PolarHBondContact O-N 3.13Å; I113-S116 PolarHBondContact O-N 3.13Å; I113-S116 PolarHBondContact O-OG 3.46Å; I113-F117 HydrophobicContact CG2-CD2 3.78Å; I113-F117 HydrophobicContact CG2-CE2 3.64Å; I113-F117 VanDerWaalsContact O-CD2 3.29Å; I113-F117 WeakPolarHBondContact O-CD2 3.35Å; I113-F117 PolarHBondContact O-N 3.42Å; I113-F117 VanDerWaalsContact O-N 3.11Å; I113-W378 HydrophobicContact CB-CZ2 3.81Å; I113-W378 HydrophobicContact CD1-CH2 4.49Å; I113-W378 HydrophobicContact CD1-CZ2 4.27Å; I113-W378 HydrophobicContact CG2-CH2 4.25Å; I113-W378 HydrophobicContact CG2-CZ2 3.52Å; I113-F383 HydrophobicContact CG2-CE2 4.5Å
114G98Very high97.4Very high0 Ų012.1 Ų12.10%05%0.054CC..Hα-helixtrans-57.8-48.2177.400000112.6L110 R111 S116 F117 E118L110-G114 WeakPolarHBondContact O-CA 3.28Å; L110-G114 PolarHBondContact O-N 3.18Å; R111-G114 PolarHBondContact O-N 3.15Å; G114-S116 VanDerWaalsContact C-N 3.32Å; G114-S116 PolarHBondContact O-N 3.43Å; G114-F117 PolarHBondContact O-N 2.88Å; G114-F117 VanDerWaalsContact O-N 3.14Å; G114-E118 PolarHBondContact O-N 3.1Å
115A98Very high97.3Very high0 Ų012.4 Ų12.40%06%0.056CC..Hα-helixtrans-58-42.3175.400000112.2R111 L112 I113 F117 E118 I119 Y161 L176R111-A115 VanDerWaalsContact O-CB 3.28Å; R111-A115 WeakPolarHBondContact O-CB 3.27Å; R111-A115 PolarHBondContact O-N 2.95Å; L112-A115 PolarHBondContact O-N 3.25Å; I113-A115 PolarHBondContact O-N 3.13Å; A115-F117 VanDerWaalsContact C-N 3.3Å; A115-F117 PolarHBondContact O-N 3.32Å; A115-E118 PolarHBondContact O-N 3.38Å; A115-I119 WeakPolarHBondContact O-CD1 3.45Å; A115-I119 VanDerWaalsContact O-CG1 3.26Å; A115-I119 WeakPolarHBondContact O-CG1 3.27Å; A115-I119 PolarHBondContact O-N 3.06Å; A115-Y161 HydrophobicContact CB-CE1 4.3Å; A115-L176 HydrophobicContact CB-CB 4.12Å; A115-L176 HydrophobicContact CB-CD2 3.71Å
116S98.1Very high97.2Very high0 Ų014.7 Ų14.70%07%0.068CC..Hα-helixtrans-63-35.8177.773.40000113.1H72 A75 L112 I113 G114 G120H72-S116 WeakPolarHBondContact CA-OG 3.28Å; A75-S116 WeakPolarHBondContact CB-OG 3.41Å; L112-S116 PolarHBondContact O-N 2.93Å; I113-S116 PolarHBondContact O-N 3.13Å; I113-S116 PolarHBondContact O-OG 3.46Å; G114-S116 VanDerWaalsContact C-N 3.32Å; G114-S116 PolarHBondContact O-N 3.43Å; S116-G120 PolarHBondContact O-N 2.64Å; S116-G120 VanDerWaalsContact O-N 3.08Å
117F98Very high97Very high10 Ų1016.3 Ų16.34%0.0448%0.077CC..Hα-helixtrans-71.6-41.2174-82.5-72.4000111.9H72 V76 I113 G114 A115 I119 G120 D121 Y382H72-F117 HydrophobicContact CB-CD1 3.78Å; H72-F117 HydrophobicContact CB-CD2 4.27Å; H72-F117 HydrophobicContact CB-CE1 3.86Å; H72-F117 HydrophobicContact CB-CE2 4.32Å; H72-F117 HydrophobicContact CB-CG 4Å; H72-F117 HydrophobicContact CB-CZ 4.13Å; H72-F117 AromaticContact CD2-CD1 3.96Å; H72-F117 AromaticContact CD2-CE1 3.39Å; H72-F117 WeakPolarHBondContact CD2-CE1 3.44Å; H72-F117 AromaticContact CD2-CZ 3.94Å; H72-F117 AromaticContact CG-CD1 3.93Å; H72-F117 AromaticContact CG-CE1 3.8Å; V76-F117 HydrophobicContact CG2-CE2 3.94Å; V76-F117 HydrophobicContact CG2-CZ 4.28Å; I113-F117 HydrophobicContact CG2-CD2 3.78Å; I113-F117 HydrophobicContact CG2-CE2 3.64Å; I113-F117 VanDerWaalsContact O-CD2 3.29Å; I113-F117 WeakPolarHBondContact O-CD2 3.35Å; I113-F117 PolarHBondContact O-N 3.42Å; I113-F117 VanDerWaalsContact O-N 3.11Å; G114-F117 PolarHBondContact O-N 2.88Å; G114-F117 VanDerWaalsContact O-N 3.14Å; A115-F117 VanDerWaalsContact C-N 3.3Å; A115-F117 PolarHBondContact O-N 3.32Å; F117-I119 VanDerWaalsContact C-N 3.34Å; F117-I119 PolarHBondContact O-N 3.36Å; F117-G120 PolarHBondContact O-N 2.74Å; F117-D121 WeakPolarHBondContact O-CB 3.43Å; F117-D121 PolarHBondContact O-N 3.32Å; F117-Y382 HydrophobicContact CB-CD1 3.33Å; F117-Y382 HydrophobicContact CB-CE1 3.33Å; F117-Y382 HydrophobicContact CB-CG 4.18Å; F117-Y382 HydrophobicContact CD1-CD1 4.08Å; F117-Y382 AromaticContact CD2-CD1 3.66Å; F117-Y382 HydrophobicContact CD2-CD1 3.66Å; F117-Y382 HydrophobicContact CD2-CD2 4.38Å; F117-Y382 HydrophobicContact CD2-CE1 4.38Å; F117-Y382 AromaticContact CD2-CG 3.65Å; F117-Y382 HydrophobicContact CD2-CG 3.65Å; F117-Y382 HydrophobicContact CE2-CD1 4.47Å; F117-Y382 HydrophobicContact CE2-CG 4.2Å; F117-Y382 AromaticContact CG-CD1 3.43Å; F117-Y382 HydrophobicContact CG-CD1 3.43Å; F117-Y382 VanDerWaalsContact CG-CD1 3.43Å; F117-Y382 AromaticContact CG-CE1 4Å; F117-Y382 HydrophobicContact CG-CE1 4Å; F117-Y382 AromaticContact CG-CG 3.95Å; F117-Y382 HydrophobicContact CG-CG 3.95Å
118E97.6Very high96.9Very high21 Ų2118 Ų1810%0.0988%0.084CC..Hα-helixtrans-62.3-39.4175.5-74.2-177.9109.400112.2G114 A115 D121 S122 I151 S175 L176 K177G114-E118 PolarHBondContact O-N 3.1Å; A115-E118 PolarHBondContact O-N 3.38Å; E118-D121 PolarHBondContact O-N 2.87Å; E118-S122 WeakPolarHBondContact O-CB 3.39Å; E118-S122 PolarHBondContact O-N 3.36Å; E118-S122 PolarHBondContact O-OG 2.98Å; E118-I151 HydrophobicContact CB-CD1 3.53Å; E118-I151 HydrophobicContact CB-CG1 4.11Å; E118-S175 VanDerWaalsContact CD-CB 3.46Å; E118-S175 WeakPolarHBondContact OE1-CB 3.39Å; E118-S175 PolarHBondContact OE1-OG 3.42Å; E118-S175 WeakPolarHBondContact OE2-CB 3.3Å; E118-L176 WeakPolarHBondContact OE2-CB 3.25Å; E118-L176 PolarHBondContact OE2-N 2.92Å; E118-K177 VanDerWaalsContact OE1-CB 3.29Å; E118-K177 WeakPolarHBondContact OE1-CB 3.36Å; E118-K177 PolarHBondContact OE1-N 3.38Å
119I97.7Very high96.6Very high2 Ų219.3 Ų19.31%0.019%0.091CC..Hα-helixtrans-62.5-48.5173.5-67.8160.4000110.3F63 E68 L71 A115 F117 D121 S122 W123 I151 P153F63-I119 HydrophobicContact CD2-CD1 3.84Å; F63-I119 HydrophobicContact CE2-CD1 3.68Å; F63-I119 HydrophobicContact CE2-CG1 4.48Å; F63-I119 HydrophobicContact CE2-CG2 4.37Å; E68-I119 HydrophobicContact CB-CG2 3.95Å; E68-I119 HydrophobicContact CG-CG2 3.76Å; L71-I119 HydrophobicContact CD2-CB 4.27Å; L71-I119 HydrophobicContact CD2-CD1 3.84Å; L71-I119 HydrophobicContact CD2-CG2 4.02Å; A115-I119 WeakPolarHBondContact O-CD1 3.45Å; A115-I119 VanDerWaalsContact O-CG1 3.26Å; A115-I119 WeakPolarHBondContact O-CG1 3.27Å; A115-I119 PolarHBondContact O-N 3.06Å; F117-I119 VanDerWaalsContact C-N 3.34Å; F117-I119 PolarHBondContact O-N 3.36Å; I119-D121 VanDerWaalsContact C-N 3.31Å; I119-D121 PolarHBondContact O-N 2.81Å; I119-S122 WeakPolarHBondContact O-CB 3.34Å; I119-S122 PolarHBondContact O-N 3.18Å; I119-W123 PolarHBondContact O-N 3.37Å; I119-I151 HydrophobicContact CG1-CD1 3.99Å; I119-I151 HydrophobicContact CG1-CG1 4.38Å; I119-P153 HydrophobicContact CD1-CG 3.88Å; I119-P153 HydrophobicContact CG1-CG 3.98Å
120G97Very high96.3Very high7 Ų726.7 Ų26.77%0.07213%0.126CC..Hα-helixtrans-63.4-34.5177.500000113.6S116 F117 R124S116-G120 PolarHBondContact O-N 2.64Å; S116-G120 VanDerWaalsContact O-N 3.08Å; F117-G120 PolarHBondContact O-N 2.74Å; G120-R124 WeakPolarHBondContact O-CB 3.29Å; G120-R124 PolarHBondContact O-N 2.93Å; G120-R124 VanDerWaalsContact O-N 3.13Å
121D96.6Very high95.9Very high18 Ų1829.3 Ų29.310%0.09614%0.144CC..Hα-helixtrans-70.1-39175-68.4-11.9000111.4F117 E118 I119 R124 I125 R386F117-D121 WeakPolarHBondContact O-CB 3.43Å; F117-D121 PolarHBondContact O-N 3.32Å; E118-D121 PolarHBondContact O-N 2.87Å; I119-D121 VanDerWaalsContact C-N 3.31Å; I119-D121 PolarHBondContact O-N 2.81Å; D121-R124 PolarHBondContact O-N 3.47Å; D121-R124 IonicContact OD1-CZ 2.82Å; D121-R124 IonicContact OD1-NH2 3.69Å; D121-R124 PolarHBondContact OD1-NH2 3.03Å; D121-I125 WeakPolarHBondContact O-CG1 3.01Å; D121-I125 PolarHBondContact O-N 2.63Å; D121-R386 IonicContact OD1-CZ 3.82Å; D121-R386 IonicContact OD1-NH1 2.88Å; D121-R386 PolarHBondContact OD1-NH1 3.25Å; D121-R386 IonicContact OD1-NH2 2.68Å; D121-R386 PolarHBondContact OD1-NH2 2.94Å; D121-R386 IonicContact OD2-CZ 2.64Å; D121-R386 IonicContact OD2-NH2 3.37Å; D121-R386 PolarHBondContact OD2-NH2 3.06Å
122S97Very high95.1Very high6 Ų635 Ų354%0.04219%0.185CC..Hα-helixtrans-62.3-43.9175.2-57.20000111.8E118 I119 R124 I125 N126 C150 I151E118-S122 WeakPolarHBondContact O-CB 3.39Å; E118-S122 PolarHBondContact O-N 3.36Å; E118-S122 PolarHBondContact O-OG 2.98Å; I119-S122 WeakPolarHBondContact O-CB 3.34Å; I119-S122 PolarHBondContact O-N 3.18Å; S122-R124 VanDerWaalsContact C-N 3.34Å; S122-R124 PolarHBondContact O-N 3.45Å; S122-I125 PolarHBondContact O-N 2.82Å; S122-N126 WeakPolarHBondContact O-CB 3.35Å; S122-N126 PolarHBondContact O-N 3.06Å; S122-N126 PolarHBondContact O-ND2 2.97Å; S122-C150 VanDerWaalsContact OG-CA 3.29Å; S122-C150 WeakPolarHBondContact OG-CA 3.46Å; S122-I151 PolarHBondContact OG-N 3.35Å; S122-I151 PolarHBondContact OG-O 3.08Å
123W96.5Very high94.4Very high89 Ų8941.7 Ų41.734%0.33722%0.22SC..Hα-helixtrans-56.7-47.4172.5176.482.1000111.8E68 R69 I119 N126 N127E68-W123 HydrophobicContact CB-CB 3.82Å; E68-W123 HydrophobicContact CB-CG 3.98Å; E68-W123 WeakPolarHBondContact OE2-CB 3.33Å; R69-W123 HydrophobicContact CB-CD2 3.95Å; R69-W123 HydrophobicContact CB-CE3 3.82Å; R69-W123 HydrophobicContact CB-CH2 3.67Å; R69-W123 HydrophobicContact CB-CZ2 3.76Å; R69-W123 HydrophobicContact CB-CZ3 3.69Å; R69-W123 HydrophobicContact CG-CZ2 4.37Å; I119-W123 PolarHBondContact O-N 3.37Å; W123-N126 PolarHBondContact O-N 2.68Å; W123-N127 VanDerWaalsContact CD2-ND2 3.35Å; W123-N127 WeakPolarHBondContact CH2-ND2 3.29Å; W123-N127 WeakPolarHBondContact CZ2-ND2 3.08Å; W123-N127 PolarHBondContact O-N 2.88Å
124R95.3Very high93.8Very high58 Ų5843.4 Ų43.422%0.21923%0.231CC..Hα-helixtrans-65.3-43.4-178176.7164.946142.65.9112.7G120 D121 S122 N126 N127 Q128 F525G120-R124 WeakPolarHBondContact O-CB 3.29Å; G120-R124 PolarHBondContact O-N 2.93Å; G120-R124 VanDerWaalsContact O-N 3.13Å; D121-R124 PolarHBondContact O-N 3.47Å; D121-R124 IonicContact OD1-CZ 2.82Å; D121-R124 IonicContact OD1-NH2 3.69Å; D121-R124 PolarHBondContact OD1-NH2 3.03Å; S122-R124 VanDerWaalsContact C-N 3.34Å; S122-R124 PolarHBondContact O-N 3.45Å; R124-N126 VanDerWaalsContact C-N 3.33Å; R124-N126 PolarHBondContact O-N 3.27Å; R124-N127 PolarHBondContact O-N 3.14Å; R124-Q128 WeakPolarHBondContact O-CG 3.48Å; R124-Q128 PolarHBondContact O-N 3.3Å; R124-F525 VanDerWaalsContact CZ-O 3.31Å; R124-F525 PolarHBondContact NH1-O 2.82Å; R124-F525 PolarHBondContact NH2-O 2.94Å
125I95.6Very high93.3Very high6 Ų649.4 Ų49.43%0.03126%0.259CS..Hα-helixtrans-60.9-44.3175.2-72.2163.2000110.5D121 S122 N127 Q128 L129 L142 L145 K146 F525D121-I125 WeakPolarHBondContact O-CG1 3.01Å; D121-I125 PolarHBondContact O-N 2.63Å; S122-I125 PolarHBondContact O-N 2.82Å; I125-N127 VanDerWaalsContact C-N 3.32Å; I125-N127 PolarHBondContact O-N 3.11Å; I125-Q128 PolarHBondContact O-N 2.94Å; I125-L129 HydrophobicContact CG2-CD1 4.07Å; I125-L129 PolarHBondContact O-N 3.46Å; I125-L142 HydrophobicContact CG1-CD2 4.3Å; I125-L142 HydrophobicContact CG2-CD2 4.17Å; I125-L145 HydrophobicContact CD1-CB 4.05Å; I125-K146 HydrophobicContact CG2-CB 4.2Å; I125-F525 HydrophobicContact CD1-CD1 4.34Å; I125-F525 HydrophobicContact CD1-CE1 3.69Å
126N94.3Very high92.7Very high50 Ų5054.4 Ų54.427%0.26729%0.291SS..Hα-helixtrans-60.5-40.7177.8-78.4-43.2000112.3S122 W123 R124 Q130 K146S122-N126 WeakPolarHBondContact O-CB 3.35Å; S122-N126 PolarHBondContact O-N 3.06Å; S122-N126 PolarHBondContact O-ND2 2.97Å; W123-N126 PolarHBondContact O-N 2.68Å; R124-N126 VanDerWaalsContact C-N 3.33Å; R124-N126 PolarHBondContact O-N 3.27Å; N126-Q130 WeakPolarHBondContact O-CG 3.24Å; N126-Q130 PolarHBondContact O-N 3.11Å; N126-K146 WeakPolarHBondContact OD1-CD 3.39Å; N126-K146 WeakPolarHBondContact OD1-CE 3.42Å; N126-K146 PolarHBondContact OD1-NZ 3.28Å
127N93.5Very high92.2Very high57 Ų5762.7 Ų62.731%0.30533%0.33SS..Hα-helixtrans-69.7-39.1176.6-68.4-16.9000112.8W123 R124 I125 L129 Q130 S131W123-N127 VanDerWaalsContact CD2-ND2 3.35Å; W123-N127 WeakPolarHBondContact CH2-ND2 3.29Å; W123-N127 WeakPolarHBondContact CZ2-ND2 3.08Å; W123-N127 PolarHBondContact O-N 2.88Å; R124-N127 PolarHBondContact O-N 3.14Å; I125-N127 VanDerWaalsContact C-N 3.32Å; I125-N127 PolarHBondContact O-N 3.11Å; N127-L129 VanDerWaalsContact C-N 3.32Å; N127-L129 PolarHBondContact O-N 3.45Å; N127-Q130 PolarHBondContact O-N 2.75Å; N127-Q130 VanDerWaalsContact O-N 3.14Å; N127-S131 PolarHBondContact O-N 3.04Å
128Q93.5Very high91.8Very high47 Ų4766 Ų6622%0.2235%0.348CS..Hα-helixtrans-60.6-44175.6-74.7176.5-36.400110.7R124 I125 Q130 S131 V134 L142R124-Q128 WeakPolarHBondContact O-CG 3.48Å; R124-Q128 PolarHBondContact O-N 3.3Å; I125-Q128 PolarHBondContact O-N 2.94Å; Q128-Q130 PolarHBondContact O-N 3.29Å; Q128-S131 PolarHBondContact O-N 3.29Å; Q128-S131 PolarHBondContact O-OG 2.9Å; Q128-V134 WeakPolarHBondContact O-CG2 3.39Å; Q128-L142 HydrophobicContact CB-CD1 3.91Å; Q128-L142 HydrophobicContact CB-CD2 4.47Å
129L92.7Very high91.5Very high31 Ų3169.7 Ų69.716%0.16236%0.364CS..Hα-helixtrans-62.3-23.2176.1-77.4168.3000114.4I125 N127 K139 L142 E143 K146I125-L129 HydrophobicContact CG2-CD1 4.07Å; I125-L129 PolarHBondContact O-N 3.46Å; N127-L129 VanDerWaalsContact C-N 3.32Å; N127-L129 PolarHBondContact O-N 3.45Å; L129-K139 HydrophobicContact CD2-CG 4.09Å; L129-L142 HydrophobicContact CD1-CB 4.31Å; L129-L142 HydrophobicContact CD2-CB 3.49Å; L129-L142 VanDerWaalsContact CD2-CB 3.49Å; L129-L142 HydrophobicContact CD2-CD1 4.36Å; L129-L142 HydrophobicContact CG-CB 3.78Å; L129-L142 HydrophobicContact CG-CD1 4.47Å; L129-E143 HydrophobicContact CD2-CG 3.88Å; L129-K146 HydrophobicContact CD1-CB 3.9Å; L129-K146 HydrophobicContact CD1-CD 3.51Å; L129-K146 HydrophobicContact CD1-CG 4.31Å
130Q90.3Very high91.2Very high154 Ų15472.5 Ų72.572%0.7238%0.384SS*.Hα-helixtrans-84.7-18.3175.7-70.7174.6-7.800113N126 N127 Q128N126-Q130 WeakPolarHBondContact O-CG 3.24Å; N126-Q130 PolarHBondContact O-N 3.11Å; N127-Q130 PolarHBondContact O-N 2.75Å; N127-Q130 VanDerWaalsContact O-N 3.14Å; Q128-Q130 PolarHBondContact O-N 3.29Å
131S88.9Confident91.1Very high56 Ų5676 Ų7639%0.39240%0.397SS..  trans-73.9135.8179.5680000111.6N127 Q128 D133 V134N127-S131 PolarHBondContact O-N 3.04Å; Q128-S131 PolarHBondContact O-N 3.29Å; Q128-S131 PolarHBondContact O-OG 2.9Å; S131-D133 PolarHBondContact O-N 3.33Å; S131-V134 WeakPolarHBondContact OG-CG2 3.32Å
132S81.4Confident91Very high123 Ų12376 Ų7686%0.8640%0.397SS*.THydrogen-bonded Turntrans-72.6-15.8-176.7-55.70000114V134S132-V134 VanDerWaalsContact C-N 3.34Å; S132-V134 PolarHBondContact O-N 3.49Å
133D85.2Confident90.9Very high141 Ų14180.4 Ų80.475%0.75442%0.417SS*.THydrogen-bonded Turntrans-87.73.9-173-61.9-35.3000114S131 Q135S131-D133 PolarHBondContact O-N 3.33Å; D133-Q135 PolarHBondContact O-N 3.14Å
134V84.5Confident90.9Very high35 Ų3577.3 Ų77.321%0.21241%0.407CS..  trans-77.7122.2-177.2-1740000110.7Q128 S131 S132 D138 K139 L142Q128-V134 WeakPolarHBondContact O-CG2 3.39Å; S131-V134 WeakPolarHBondContact OG-CG2 3.32Å; S132-V134 VanDerWaalsContact C-N 3.34Å; S132-V134 PolarHBondContact O-N 3.49Å; V134-D138 HydrophobicContact CG1-CB 3.73Å; V134-K139 HydrophobicContact CG1-CB 3.89Å; V134-L142 HydrophobicContact CG1-CD1 4.01Å
135Q87.7Confident90.9Very high127 Ų12774.7 Ų74.759%0.59340%0.397SS*.  trans-60.4147.1174.5-65.1-62.9-28.100111.1D133 Q137 D138 K139D133-Q135 PolarHBondContact O-N 3.14Å; Q135-Q137 PolarHBondContact O-N 2.89Å; Q135-Q137 VanDerWaalsContact O-N 3.13Å; Q135-D138 PolarHBondContact O-N 3.2Å; Q135-K139 PolarHBondContact O-N 2.96Å
136P86.5Confident90.9Very high105 Ų10579.4 Ų79.468%0.68242%0.417SS*.Hα-helixtrans-54.6-37.5-175.9-28.234.9000114.5K139 S140P136-K139 PolarHBondContact O-N 3.42Å; P136-S140 PolarHBondContact O-N 2.84Å; P136-S140 VanDerWaalsContact O-N 3.1Å
137Q85.6Confident91Very high173 Ų17382.5 Ų82.581%0.80843%0.428SS*.Hα-helixtrans-66.4-44.8178.1-66.5-178.3-6.800112Q135 K139 S140 K141Q135-Q137 PolarHBondContact O-N 2.89Å; Q135-Q137 VanDerWaalsContact O-N 3.13Å; Q137-K139 VanDerWaalsContact C-N 3.29Å; Q137-K139 PolarHBondContact O-N 3.16Å; Q137-S140 PolarHBondContact O-N 3.39Å; Q137-K141 PolarHBondContact O-N 3.12Å
138D90Very high91.1Very high81 Ų8181.3 Ų81.343%0.43342%0.42SS..Hα-helixtrans-66.3-35.6176.9-67.6-37.9000111.3V134 Q135 K141 L142V134-D138 HydrophobicContact CG1-CB 3.73Å; Q135-D138 PolarHBondContact O-N 3.2Å; D138-K141 PolarHBondContact O-N 2.92Å; D138-L142 WeakPolarHBondContact O-CB 3.49Å; D138-L142 VanDerWaalsContact O-CG 3.27Å; D138-L142 WeakPolarHBondContact O-CG 3.36Å; D138-L142 PolarHBondContact O-N 3.4Å
139K92Very high91.2Very high97 Ų9780.3 Ų80.342%0.42242%0.415SS..Hα-helixtrans-62.2-48.4176.5-170.6176.3179.3178.50111.6L129 V134 Q135 P136 Q137 K141 L142 E143L129-K139 HydrophobicContact CD2-CG 4.09Å; V134-K139 HydrophobicContact CG1-CB 3.89Å; Q135-K139 PolarHBondContact O-N 2.96Å; P136-K139 PolarHBondContact O-N 3.42Å; Q137-K139 VanDerWaalsContact C-N 3.29Å; Q137-K139 PolarHBondContact O-N 3.16Å; K139-K141 VanDerWaalsContact C-N 3.3Å; K139-K141 PolarHBondContact O-N 2.84Å; K139-L142 PolarHBondContact O-N 2.93Å; K139-E143 WeakPolarHBondContact CE-OE1 3.5Å; K139-E143 WeakPolarHBondContact O-CG 3.11Å; K139-E143 PolarHBondContact O-N 3.24Å
140S92.1Very high91.4Very high62 Ų6279.7 Ų79.743%0.43441%0.413SS..Hα-helixtrans-58.9-42176.9178.10000111.9P136 Q137 E143 L144P136-S140 PolarHBondContact O-N 2.84Å; P136-S140 VanDerWaalsContact O-N 3.1Å; Q137-S140 PolarHBondContact O-N 3.39Å; S140-E143 PolarHBondContact O-N 3.06Å; S140-L144 PolarHBondContact O-N 3.18Å; S140-L144 VanDerWaalsContact O-N 3.08Å
141K93.7Very high91.6Very high79 Ų7972.9 Ų72.934%0.34338%0.381SS..Hα-helixtrans-63.8-43.7176-177.5-179.5175.3-1730112.2Q137 D138 K139 E143 L144 L145Q137-K141 PolarHBondContact O-N 3.12Å; D138-K141 PolarHBondContact O-N 2.92Å; K139-K141 VanDerWaalsContact C-N 3.3Å; K139-K141 PolarHBondContact O-N 2.84Å; K141-E143 VanDerWaalsContact C-N 3.32Å; K141-L144 PolarHBondContact O-N 3.23Å; K141-L145 HydrophobicContact CG-CD1 4.43Å; K141-L145 WeakPolarHBondContact O-CG 3.49Å; K141-L145 PolarHBondContact O-N 2.96Å
142L94.4Very high91.9Very high18 Ų1879 Ų799%0.09440%0.401CS..Hα-helixtrans-65.5-34.8176.5-74.2169.2000112.2I125 Q128 L129 V134 D138 K139 L145 K146I125-L142 HydrophobicContact CG1-CD2 4.3Å; I125-L142 HydrophobicContact CG2-CD2 4.17Å; Q128-L142 HydrophobicContact CB-CD1 3.91Å; Q128-L142 HydrophobicContact CB-CD2 4.47Å; L129-L142 HydrophobicContact CD1-CB 4.31Å; L129-L142 HydrophobicContact CD2-CB 3.49Å; L129-L142 VanDerWaalsContact CD2-CB 3.49Å; L129-L142 HydrophobicContact CD2-CD1 4.36Å; L129-L142 HydrophobicContact CG-CB 3.78Å; L129-L142 HydrophobicContact CG-CD1 4.47Å; V134-L142 HydrophobicContact CG1-CD1 4.01Å; D138-L142 WeakPolarHBondContact O-CB 3.49Å; D138-L142 VanDerWaalsContact O-CG 3.27Å; D138-L142 WeakPolarHBondContact O-CG 3.36Å; D138-L142 PolarHBondContact O-N 3.4Å; K139-L142 PolarHBondContact O-N 2.93Å; L142-L145 HydrophobicContact CD2-CD1 4.29Å; L142-L145 PolarHBondContact O-N 2.75Å; L142-K146 WeakPolarHBondContact O-CB 3.37Å; L142-K146 PolarHBondContact O-N 3.2Å
143E95.3Very high92.6Very high99 Ų9973.7 Ų73.746%0.46336%0.363SS..Hα-helixtrans-63.9-43.3174.1-74.7170.6177.100111.4L129 K139 S140 K141 K146 K147L129-E143 HydrophobicContact CD2-CG 3.88Å; K139-E143 WeakPolarHBondContact CE-OE1 3.5Å; K139-E143 WeakPolarHBondContact O-CG 3.11Å; K139-E143 PolarHBondContact O-N 3.24Å; S140-E143 PolarHBondContact O-N 3.06Å; K141-E143 VanDerWaalsContact C-N 3.32Å; E143-K146 WeakPolarHBondContact O-CB 3.47Å; E143-K146 PolarHBondContact O-N 2.93Å; E143-K147 WeakPolarHBondContact O-CB 3.39Å; E143-K147 PolarHBondContact O-N 2.7Å
144L95.5Very high93.1Very high25 Ų2569.8 Ų69.813%0.13135%0.347CS..Hα-helixtrans-62.7-43.7172.9-71174.3000112S140 K141 K146 K147 Y148 L285 H286 D289S140-L144 PolarHBondContact O-N 3.18Å; S140-L144 VanDerWaalsContact O-N 3.08Å; K141-L144 PolarHBondContact O-N 3.23Å; L144-K146 VanDerWaalsContact C-N 3.31Å; L144-K146 PolarHBondContact O-N 2.89Å; L144-K147 PolarHBondContact O-N 2.75Å; L144-Y148 HydrophobicContact CD2-CD2 4.43Å; L144-Y148 HydrophobicContact CD2-CE2 4.21Å; L144-Y148 WeakPolarHBondContact O-CD2 3.43Å; L144-Y148 PolarHBondContact O-N 3.39Å; L144-L285 HydrophobicContact CB-CB 4.05Å; L144-L285 HydrophobicContact CB-CD1 4.28Å; L144-L285 HydrophobicContact CD1-CB 4.44Å; L144-H286 HydrophobicContact CD1-CB 4.15Å; L144-D289 HydrophobicContact CD2-CB 3.81Å
145L96.2Very high93.6Very high2 Ų270.4 Ų70.41%0.0135%0.352CS..Hα-helixtrans-61.5-40.5174.5-73.4168.2000111.8I125 K141 L142 K147 K149 C150 L285 M524 F525I125-L145 HydrophobicContact CD1-CB 4.05Å; K141-L145 HydrophobicContact CG-CD1 4.43Å; K141-L145 WeakPolarHBondContact O-CG 3.49Å; K141-L145 PolarHBondContact O-N 2.96Å; L142-L145 HydrophobicContact CD2-CD1 4.29Å; L142-L145 PolarHBondContact O-N 2.75Å; L145-K147 VanDerWaalsContact C-N 3.34Å; L145-K147 PolarHBondContact O-N 2.97Å; L145-K149 HydrophobicContact CD2-CB 4.38Å; L145-K149 HydrophobicContact CD2-CG 3.96Å; L145-K149 CarbonylContact O-C 3.49Å; L145-K149 WeakPolarHBondContact O-CA 3.47Å; L145-K149 VanDerWaalsContact O-CB 3.3Å; L145-K149 WeakPolarHBondContact O-CB 3.45Å; L145-K149 PolarHBondContact O-N 3.15Å; L145-C150 PolarHBondContact O-N 3.37Å; L145-L285 HydrophobicContact CD2-CD1 3.73Å; L145-L285 HydrophobicContact CG-CD1 4.16Å; L145-M524 HydrophobicContact CD1-CG 3.98Å; L145-M524 HydrophobicContact CD2-CE 4.15Å; L145-M524 HydrophobicContact CD2-CG 4.06Å; L145-M524 HydrophobicContact CD2-SD 4.22Å; L145-F525 HydrophobicContact CD2-CE1 4.49Å; L145-F525 HydrophobicContact CD2-CE2 4.14Å; L145-F525 HydrophobicContact CD2-CZ 3.73Å
146K96.2Very high94Very high106 Ų10667.8 Ų67.846%0.46134%0.342SS..Hα-helixtrans-61.8-42.6175-178.7174175.9173.80111.9I125 N126 L129 L142 E143 L144 C150I125-K146 HydrophobicContact CG2-CB 4.2Å; N126-K146 WeakPolarHBondContact OD1-CD 3.39Å; N126-K146 WeakPolarHBondContact OD1-CE 3.42Å; N126-K146 PolarHBondContact OD1-NZ 3.28Å; L129-K146 HydrophobicContact CD1-CB 3.9Å; L129-K146 HydrophobicContact CD1-CD 3.51Å; L129-K146 HydrophobicContact CD1-CG 4.31Å; L142-K146 WeakPolarHBondContact O-CB 3.37Å; L142-K146 PolarHBondContact O-N 3.2Å; E143-K146 WeakPolarHBondContact O-CB 3.47Å; E143-K146 PolarHBondContact O-N 2.93Å; L144-K146 VanDerWaalsContact C-N 3.31Å; L144-K146 PolarHBondContact O-N 2.89Å; K146-C150 VanDerWaalsContact CA-SG 3.59Å; K146-C150 WeakPolarHBondContact O-CB 3.4Å
147K95.3Very high94.5Very high114 Ų11464 Ų6450%0.49632%0.315SS..Hα-helixtrans-69.7-41.5-179.1-169.9173.3-179.8-173.80112.7E143 L144 L145 D289E143-K147 WeakPolarHBondContact O-CB 3.39Å; E143-K147 PolarHBondContact O-N 2.7Å; L144-K147 PolarHBondContact O-N 2.75Å; L145-K147 VanDerWaalsContact C-N 3.34Å; L145-K147 PolarHBondContact O-N 2.97Å; K147-D289 WeakPolarHBondContact CE-OD1 3.4Å; K147-D289 IonicContact NZ-OD1 2.66Å; K147-D289 PolarHBondContact NZ-OD1 2.81Å
148Y95.5Very high95Very high32 Ų3255.8 Ų55.813%0.12528%0.277CS..Hα-helixtrans-112.4-10.8-168-66.8-67.4000116L144 K177 L285 L288 D289 M292L144-Y148 HydrophobicContact CD2-CD2 4.43Å; L144-Y148 HydrophobicContact CD2-CE2 4.21Å; L144-Y148 WeakPolarHBondContact O-CD2 3.43Å; L144-Y148 PolarHBondContact O-N 3.39Å; Y148-K177 WeakPolarHBondContact O-CE 3.44Å; Y148-L285 HydrophobicContact CD2-CB 4.42Å; Y148-L288 HydrophobicContact CD1-CD2 3.56Å; Y148-L288 HydrophobicContact CD1-CG 4.2Å; Y148-L288 HydrophobicContact CE1-CD2 3.91Å; Y148-L288 HydrophobicContact CE1-CG 4.03Å; Y148-L288 HydrophobicContact CG-CD2 3.98Å; Y148-D289 HydrophobicContact CE2-CB 3.8Å; Y148-D289 WeakPolarHBondContact CE2-OD1 3.2Å; Y148-D289 WeakPolarHBondContact OH-CA 3.18Å; Y148-D289 PolarHBondContact OH-OD1 3.48Å; Y148-M292 HydrophobicContact CE1-CG 4.28Å
149K95.7Very high95.3Very high26 Ų2656.2 Ų56.211%0.11328%0.277CS..THydrogen-bonded Turntrans-125.9-29.6-178.7-63-67.3-174.6-179.30114.1L145 E280 P282 L285L145-K149 HydrophobicContact CD2-CB 4.38Å; L145-K149 HydrophobicContact CD2-CG 3.96Å; L145-K149 CarbonylContact O-C 3.49Å; L145-K149 WeakPolarHBondContact O-CA 3.47Å; L145-K149 VanDerWaalsContact O-CB 3.3Å; L145-K149 WeakPolarHBondContact O-CB 3.45Å; L145-K149 PolarHBondContact O-N 3.15Å; K149-E280 PolarHBondContact NZ-O 2.76Å; K149-P282 WeakPolarHBondContact CE-O 3.48Å; K149-P282 PolarHBondContact NZ-O 3.43Å; K149-L285 HydrophobicContact CG-CD1 4.25Å
150C96.6Very high95.6Very high18 Ų1852.2 Ų52.212%0.12226%0.26CS..  trans-70.1144179.2-69.10000111.5S122 L145 K146S122-C150 VanDerWaalsContact OG-CA 3.29Å; S122-C150 WeakPolarHBondContact OG-CA 3.46Å; L145-C150 PolarHBondContact O-N 3.37Å; K146-C150 VanDerWaalsContact CA-SG 3.59Å; K146-C150 WeakPolarHBondContact O-CB 3.4Å
151I95.9Very high95.9Very high11 Ų1149.2 Ų49.26%0.05624%0.24CC..  trans-127.6149.4179.557.1167.5000110.4E118 I119 S122 P153 L176 K177E118-I151 HydrophobicContact CB-CD1 3.53Å; E118-I151 HydrophobicContact CB-CG1 4.11Å; I119-I151 HydrophobicContact CG1-CD1 3.99Å; I119-I151 HydrophobicContact CG1-CG1 4.38Å; S122-I151 PolarHBondContact OG-N 3.35Å; S122-I151 PolarHBondContact OG-O 3.08Å; I151-P153 HydrophobicContact CD1-CG 4.5Å; I151-L176 HydrophobicContact CD1-CB 4.05Å; I151-L176 HydrophobicContact CD1-CD2 3.64Å; I151-L176 HydrophobicContact CD1-CG 3.86Å; I151-K177 HydrophobicContact CG2-CB 3.82Å; I151-K177 HydrophobicContact CG2-CD 3.63Å; I151-K177 HydrophobicContact CG2-CG 4.3Å
152K94.7Very high96Very high184 Ų18445.5 Ų45.580%0.822%0.223SC*.  trans-137.572.4169.5-168.5175.3-177.5176.30109
153P96Very high96.2Very high12 Ų1245.3 Ų45.38%0.07822%0.221CC..  trans-70.7147-170.830.8-36000111.2F63 I119 I151 M157 I158 L176F63-P153 HydrophobicContact CE2-CG 4.5Å; F63-P153 HydrophobicContact CZ-CG 4.2Å; F63-P153 VanDerWaalsContact CZ-O 3.29Å; F63-P153 WeakPolarHBondContact CZ-O 3.5Å; I119-P153 HydrophobicContact CD1-CG 3.88Å; I119-P153 HydrophobicContact CG1-CG 3.98Å; I151-P153 HydrophobicContact CD1-CG 4.5Å; P153-M157 HydrophobicContact CB-CB 4.14Å; P153-M157 HydrophobicContact CB-CG 4.21Å; P153-I158 HydrophobicContact CB-CG1 4.12Å; P153-I158 HydrophobicContact CG-CD1 4.28Å; P153-I158 HydrophobicContact CG-CG1 4.24Å; P153-L176 HydrophobicContact CB-CD2 3.96Å; P153-L176 HydrophobicContact CG-CD2 3.87Å
154S95.9Very high96.3Very high59 Ų5940.6 Ų40.641%0.41320%0.199SC..  trans-77158.1162.866.30000110.2L156 M157 I158S154-L156 PolarHBondContact O-N 3.44Å; S154-M157 WeakPolarHBondContact O-CB 3.18Å; S154-M157 PolarHBondContact O-N 3.38Å; S154-M157 PolarHBondContact OG-N 3.25Å; S154-M157 VanDerWaalsContact OG-N 3.13Å; S154-I158 PolarHBondContact O-N 2.92Å
155P95.7Very high96.3Very high48 Ų4839.5 Ų39.531%0.31219%0.194SC..Hα-helixtrans-51.1-39.3170.6-29.737.2000112.5T60 F63 I64 M157 I158 M159T60-P155 HydrophobicContact CG2-CB 3.73Å; F63-P155 HydrophobicContact CD1-CG 4.38Å; F63-P155 HydrophobicContact CE1-CG 4.14Å; I64-P155 HydrophobicContact CD1-CG 4.08Å; I64-P155 HydrophobicContact CG1-CG 4.11Å; P155-M157 PolarHBondContact O-N 2.97Å; P155-I158 WeakPolarHBondContact O-CB 3.38Å; P155-I158 PolarHBondContact O-N 3.35Å; P155-M159 WeakPolarHBondContact O-CG 3.47Å; P155-M159 PolarHBondContact O-N 2.94Å; P155-M159 VanDerWaalsContact O-N 3.08Å
156L95.7Very high96.3Very high73 Ų7339.4 Ų39.438%0.38219%0.193SC..Hα-helixtrans-61.6-42.6175.6178.964.2000112.2W31 S154 I158 M159 L160W31-L156 HydrophobicContact CH2-CD1 3.68Å; W31-L156 HydrophobicContact CH2-CD2 4.36Å; W31-L156 HydrophobicContact CZ2-CD1 3.73Å; W31-L156 HydrophobicContact CZ2-CD2 3.61Å; W31-L156 HydrophobicContact CZ2-CG 4.21Å; W31-L156 HydrophobicContact CZ3-CD1 4.5Å; S154-L156 PolarHBondContact O-N 3.44Å; L156-I158 VanDerWaalsContact C-N 3.29Å; L156-I158 PolarHBondContact O-N 3.07Å; L156-M159 WeakPolarHBondContact O-CB 3.44Å; L156-M159 PolarHBondContact O-N 3.21Å; L156-M159 VanDerWaalsContact O-N 3.15Å; L156-L160 HydrophobicContact CD1-CD1 4.33Å; L156-L160 HydrophobicContact CD1-CG 4.25Å; L156-L160 HydrophobicContact CG-CD1 4Å; L156-L160 HydrophobicContact CG-CG 4.34Å; L156-L160 VanDerWaalsContact O-CG 3.29Å; L156-L160 WeakPolarHBondContact O-CG 3.43Å; L156-L160 PolarHBondContact O-N 2.95Å
157M96.2Very high96.2Very high25 Ų2534.5 Ų34.512%0.12317%0.173CC..Hα-helixtrans-61.2-39.3177.8-174.461.3172.200111.8P153 S154 P155 L160 Y161 L176 F179 E180 C183P153-M157 HydrophobicContact CB-CB 4.14Å; P153-M157 HydrophobicContact CB-CG 4.21Å; S154-M157 WeakPolarHBondContact O-CB 3.18Å; S154-M157 PolarHBondContact O-N 3.38Å; S154-M157 PolarHBondContact OG-N 3.25Å; S154-M157 VanDerWaalsContact OG-N 3.13Å; P155-M157 PolarHBondContact O-N 2.97Å; M157-L160 PolarHBondContact O-N 2.96Å; M157-Y161 VanDerWaalsContact O-CB 3.31Å; M157-Y161 WeakPolarHBondContact O-CB 3.39Å; M157-Y161 PolarHBondContact O-N 3.41Å; M157-L176 HydrophobicContact CG-CD1 4.35Å; M157-F179 HydrophobicContact CE-CD1 3.4Å; M157-F179 VanDerWaalsContact CE-CD1 3.4Å; M157-F179 HydrophobicContact CE-CE1 3.66Å; M157-F179 HydrophobicContact CE-CG 4.45Å; M157-F179 HydrophobicContact SD-CD1 4.06Å; M157-F179 HydrophobicContact SD-CE1 3.72Å; M157-E180 HydrophobicContact CE-CB 3.67Å; M157-E180 HydrophobicContact CE-CG 4.1Å; M157-C183 HydrophobicContact CE-CB 4.29Å
158I97Very high96.3Very high0 Ų029.1 Ų29.10%015%0.149CC..Hα-helixtrans-63.2-43.2174.8-63.6169.5000110.4L56 F59 F63 L112 P153 S154 P155 L156 Y161 A162 L176L56-I158 HydrophobicContact CD1-CG2 4.03Å; F59-I158 HydrophobicContact CD1-CG2 3.95Å; F59-I158 HydrophobicContact CE1-CD1 4.24Å; F59-I158 HydrophobicContact CE1-CG2 3.75Å; F63-I158 HydrophobicContact CB-CD1 4.36Å; F63-I158 HydrophobicContact CD1-CD1 3.41Å; F63-I158 VanDerWaalsContact CD1-CD1 3.41Å; F63-I158 HydrophobicContact CD2-CD1 4.14Å; F63-I158 HydrophobicContact CE1-CD1 3.6Å; F63-I158 HydrophobicContact CE2-CD1 4.32Å; F63-I158 HydrophobicContact CG-CD1 3.69Å; F63-I158 HydrophobicContact CZ-CD1 4.07Å; L112-I158 HydrophobicContact CD2-CG2 4.09Å; P153-I158 HydrophobicContact CB-CG1 4.12Å; P153-I158 HydrophobicContact CG-CD1 4.28Å; P153-I158 HydrophobicContact CG-CG1 4.24Å; S154-I158 PolarHBondContact O-N 2.92Å; P155-I158 WeakPolarHBondContact O-CB 3.38Å; P155-I158 PolarHBondContact O-N 3.35Å; L156-I158 VanDerWaalsContact C-N 3.29Å; L156-I158 PolarHBondContact O-N 3.07Å; I158-Y161 PolarHBondContact O-N 3.05Å; I158-A162 VanDerWaalsContact O-CB 3.32Å; I158-A162 WeakPolarHBondContact O-CB 3.37Å; I158-A162 PolarHBondContact O-N 3.21Å; I158-L176 HydrophobicContact CG1-CD2 4.48Å
159M96.4Very high96.2Very high90 Ų9027.8 Ų27.844%0.44314%0.144SC..Hα-helixtrans-64.1-42.8177.3-66.1177.568.400112.6L56 P155 L156 Y161 A162 Y163L56-M159 HydrophobicContact CD2-CB 4.3Å; L56-M159 HydrophobicContact CD2-CG 4.09Å; L56-M159 HydrophobicContact CG-CG 4.44Å; P155-M159 WeakPolarHBondContact O-CG 3.47Å; P155-M159 PolarHBondContact O-N 2.94Å; P155-M159 VanDerWaalsContact O-N 3.08Å; L156-M159 WeakPolarHBondContact O-CB 3.44Å; L156-M159 PolarHBondContact O-N 3.21Å; L156-M159 VanDerWaalsContact O-N 3.15Å; M159-Y161 VanDerWaalsContact C-N 3.34Å; M159-A162 PolarHBondContact O-N 3.38Å; M159-Y163 PolarHBondContact O-N 2.76Å
160L97.5Very high96Very high13 Ų1327.6 Ų27.67%0.06815%0.145CC..Hα-helixtrans-64.8-40177-66.1172.9000111.3P30 W31 A34 L156 M157 C164 F179P30-L160 HydrophobicContact CB-CD1 4.11Å; W31-L160 HydrophobicContact CD2-CD2 4.01Å; W31-L160 HydrophobicContact CE3-CD2 4.02Å; W31-L160 HydrophobicContact CG-CD2 4.35Å; A34-L160 HydrophobicContact CB-CB 4.32Å; A34-L160 HydrophobicContact CB-CD2 3.53Å; L156-L160 HydrophobicContact CD1-CD1 4.33Å; L156-L160 HydrophobicContact CD1-CG 4.25Å; L156-L160 HydrophobicContact CG-CD1 4Å; L156-L160 HydrophobicContact CG-CG 4.34Å; L156-L160 VanDerWaalsContact O-CG 3.29Å; L156-L160 WeakPolarHBondContact O-CG 3.43Å; L156-L160 PolarHBondContact O-N 2.95Å; M157-L160 PolarHBondContact O-N 2.96Å; L160-C164 WeakPolarHBondContact O-CB 3.37Å; L160-C164 PolarHBondContact O-N 2.73Å; L160-F179 HydrophobicContact CB-CE1 4.18Å; L160-F179 HydrophobicContact CB-CZ 4.13Å
161Y97.7Very high95.5Very high0 Ų026.9 Ų26.90%014%0.141CC..Hα-helixtrans-64.7-43.4174.6173.1-123.1000112.2R111 A115 M157 I158 M159 Y163 C164 Y174 L176 F179R111-Y161 HydrophobicContact CB-CD1 4.31Å; R111-Y161 HydrophobicContact CB-CE1 3.51Å; R111-Y161 HydrophobicContact CG-CE1 3.92Å; R111-Y161 HydrophobicContact CG-CE2 4.28Å; R111-Y161 WeakPolarHBondContact CG-OH 3.27Å; R111-Y161 PolarHBondContact NH1-O 3.2Å; A115-Y161 HydrophobicContact CB-CE1 4.3Å; M157-Y161 VanDerWaalsContact O-CB 3.31Å; M157-Y161 WeakPolarHBondContact O-CB 3.39Å; M157-Y161 PolarHBondContact O-N 3.41Å; I158-Y161 PolarHBondContact O-N 3.05Å; M159-Y161 VanDerWaalsContact C-N 3.34Å; Y161-Y163 VanDerWaalsContact C-N 3.35Å; Y161-Y163 PolarHBondContact O-N 2.74Å; Y161-C164 PolarHBondContact O-N 2.98Å; Y161-Y174 AromaticContact CD2-CE2 3.91Å; Y161-Y174 HydrophobicContact CD2-CE2 3.91Å; Y161-Y174 AromaticContact CE2-CD2 3.78Å; Y161-Y174 HydrophobicContact CE2-CD2 3.78Å; Y161-Y174 AromaticContact CE2-CE2 3.5Å; Y161-Y174 HydrophobicContact CE2-CE2 3.5Å; Y161-Y174 PolarHBondContact OH-O 3.17Å; Y161-L176 HydrophobicContact CD1-CB 4.36Å; Y161-L176 HydrophobicContact CD1-CD1 3.82Å; Y161-L176 HydrophobicContact CD2-CD1 4.2Å; Y161-L176 HydrophobicContact CE1-CB 4.12Å; Y161-L176 HydrophobicContact CE1-CD1 4.42Å; Y161-L176 HydrophobicContact CG-CD1 3.67Å; Y161-F179 HydrophobicContact CD2-CB 3.54Å; Y161-F179 AromaticContact CD2-CD1 3.84Å; Y161-F179 HydrophobicContact CD2-CD1 3.84Å; Y161-F179 HydrophobicContact CD2-CD2 4.18Å; Y161-F179 AromaticContact CD2-CG 3.58Å; Y161-F179 HydrophobicContact CD2-CG 3.58Å; Y161-F179 HydrophobicContact CE2-CB 3.97Å; Y161-F179 HydrophobicContact CE2-CG 4.46Å; Y161-F179 HydrophobicContact CG-CB 4.47Å; Y161-F179 HydrophobicContact CG-CD1 4.09Å; Y161-F179 HydrophobicContact CG-CG 4.3Å
162A97.6Very high95.5Very high0 Ų026.4 Ų26.40%014%0.139CC..Hα-helixtrans-59.7-43.2-179.500000112.6L56 L108 I158 M159 L168L56-A162 HydrophobicContact CD1-CB 3.6Å; L56-A162 HydrophobicContact CD2-CB 3.81Å; L56-A162 HydrophobicContact CG-CB 4.28Å; L108-A162 HydrophobicContact CD1-CB 3.56Å; I158-A162 VanDerWaalsContact O-CB 3.32Å; I158-A162 WeakPolarHBondContact O-CB 3.37Å; I158-A162 PolarHBondContact O-N 3.21Å; M159-A162 PolarHBondContact O-N 3.38Å; A162-L168 WeakPolarHBondContact O-CD1 3.49Å
163Y97.4Very high95.6Very high14 Ų1417.8 Ų17.86%0.05510%0.101CC..Hα-helixtrans-100.96.9-177.9-72.2-64.3000114.9A34 G37 F38 F41 S52 L53 L56 M159 Y161 Y165A34-Y163 WeakPolarHBondContact CA-O 3.27Å; G37-Y163 WeakPolarHBondContact CA-O 3.5Å; F38-Y163 HydrophobicContact CB-CD1 4.4Å; F38-Y163 HydrophobicContact CB-CG 4.38Å; F38-Y163 HydrophobicContact CD2-CD1 4.11Å; F38-Y163 HydrophobicContact CD2-CD2 4.48Å; F38-Y163 HydrophobicContact CD2-CE1 4.02Å; F38-Y163 HydrophobicContact CD2-CE2 4.36Å; F38-Y163 HydrophobicContact CD2-CG 4.36Å; F41-Y163 HydrophobicContact CD1-CE1 4.25Å; S52-Y163 WeakPolarHBondContact OG-CE1 3.49Å; S52-Y163 PolarHBondContact OG-OH 3.45Å; L53-Y163 WeakPolarHBondContact CA-OH 3.37Å; L53-Y163 HydrophobicContact CD2-CE2 3.96Å; L53-Y163 VanDerWaalsContact CD2-OH 3.25Å; L53-Y163 WeakPolarHBondContact CD2-OH 3.44Å; L53-Y163 WeakPolarHBondContact CG-OH 3.4Å; L53-Y163 PolarHBondContact N-OH 3.47Å; L53-Y163 VanDerWaalsContact N-OH 3.12Å; L56-Y163 HydrophobicContact CD2-CD2 3.86Å; L56-Y163 HydrophobicContact CD2-CE2 3.38Å; M159-Y163 PolarHBondContact O-N 2.76Å; Y161-Y163 VanDerWaalsContact C-N 3.35Å; Y161-Y163 PolarHBondContact O-N 2.74Å; Y163-Y165 PolarHBondContact O-N 3.29Å
164C97.2Very high95.6Very high0 Ų017.2 Ų17.20%010%0.098CC..  trans-58.5117.4173-176.40000109.9R111 L160 Y161 I166 L168 F179R111-C164 PolarHBondContact NH1-O 3.41Å; L160-C164 WeakPolarHBondContact O-CB 3.37Å; L160-C164 PolarHBondContact O-N 2.73Å; Y161-C164 PolarHBondContact O-N 2.98Å; C164-I166 PolarHBondContact O-N 2.85Å; C164-I166 VanDerWaalsContact O-N 3.17Å; C164-L168 WeakPolarHBondContact O-CB 3.42Å; C164-F179 HydrophobicContact CB-CD2 4.38Å; C164-F179 HydrophobicContact CB-CE2 3.74Å; C164-F179 HydrophobicContact CB-CZ 4.33Å
165Y96.5Very high95.7Very high2 Ų214.6 Ų14.61%0.0088%0.079CC..SBendtrans-57.5-30.8-175.682.7-73.1000113.2S15 I18 G19 I22 A33 V36 G37 Y163 G167 L168 V261S15-Y165 WeakPolarHBondContact O-CE2 3.34Å; I18-Y165 HydrophobicContact CG2-CE2 4.47Å; G19-Y165 WeakPolarHBondContact CA-OH 3.4Å; I22-Y165 HydrophobicContact CD1-CD1 3.94Å; I22-Y165 HydrophobicContact CD1-CE1 3.03Å; I22-Y165 WeakPolarHBondContact CD1-OH 3.43Å; A33-Y165 HydrophobicContact CB-CD1 4Å; A33-Y165 HydrophobicContact CB-CE1 4.08Å; A33-Y165 WeakPolarHBondContact O-CD1 3.44Å; A33-Y165 PolarHBondContact O-N 3.45Å; A33-Y165 VanDerWaalsContact O-N 3.14Å; V36-Y165 HydrophobicContact CG1-CD1 4.39Å; V36-Y165 HydrophobicContact CG1-CG 4.07Å; G37-Y165 VanDerWaalsContact CA-CB 3.41Å; Y163-Y165 PolarHBondContact O-N 3.29Å; Y165-G167 PolarHBondContact O-N 2.6Å; Y165-G167 VanDerWaalsContact O-N 3.09Å; Y165-L168 WeakPolarHBondContact O-CB 3.29Å; Y165-L168 PolarHBondContact O-N 3.23Å; Y165-V261 HydrophobicContact CE2-CG1 3.9Å
166I96.4Very high95.8Very high0 Ų012.4 Ų12.40%07%0.065CC..THydrogen-bonded Turntrans-60.5115.9178.5-51.7171.9000107.4R111 C164 L168 Y174 F182 V261 C262 A265 L267R111-I166 PolarHBondContact NH2-O 3.23Å; C164-I166 PolarHBondContact O-N 2.85Å; C164-I166 VanDerWaalsContact O-N 3.17Å; I166-L168 VanDerWaalsContact C-N 3.26Å; I166-L168 PolarHBondContact O-N 3.49Å; I166-Y174 HydrophobicContact CG2-CE1 4.35Å; I166-Y174 WeakPolarHBondContact O-CE1 3.44Å; I166-Y174 PolarHBondContact O-OH 2.99Å; I166-F182 HydrophobicContact CD1-CE1 4.31Å; I166-F182 HydrophobicContact CD1-CE2 4.04Å; I166-F182 HydrophobicContact CD1-CZ 3.73Å; I166-V261 HydrophobicContact CG2-CG1 4.39Å; I166-C262 HydrophobicContact CG2-CB 4.34Å; I166-C262 VanDerWaalsContact CG2-SG 3.58Å; I166-A265 HydrophobicContact CD1-CB 3.42Å; I166-A265 VanDerWaalsContact CD1-CB 3.42Å; I166-A265 HydrophobicContact CG1-CB 4.2Å; I166-L267 HydrophobicContact CB-CD1 4.18Å; I166-L267 HydrophobicContact CD1-CB 4.12Å; I166-L267 HydrophobicContact CD1-CD1 3.75Å; I166-L267 HydrophobicContact CG2-CB 4.37Å; I166-L267 HydrophobicContact CG2-CD1 3.95Å; I166-L267 HydrophobicContact CG2-CG 4.5Å
167G94Very high95.8Very high3 Ų39.9 Ų9.93%0.0315%0.051CC..THydrogen-bonded Turntrans68.114.1-178.700000115.9L107 R111 Y165 G171L107-G167 WeakPolarHBondContact CD1-O 3.23Å; R111-G167 PolarHBondContact NH2-O 2.9Å; Y165-G167 PolarHBondContact O-N 2.6Å; Y165-G167 VanDerWaalsContact O-N 3.09Å; G167-G171 WeakPolarHBondContact CA-O 3.44Å; G167-G171 PolarHBondContact O-N 2.91Å
168L96Very high95.9Very high1 Ų18.8 Ų8.81%0.0055%0.045CC..THydrogen-bonded Turntrans-73.5-32.8179-175.558.7000113V104 L107 A162 C164 Y165 I166V104-L168 HydrophobicContact CG1-CD1 3.9Å; V104-L168 HydrophobicContact CG1-CG 4.35Å; V104-L168 HydrophobicContact CG2-CG 4.17Å; L107-L168 WeakPolarHBondContact CD1-O 3.38Å; A162-L168 WeakPolarHBondContact O-CD1 3.49Å; C164-L168 WeakPolarHBondContact O-CB 3.42Å; Y165-L168 WeakPolarHBondContact O-CB 3.29Å; Y165-L168 PolarHBondContact O-N 3.23Å; I166-L168 VanDerWaalsContact C-N 3.26Å; I166-L168 PolarHBondContact O-N 3.49Å
169F94.6Very high95.9Very high4 Ų48.8 Ų8.82%0.0185%0.045CC..THydrogen-bonded Turntrans-107-13.5-171.2-62.7-81.4000114.6I11 M40 F41 V100 I103 V104I11-F169 HydrophobicContact CD1-CD1 4.02Å; I11-F169 HydrophobicContact CD1-CE1 4.26Å; I11-F169 HydrophobicContact CD1-CG 4.41Å; I11-F169 HydrophobicContact CG2-CB 3.69Å; I11-F169 HydrophobicContact CG2-CD1 4.17Å; I11-F169 HydrophobicContact CG2-CD2 3.46Å; I11-F169 VanDerWaalsContact CG2-CD2 3.46Å; I11-F169 HydrophobicContact CG2-CE2 4.09Å; I11-F169 HydrophobicContact CG2-CG 3.51Å; M40-F169 HydrophobicContact CB-CE2 3.95Å; M40-F169 HydrophobicContact CB-CZ 3.76Å; M40-F169 HydrophobicContact CE-CE2 4.12Å; M40-F169 HydrophobicContact SD-CE2 4.49Å; F41-F169 HydrophobicContact CB-CE1 4.21Å; F41-F169 HydrophobicContact CB-CZ 3.98Å; F41-F169 HydrophobicContact CD2-CE1 4.21Å; V100-F169 HydrophobicContact CG1-CD1 3.97Å; V100-F169 HydrophobicContact CG1-CE1 3.89Å; I103-F169 WeakPolarHBondContact CG2-O 3.4Å; V104-F169 HydrophobicContact CG2-CD1 3.69Å; V104-F169 HydrophobicContact CG2-CE1 3.74Å
170T91.1Very high95.8Very high23 Ų236.3 Ų6.314%0.1413%0.033CC..THydrogen-bonded Turntrans-146.5-3.8-173.2480000114.2L12 W255 S258L12-T170 HydrophobicContact CD1-CG2 4.27Å; L12-T170 HydrophobicContact CD2-CG2 3.93Å; L12-T170 HydrophobicContact CG-CG2 4.24Å; T170-W255 PolarHBondContact O-NE1 3.05Å; T170-S258 WeakPolarHBondContact OG1-CB 3.35Å; T170-S258 PolarHBondContact OG1-OG 2.98Å
171G86.3Confident95.7Very high3 Ų37.4 Ų7.43%0.0314%0.038CC..  trans74.3-171.3-162.100000111.1L107 G167 S258L107-G171 VanDerWaalsContact CD1-N 3.35Å; G167-G171 WeakPolarHBondContact CA-O 3.44Å; G167-G171 PolarHBondContact O-N 2.91Å; G171-S258 VanDerWaalsContact O-CB 3.23Å; G171-S258 WeakPolarHBondContact O-CB 3.49Å; G171-S258 PolarHBondContact O-OG 3.4Å
172P95.2Very high95.5Very high1 Ų17.7 Ų7.71%0.0064%0.04CC..  cis-62.3159.3-0.325-33.3000113I350 N352P172-I350 HydrophobicContact CG-CB 4.13Å; P172-N352 HydrophobicContact CB-CB 4.01Å
173Y96.3Very high95.3Very high3 Ų38.6 Ų8.61%0.0125%0.046CC..  trans-69.1139.7160168-94.1000108.9L110 S374 F377 W378 Y382L110-Y173 HydrophobicContact CB-CD2 3.92Å; L110-Y173 HydrophobicContact CB-CE2 4.41Å; Y173-S374 PolarHBondContact N-OG 3.13Å; Y173-S374 WeakPolarHBondContact O-CB 3.27Å; Y173-F377 HydrophobicContact CE1-CD1 4.26Å; Y173-F377 HydrophobicContact CE1-CE1 4.31Å; Y173-W378 HydrophobicContact CD1-CB 4.22Å; Y173-W378 AromaticContact CD2-CD1 3.97Å; Y173-W378 HydrophobicContact CE1-CB 4.28Å; Y173-W378 AromaticContact CE1-CD1 3.79Å; Y173-W378 HydrophobicContact CE1-CG 4.46Å; Y173-W378 AromaticContact CE2-CD1 3.54Å; Y173-W378 AromaticContact CZ-CD1 3.45Å; Y173-W378 VanDerWaalsContact CZ-CD1 3.45Å; Y173-Y382 PolarHBondContact OH-OH 3.36Å
174Y97Very high94.9Very high0 Ų013.7 Ų13.70%07%0.074CC..  trans-139.7149.4167.852.3-94.4000108R111 Y161 I166 F179 L267R111-Y174 PolarHBondContact NH1-OH 3.18Å; R111-Y174 PolarHBondContact NH2-OH 3.34Å; R111-Y174 VanDerWaalsContact NH2-OH 3.13Å; Y161-Y174 AromaticContact CD2-CE2 3.91Å; Y161-Y174 HydrophobicContact CD2-CE2 3.91Å; Y161-Y174 AromaticContact CE2-CD2 3.78Å; Y161-Y174 HydrophobicContact CE2-CD2 3.78Å; Y161-Y174 AromaticContact CE2-CE2 3.5Å; Y161-Y174 HydrophobicContact CE2-CE2 3.5Å; Y161-Y174 PolarHBondContact OH-O 3.17Å; I166-Y174 HydrophobicContact CG2-CE1 4.35Å; I166-Y174 WeakPolarHBondContact O-CE1 3.44Å; I166-Y174 PolarHBondContact O-OH 2.99Å; Y174-F179 HydrophobicContact CD2-CB 4.22Å; Y174-F179 HydrophobicContact CE2-CB 3.96Å; Y174-F179 HydrophobicContact CE2-CD2 4.12Å; Y174-F179 HydrophobicContact CE2-CG 4.41Å; Y174-L267 HydrophobicContact CD1-CD1 4.5Å; Y174-L267 HydrophobicContact CD1-CD2 3.86Å; Y174-L267 HydrophobicContact CD2-CD1 4.35Å; Y174-L267 HydrophobicContact CD2-CD2 4.38Å; Y174-L267 HydrophobicContact CE1-CD1 4.11Å; Y174-L267 HydrophobicContact CE1-CD2 4.21Å; Y174-L267 HydrophobicContact CE2-CD1 3.96Å; Y174-L267 HydrophobicContact CG-CD2 3.95Å
175S97.4Very high94.1Very high4 Ų415.5 Ų15.53%0.0288%0.081CC..  trans-72.5162-174.993.30000112.1E118 K177 T178 F179E118-S175 VanDerWaalsContact CD-CB 3.46Å; E118-S175 WeakPolarHBondContact OE1-CB 3.39Å; E118-S175 PolarHBondContact OE1-OG 3.42Å; E118-S175 WeakPolarHBondContact OE2-CB 3.3Å; S175-K177 PolarHBondContact O-N 3.44Å; S175-K177 PolarHBondContact OG-N 3.06Å; S175-T178 PolarHBondContact O-N 2.93Å; S175-T178 PolarHBondContact OG-N 3.22Å; S175-F179 PolarHBondContact O-N 3.34Å
176L97.6Very high93.2Very high2 Ų219 Ų191%0.0110%0.1CC..Hα-helixtrans-62.8-32.8173.9178.154.3000110.5A115 E118 I151 P153 M157 I158 Y161 F179 E180A115-L176 HydrophobicContact CB-CB 4.12Å; A115-L176 HydrophobicContact CB-CD2 3.71Å; E118-L176 WeakPolarHBondContact OE2-CB 3.25Å; E118-L176 PolarHBondContact OE2-N 2.92Å; I151-L176 HydrophobicContact CD1-CB 4.05Å; I151-L176 HydrophobicContact CD1-CD2 3.64Å; I151-L176 HydrophobicContact CD1-CG 3.86Å; P153-L176 HydrophobicContact CB-CD2 3.96Å; P153-L176 HydrophobicContact CG-CD2 3.87Å; M157-L176 HydrophobicContact CG-CD1 4.35Å; I158-L176 HydrophobicContact CG1-CD2 4.48Å; Y161-L176 HydrophobicContact CD1-CB 4.36Å; Y161-L176 HydrophobicContact CD1-CD1 3.82Å; Y161-L176 HydrophobicContact CD2-CD1 4.2Å; Y161-L176 HydrophobicContact CE1-CB 4.12Å; Y161-L176 HydrophobicContact CE1-CD1 4.42Å; Y161-L176 HydrophobicContact CG-CD1 3.67Å; L176-F179 HydrophobicContact CD1-CD1 4.15Å; L176-F179 WeakPolarHBondContact O-CB 3.19Å; L176-F179 PolarHBondContact O-N 3.46Å; L176-E180 PolarHBondContact O-N 3.48Å
177K97.3Very high91.9Very high20 Ų2021.5 Ų21.59%0.08712%0.117CC..Hα-helixtrans-61.6-45.3171.7-179.761.1-169.2150.50112.5E118 Y148 I151 S175 F179 E180 D181E118-K177 VanDerWaalsContact OE1-CB 3.29Å; E118-K177 WeakPolarHBondContact OE1-CB 3.36Å; E118-K177 PolarHBondContact OE1-N 3.38Å; Y148-K177 WeakPolarHBondContact O-CE 3.44Å; I151-K177 HydrophobicContact CG2-CB 3.82Å; I151-K177 HydrophobicContact CG2-CD 3.63Å; I151-K177 HydrophobicContact CG2-CG 4.3Å; S175-K177 PolarHBondContact O-N 3.44Å; S175-K177 PolarHBondContact OG-N 3.06Å; K177-F179 VanDerWaalsContact C-N 3.27Å; K177-F179 PolarHBondContact O-N 3.46Å; K177-E180 IonicContact NZ-OE2 2.67Å; K177-E180 PolarHBondContact NZ-OE2 2.84Å; K177-E180 WeakPolarHBondContact O-CB 3.37Å; K177-E180 PolarHBondContact O-N 3Å; K177-E180 VanDerWaalsContact O-N 3.15Å; K177-D181 WeakPolarHBondContact CE-OD1 3.18Å; K177-D181 IonicContact NZ-OD1 3.6Å; K177-D181 PolarHBondContact NZ-OD1 3.19Å; K177-D181 VanDerWaalsContact O-CG 3.3Å; K177-D181 PolarHBondContact O-N 3.17Å
178T97Very high90.7Very high1 Ų130.1 Ų30.11%0.00615%0.154CC..Hα-helixtrans-61.8-36.5175.6-600000112.1S175 F182 L267 Y270 T349S175-T178 PolarHBondContact O-N 2.93Å; S175-T178 PolarHBondContact OG-N 3.22Å; T178-F182 WeakPolarHBondContact O-CB 3.44Å; T178-F182 PolarHBondContact O-N 2.78Å; T178-L267 HydrophobicContact CG2-CD2 4.33Å; T178-Y270 WeakPolarHBondContact CA-OH 3.25Å; T178-Y270 HydrophobicContact CG2-CE2 4.41Å; T178-T349 HydrophobicContact CG2-CG2 4.22Å
179F97.1Very high89.6Confident0 Ų031.9 Ų31.90%017%0.165CC..Hα-helixtrans-66-42.6173.2-178.5-110.9000112.3P30 M157 L160 Y161 C164 Y174 S175 L176 K177 D181 F182 C183P30-F179 HydrophobicContact CB-CZ 4.13Å; M157-F179 HydrophobicContact CE-CD1 3.4Å; M157-F179 VanDerWaalsContact CE-CD1 3.4Å; M157-F179 HydrophobicContact CE-CE1 3.66Å; M157-F179 HydrophobicContact CE-CG 4.45Å; M157-F179 HydrophobicContact SD-CD1 4.06Å; M157-F179 HydrophobicContact SD-CE1 3.72Å; L160-F179 HydrophobicContact CB-CE1 4.18Å; L160-F179 HydrophobicContact CB-CZ 4.13Å; Y161-F179 HydrophobicContact CD2-CB 3.54Å; Y161-F179 AromaticContact CD2-CD1 3.84Å; Y161-F179 HydrophobicContact CD2-CD1 3.84Å; Y161-F179 HydrophobicContact CD2-CD2 4.18Å; Y161-F179 AromaticContact CD2-CG 3.58Å; Y161-F179 HydrophobicContact CD2-CG 3.58Å; Y161-F179 HydrophobicContact CE2-CB 3.97Å; Y161-F179 HydrophobicContact CE2-CG 4.46Å; Y161-F179 HydrophobicContact CG-CB 4.47Å; Y161-F179 HydrophobicContact CG-CD1 4.09Å; Y161-F179 HydrophobicContact CG-CG 4.3Å; C164-F179 HydrophobicContact CB-CD2 4.38Å; C164-F179 HydrophobicContact CB-CE2 3.74Å; C164-F179 HydrophobicContact CB-CZ 4.33Å; Y174-F179 HydrophobicContact CD2-CB 4.22Å; Y174-F179 HydrophobicContact CE2-CB 3.96Å; Y174-F179 HydrophobicContact CE2-CD2 4.12Å; Y174-F179 HydrophobicContact CE2-CG 4.41Å; S175-F179 PolarHBondContact O-N 3.34Å; L176-F179 HydrophobicContact CD1-CD1 4.15Å; L176-F179 WeakPolarHBondContact O-CB 3.19Å; L176-F179 PolarHBondContact O-N 3.46Å; K177-F179 VanDerWaalsContact C-N 3.27Å; K177-F179 PolarHBondContact O-N 3.46Å; F179-D181 PolarHBondContact O-N 3.22Å; F179-F182 AromaticContact CD2-CD1 3.98Å; F179-F182 HydrophobicContact CD2-CD1 3.98Å; F179-F182 HydrophobicContact CE2-CD1 4.02Å; F179-F182 HydrophobicContact CE2-CE1 4.18Å; F179-F182 WeakPolarHBondContact O-CB 3.33Å; F179-F182 PolarHBondContact O-N 2.69Å; F179-C183 VanDerWaalsContact CZ-SG 3.6Å; F179-C183 PolarHBondContact O-N 3.13Å; F179-C183 PolarHBondContact O-SG 3.16Å
180E95.6Very high88.4Confident39 Ų3937.5 Ų37.518%0.18220%0.199CC..Hα-helixtrans-59.7-43.8174.9-175.9-175.2-110.300112.1M157 L176 K177 F182 C183 N184M157-E180 HydrophobicContact CE-CB 3.67Å; M157-E180 HydrophobicContact CE-CG 4.1Å; L176-E180 PolarHBondContact O-N 3.48Å; K177-E180 IonicContact NZ-OE2 2.67Å; K177-E180 PolarHBondContact NZ-OE2 2.84Å; K177-E180 WeakPolarHBondContact O-CB 3.37Å; K177-E180 PolarHBondContact O-N 3Å; K177-E180 VanDerWaalsContact O-N 3.15Å; E180-F182 VanDerWaalsContact C-N 3.33Å; E180-F182 PolarHBondContact O-N 3.49Å; E180-C183 WeakPolarHBondContact O-CB 3.45Å; E180-C183 PolarHBondContact O-N 2.73Å; E180-C183 VanDerWaalsContact O-N 3.15Å; E180-N184 WeakPolarHBondContact CG-ND2 3.41Å; E180-N184 WeakPolarHBondContact O-CB 3.45Å; E180-N184 PolarHBondContact O-N 3.03Å; E180-N184 PolarHBondContact O-ND2 3.23Å
181D94.1Very high87.7Confident35 Ų3536.6 Ų36.619%0.18719%0.193CC..Hα-helixtrans-61.9-41.9175.6-64.2-21.3000111.4K177 F179 C183 N184 W185 Y270K177-D181 WeakPolarHBondContact CE-OD1 3.18Å; K177-D181 IonicContact NZ-OD1 3.6Å; K177-D181 PolarHBondContact NZ-OD1 3.19Å; K177-D181 VanDerWaalsContact O-CG 3.3Å; K177-D181 PolarHBondContact O-N 3.17Å; F179-D181 PolarHBondContact O-N 3.22Å; D181-C183 VanDerWaalsContact C-N 3.33Å; D181-C183 PolarHBondContact O-N 3.06Å; D181-N184 PolarHBondContact O-N 3.19Å; D181-W185 PolarHBondContact O-N 3.13Å; D181-Y270 HydrophobicContact CB-CE1 4.27Å; D181-Y270 WeakPolarHBondContact OD2-CE1 3.33Å; D181-Y270 PolarHBondContact OD2-OH 3.21Å
182F93.7Very high87.2Confident7 Ų741.2 Ų41.23%0.03122%0.221CC..Hα-helixtrans-61-38.8173.3161.8-99.1000112.8I22 R29 I166 T178 F179 E180 A265 L267I22-F182 HydrophobicContact CG2-CE2 4.39Å; I22-F182 HydrophobicContact CG2-CZ 3.85Å; R29-F182 HydrophobicContact CG-CE1 4Å; R29-F182 HydrophobicContact CG-CE2 4.31Å; R29-F182 HydrophobicContact CG-CZ 3.65Å; R29-F182 PolarHBondContact NH1-O 3.35Å; I166-F182 HydrophobicContact CD1-CE1 4.31Å; I166-F182 HydrophobicContact CD1-CE2 4.04Å; I166-F182 HydrophobicContact CD1-CZ 3.73Å; T178-F182 WeakPolarHBondContact O-CB 3.44Å; T178-F182 PolarHBondContact O-N 2.78Å; F179-F182 AromaticContact CD2-CD1 3.98Å; F179-F182 HydrophobicContact CD2-CD1 3.98Å; F179-F182 HydrophobicContact CE2-CD1 4.02Å; F179-F182 HydrophobicContact CE2-CE1 4.18Å; F179-F182 WeakPolarHBondContact O-CB 3.33Å; F179-F182 PolarHBondContact O-N 2.69Å; E180-F182 VanDerWaalsContact C-N 3.33Å; E180-F182 PolarHBondContact O-N 3.49Å; F182-A265 HydrophobicContact CE2-CB 4.37Å; F182-A265 WeakPolarHBondContact CE2-O 3.49Å; F182-L267 HydrophobicContact CB-CD1 4.37Å; F182-L267 HydrophobicContact CB-CG 4.32Å; F182-L267 HydrophobicContact CD1-CD1 4.28Å; F182-L267 HydrophobicContact CD2-CB 3.9Å; F182-L267 HydrophobicContact CD2-CD1 4.31Å; F182-L267 HydrophobicContact CD2-CG 4.29Å; F182-L267 HydrophobicContact CE2-CB 4.3Å; F182-L267 HydrophobicContact CG-CB 4.41Å; F182-L267 HydrophobicContact CG-CD1 4.06Å; F182-L267 HydrophobicContact CG-CG 4.3Å
183C92.6Very high86.5Confident18 Ų1842.1 Ų42.112%0.12223%0.227CC..Hα-helixtrans-68.8-39.8177.8-64.80000112.1P30 M157 F179 E180 D181 W185P30-C183 HydrophobicContact CG-CB 4.44Å; M157-C183 HydrophobicContact CE-CB 4.29Å; F179-C183 VanDerWaalsContact CZ-SG 3.6Å; F179-C183 PolarHBondContact O-N 3.13Å; F179-C183 PolarHBondContact O-SG 3.16Å; E180-C183 WeakPolarHBondContact O-CB 3.45Å; E180-C183 PolarHBondContact O-N 2.73Å; E180-C183 VanDerWaalsContact O-N 3.15Å; D181-C183 VanDerWaalsContact C-N 3.33Å; D181-C183 PolarHBondContact O-N 3.06Å; C183-W185 VanDerWaalsContact C-N 3.34Å
184N89.4Confident85.9Confident122 Ų12249.7 Ų49.765%0.65226%0.262SS*.Hα-helixtrans-86.9-5.3-175.6-67.5-31.4000113.6E180 D181 N186E180-N184 WeakPolarHBondContact CG-ND2 3.41Å; E180-N184 WeakPolarHBondContact O-CB 3.45Å; E180-N184 PolarHBondContact O-N 3.03Å; E180-N184 PolarHBondContact O-ND2 3.23Å; D181-N184 PolarHBondContact O-N 3.19Å; N184-N186 PolarHBondContact O-N 3.45Å
185W80.6Confident85.5Confident37 Ų3756 Ų5614%0.1429%0.292CS..  trans-57.3124.8-178.9-164.5-85.3000112.7R29 D181 C183 S187 T189 I191 Y345R29-W185 PolarHBondContact NH1-O 3.15Å; D181-W185 PolarHBondContact O-N 3.13Å; C183-W185 VanDerWaalsContact C-N 3.34Å; W185-S187 PolarHBondContact O-N 3.23Å; W185-T189 HydrophobicContact CZ2-CG2 3.81Å; W185-I191 HydrophobicContact CD2-CD1 4.23Å; W185-I191 HydrophobicContact CH2-CD1 4.33Å; W185-I191 HydrophobicContact CZ2-CD1 3.39Å; W185-I191 HydrophobicContact CZ2-CG1 3.98Å; W185-I191 VanDerWaalsContact NE1-CD1 3.32Å; W185-Y345 HydrophobicContact CH2-CD1 4.33Å; W185-Y345 AromaticContact CH2-CE1 3.33Å; W185-Y345 HydrophobicContact CH2-CE1 3.33Å; W185-Y345 AromaticContact CH2-CZ 3.8Å; W185-Y345 AromaticContact CZ2-CE1 3.56Å; W185-Y345 HydrophobicContact CZ2-CE1 3.56Å; W185-Y345 AromaticContact CZ2-CZ 3.65Å; W185-Y345 WeakPolarHBondContact CZ2-OH 3.36Å; W185-Y345 HydrophobicContact CZ3-CE1 4.44Å
186N77.3Confident85.2Confident76 Ų7657 Ų5741%0.40630%0.298SS..  trans-63.7119.9177.6-176.3-4.7000110.2N184 K188 T189N184-N186 PolarHBondContact O-N 3.45Å; N186-K188 PolarHBondContact O-N 2.93Å; N186-K188 VanDerWaalsContact O-N 3.16Å; N186-K188 WeakPolarHBondContact OD1-CB 3.41Å; N186-K188 PolarHBondContact OD1-N 3.25Å; N186-T189 WeakPolarHBondContact O-CB 3.48Å; N186-T189 PolarHBondContact O-N 3.33Å; N186-T189 PolarHBondContact O-OG1 3.39Å
187S69.6Low85Confident53 Ų5358.7 Ų58.737%0.37131%0.307SS..THydrogen-bonded Turntrans-67-17.4-177.3-55.70000113.1G26 R29 W185 T189G26-S187 WeakPolarHBondContact CA-OG 3.39Å; R29-S187 PolarHBondContact NH2-OG 3.28Å; W185-S187 PolarHBondContact O-N 3.23Å; S187-T189 VanDerWaalsContact C-N 3.35Å
188K68.9Low84.8Confident183 Ų18363 Ų6380%0.79633%0.331SS*.THydrogen-bonded Turntrans-78.2-18.7175-62.1-177.2179-179.20113.1N186 V190N186-K188 PolarHBondContact O-N 2.93Å; N186-K188 VanDerWaalsContact O-N 3.16Å; N186-K188 WeakPolarHBondContact OD1-CB 3.41Å; N186-K188 PolarHBondContact OD1-N 3.25Å; K188-V190 PolarHBondContact O-N 2.85Å
189T72.6Confident84.5Confident38 Ų3867 Ų6723%0.23335%0.349CS..SBendtrans-67.4118.9179.7-53.90000109.4W185 N186 S187 I191 R266W185-T189 HydrophobicContact CZ2-CG2 3.81Å; N186-T189 WeakPolarHBondContact O-CB 3.48Å; N186-T189 PolarHBondContact O-N 3.33Å; N186-T189 PolarHBondContact O-OG1 3.39Å; S187-T189 VanDerWaalsContact C-N 3.35Å; T189-I191 HydrophobicContact CG2-CG1 4.3Å; T189-I191 PolarHBondContact O-N 3.09Å; T189-R266 PolarHBondContact O-NH1 3.37Å
190V70.6Confident84.3Confident123 Ų12368.6 Ų68.675%0.74536%0.357SS*.  trans-75.7104.6176.3-177.50000107.8K188K188-V190 PolarHBondContact O-N 2.85Å
191I75.6Confident84.2Confident3 Ų369.7 Ų69.72%0.01536%0.363CS..  trans-107.2120.2167-56.6168.4000107.3W185 T189 T193 R266 A269 Y345 Y347W185-I191 HydrophobicContact CD2-CD1 4.23Å; W185-I191 HydrophobicContact CH2-CD1 4.33Å; W185-I191 HydrophobicContact CZ2-CD1 3.39Å; W185-I191 HydrophobicContact CZ2-CG1 3.98Å; W185-I191 VanDerWaalsContact NE1-CD1 3.32Å; T189-I191 HydrophobicContact CG2-CG1 4.3Å; T189-I191 PolarHBondContact O-N 3.09Å; I191-T193 PolarHBondContact O-N 2.86Å; I191-R266 HydrophobicContact CD1-CB 4.39Å; I191-R266 HydrophobicContact CD1-CG 4.46Å; I191-R266 PolarHBondContact O-NH2 3.36Å; I191-A269 HydrophobicContact CD1-CB 3.93Å; I191-A269 HydrophobicContact CG2-CB 4.5Å; I191-Y345 HydrophobicContact CB-CD2 4.32Å; I191-Y345 HydrophobicContact CD1-CD1 4.38Å; I191-Y345 HydrophobicContact CD1-CE1 4.38Å; I191-Y345 HydrophobicContact CG1-CD1 4.35Å; I191-Y345 HydrophobicContact CG1-CD2 3.91Å; I191-Y345 HydrophobicContact CG1-CE1 4.33Å; I191-Y345 HydrophobicContact CG1-CE2 3.84Å; I191-Y345 HydrophobicContact CG1-CG 4.16Å; I191-Y345 HydrophobicContact CG2-CD2 3.93Å; I191-Y345 HydrophobicContact CG2-CG 3.85Å; I191-Y347 WeakPolarHBondContact CG2-OH 3.15Å
192T76.7Confident84.3Confident100 Ų10074 Ų7461%0.61338%0.382SS*.  trans-71.7111.2171.144.40000109.4
193T80Confident84.2Confident20 Ų2077.3 Ų77.312%0.12340%0.398CS..  trans-98.8-20.1177.749.60000112.9I191 P196 L197 I263 R266 Y347I191-T193 PolarHBondContact O-N 2.86Å; T193-P196 WeakPolarHBondContact O-CD 3.11Å; T193-L197 WeakPolarHBondContact O-CB 3.36Å; T193-L197 PolarHBondContact O-N 2.96Å; T193-I263 WeakPolarHBondContact CG2-O 3.48Å; T193-R266 HydrophobicContact CG2-CG 3.52Å; T193-Y347 WeakPolarHBondContact CG2-OH 3.33Å
194E84.2Confident84.3Confident162 Ų16276.5 Ų76.576%0.75739%0.392SS*.Hα-helixtrans-62.8-49.7-167.2-64.1178.8177.900112.5L197 L198E194-L197 PolarHBondContact O-N 3.08Å; E194-L198 VanDerWaalsContact O-CB 3.26Å; E194-L198 WeakPolarHBondContact O-CB 3.24Å; E194-L198 PolarHBondContact O-N 3.21Å
195E88Confident84.6Confident133 Ų13373.7 Ų73.762%0.62138%0.381SS*.Hα-helixtrans-66.4-52.1-178.3-179.3-168.1175.200112.4L197 L198 Q199E195-L197 VanDerWaalsContact C-N 3.28Å; E195-L197 PolarHBondContact O-N 3.13Å; E195-L198 PolarHBondContact O-N 3.12Å; E195-Q199 WeakPolarHBondContact O-CG 3.14Å; E195-Q199 PolarHBondContact O-N 3.04Å; E195-Q199 PolarHBondContact OE1-NE2 2.99Å
196P90.2Very high85.3Confident26 Ų2675.7 Ų75.717%0.16940%0.398CS..Hα-helixtrans-60.3-38.2176.8-2433.9000112.9T193 H200 I263 Y347T193-P196 WeakPolarHBondContact O-CD 3.11Å; P196-H200 PolarHBondContact O-N 3.23Å; P196-H200 VanDerWaalsContact O-N 3.16Å; P196-H200 PolarHBondContact O-ND1 3.46Å; P196-I263 HydrophobicContact CB-CG2 4.24Å; P196-Y347 HydrophobicContact CB-CD2 4.13Å; P196-Y347 HydrophobicContact CB-CE2 4.34Å; P196-Y347 HydrophobicContact CG-CD2 4.28Å; P196-Y347 HydrophobicContact CG-CE2 4.21Å
197L93.4Very high86.2Confident36 Ų3673.7 Ų73.719%0.18839%0.386CS..Hα-helixtrans-65.3-47.5178.8178.458.5000111.1L16 T193 E194 E195 Q199 H200 L201 C260 I263L16-L197 HydrophobicContact CD1-CD1 4.12Å; T193-L197 WeakPolarHBondContact O-CB 3.36Å; T193-L197 PolarHBondContact O-N 2.96Å; E194-L197 PolarHBondContact O-N 3.08Å; E195-L197 VanDerWaalsContact C-N 3.28Å; E195-L197 PolarHBondContact O-N 3.13Å; L197-Q199 VanDerWaalsContact C-N 3.31Å; L197-Q199 PolarHBondContact O-N 3.26Å; L197-H200 PolarHBondContact O-N 2.94Å; L197-L201 WeakPolarHBondContact O-CB 3.1Å; L197-L201 PolarHBondContact O-N 3.27Å; L197-C260 HydrophobicContact CD1-CB 3.61Å; L197-I263 HydrophobicContact CB-CG2 3.84Å
198L93.7Very high87.4Confident112 Ų11271.7 Ų71.759%0.58637%0.374SS*.Hα-helixtrans-61.1-42.2179.1-175.961.4000111.2E194 E195 H200 L201 Q202E194-L198 VanDerWaalsContact O-CB 3.26Å; E194-L198 WeakPolarHBondContact O-CB 3.24Å; E194-L198 PolarHBondContact O-N 3.21Å; E195-L198 PolarHBondContact O-N 3.12Å; L198-H200 PolarHBondContact O-N 3.42Å; L198-L201 PolarHBondContact O-N 2.91Å; L198-Q202 WeakPolarHBondContact O-CG 3.1Å; L198-Q202 PolarHBondContact O-N 3.12Å
199Q91.7Very high88.7Confident83 Ų8366.8 Ų66.839%0.38836%0.359SS..Hα-helixtrans-59.5-43.6177-74174.62.300112.7E195 L197 Q202 E203E195-Q199 WeakPolarHBondContact O-CG 3.14Å; E195-Q199 PolarHBondContact O-N 3.04Å; E195-Q199 PolarHBondContact OE1-NE2 2.99Å; L197-Q199 VanDerWaalsContact C-N 3.31Å; L197-Q199 PolarHBondContact O-N 3.26Å; Q199-Q202 VanDerWaalsContact O-CG 3.24Å; Q199-Q202 WeakPolarHBondContact O-CG 3.17Å; Q199-E203 WeakPolarHBondContact O-CG 3.46Å
200H92.2Very high89.8Confident35 Ų3566.2 Ų66.216%0.16236%0.358CS..Hα-helixtrans-75.1-36.2178.2-71.768.8000112P196 L197 L198 E203 A204 E259 C260 I263P196-H200 PolarHBondContact O-N 3.23Å; P196-H200 VanDerWaalsContact O-N 3.16Å; P196-H200 PolarHBondContact O-ND1 3.46Å; L197-H200 PolarHBondContact O-N 2.94Å; L198-H200 PolarHBondContact O-N 3.42Å; H200-E203 PolarHBondContact O-N 3.11Å; H200-A204 PolarHBondContact O-N 3.09Å; H200-E259 IonicContact CD2-OE2 2.66Å; H200-E259 PolarHBondContact CD2-OE2 3.01Å; H200-E259 IonicContact NE2-OE2 3.08Å; H200-C260 WeakPolarHBondContact CB-SG 2.78Å; H200-I263 HydrophobicContact CB-CD1 4.34Å
201L94Very high91Very high62 Ų6261.8 Ų61.833%0.32533%0.328SS..Hα-helixtrans-70.4-34.7-177.7-173.263.4000112.3L16 L197 L198 E203 P205 M257 C260L16-L201 HydrophobicContact CD2-CD1 4.22Å; L197-L201 WeakPolarHBondContact O-CB 3.1Å; L197-L201 PolarHBondContact O-N 3.27Å; L198-L201 PolarHBondContact O-N 2.91Å; L201-E203 VanDerWaalsContact C-N 3.31Å; L201-P205 WeakPolarHBondContact O-CD 3.36Å; L201-M257 HydrophobicContact CD1-CE 4.3Å; L201-M257 HydrophobicContact CD1-SD 3.93Å; L201-C260 PolarHBondContact N-SG 2.74Å
202Q94.9Very high91.9Very high125 Ų12565.4 Ų65.458%0.58435%0.347SS*.Hα-helixtrans-70.9-26.5175.367.7-176.9-900113L198 Q199 P206L198-Q202 WeakPolarHBondContact O-CG 3.1Å; L198-Q202 PolarHBondContact O-N 3.12Å; Q199-Q202 VanDerWaalsContact O-CG 3.24Å; Q199-Q202 WeakPolarHBondContact O-CG 3.17Å; Q202-P206 WeakPolarHBondContact O-CD 3.3Å
203E93.1Very high92.8Very high77 Ų7765.1 Ų65.136%0.3634%0.341SS..Hα-helixtrans-74.8-29.7178.1-73177.2-175.300112.6Q199 H200 L201 P206 F207 K256Q199-E203 WeakPolarHBondContact O-CG 3.46Å; H200-E203 PolarHBondContact O-N 3.11Å; L201-E203 VanDerWaalsContact C-N 3.31Å; E203-P206 WeakPolarHBondContact O-CD 3.41Å; E203-F207 WeakPolarHBondContact O-CD2 3.43Å; E203-F207 WeakPolarHBondContact O-CE2 3.49Å; E203-K256 WeakPolarHBondContact OE2-CE 3.43Å; E203-K256 IonicContact OE2-NZ 3.66Å; E203-K256 PolarHBondContact OE2-NZ 3.5Å
204A94.1Very high93.6Very high0 Ų066 Ų660%035%0.345CS..Hα-helixtrans-70.4-50.2-172.400000114.5H200 F207 G208 F253 K256 M257H200-A204 PolarHBondContact O-N 3.09Å; A204-F207 WeakPolarHBondContact O-CB 3.49Å; A204-F207 PolarHBondContact O-N 3.2Å; A204-G208 PolarHBondContact O-N 3.29Å; A204-F253 HydrophobicContact CB-CD2 4.13Å; A204-F253 HydrophobicContact CB-CE2 4.46Å; A204-F253 WeakPolarHBondContact O-CD2 3.33Å; A204-K256 HydrophobicContact CB-CB 3.88Å; A204-M257 HydrophobicContact CB-CG 4.01Å; A204-M257 HydrophobicContact CB-SD 3.8Å
205P94.7Very high94Very high64 Ų6459.5 Ų59.542%0.41632%0.317SS..Hα-helixtrans-55.4-41.6-173.8-24.831.4000115.2L201 F207 G208 V209L201-P205 WeakPolarHBondContact O-CD 3.36Å; P205-F207 PolarHBondContact O-N 3.45Å; P205-G208 PolarHBondContact O-N 3.43Å; P205-G208 VanDerWaalsContact O-N 3.07Å; P205-V209 WeakPolarHBondContact O-CG2 3.25Å; P205-V209 PolarHBondContact O-N 3.14Å
206P96.2Very high94.3Very high78 Ų7860.1 Ų60.151%0.50632%0.32SS..Hα-helixtrans-53.3-40.1174.9-28.535.8000113.6Q202 E203 A210Q202-P206 WeakPolarHBondContact O-CD 3.3Å; E203-P206 WeakPolarHBondContact O-CD 3.41Å; P206-A210 VanDerWaalsContact O-CB 3.31Å; P206-A210 WeakPolarHBondContact O-CB 3.25Å; P206-A210 PolarHBondContact O-N 3.38Å
207F96.2Very high94.4Very high35 Ų3565.5 Ų65.515%0.15434%0.341CS..Hα-helixtrans-68.7-41.1176.5-58-52.5000112.2E203 A204 P205 A210 Y211 M249 Y252 F253 I355E203-F207 WeakPolarHBondContact O-CD2 3.43Å; E203-F207 WeakPolarHBondContact O-CE2 3.49Å; A204-F207 WeakPolarHBondContact O-CB 3.49Å; A204-F207 PolarHBondContact O-N 3.2Å; P205-F207 PolarHBondContact O-N 3.45Å; F207-A210 PolarHBondContact O-N 3Å; F207-Y211 WeakPolarHBondContact O-CB 2.89Å; F207-Y211 PolarHBondContact O-N 3.45Å; F207-M249 HydrophobicContact CD1-CE 4.38Å; F207-M249 HydrophobicContact CD1-SD 3.62Å; F207-M249 HydrophobicContact CE1-SD 4.32Å; F207-Y252 AromaticContact CD1-CD2 3.93Å; F207-Y252 HydrophobicContact CD1-CD2 3.93Å; F207-Y252 AromaticContact CE1-CD2 3.86Å; F207-Y252 HydrophobicContact CE1-CD2 3.86Å; F207-Y252 HydrophobicContact CG-CD2 4.37Å; F207-Y252 HydrophobicContact CZ-CD2 4.26Å; F207-F253 HydrophobicContact CB-CB 4.11Å; F207-I355 HydrophobicContact CE2-CD1 3.44Å; F207-I355 VanDerWaalsContact CE2-CD1 3.44Å; F207-I355 HydrophobicContact CE2-CG1 4.32Å; F207-I355 HydrophobicContact CZ-CD1 3.49Å; F207-I355 VanDerWaalsContact CZ-CD1 3.49Å; F207-I355 HydrophobicContact CZ-CG1 4.12Å; F207-I355 HydrophobicContact CZ-CG2 4.12Å
208G94.6Very high94.5Very high10 Ų1067.4 Ų67.410%0.10335%0.346CS..Hα-helixtrans-61.5-46176.100000112.1A204 P205 Y211 L212A204-G208 PolarHBondContact O-N 3.29Å; P205-G208 PolarHBondContact O-N 3.43Å; P205-G208 VanDerWaalsContact O-N 3.07Å; G208-Y211 PolarHBondContact O-N 2.7Å; G208-L212 VanDerWaalsContact O-CG 3.32Å; G208-L212 WeakPolarHBondContact O-CG 3.45Å; G208-L212 PolarHBondContact O-N 2.73Å
209V95.8Very high94.5Very high81 Ų8164.8 Ų64.849%0.49134%0.335SS..Hα-helixtrans-63.9-46.5177.1174.40000111.1P205 Y211 L212 I213P205-V209 WeakPolarHBondContact O-CG2 3.25Å; P205-V209 PolarHBondContact O-N 3.14Å; V209-Y211 VanDerWaalsContact C-N 3.31Å; V209-Y211 PolarHBondContact O-N 3.39Å; V209-L212 PolarHBondContact O-N 2.92Å; V209-I213 HydrophobicContact CG1-CD1 3.8Å; V209-I213 HydrophobicContact CG1-CG1 4.4Å; V209-I213 WeakPolarHBondContact O-CG1 3.36Å; V209-I213 PolarHBondContact O-N 2.93Å
210A96.5Very high94.6Very high26 Ų2662.4 Ų62.422%0.21533%0.326CS..Hα-helixtrans-58.7-42.8176.700000111.8P206 F207 L214 M249P206-A210 VanDerWaalsContact O-CB 3.31Å; P206-A210 WeakPolarHBondContact O-CB 3.25Å; P206-A210 PolarHBondContact O-N 3.38Å; F207-A210 PolarHBondContact O-N 3Å; A210-L214 WeakPolarHBondContact O-CB 3.36Å; A210-L214 VanDerWaalsContact O-CG 3.27Å; A210-L214 WeakPolarHBondContact O-CG 3.37Å; A210-L214 PolarHBondContact O-N 3.32Å; A210-M249 HydrophobicContact CB-CB 4.43Å; A210-M249 HydrophobicContact CB-CG 3.95Å; A210-M249 HydrophobicContact CB-SD 4.2Å
211Y95.9Very high94.7Very high29 Ų2966 Ų6611%0.11435%0.346CS..Hα-helixtrans-59.9-47.8173.7167.8-115.3000112.1D5 F207 G208 V209 I213 L214 S215 T246 R250D5-Y211 PolarHBondContact OD2-OH 3.39Å; F207-Y211 WeakPolarHBondContact O-CB 2.89Å; F207-Y211 PolarHBondContact O-N 3.45Å; G208-Y211 PolarHBondContact O-N 2.7Å; V209-Y211 VanDerWaalsContact C-N 3.31Å; V209-Y211 PolarHBondContact O-N 3.39Å; Y211-I213 PolarHBondContact O-N 3.36Å; Y211-L214 PolarHBondContact O-N 2.96Å; Y211-S215 WeakPolarHBondContact O-CB 3.15Å; Y211-S215 PolarHBondContact O-N 3.04Å; Y211-S215 PolarHBondContact O-OG 2.74Å; Y211-T246 HydrophobicContact CD2-CG2 3.89Å; Y211-T246 HydrophobicContact CE2-CG2 4.25Å; Y211-R250 HydrophobicContact CD1-CB 4.36Å; Y211-R250 HydrophobicContact CD1-CG 4.28Å; Y211-R250 HydrophobicContact CD2-CB 3.6Å; Y211-R250 HydrophobicContact CD2-CG 4.14Å; Y211-R250 HydrophobicContact CE1-CB 4.48Å; Y211-R250 HydrophobicContact CE1-CG 4.01Å; Y211-R250 HydrophobicContact CE2-CB 3.76Å; Y211-R250 HydrophobicContact CE2-CG 3.87Å; Y211-R250 HydrophobicContact CG-CB 3.91Å; Y211-R250 HydrophobicContact CG-CG 4.33Å
212L94.3Very high94.8Very high80 Ų8064.8 Ų64.842%0.41934%0.337SS..Hα-helixtrans-62-42.1-178.8-72174.2000112.5M1 G208 V209 S215M1-L212 HydrophobicContact CB-CD2 3.92Å; M1-L212 HydrophobicContact CG-CD2 4.17Å; M1-L212 HydrophobicContact SD-CD2 3.7Å; G208-L212 VanDerWaalsContact O-CG 3.32Å; G208-L212 WeakPolarHBondContact O-CG 3.45Å; G208-L212 PolarHBondContact O-N 2.73Å; V209-L212 PolarHBondContact O-N 2.92Å; L212-S215 PolarHBondContact O-OG 2.85Å
213I96Very high94.8Very high94 Ų9458.8 Ų58.848%0.48231%0.31SS..Hα-helixtrans-65.4-52.5176.9-64.8170.4000109.8V209 Y211 H216 F217V209-I213 HydrophobicContact CG1-CD1 3.8Å; V209-I213 HydrophobicContact CG1-CG1 4.4Å; V209-I213 WeakPolarHBondContact O-CG1 3.36Å; V209-I213 PolarHBondContact O-N 2.93Å; Y211-I213 PolarHBondContact O-N 3.36Å; I213-H216 WeakPolarHBondContact O-CB 3.21Å; I213-H216 PolarHBondContact O-N 3.07Å; I213-F217 HydrophobicContact CG2-CD2 4.45Å; I213-F217 HydrophobicContact CG2-CE2 4.18Å; I213-F217 WeakPolarHBondContact O-CD2 3.36Å
214L95.8Very high94.9Very high38 Ų3859.8 Ų59.820%0.19931%0.31CS..Hα-helixtrans-71.4-37.6-172.6-68.6171000113.1A210 Y211 H216 F217 Y218 F245 T246A210-L214 WeakPolarHBondContact O-CB 3.36Å; A210-L214 VanDerWaalsContact O-CG 3.27Å; A210-L214 WeakPolarHBondContact O-CG 3.37Å; A210-L214 PolarHBondContact O-N 3.32Å; Y211-L214 PolarHBondContact O-N 2.96Å; L214-H216 PolarHBondContact O-N 2.91Å; L214-F217 PolarHBondContact O-N 3.25Å; L214-F217 VanDerWaalsContact O-N 3.13Å; L214-Y218 HydrophobicContact CD2-CD2 4.38Å; L214-Y218 HydrophobicContact CD2-CE2 4.46Å; L214-Y218 PolarHBondContact O-N 3.41Å; L214-F245 HydrophobicContact CD1-CD1 3.41Å; L214-F245 VanDerWaalsContact CD1-CD1 3.41Å; L214-F245 HydrophobicContact CD1-CE1 3.56Å; L214-T246 HydrophobicContact CB-CG2 4.02Å; L214-T246 VanDerWaalsContact CB-OG1 3.3Å; L214-T246 WeakPolarHBondContact CB-OG1 3.39Å
215S93.8Very high95Very high26 Ų2662.3 Ų62.318%0.18233%0.325CS..Hα-helixtrans-66.8-17.8177.162.10000113.5Y211 L212Y211-S215 WeakPolarHBondContact O-CB 3.15Å; Y211-S215 PolarHBondContact O-N 3.04Å; Y211-S215 PolarHBondContact O-OG 2.74Å; L212-S215 PolarHBondContact O-OG 2.85Å
216H92.8Very high95Very high145 Ų14562.9 Ų62.967%0.67134%0.336SS*.Hα-helixtrans-71.7-38.4171.4-179.165.3000112.1I213 L214I213-H216 WeakPolarHBondContact O-CB 3.21Å; I213-H216 PolarHBondContact O-N 3.07Å; L214-H216 PolarHBondContact O-N 2.91Å
217F93.8Very high95Very high140 Ų14063.8 Ų63.861%0.61433%0.333SS*.Hα-helixtrans-94.9-30.2-176-63-72.2000113.7I213 L214I213-F217 HydrophobicContact CG2-CD2 4.45Å; I213-F217 HydrophobicContact CG2-CE2 4.18Å; I213-F217 WeakPolarHBondContact O-CD2 3.36Å; L214-F217 PolarHBondContact O-N 3.25Å; L214-F217 VanDerWaalsContact O-N 3.13Å
218Y94.3Very high95.1Very high76 Ų7662.1 Ų62.130%0.29833%0.326SS..  trans-124.4115.9-173.2-60.4-87.7000110.2L214 Y239 I242L214-Y218 HydrophobicContact CD2-CD2 4.38Å; L214-Y218 HydrophobicContact CD2-CE2 4.46Å; L214-Y218 PolarHBondContact O-N 3.41Å; Y218-Y239 HydrophobicContact CD1-CD2 4.05Å; Y218-Y239 AromaticContact CD1-CE2 3.56Å; Y218-Y239 HydrophobicContact CD1-CE2 3.56Å; Y218-Y239 AromaticContact CD1-CZ 4Å; Y218-Y239 HydrophobicContact CE1-CD2 4.38Å; Y218-Y239 HydrophobicContact CE1-CE2 4.16Å; Y218-I242 HydrophobicContact CD1-CB 4.24Å; Y218-I242 HydrophobicContact CD1-CD1 4.14Å; Y218-I242 HydrophobicContact CD1-CG2 3.69Å; Y218-I242 HydrophobicContact CD2-CG2 3.53Å; Y218-I242 HydrophobicContact CE1-CB 4.43Å; Y218-I242 HydrophobicContact CE1-CD1 3.48Å; Y218-I242 VanDerWaalsContact CE1-CD1 3.48Å; Y218-I242 HydrophobicContact CE1-CG2 3.99Å; Y218-I242 HydrophobicContact CE2-CD1 4.4Å; Y218-I242 HydrophobicContact CE2-CG2 3.84Å; Y218-I242 HydrophobicContact CG-CB 4.44Å; Y218-I242 HydrophobicContact CG-CG2 3.45Å; Y218-I242 VanDerWaalsContact CG-CG2 3.45Å
219T94.2Very high95.1Very high57 Ų5764.8 Ų64.835%0.3533%0.333SS..  trans-122.8147.7-177.367.30000110.6D221 Y222 Y239T219-D221 PolarHBondContact O-N 2.98Å; T219-Y222 PolarHBondContact O-N 3.15Å; T219-Y222 PolarHBondContact OG1-N 3.32Å; T219-Y239 PolarHBondContact N-OH 3.33Å; T219-Y239 VanDerWaalsContact N-OH 3.12Å; T219-Y239 PolarHBondContact O-OH 3.43Å; T219-Y239 VanDerWaalsContact O-OH 3.04Å
220V93.7Very high95.2Very high33 Ų3367.6 Ų67.620%0.235%0.346CS..THydrogen-bonded Turntrans-65.8-31.9173.8178.60000110.4Y222 V223 I243 L465 L466V220-Y222 VanDerWaalsContact C-N 3.29Å; V220-Y222 PolarHBondContact O-N 3.35Å; V220-V223 WeakPolarHBondContact O-CB 3.05Å; V220-V223 PolarHBondContact O-N 3.06Å; V220-V223 VanDerWaalsContact O-N 3.12Å; V220-I243 HydrophobicContact CG2-CD1 4.46Å; V220-I243 HydrophobicContact CG2-CG2 4.06Å; V220-L465 HydrophobicContact CG1-CB 4.14Å; V220-L465 HydrophobicContact CG2-CB 4.12Å; V220-L465 HydrophobicContact CG2-CD1 3.88Å; V220-L465 HydrophobicContact CG2-CG 4.49Å; V220-L466 HydrophobicContact CG1-CD2 3.87Å
221D93.7Very high95.2Very high110 Ų11071.4 Ų71.459%0.58835%0.354SS*.G310 helixtrans-64.1-31.9-179.1-62.1-41.4000113T219 V223 R224T219-D221 PolarHBondContact O-N 2.98Å; D221-V223 PolarHBondContact O-N 3.38Å; D221-R224 WeakPolarHBondContact O-CB 3.33Å; D221-R224 PolarHBondContact O-N 3.08Å
222Y95.7Very high95.2Very high36 Ų3675.8 Ų75.814%0.14138%0.376CS..G310 helixtrans-58.2-36.1175-177.6-123.8000111.9T219 V220 R224 T225 E227 F228 R231 Y235 Y239T219-Y222 PolarHBondContact O-N 3.15Å; T219-Y222 PolarHBondContact OG1-N 3.32Å; V220-Y222 VanDerWaalsContact C-N 3.29Å; V220-Y222 PolarHBondContact O-N 3.35Å; Y222-R224 PolarHBondContact O-N 3.03Å; Y222-R224 VanDerWaalsContact O-N 3.13Å; Y222-T225 HydrophobicContact CD2-CG2 4.45Å; Y222-T225 WeakPolarHBondContact O-CB 3.22Å; Y222-T225 PolarHBondContact O-N 3.32Å; Y222-T225 PolarHBondContact O-OG1 2.89Å; Y222-E227 HydrophobicContact CE2-CB 4.36Å; Y222-E227 PolarHBondContact OH-OE1 3.18Å; Y222-F228 HydrophobicContact CD1-CB 4.45Å; Y222-F228 AromaticContact CD1-CD2 3.63Å; Y222-F228 HydrophobicContact CD1-CD2 3.63Å; Y222-F228 HydrophobicContact CD1-CE2 4.42Å; Y222-F228 HydrophobicContact CD1-CG 4.5Å; Y222-F228 HydrophobicContact CE1-CB 4.3Å; Y222-F228 AromaticContact CE1-CD2 3.6Å; Y222-F228 HydrophobicContact CE1-CD2 3.6Å; Y222-F228 HydrophobicContact CE1-CE2 4.47Å; Y222-F228 HydrophobicContact CE1-CG 4.46Å; Y222-F228 VanDerWaalsContact O-CB 3.27Å; Y222-F228 WeakPolarHBondContact O-CB 3.49Å; Y222-R231 PolarHBondContact OH-NE 3.27Å; Y222-Y235 HydrophobicContact CE1-CE1 4.08Å; Y222-Y239 HydrophobicContact CD1-CD2 4.48Å; Y222-Y239 HydrophobicContact CD1-CE1 4.36Å; Y222-Y239 AromaticContact CD1-CE2 3.66Å; Y222-Y239 HydrophobicContact CD1-CE2 3.66Å; Y222-Y239 AromaticContact CD1-CZ 3.61Å; Y222-Y239 HydrophobicContact CE1-CE2 4.1Å
223V95.2Very high95.3Very high0 Ų075.4 Ų75.40%037%0.371CS..G310 helixtrans-64.1-18.7178.3-175.40000112.7V220 D221 F228 Y229 Y239 M462 L466 Y475V220-V223 WeakPolarHBondContact O-CB 3.05Å; V220-V223 PolarHBondContact O-N 3.06Å; V220-V223 VanDerWaalsContact O-N 3.12Å; D221-V223 PolarHBondContact O-N 3.38Å; V223-F228 HydrophobicContact CG1-CD1 4.14Å; V223-F228 HydrophobicContact CG1-CE1 3.89Å; V223-F228 HydrophobicContact CG1-CZ 4.24Å; V223-F228 HydrophobicContact CG2-CD2 4.39Å; V223-F228 HydrophobicContact CG2-CE2 4.11Å; V223-F228 HydrophobicContact CG2-CZ 4.23Å; V223-Y229 WeakPolarHBondContact O-CE2 3.33Å; V223-Y229 PolarHBondContact O-OH 3.22Å; V223-Y239 HydrophobicContact CG2-CD1 3.75Å; V223-Y239 HydrophobicContact CG2-CE1 3.53Å; V223-M462 HydrophobicContact CB-CE 4.35Å; V223-M462 HydrophobicContact CG1-CE 3.82Å; V223-M462 HydrophobicContact CG2-CE 3.99Å; V223-L466 HydrophobicContact CG1-CD1 4.43Å; V223-L466 HydrophobicContact CG1-CD2 4.42Å; V223-Y475 HydrophobicContact CG1-CD2 3.31Å; V223-Y475 HydrophobicContact CG1-CE2 3.93Å; V223-Y475 HydrophobicContact CG1-CG 3.96Å
224R95.2Very high95.4Very high97 Ų9775.3 Ų75.337%0.36637%0.371SS..G310 helixtrans-85.6-8.1175.8-56.5179.2178.7-92.3-4.2113.2D221 Y222 L466 D468 T471D221-R224 WeakPolarHBondContact O-CB 3.33Å; D221-R224 PolarHBondContact O-N 3.08Å; Y222-R224 PolarHBondContact O-N 3.03Å; Y222-R224 VanDerWaalsContact O-N 3.13Å; R224-L466 HydrophobicContact CG-CD2 4.2Å; R224-L466 PolarHBondContact NH2-O 2.82Å; R224-D468 IonicContact CZ-OD2 3.17Å; R224-D468 IonicContact NH1-OD2 2.7Å; R224-D468 PolarHBondContact NH1-OD2 2.91Å; R224-D468 IonicContact NH2-OD2 2.79Å; R224-T471 HydrophobicContact CG-CG2 4.45Å
225T96.5Very high95.4Very high53 Ų5377 Ų7733%0.32538%0.375SS..SBendtrans-87.2151.4-176.269.30000112.2Y222 E227 F228 Y229Y222-T225 HydrophobicContact CD2-CG2 4.45Å; Y222-T225 WeakPolarHBondContact O-CB 3.22Å; Y222-T225 PolarHBondContact O-N 3.32Å; Y222-T225 PolarHBondContact O-OG1 2.89Å; T225-E227 VanDerWaalsContact C-N 3.28Å; T225-E227 PolarHBondContact O-N 3.39Å; T225-F228 WeakPolarHBondContact O-CB 3.46Å; T225-F228 PolarHBondContact O-N 3.09Å; T225-F228 PolarHBondContact OG1-N 3.48Å; T225-Y229 WeakPolarHBondContact O-CD2 3.48Å
226A95.5Very high95.6Very high77 Ų7777 Ų7764%0.63637%0.371SS*.Hα-helixtrans-60.9-38.417300000112.1F228 Y229 D230A226-F228 PolarHBondContact O-N 3.23Å; A226-F228 VanDerWaalsContact O-N 3.17Å; A226-Y229 PolarHBondContact O-N 2.95Å; A226-D230 PolarHBondContact O-N 3.06Å
227E96.1Very high95.7Very high97 Ų9771.4 Ų71.445%0.45335%0.346SS..Hα-helixtrans-55.9-35.6179.1-165.5-153.4133.100112.4Y222 T225 Y229 D230 R231Y222-E227 HydrophobicContact CE2-CB 4.36Å; Y222-E227 PolarHBondContact OH-OE1 3.18Å; T225-E227 VanDerWaalsContact C-N 3.28Å; T225-E227 PolarHBondContact O-N 3.39Å; E227-Y229 VanDerWaalsContact C-N 3.3Å; E227-Y229 PolarHBondContact O-N 3.27Å; E227-D230 PolarHBondContact O-N 2.97Å; E227-R231 IonicContact OE1-CZ 2.77Å; E227-R231 IonicContact OE1-NE 2.65Å; E227-R231 IonicContact OE1-NH2 3.69Å; E227-R231 PolarHBondContact OE1-NH2 3.23Å
228F96.8Very high95.8Very high0 Ų070.2 Ų70.20%034%0.341CS..Hα-helixtrans-62.2-38.5176179.4-95.4000112.4Y222 V223 T225 A226 D230 R231 Y235 R236 Y239 Y475Y222-F228 HydrophobicContact CD1-CB 4.45Å; Y222-F228 AromaticContact CD1-CD2 3.63Å; Y222-F228 HydrophobicContact CD1-CD2 3.63Å; Y222-F228 HydrophobicContact CD1-CE2 4.42Å; Y222-F228 HydrophobicContact CD1-CG 4.5Å; Y222-F228 HydrophobicContact CE1-CB 4.3Å; Y222-F228 AromaticContact CE1-CD2 3.6Å; Y222-F228 HydrophobicContact CE1-CD2 3.6Å; Y222-F228 HydrophobicContact CE1-CE2 4.47Å; Y222-F228 HydrophobicContact CE1-CG 4.46Å; Y222-F228 VanDerWaalsContact O-CB 3.27Å; Y222-F228 WeakPolarHBondContact O-CB 3.49Å; V223-F228 HydrophobicContact CG1-CD1 4.14Å; V223-F228 HydrophobicContact CG1-CE1 3.89Å; V223-F228 HydrophobicContact CG1-CZ 4.24Å; V223-F228 HydrophobicContact CG2-CD2 4.39Å; V223-F228 HydrophobicContact CG2-CE2 4.11Å; V223-F228 HydrophobicContact CG2-CZ 4.23Å; T225-F228 WeakPolarHBondContact O-CB 3.46Å; T225-F228 PolarHBondContact O-N 3.09Å; T225-F228 PolarHBondContact OG1-N 3.48Å; A226-F228 PolarHBondContact O-N 3.23Å; A226-F228 VanDerWaalsContact O-N 3.17Å; F228-D230 VanDerWaalsContact C-N 3.31Å; F228-R231 WeakPolarHBondContact O-CB 3.39Å; F228-R231 PolarHBondContact O-N 2.96Å; F228-Y235 HydrophobicContact CD2-CE1 4.36Å; F228-Y235 HydrophobicContact CE2-CD1 4.49Å; F228-Y235 HydrophobicContact CE2-CE1 4.21Å; F228-R236 HydrophobicContact CD1-CG 4.34Å; F228-R236 HydrophobicContact CE1-CB 4.05Å; F228-R236 HydrophobicContact CE1-CG 3.68Å; F228-R236 HydrophobicContact CE2-CG 4.36Å; F228-R236 HydrophobicContact CZ-CB 3.79Å; F228-R236 HydrophobicContact CZ-CG 3.69Å; F228-Y239 AromaticContact CE2-CD1 3.77Å; F228-Y239 HydrophobicContact CE2-CD1 3.77Å; F228-Y239 HydrophobicContact CE2-CD2 4.17Å; F228-Y239 HydrophobicContact CE2-CE1 4.36Å; F228-Y239 AromaticContact CE2-CG 3.69Å; F228-Y239 HydrophobicContact CE2-CG 3.69Å; F228-Y239 HydrophobicContact CZ-CD1 4.38Å; F228-Y239 HydrophobicContact CZ-CG 4.42Å; F228-Y475 AromaticContact CE1-CD2 3.7Å; F228-Y475 HydrophobicContact CE1-CD2 3.7Å; F228-Y475 AromaticContact CE1-CE2 3.6Å; F228-Y475 HydrophobicContact CE1-CE2 3.6Å; F228-Y475 HydrophobicContact CZ-CD2 4.2Å; F228-Y475 AromaticContact CZ-CE2 3.65Å; F228-Y475 HydrophobicContact CZ-CE2 3.65Å
229Y96.5Very high95.9Very high66 Ų6667 Ų6726%0.25933%0.328SS..Hα-helixtrans-76.8-18.4-179.7-65.9-78.8000113V223 T225 A226 E227 R231 R236 Y475V223-Y229 WeakPolarHBondContact O-CE2 3.33Å; V223-Y229 PolarHBondContact O-OH 3.22Å; T225-Y229 WeakPolarHBondContact O-CD2 3.48Å; A226-Y229 PolarHBondContact O-N 2.95Å; E227-Y229 VanDerWaalsContact C-N 3.3Å; E227-Y229 PolarHBondContact O-N 3.27Å; Y229-R231 VanDerWaalsContact C-N 3.28Å; Y229-R236 PolarHBondContact O-NH1 3.42Å; Y229-Y475 PolarHBondContact OH-N 3.29Å
230D96.5Very high96Very high139 Ų13964.2 Ų64.274%0.74331%0.311SS*.Hα-helixtrans-74.4-19.7170.6-64.9-27.7000112.5A226 E227 F228A226-D230 PolarHBondContact O-N 3.06Å; E227-D230 PolarHBondContact O-N 2.97Å; F228-D230 VanDerWaalsContact C-N 3.31Å
231R96.9Very high96.2Very high106 Ų10664.2 Ų64.240%0.431%0.309SS..SBendtrans-70.5145.6176.1-55.8-62.2-175.6174.6-3.7110.8Y222 E227 F228 Y229 Y235 R236Y222-R231 PolarHBondContact OH-NE 3.27Å; E227-R231 IonicContact OE1-CZ 2.77Å; E227-R231 IonicContact OE1-NE 2.65Å; E227-R231 IonicContact OE1-NH2 3.69Å; E227-R231 PolarHBondContact OE1-NH2 3.23Å; F228-R231 WeakPolarHBondContact O-CB 3.39Å; F228-R231 PolarHBondContact O-N 2.96Å; Y229-R231 VanDerWaalsContact C-N 3.28Å; R231-Y235 HydrophobicContact CB-CD1 3.43Å; R231-Y235 VanDerWaalsContact CB-CD1 3.43Å; R231-Y235 HydrophobicContact CB-CE1 4.08Å; R231-Y235 HydrophobicContact CB-CG 3.86Å; R231-Y235 HydrophobicContact CG-CD1 3.66Å; R231-Y235 HydrophobicContact CG-CE1 3.76Å; R231-Y235 HydrophobicContact CG-CG 4.26Å; R231-R236 PolarHBondContact O-NH1 2.91Å
232H96.7Very high96.3Very high122 Ų12261.3 Ų61.357%0.56529%0.293SS*.  trans-63.9161.4-17962.8-86.7000113.4L234 Y235 R236H232-L234 PolarHBondContact O-N 3.03Å; H232-Y235 PolarHBondContact CD2-N 2.84Å; H232-Y235 PolarHBondContact NE2-N 2.72Å; H232-Y235 WeakPolarHBondContact O-CB 3.28Å; H232-Y235 PolarHBondContact O-N 3.16Å; H232-Y235 VanDerWaalsContact O-N 3.1Å; H232-R236 PolarHBondContact O-N 3.23Å
233F96.4Very high96.4Very high71 Ų7159.8 Ų59.831%0.31129%0.288SS..Hα-helixtrans-50.4-48-175.5168.4-99.8000114.2Y235 R236 L237 I479 Y480F233-Y235 VanDerWaalsContact C-N 3.34Å; F233-Y235 PolarHBondContact O-N 3.13Å; F233-R236 PolarHBondContact O-N 2.69Å; F233-L237 HydrophobicContact CE1-CD2 4.17Å; F233-L237 HydrophobicContact CZ-CD2 4.21Å; F233-L237 PolarHBondContact O-N 3.24Å; F233-I479 HydrophobicContact CE2-CB 4.07Å; F233-I479 HydrophobicContact CE2-CG2 4.46Å; F233-Y480 AromaticContact CD2-CD2 3.83Å; F233-Y480 HydrophobicContact CD2-CD2 3.83Å; F233-Y480 AromaticContact CD2-CE2 3.94Å; F233-Y480 HydrophobicContact CD2-CE2 3.94Å; F233-Y480 AromaticContact CE2-CD2 3.98Å; F233-Y480 HydrophobicContact CE2-CD2 3.98Å
234L96.3Very high96.5Very high93 Ų9360.6 Ų60.649%0.48729%0.291SS..Hα-helixtrans-62.5-40.7-178.5-63.3175.1000111.9H232 R236 L237 F238H232-L234 PolarHBondContact O-N 3.03Å; L234-R236 PolarHBondContact O-N 3.36Å; L234-L237 PolarHBondContact O-N 3.37Å; L234-F238 HydrophobicContact CB-CD2 4.32Å; L234-F238 HydrophobicContact CB-CE2 4.39Å; L234-F238 WeakPolarHBondContact O-CD2 3.47Å; L234-F238 PolarHBondContact O-N 2.9Å
235Y97.2Very high96.6Very high74 Ų7459.8 Ų59.829%0.2929%0.291SS..Hα-helixtrans-56.9-49.8175-177.6-84.8000111Y222 F228 R231 H232 F233 L237 F238 Y239Y222-Y235 HydrophobicContact CE1-CE1 4.08Å; F228-Y235 HydrophobicContact CD2-CE1 4.36Å; F228-Y235 HydrophobicContact CE2-CD1 4.49Å; F228-Y235 HydrophobicContact CE2-CE1 4.21Å; R231-Y235 HydrophobicContact CB-CD1 3.43Å; R231-Y235 VanDerWaalsContact CB-CD1 3.43Å; R231-Y235 HydrophobicContact CB-CE1 4.08Å; R231-Y235 HydrophobicContact CB-CG 3.86Å; R231-Y235 HydrophobicContact CG-CD1 3.66Å; R231-Y235 HydrophobicContact CG-CE1 3.76Å; R231-Y235 HydrophobicContact CG-CG 4.26Å; H232-Y235 PolarHBondContact CD2-N 2.84Å; H232-Y235 PolarHBondContact NE2-N 2.72Å; H232-Y235 WeakPolarHBondContact O-CB 3.28Å; H232-Y235 PolarHBondContact O-N 3.16Å; H232-Y235 VanDerWaalsContact O-N 3.1Å; F233-Y235 VanDerWaalsContact C-N 3.34Å; F233-Y235 PolarHBondContact O-N 3.13Å; Y235-L237 VanDerWaalsContact C-N 3.29Å; Y235-L237 PolarHBondContact O-N 2.92Å; Y235-F238 PolarHBondContact O-N 2.7Å; Y235-Y239 AromaticContact CE1-CD2 3.85Å; Y235-Y239 HydrophobicContact CE1-CD2 3.85Å; Y235-Y239 VanDerWaalsContact O-CB 3.31Å; Y235-Y239 WeakPolarHBondContact O-CB 3.48Å; Y235-Y239 PolarHBondContact O-N 2.92Å
236R96.9Very high96.6Very high25 Ų2557.7 Ų57.79%0.09428%0.278CS..Hα-helixtrans-62.8-35.8179.8-61.8-168.9-64.9-113.26.5112.7F228 Y229 R231 H232 F233 L234 Y475 S478 I479F228-R236 HydrophobicContact CD1-CG 4.34Å; F228-R236 HydrophobicContact CE1-CB 4.05Å; F228-R236 HydrophobicContact CE1-CG 3.68Å; F228-R236 HydrophobicContact CE2-CG 4.36Å; F228-R236 HydrophobicContact CZ-CB 3.79Å; F228-R236 HydrophobicContact CZ-CG 3.69Å; Y229-R236 PolarHBondContact O-NH1 3.42Å; R231-R236 PolarHBondContact O-NH1 2.91Å; H232-R236 PolarHBondContact O-N 3.23Å; F233-R236 PolarHBondContact O-N 2.69Å; L234-R236 PolarHBondContact O-N 3.36Å; R236-Y475 PolarHBondContact O-OH 2.77Å; R236-S478 PolarHBondContact NE-O 2.82Å; R236-S478 PolarHBondContact NH2-O 3.4Å; R236-I479 HydrophobicContact CB-CG2 4.08Å
237L95.5Very high96.6Very high28 Ų2855.6 Ų55.615%0.14725%0.254CS..Hα-helixtrans-68.8-46.7176.5-173.269.5000112F233 L234 Y235 M240 M241F233-L237 HydrophobicContact CE1-CD2 4.17Å; F233-L237 HydrophobicContact CZ-CD2 4.21Å; F233-L237 PolarHBondContact O-N 3.24Å; L234-L237 PolarHBondContact O-N 3.37Å; Y235-L237 VanDerWaalsContact C-N 3.29Å; Y235-L237 PolarHBondContact O-N 2.92Å; L237-M240 HydrophobicContact CD1-CE 4.07Å; L237-M241 HydrophobicContact CG-CE 4.24Å
238F96.3Very high96.6Very high114 Ų11451.4 Ų51.450%0.523%0.234SC..Hα-helixtrans-68.2-35.1177.5-80.6-66.6000112.4L234 Y235 M240 M241 I242L234-F238 HydrophobicContact CB-CD2 4.32Å; L234-F238 HydrophobicContact CB-CE2 4.39Å; L234-F238 WeakPolarHBondContact O-CD2 3.47Å; L234-F238 PolarHBondContact O-N 2.9Å; Y235-F238 PolarHBondContact O-N 2.7Å; F238-M240 VanDerWaalsContact C-N 3.26Å; F238-M240 PolarHBondContact O-N 3.37Å; F238-M241 HydrophobicContact CD1-CE 3.91Å; F238-M241 HydrophobicContact CD1-SD 3.65Å; F238-M241 HydrophobicContact CE1-CE 4.09Å; F238-M241 HydrophobicContact CE1-SD 4.02Å; F238-M241 WeakPolarHBondContact O-CB 3.28Å; F238-M241 PolarHBondContact O-N 3.39Å; F238-I242 PolarHBondContact O-N 3.07Å
239Y97Very high96.6Very high8 Ų851.8 Ų51.83%0.03124%0.236CC..Hα-helixtrans-57.2-41.7178.7-162.2-88.3000111.7Y218 T219 Y222 V223 F228 Y235 M241 I242 I243Y218-Y239 HydrophobicContact CD1-CD2 4.05Å; Y218-Y239 AromaticContact CD1-CE2 3.56Å; Y218-Y239 HydrophobicContact CD1-CE2 3.56Å; Y218-Y239 AromaticContact CD1-CZ 4Å; Y218-Y239 HydrophobicContact CE1-CD2 4.38Å; Y218-Y239 HydrophobicContact CE1-CE2 4.16Å; T219-Y239 PolarHBondContact N-OH 3.33Å; T219-Y239 VanDerWaalsContact N-OH 3.12Å; T219-Y239 PolarHBondContact O-OH 3.43Å; T219-Y239 VanDerWaalsContact O-OH 3.04Å; Y222-Y239 HydrophobicContact CD1-CD2 4.48Å; Y222-Y239 HydrophobicContact CD1-CE1 4.36Å; Y222-Y239 AromaticContact CD1-CE2 3.66Å; Y222-Y239 HydrophobicContact CD1-CE2 3.66Å; Y222-Y239 AromaticContact CD1-CZ 3.61Å; Y222-Y239 HydrophobicContact CE1-CE2 4.1Å; V223-Y239 HydrophobicContact CG2-CD1 3.75Å; V223-Y239 HydrophobicContact CG2-CE1 3.53Å; F228-Y239 AromaticContact CE2-CD1 3.77Å; F228-Y239 HydrophobicContact CE2-CD1 3.77Å; F228-Y239 HydrophobicContact CE2-CD2 4.17Å; F228-Y239 HydrophobicContact CE2-CE1 4.36Å; F228-Y239 AromaticContact CE2-CG 3.69Å; F228-Y239 HydrophobicContact CE2-CG 3.69Å; F228-Y239 HydrophobicContact CZ-CD1 4.38Å; F228-Y239 HydrophobicContact CZ-CG 4.42Å; Y235-Y239 AromaticContact CE1-CD2 3.85Å; Y235-Y239 HydrophobicContact CE1-CD2 3.85Å; Y235-Y239 VanDerWaalsContact O-CB 3.31Å; Y235-Y239 WeakPolarHBondContact O-CB 3.48Å; Y235-Y239 PolarHBondContact O-N 2.92Å; Y239-M241 VanDerWaalsContact C-N 3.31Å; Y239-M241 PolarHBondContact O-N 3.45Å; Y239-I242 PolarHBondContact O-N 3.2Å; Y239-I243 HydrophobicContact CD1-CD1 4.33Å; Y239-I243 HydrophobicContact CD1-CG1 3.59Å; Y239-I243 HydrophobicContact CE1-CD1 3.63Å; Y239-I243 HydrophobicContact CE1-CG1 3.4Å; Y239-I243 VanDerWaalsContact CE1-CG1 3.4Å; Y239-I243 WeakPolarHBondContact O-CG1 3.41Å; Y239-I243 PolarHBondContact O-N 3.31Å
240M96.1Very high96.5Very high0 Ų052.8 Ų52.80%024%0.24CC..Hα-helixtrans-62.9-34.6175.7152.4-178.298.500113L237 F238 I242 I243 F244 E458 Y459 M462 Y475 I479L237-M240 HydrophobicContact CD1-CE 4.07Å; F238-M240 VanDerWaalsContact C-N 3.26Å; F238-M240 PolarHBondContact O-N 3.37Å; M240-I242 VanDerWaalsContact C-N 3.33Å; M240-I243 PolarHBondContact O-N 3.39Å; M240-F244 WeakPolarHBondContact O-CB 3.41Å; M240-F244 PolarHBondContact O-N 2.89Å; M240-E458 HydrophobicContact CE-CB 3.75Å; M240-E458 HydrophobicContact CG-CB 3.65Å; M240-E458 HydrophobicContact SD-CB 3.99Å; M240-Y459 WeakPolarHBondContact SD-CA 3.45Å; M240-Y459 PolarHBondContact SD-N 3.36Å; M240-M462 HydrophobicContact CB-CG 3.75Å; M240-M462 HydrophobicContact CB-SD 3.89Å; M240-M462 HydrophobicContact CG-CG 3.5Å; M240-M462 VanDerWaalsContact CG-CG 3.5Å; M240-M462 HydrophobicContact CG-SD 4.12Å; M240-M462 HydrophobicContact SD-CG 3.69Å; M240-Y475 HydrophobicContact CB-CE1 4.42Å; M240-Y475 WeakPolarHBondContact CB-OH 3.31Å; M240-Y475 HydrophobicContact SD-CE1 4.1Å; M240-I479 HydrophobicContact SD-CD1 4.47Å
241M96.7Very high96.5Very high32 Ų3247.7 Ų47.716%0.15821%0.212CC..Hα-helixtrans-62.8-43.2174.9-50-173-172.400110.9L237 F238 Y239 F245 R455 E458L237-M241 HydrophobicContact CG-CE 4.24Å; F238-M241 HydrophobicContact CD1-CE 3.91Å; F238-M241 HydrophobicContact CD1-SD 3.65Å; F238-M241 HydrophobicContact CE1-CE 4.09Å; F238-M241 HydrophobicContact CE1-SD 4.02Å; F238-M241 WeakPolarHBondContact O-CB 3.28Å; F238-M241 PolarHBondContact O-N 3.39Å; Y239-M241 VanDerWaalsContact C-N 3.31Å; Y239-M241 PolarHBondContact O-N 3.45Å; M241-F245 WeakPolarHBondContact O-CB 3.49Å; M241-F245 PolarHBondContact O-N 2.95Å; M241-R455 PolarHBondContact SD-NH2 3.07Å; M241-E458 WeakPolarHBondContact CG-OE2 3.47Å
242I97.1Very high96.4Very high49 Ų4942.7 Ų42.725%0.25119%0.193SC..Hα-helixtrans-67.8-45.6179.2-58.5174.2000110.4Y218 F238 Y239 M240 F244 F245 T246Y218-I242 HydrophobicContact CD1-CB 4.24Å; Y218-I242 HydrophobicContact CD1-CD1 4.14Å; Y218-I242 HydrophobicContact CD1-CG2 3.69Å; Y218-I242 HydrophobicContact CD2-CG2 3.53Å; Y218-I242 HydrophobicContact CE1-CB 4.43Å; Y218-I242 HydrophobicContact CE1-CD1 3.48Å; Y218-I242 VanDerWaalsContact CE1-CD1 3.48Å; Y218-I242 HydrophobicContact CE1-CG2 3.99Å; Y218-I242 HydrophobicContact CE2-CD1 4.4Å; Y218-I242 HydrophobicContact CE2-CG2 3.84Å; Y218-I242 HydrophobicContact CG-CB 4.44Å; Y218-I242 HydrophobicContact CG-CG2 3.45Å; Y218-I242 VanDerWaalsContact CG-CG2 3.45Å; F238-I242 PolarHBondContact O-N 3.07Å; Y239-I242 PolarHBondContact O-N 3.2Å; M240-I242 VanDerWaalsContact C-N 3.33Å; I242-F244 VanDerWaalsContact C-N 3.34Å; I242-F244 PolarHBondContact O-N 2.94Å; I242-F245 PolarHBondContact O-N 2.78Å; I242-T246 WeakPolarHBondContact O-CB 3.36Å; I242-T246 PolarHBondContact O-N 3.43Å; I242-T246 PolarHBondContact O-OG1 3.28Å
243I97.1Very high96.4Very high5 Ų539 Ų393%0.02618%0.175CC..Hα-helixtrans-59.4-45176.4-69.9-64.5000111.4V220 Y239 M240 F245 T246 F247 M462 L465V220-I243 HydrophobicContact CG2-CD1 4.46Å; V220-I243 HydrophobicContact CG2-CG2 4.06Å; Y239-I243 HydrophobicContact CD1-CD1 4.33Å; Y239-I243 HydrophobicContact CD1-CG1 3.59Å; Y239-I243 HydrophobicContact CE1-CD1 3.63Å; Y239-I243 HydrophobicContact CE1-CG1 3.4Å; Y239-I243 VanDerWaalsContact CE1-CG1 3.4Å; Y239-I243 WeakPolarHBondContact O-CG1 3.41Å; Y239-I243 PolarHBondContact O-N 3.31Å; M240-I243 PolarHBondContact O-N 3.39Å; I243-F245 PolarHBondContact O-N 2.94Å; I243-T246 PolarHBondContact O-N 3.49Å; I243-F247 WeakPolarHBondContact O-CB 3.41Å; I243-F247 PolarHBondContact O-N 3.06Å; I243-M462 HydrophobicContact CB-SD 4.2Å; I243-M462 HydrophobicContact CG2-SD 3.86Å; I243-L465 HydrophobicContact CG2-CD1 3.53Å
244F97.2Very high96.3Very high16 Ų1636.6 Ų36.67%0.0717%0.169CC..Hα-helixtrans-63.7-40.8176.8177.9-126.1000112.4M240 I242 F247 R248 M454 F457 E458 C461M240-F244 WeakPolarHBondContact O-CB 3.41Å; M240-F244 PolarHBondContact O-N 2.89Å; I242-F244 VanDerWaalsContact C-N 3.34Å; I242-F244 PolarHBondContact O-N 2.94Å; F244-F247 PolarHBondContact O-N 3.4Å; F244-R248 HydrophobicContact CD2-CG 4.17Å; F244-R248 HydrophobicContact CE2-CG 3.78Å; F244-R248 HydrophobicContact CZ-CG 3.98Å; F244-R248 WeakPolarHBondContact O-CG 3.09Å; F244-R248 PolarHBondContact O-N 3.33Å; F244-R248 PolarHBondContact O-NE 2.84Å; F244-M454 HydrophobicContact CE1-CE 4.31Å; F244-F457 HydrophobicContact CE1-CB 3.87Å; F244-F457 HydrophobicContact CE2-CB 4.28Å; F244-F457 HydrophobicContact CZ-CB 3.57Å; F244-F457 HydrophobicContact CZ-CD2 4.17Å; F244-F457 HydrophobicContact CZ-CG 4.37Å; F244-E458 HydrophobicContact CB-CB 4.25Å; F244-E458 HydrophobicContact CB-CG 3.76Å; F244-E458 HydrophobicContact CD1-CB 4.29Å; F244-E458 HydrophobicContact CD1-CG 3.3Å; F244-E458 HydrophobicContact CE1-CG 4.12Å; F244-E458 HydrophobicContact CG-CB 4.39Å; F244-E458 HydrophobicContact CG-CG 3.77Å; F244-C461 HydrophobicContact CB-CB 4.29Å; F244-C461 HydrophobicContact CD2-CB 3.43Å; F244-C461 VanDerWaalsContact CD2-CB 3.43Å; F244-C461 HydrophobicContact CE2-CB 4.07Å; F244-C461 HydrophobicContact CG-CB 4.17Å
245F97Very high96.3Very high81 Ų8133.4 Ų33.436%0.35515%0.15SC..Hα-helixtrans-61.8-49.4174.5-175.1-91.6000111.2L214 M241 I242 I243 F247 R248 M249L214-F245 HydrophobicContact CD1-CD1 3.41Å; L214-F245 VanDerWaalsContact CD1-CD1 3.41Å; L214-F245 HydrophobicContact CD1-CE1 3.56Å; M241-F245 WeakPolarHBondContact O-CB 3.49Å; M241-F245 PolarHBondContact O-N 2.95Å; I242-F245 PolarHBondContact O-N 2.78Å; I243-F245 PolarHBondContact O-N 2.94Å; F245-F247 VanDerWaalsContact C-N 3.33Å; F245-F247 PolarHBondContact O-N 3.29Å; F245-R248 PolarHBondContact O-N 2.86Å; F245-R248 VanDerWaalsContact O-N 3.13Å; F245-M249 HydrophobicContact CD1-CE 4.46Å; F245-M249 HydrophobicContact CD1-CG 3.91Å; F245-M249 HydrophobicContact CD1-SD 4.5Å; F245-M249 HydrophobicContact CD2-CE 4Å; F245-M249 HydrophobicContact CE1-CE 4.11Å; F245-M249 HydrophobicContact CE1-CG 3.58Å; F245-M249 HydrophobicContact CE1-SD 3.78Å; F245-M249 HydrophobicContact CE2-CE 3.59Å; F245-M249 HydrophobicContact CE2-SD 4.18Å; F245-M249 HydrophobicContact CG-CE 4.42Å; F245-M249 HydrophobicContact CZ-CE 3.65Å; F245-M249 HydrophobicContact CZ-CG 4.05Å; F245-M249 HydrophobicContact CZ-SD 3.59Å; F245-M249 VanDerWaalsContact CZ-SD 3.59Å; F245-M249 WeakPolarHBondContact O-CG 3.26Å; F245-M249 PolarHBondContact O-N 3.48Å
246T96.7Very high96.2Very high9 Ų930.5 Ų30.56%0.05514%0.139CC..Hα-helixtrans-55.8-45.8176-57.30000112Y211 L214 I242 I243 R248 M249 R250Y211-T246 HydrophobicContact CD2-CG2 3.89Å; Y211-T246 HydrophobicContact CE2-CG2 4.25Å; L214-T246 HydrophobicContact CB-CG2 4.02Å; L214-T246 VanDerWaalsContact CB-OG1 3.3Å; L214-T246 WeakPolarHBondContact CB-OG1 3.39Å; I242-T246 WeakPolarHBondContact O-CB 3.36Å; I242-T246 PolarHBondContact O-N 3.43Å; I242-T246 PolarHBondContact O-OG1 3.28Å; I243-T246 PolarHBondContact O-N 3.49Å; T246-R248 PolarHBondContact O-N 2.92Å; T246-M249 PolarHBondContact O-N 2.98Å; T246-R250 PolarHBondContact O-N 3.48Å
247F95.6Very high96.2Very high32 Ų3230 Ų3014%0.1414%0.138CC..Hα-helixtrans-60.1-46.1176.4173.6-110.8000111.8I243 F244 F245 M249 R250 I251 W371 F464 L465I243-F247 WeakPolarHBondContact O-CB 3.41Å; I243-F247 PolarHBondContact O-N 3.06Å; F244-F247 PolarHBondContact O-N 3.4Å; F245-F247 VanDerWaalsContact C-N 3.33Å; F245-F247 PolarHBondContact O-N 3.29Å; F247-M249 PolarHBondContact O-N 3.49Å; F247-R250 WeakPolarHBondContact O-CB 3.3Å; F247-R250 PolarHBondContact O-N 3.47Å; F247-I251 HydrophobicContact CD2-CG1 4.3Å; F247-I251 HydrophobicContact CE1-CG1 4.19Å; F247-I251 HydrophobicContact CE2-CD1 4.05Å; F247-I251 HydrophobicContact CE2-CG1 3.84Å; F247-I251 HydrophobicContact CZ-CD1 4.19Å; F247-I251 HydrophobicContact CZ-CG1 3.78Å; F247-I251 WeakPolarHBondContact O-CG1 3.42Å; F247-I251 PolarHBondContact O-N 2.93Å; F247-I251 VanDerWaalsContact O-N 3.14Å; F247-W371 HydrophobicContact CE1-CH2 4.18Å; F247-W371 HydrophobicContact CE1-CZ2 4.22Å; F247-F464 HydrophobicContact CZ-CD1 4.31Å; F247-F464 HydrophobicContact CZ-CE1 4.1Å; F247-L465 HydrophobicContact CB-CD1 4.16Å; F247-L465 HydrophobicContact CD2-CD1 4.49Å; F247-L465 HydrophobicContact CD2-CD2 3.68Å; F247-L465 HydrophobicContact CE2-CD2 3.9Å; F247-L465 HydrophobicContact CG-CD1 4.33Å; F247-L465 HydrophobicContact CG-CD2 4.26Å
248R96.2Very high96.2Very high9 Ų928.7 Ų28.73%0.03413%0.132CC..Hα-helixtrans-62.2-42.5177-75.1-175.8-67.5153.42.6112.3F244 F245 T246 R250 I251 Y252 E359 W371F244-R248 HydrophobicContact CD2-CG 4.17Å; F244-R248 HydrophobicContact CE2-CG 3.78Å; F244-R248 HydrophobicContact CZ-CG 3.98Å; F244-R248 WeakPolarHBondContact O-CG 3.09Å; F244-R248 PolarHBondContact O-N 3.33Å; F244-R248 PolarHBondContact O-NE 2.84Å; F245-R248 PolarHBondContact O-N 2.86Å; F245-R248 VanDerWaalsContact O-N 3.13Å; T246-R248 PolarHBondContact O-N 2.92Å; R248-R250 VanDerWaalsContact C-N 3.27Å; R248-R250 PolarHBondContact O-N 2.94Å; R248-I251 PolarHBondContact O-N 3.41Å; R248-I251 VanDerWaalsContact O-N 3.13Å; R248-Y252 HydrophobicContact CB-CE1 4.23Å; R248-Y252 HydrophobicContact CB-CE2 4.3Å; R248-Y252 WeakPolarHBondContact O-CB 3.26Å; R248-Y252 VanDerWaalsContact O-CD1 3.31Å; R248-Y252 WeakPolarHBondContact O-CD1 3.29Å; R248-Y252 PolarHBondContact O-N 2.74Å; R248-E359 IonicContact CZ-OE1 3.49Å; R248-E359 IonicContact CZ-OE2 3.74Å; R248-E359 IonicContact NH1-OE1 3.66Å; R248-E359 PolarHBondContact NH1-OE1 3.12Å; R248-E359 IonicContact NH1-OE2 2.76Å; R248-E359 PolarHBondContact NH1-OE2 3Å; R248-E359 IonicContact NH2-OE2 2.77Å; R248-W371 HydrophobicContact CG-CH2 4.44Å; R248-W371 HydrophobicContact CG-CZ3 4.08Å
249M96.7Very high96.2Very high8 Ų823.3 Ų23.34%0.03911%0.108CC..Hα-helixtrans-56.9-42.3177-64.1-51.799.300111.6F207 A210 F245 T246 F247 Y252 F253F207-M249 HydrophobicContact CD1-CE 4.38Å; F207-M249 HydrophobicContact CD1-SD 3.62Å; F207-M249 HydrophobicContact CE1-SD 4.32Å; A210-M249 HydrophobicContact CB-CB 4.43Å; A210-M249 HydrophobicContact CB-CG 3.95Å; A210-M249 HydrophobicContact CB-SD 4.2Å; F245-M249 HydrophobicContact CD1-CE 4.46Å; F245-M249 HydrophobicContact CD1-CG 3.91Å; F245-M249 HydrophobicContact CD1-SD 4.5Å; F245-M249 HydrophobicContact CD2-CE 4Å; F245-M249 HydrophobicContact CE1-CE 4.11Å; F245-M249 HydrophobicContact CE1-CG 3.58Å; F245-M249 HydrophobicContact CE1-SD 3.78Å; F245-M249 HydrophobicContact CE2-CE 3.59Å; F245-M249 HydrophobicContact CE2-SD 4.18Å; F245-M249 HydrophobicContact CG-CE 4.42Å; F245-M249 HydrophobicContact CZ-CE 3.65Å; F245-M249 HydrophobicContact CZ-CG 4.05Å; F245-M249 HydrophobicContact CZ-SD 3.59Å; F245-M249 VanDerWaalsContact CZ-SD 3.59Å; F245-M249 WeakPolarHBondContact O-CG 3.26Å; F245-M249 PolarHBondContact O-N 3.48Å; T246-M249 PolarHBondContact O-N 2.98Å; F247-M249 PolarHBondContact O-N 3.49Å; M249-Y252 HydrophobicContact CE-CD2 3.74Å; M249-Y252 HydrophobicContact CE-CE2 3.78Å; M249-F253 PolarHBondContact O-N 3.45Å; M249-F253 VanDerWaalsContact O-N 3.09Å
250R95.1Very high96.1Very high88 Ų8822.9 Ų22.933%0.33211%0.106SC..Hα-helixtrans-58.6-49.3174.5-170.2-176.2177.8-164.3-3.3112D5 Y211 T246 F247 R248 A254D5-R250 IonicContact OD1-CZ 2.93Å; D5-R250 IonicContact OD1-NE 2.75Å; D5-R250 PolarHBondContact OD1-NE 2.94Å; D5-R250 IonicContact OD1-NH2 2.63Å; D5-R250 PolarHBondContact OD1-NH2 3.22Å; Y211-R250 HydrophobicContact CD1-CB 4.36Å; Y211-R250 HydrophobicContact CD1-CG 4.28Å; Y211-R250 HydrophobicContact CD2-CB 3.6Å; Y211-R250 HydrophobicContact CD2-CG 4.14Å; Y211-R250 HydrophobicContact CE1-CB 4.48Å; Y211-R250 HydrophobicContact CE1-CG 4.01Å; Y211-R250 HydrophobicContact CE2-CB 3.76Å; Y211-R250 HydrophobicContact CE2-CG 3.87Å; Y211-R250 HydrophobicContact CG-CB 3.91Å; Y211-R250 HydrophobicContact CG-CG 4.33Å; T246-R250 PolarHBondContact O-N 3.48Å; F247-R250 WeakPolarHBondContact O-CB 3.3Å; F247-R250 PolarHBondContact O-N 3.47Å; R248-R250 VanDerWaalsContact C-N 3.27Å; R248-R250 PolarHBondContact O-N 2.94Å; R250-A254 PolarHBondContact O-N 2.94Å; R250-A254 VanDerWaalsContact O-N 3.17Å
251I94.7Very high96.1Very high32 Ų3223 Ų2316%0.16411%0.107CC..Hα-helixtrans-71.3-37.8-177.3-60.4-59.4000111.8F247 R248 A254 W255 W371F247-I251 HydrophobicContact CD2-CG1 4.3Å; F247-I251 HydrophobicContact CE1-CG1 4.19Å; F247-I251 HydrophobicContact CE2-CD1 4.05Å; F247-I251 HydrophobicContact CE2-CG1 3.84Å; F247-I251 HydrophobicContact CZ-CD1 4.19Å; F247-I251 HydrophobicContact CZ-CG1 3.78Å; F247-I251 WeakPolarHBondContact O-CG1 3.42Å; F247-I251 PolarHBondContact O-N 2.93Å; F247-I251 VanDerWaalsContact O-N 3.14Å; R248-I251 PolarHBondContact O-N 3.41Å; R248-I251 VanDerWaalsContact O-N 3.13Å; I251-A254 PolarHBondContact O-N 3.43Å; I251-W255 HydrophobicContact CG2-CD2 3.54Å; I251-W255 HydrophobicContact CG2-CE3 3.48Å; I251-W255 VanDerWaalsContact CG2-CE3 3.48Å; I251-W255 HydrophobicContact CG2-CG 4.26Å; I251-W255 HydrophobicContact CG2-CH2 3.59Å; I251-W255 HydrophobicContact CG2-CZ2 3.7Å; I251-W255 HydrophobicContact CG2-CZ3 3.51Å; I251-W255 PolarHBondContact O-N 2.84Å; I251-W371 HydrophobicContact CB-CH2 3.71Å; I251-W371 HydrophobicContact CB-CZ2 4.44Å; I251-W371 HydrophobicContact CB-CZ3 4.41Å; I251-W371 HydrophobicContact CG1-CH2 3.98Å; I251-W371 HydrophobicContact CG1-CZ2 4.45Å; I251-W371 HydrophobicContact CG2-CH2 3.46Å; I251-W371 VanDerWaalsContact CG2-CH2 3.46Å; I251-W371 HydrophobicContact CG2-CZ2 3.88Å; I251-W371 HydrophobicContact CG2-CZ3 4.11Å
252Y96.6Very high96.1Very high1 Ų121.5 Ų21.50%0.00410%0.099CC..Hα-helixtrans-60.3-46.9176.5-70.8-1.4000111.2F207 R248 M249 K256 L353 I355 C358 E359 W371F207-Y252 AromaticContact CD1-CD2 3.93Å; F207-Y252 HydrophobicContact CD1-CD2 3.93Å; F207-Y252 AromaticContact CE1-CD2 3.86Å; F207-Y252 HydrophobicContact CE1-CD2 3.86Å; F207-Y252 HydrophobicContact CG-CD2 4.37Å; F207-Y252 HydrophobicContact CZ-CD2 4.26Å; R248-Y252 HydrophobicContact CB-CE1 4.23Å; R248-Y252 HydrophobicContact CB-CE2 4.3Å; R248-Y252 WeakPolarHBondContact O-CB 3.26Å; R248-Y252 VanDerWaalsContact O-CD1 3.31Å; R248-Y252 WeakPolarHBondContact O-CD1 3.29Å; R248-Y252 PolarHBondContact O-N 2.74Å; M249-Y252 HydrophobicContact CE-CD2 3.74Å; M249-Y252 HydrophobicContact CE-CE2 3.78Å; Y252-K256 VanDerWaalsContact O-CB 3.25Å; Y252-K256 WeakPolarHBondContact O-CB 3.46Å; Y252-K256 WeakPolarHBondContact O-CG 3.37Å; Y252-K256 PolarHBondContact O-N 3.22Å; Y252-L353 HydrophobicContact CD1-CD1 3.86Å; Y252-L353 HydrophobicContact CD1-CD2 3.27Å; Y252-L353 HydrophobicContact CD1-CG 4.17Å; Y252-L353 HydrophobicContact CE1-CD1 3.61Å; Y252-L353 HydrophobicContact CE1-CD2 3.84Å; Y252-L353 HydrophobicContact CE1-CG 4.29Å; Y252-L353 HydrophobicContact CG-CD2 3.73Å; Y252-I355 HydrophobicContact CD2-CG1 4.34Å; Y252-I355 HydrophobicContact CD2-CG2 4.41Å; Y252-I355 HydrophobicContact CE2-CG1 4.48Å; Y252-I355 HydrophobicContact CE2-CG2 4.02Å; Y252-C358 HydrophobicContact CE1-CB 4.48Å; Y252-C358 WeakPolarHBondContact OH-CB 3.33Å; Y252-E359 WeakPolarHBondContact CE2-OE1 3.39Å; Y252-E359 VanDerWaalsContact CZ-OE1 3.3Å; Y252-E359 PolarHBondContact OH-OE1 2.86Å; Y252-W371 HydrophobicContact CD1-CZ3 4.17Å; Y252-W371 HydrophobicContact CE1-CE3 4.1Å; Y252-W371 AromaticContact CE1-CZ3 3.66Å; Y252-W371 HydrophobicContact CE1-CZ3 3.66Å
253F95.5Very high96Very high43 Ų4319.1 Ų19.119%0.1899%0.087CC..Hα-helixtrans-56.4-53.3173.2174.4-103.8000111.4A204 F207 M249 W255 K256 M257A204-F253 HydrophobicContact CB-CD2 4.13Å; A204-F253 HydrophobicContact CB-CE2 4.46Å; A204-F253 WeakPolarHBondContact O-CD2 3.33Å; F207-F253 HydrophobicContact CB-CB 4.11Å; M249-F253 PolarHBondContact O-N 3.45Å; M249-F253 VanDerWaalsContact O-N 3.09Å; F253-W255 PolarHBondContact O-N 3.29Å; F253-K256 PolarHBondContact O-N 3.02Å; F253-M257 HydrophobicContact CD2-CG 4.09Å; F253-M257 HydrophobicContact CE1-CG 4.25Å; F253-M257 HydrophobicContact CE2-CG 3.73Å; F253-M257 HydrophobicContact CE2-SD 4.23Å; F253-M257 HydrophobicContact CZ-CG 3.82Å; F253-M257 WeakPolarHBondContact O-CB 3.36Å; F253-M257 VanDerWaalsContact O-CG 3.27Å; F253-M257 WeakPolarHBondContact O-CG 3.5Å; F253-M257 PolarHBondContact O-N 3.36Å
254A94.9Very high95.8Very high22 Ų2219 Ų1918%0.1829%0.087CC..Hα-helixtrans-61.7-44.3-175.600000113R250 I251 S258R250-A254 PolarHBondContact O-N 2.94Å; R250-A254 VanDerWaalsContact O-N 3.17Å; I251-A254 PolarHBondContact O-N 3.43Å; A254-S258 WeakPolarHBondContact O-CB 3.48Å; A254-S258 PolarHBondContact O-N 2.91Å
255W96.2Very high95.6Very high26 Ų2618.3 Ų18.310%0.0988%0.084CC..Hα-helixtrans-74.5-36.8-180-73.2-14.6000113.1T170 I251 F253 S258 E259 L353 W371 N372T170-W255 PolarHBondContact O-NE1 3.05Å; I251-W255 HydrophobicContact CG2-CD2 3.54Å; I251-W255 HydrophobicContact CG2-CE3 3.48Å; I251-W255 VanDerWaalsContact CG2-CE3 3.48Å; I251-W255 HydrophobicContact CG2-CG 4.26Å; I251-W255 HydrophobicContact CG2-CH2 3.59Å; I251-W255 HydrophobicContact CG2-CZ2 3.7Å; I251-W255 HydrophobicContact CG2-CZ3 3.51Å; I251-W255 PolarHBondContact O-N 2.84Å; F253-W255 PolarHBondContact O-N 3.29Å; W255-S258 PolarHBondContact O-N 2.87Å; W255-E259 WeakPolarHBondContact O-CG 3.39Å; W255-E259 PolarHBondContact O-N 3.45Å; W255-L353 HydrophobicContact CE3-CB 4.31Å; W255-L353 HydrophobicContact CE3-CD1 4.22Å; W255-L353 HydrophobicContact CZ3-CD1 4.44Å; W255-W371 HydrophobicContact CH2-CD2 4.05Å; W255-W371 AromaticContact CH2-CE2 3.5Å; W255-W371 HydrophobicContact CH2-CH2 4.27Å; W255-W371 AromaticContact CH2-CZ2 3.63Å; W255-W371 HydrophobicContact CH2-CZ2 3.63Å; W255-W371 AromaticContact CH2-NE1 3.69Å; W255-W371 AromaticContact CZ3-CD2 3.75Å; W255-W371 HydrophobicContact CZ3-CD2 3.75Å; W255-W371 AromaticContact CZ3-CE2 3.68Å; W255-W371 AromaticContact CZ3-CE3 3.98Å; W255-W371 HydrophobicContact CZ3-CE3 3.98Å; W255-W371 HydrophobicContact CZ3-CG 4.3Å; W255-W371 HydrophobicContact CZ3-CH2 4.14Å; W255-W371 AromaticContact CZ3-CZ2 3.89Å; W255-W371 HydrophobicContact CZ3-CZ2 3.89Å; W255-W371 HydrophobicContact CZ3-CZ3 4.17Å; W255-N372 HydrophobicContact CH2-CB 3.38Å; W255-N372 HydrophobicContact CZ2-CB 3.96Å; W255-N372 HydrophobicContact CZ3-CB 3.82Å
256K95.4Very high95.4Very high13 Ų1316.9 Ų16.96%0.0578%0.076CC..Hα-helixtrans-63.8-43.8173.1-77.7-76.8169175.30111.8E203 A204 Y252 F253 S258 E259 C260 I355E203-K256 WeakPolarHBondContact OE2-CE 3.43Å; E203-K256 IonicContact OE2-NZ 3.66Å; E203-K256 PolarHBondContact OE2-NZ 3.5Å; A204-K256 HydrophobicContact CB-CB 3.88Å; Y252-K256 VanDerWaalsContact O-CB 3.25Å; Y252-K256 WeakPolarHBondContact O-CB 3.46Å; Y252-K256 WeakPolarHBondContact O-CG 3.37Å; Y252-K256 PolarHBondContact O-N 3.22Å; F253-K256 PolarHBondContact O-N 3.02Å; K256-S258 PolarHBondContact O-N 3.44Å; K256-E259 IonicContact NZ-OE2 3.26Å; K256-E259 PolarHBondContact NZ-OE2 3.1Å; K256-E259 WeakPolarHBondContact O-CB 3.44Å; K256-E259 PolarHBondContact O-N 3.17Å; K256-C260 PolarHBondContact O-N 3.48Å; K256-C260 PolarHBondContact O-SG 2.88Å; K256-I355 HydrophobicContact CD-CD1 4.49Å; K256-I355 HydrophobicContact CG-CD1 4.48Å
257M95.9Very high95.3Very high13 Ų1316.4 Ų16.46%0.0647%0.074CC..Hα-helixtrans-60.1-36.9173.1-72.9-59-6500111.9L12 L16 L201 A204 F253 C260 V261L12-M257 HydrophobicContact CB-CB 4.49Å; L12-M257 HydrophobicContact CD1-CB 4.08Å; L12-M257 HydrophobicContact CD2-CB 4.3Å; L16-M257 HydrophobicContact CD2-CE 3.99Å; L201-M257 HydrophobicContact CD1-CE 4.3Å; L201-M257 HydrophobicContact CD1-SD 3.93Å; A204-M257 HydrophobicContact CB-CG 4.01Å; A204-M257 HydrophobicContact CB-SD 3.8Å; F253-M257 HydrophobicContact CD2-CG 4.09Å; F253-M257 HydrophobicContact CE1-CG 4.25Å; F253-M257 HydrophobicContact CE2-CG 3.73Å; F253-M257 HydrophobicContact CE2-SD 4.23Å; F253-M257 HydrophobicContact CZ-CG 3.82Å; F253-M257 WeakPolarHBondContact O-CB 3.36Å; F253-M257 VanDerWaalsContact O-CG 3.27Å; F253-M257 WeakPolarHBondContact O-CG 3.5Å; F253-M257 PolarHBondContact O-N 3.36Å; M257-C260 VanDerWaalsContact O-CB 3.29Å; M257-C260 WeakPolarHBondContact O-CB 3.13Å; M257-C260 PolarHBondContact O-N 3.49Å; M257-V261 WeakPolarHBondContact O-CG2 3.16Å; M257-V261 PolarHBondContact O-N 3.1Å
258S96Very high95.2Very high2 Ų215.1 Ų15.11%0.0147%0.069CC..Hα-helixtrans-74.2-33.4178-151.50000114.3T170 G171 A254 W255 K256 C260 V261 C262T170-S258 WeakPolarHBondContact OG1-CB 3.35Å; T170-S258 PolarHBondContact OG1-OG 2.98Å; G171-S258 VanDerWaalsContact O-CB 3.23Å; G171-S258 WeakPolarHBondContact O-CB 3.49Å; G171-S258 PolarHBondContact O-OG 3.4Å; A254-S258 WeakPolarHBondContact O-CB 3.48Å; A254-S258 PolarHBondContact O-N 2.91Å; W255-S258 PolarHBondContact O-N 2.87Å; K256-S258 PolarHBondContact O-N 3.44Å; S258-C260 VanDerWaalsContact C-N 3.27Å; S258-C260 PolarHBondContact O-N 2.99Å; S258-V261 WeakPolarHBondContact O-CB 3.49Å; S258-V261 PolarHBondContact O-N 2.7Å; S258-C262 PolarHBondContact O-N 3.34Å; S258-C262 PolarHBondContact O-SG 3.1Å
259E96.4Very high95.1Very high0 Ų014.8 Ų14.80%07%0.069CC..Hα-helixtrans-58-43.4167-72.6173.3-179.100110.1H200 W255 K256 V261 C262 I263 I350 S351 N352 L353H200-E259 IonicContact CD2-OE2 2.66Å; H200-E259 PolarHBondContact CD2-OE2 3.01Å; H200-E259 IonicContact NE2-OE2 3.08Å; W255-E259 WeakPolarHBondContact O-CG 3.39Å; W255-E259 PolarHBondContact O-N 3.45Å; K256-E259 IonicContact NZ-OE2 3.26Å; K256-E259 PolarHBondContact NZ-OE2 3.1Å; K256-E259 WeakPolarHBondContact O-CB 3.44Å; K256-E259 PolarHBondContact O-N 3.17Å; E259-V261 VanDerWaalsContact C-N 3.33Å; E259-V261 PolarHBondContact O-N 3.18Å; E259-C262 WeakPolarHBondContact O-CB 3.47Å; E259-C262 PolarHBondContact O-N 2.9Å; E259-C262 VanDerWaalsContact O-N 3.12Å; E259-I263 VanDerWaalsContact O-CG1 3.3Å; E259-I263 WeakPolarHBondContact O-CG1 3.49Å; E259-I263 PolarHBondContact O-N 3.15Å; E259-I350 HydrophobicContact CB-CD1 4.19Å; E259-I350 HydrophobicContact CG-CD1 4.26Å; E259-S351 WeakPolarHBondContact OE1-CA 3.36Å; E259-N352 WeakPolarHBondContact OE1-CA 3.34Å; E259-N352 PolarHBondContact OE1-N 3.32Å; E259-L353 PolarHBondContact OE1-N 3.16Å
260C96.1Very high95Very high0 Ų014.9 Ų14.90%07%0.069CC..Hα-helixtrans-58.9-40.3173.7-64.30000112.8L16 L197 H200 L201 K256 M257 S258 C262 I263 S264L16-C260 HydrophobicContact CD1-CB 3.72Å; L16-C260 WeakPolarHBondContact CD1-O 3.41Å; L197-C260 HydrophobicContact CD1-CB 3.61Å; H200-C260 WeakPolarHBondContact CB-SG 2.78Å; L201-C260 PolarHBondContact N-SG 2.74Å; K256-C260 PolarHBondContact O-N 3.48Å; K256-C260 PolarHBondContact O-SG 2.88Å; M257-C260 VanDerWaalsContact O-CB 3.29Å; M257-C260 WeakPolarHBondContact O-CB 3.13Å; M257-C260 PolarHBondContact O-N 3.49Å; S258-C260 VanDerWaalsContact C-N 3.27Å; S258-C260 PolarHBondContact O-N 2.99Å; C260-C262 VanDerWaalsContact C-N 3.33Å; C260-C262 PolarHBondContact O-N 2.92Å; C260-I263 PolarHBondContact O-N 3.01Å; C260-S264 VanDerWaalsContact O-CB 3.32Å; C260-S264 WeakPolarHBondContact O-CB 3.43Å; C260-S264 PolarHBondContact O-N 2.86Å; C260-S264 PolarHBondContact O-OG 3.07Å
261V96.2Very high94.8Very high2 Ų210.7 Ų10.71%0.0125%0.053CC..Hα-helixtrans-61.4-41.7174.8175.80000111.1L16 Y165 I166 M257 S258 E259 S264 A265L16-V261 HydrophobicContact CB-CG2 4.12Å; Y165-V261 HydrophobicContact CE2-CG1 3.9Å; I166-V261 HydrophobicContact CG2-CG1 4.39Å; M257-V261 WeakPolarHBondContact O-CG2 3.16Å; M257-V261 PolarHBondContact O-N 3.1Å; S258-V261 WeakPolarHBondContact O-CB 3.49Å; S258-V261 PolarHBondContact O-N 2.7Å; E259-V261 VanDerWaalsContact C-N 3.33Å; E259-V261 PolarHBondContact O-N 3.18Å; V261-S264 PolarHBondContact O-OG 3.31Å; V261-S264 VanDerWaalsContact O-OG 3.13Å; V261-A265 PolarHBondContact O-N 2.65Å; V261-A265 VanDerWaalsContact O-N 3.16Å
262C95.7Very high94.7Very high0 Ų015.3 Ų15.30%07%0.071CC..Hα-helixtrans-64.4-46.5177.3-60.90000111.2I166 S258 E259 C260 A265 R266 L267 I350I166-C262 HydrophobicContact CG2-CB 4.34Å; I166-C262 VanDerWaalsContact CG2-SG 3.58Å; S258-C262 PolarHBondContact O-N 3.34Å; S258-C262 PolarHBondContact O-SG 3.1Å; E259-C262 WeakPolarHBondContact O-CB 3.47Å; E259-C262 PolarHBondContact O-N 2.9Å; E259-C262 VanDerWaalsContact O-N 3.12Å; C260-C262 VanDerWaalsContact C-N 3.33Å; C260-C262 PolarHBondContact O-N 2.92Å; C262-A265 CarbonylContact O-C 3.31Å; C262-A265 PolarHBondContact O-N 2.98Å; C262-R266 PolarHBondContact O-N 3.14Å; C262-L267 PolarHBondContact O-N 3.32Å; C262-I350 HydrophobicContact CB-CB 4.03Å; C262-I350 HydrophobicContact CB-CD1 4.12Å; C262-I350 HydrophobicContact CB-CG1 3.78Å; C262-I350 HydrophobicContact CB-CG2 4.12Å
263I94.5Very high94.6Very high0 Ų018.7 Ų18.70%09%0.089CC..Hα-helixtrans-63.6-43.8178.8-63.1164.3000110.6T193 P196 L197 H200 E259 C260 A265 R266 Y347 I350T193-I263 WeakPolarHBondContact CG2-O 3.48Å; P196-I263 HydrophobicContact CB-CG2 4.24Å; L197-I263 HydrophobicContact CB-CG2 3.84Å; H200-I263 HydrophobicContact CB-CD1 4.34Å; E259-I263 VanDerWaalsContact O-CG1 3.3Å; E259-I263 WeakPolarHBondContact O-CG1 3.49Å; E259-I263 PolarHBondContact O-N 3.15Å; C260-I263 PolarHBondContact O-N 3.01Å; I263-A265 PolarHBondContact O-N 3.13Å; I263-R266 PolarHBondContact O-N 2.89Å; I263-Y347 HydrophobicContact CB-CD1 4.41Å; I263-Y347 HydrophobicContact CB-CE1 4.35Å; I263-Y347 HydrophobicContact CG1-CD1 3.8Å; I263-Y347 HydrophobicContact CG1-CD2 4.43Å; I263-Y347 HydrophobicContact CG1-CE1 4.24Å; I263-Y347 HydrophobicContact CG1-CG 3.9Å; I263-Y347 HydrophobicContact CG2-CE1 4.29Å; I263-Y347 HydrophobicContact CG2-CE2 4.31Å; I263-I350 HydrophobicContact CG1-CD1 4.12Å
264S94.1Very high94.5Very high3 Ų316.7 Ų16.72%0.0218%0.08CC..Hα-helixtrans-65.7-22.1179.281.50000112.7L16 G19 Q23 C260 V261L16-S264 PolarHBondContact O-OG 3.03Å; G19-S264 CarbonylContact C-O 3.58Å; Q23-S264 PolarHBondContact NE2-O 3.23Å; C260-S264 VanDerWaalsContact O-CB 3.32Å; C260-S264 WeakPolarHBondContact O-CB 3.43Å; C260-S264 PolarHBondContact O-N 2.86Å; C260-S264 PolarHBondContact O-OG 3.07Å; V261-S264 PolarHBondContact O-OG 3.31Å; V261-S264 VanDerWaalsContact O-OG 3.13Å
265A92.9Very high94.6Very high1 Ų120.8 Ų20.81%0.00810%0.096CC..Hα-helixtrans-94.2-6.2172.100000114I166 F182 V261 C262 I263 L267I166-A265 HydrophobicContact CD1-CB 3.42Å; I166-A265 VanDerWaalsContact CD1-CB 3.42Å; I166-A265 HydrophobicContact CG1-CB 4.2Å; F182-A265 HydrophobicContact CE2-CB 4.37Å; F182-A265 WeakPolarHBondContact CE2-O 3.49Å; V261-A265 PolarHBondContact O-N 2.65Å; V261-A265 VanDerWaalsContact O-N 3.16Å; C262-A265 CarbonylContact O-C 3.31Å; C262-A265 PolarHBondContact O-N 2.98Å; I263-A265 PolarHBondContact O-N 3.13Å; A265-L267 VanDerWaalsContact C-N 3.25Å; A265-L267 PolarHBondContact O-N 3.18Å
266R93.2Very high94.6Very high50 Ų5019.6 Ų19.619%0.1899%0.092CC..THydrogen-bonded Turntrans63.721.8-169.1-58.6176.3178.3178.43.4114.7Q23 T189 I191 T193 C262 I263Q23-R266 HydrophobicContact CG-CG 4.28Å; T189-R266 PolarHBondContact O-NH1 3.37Å; I191-R266 HydrophobicContact CD1-CB 4.39Å; I191-R266 HydrophobicContact CD1-CG 4.46Å; I191-R266 PolarHBondContact O-NH2 3.36Å; T193-R266 HydrophobicContact CG2-CG 3.52Å; C262-R266 PolarHBondContact O-N 3.14Å; I263-R266 PolarHBondContact O-N 2.89Å
267L94.1Very high94.6Very high0 Ų023.3 Ų23.30%011%0.109CC..THydrogen-bonded Turntrans-76.1129.7175.8-172.8146.9000109.9I166 Y174 T178 F182 C262 A265 I350I166-L267 HydrophobicContact CB-CD1 4.18Å; I166-L267 HydrophobicContact CD1-CB 4.12Å; I166-L267 HydrophobicContact CD1-CD1 3.75Å; I166-L267 HydrophobicContact CG2-CB 4.37Å; I166-L267 HydrophobicContact CG2-CD1 3.95Å; I166-L267 HydrophobicContact CG2-CG 4.5Å; Y174-L267 HydrophobicContact CD1-CD1 4.5Å; Y174-L267 HydrophobicContact CD1-CD2 3.86Å; Y174-L267 HydrophobicContact CD2-CD1 4.35Å; Y174-L267 HydrophobicContact CD2-CD2 4.38Å; Y174-L267 HydrophobicContact CE1-CD1 4.11Å; Y174-L267 HydrophobicContact CE1-CD2 4.21Å; Y174-L267 HydrophobicContact CE2-CD1 3.96Å; Y174-L267 HydrophobicContact CG-CD2 3.95Å; T178-L267 HydrophobicContact CG2-CD2 4.33Å; F182-L267 HydrophobicContact CB-CD1 4.37Å; F182-L267 HydrophobicContact CB-CG 4.32Å; F182-L267 HydrophobicContact CD1-CD1 4.28Å; F182-L267 HydrophobicContact CD2-CB 3.9Å; F182-L267 HydrophobicContact CD2-CD1 4.31Å; F182-L267 HydrophobicContact CD2-CG 4.29Å; F182-L267 HydrophobicContact CE2-CB 4.3Å; F182-L267 HydrophobicContact CG-CB 4.41Å; F182-L267 HydrophobicContact CG-CD1 4.06Å; F182-L267 HydrophobicContact CG-CG 4.3Å; C262-L267 PolarHBondContact O-N 3.32Å; A265-L267 VanDerWaalsContact C-N 3.25Å; A265-L267 PolarHBondContact O-N 3.18Å; L267-I350 HydrophobicContact CD2-CG2 3.62Å
268G93.9Very high94.6Very high4 Ų425 Ų254%0.04112%0.116CC..THydrogen-bonded Turntrans8111.4-18000000115.2Y270G268-Y270 WeakPolarHBondContact O-CD2 3.3Å; G268-Y270 PolarHBondContact O-N 3.24Å
269A93.7Very high94.5Very high3 Ų325 Ų253%0.02512%0.116CC..  trans-74.7116.117200000110.4I191 Y345 Y347I191-A269 HydrophobicContact CD1-CB 3.93Å; I191-A269 HydrophobicContact CG2-CB 4.5Å; A269-Y345 HydrophobicContact CB-CD1 4.11Å; A269-Y347 HydrophobicContact CB-CD1 4.2Å; A269-Y347 HydrophobicContact CB-CE1 3.54Å; A269-Y347 HydrophobicContact CB-CE2 4.42Å
270Y93.3Very high94.4Very high10 Ų1027.1 Ų27.14%0.03913%0.126CC..EExtended strand (participates in β ladder)trans-127.6152.8172.8-66-82.3000111.2T178 D181 G268 K272 P276 P282 Y345 N346 T349T178-Y270 WeakPolarHBondContact CA-OH 3.25Å; T178-Y270 HydrophobicContact CG2-CE2 4.41Å; D181-Y270 HydrophobicContact CB-CE1 4.27Å; D181-Y270 WeakPolarHBondContact OD2-CE1 3.33Å; D181-Y270 PolarHBondContact OD2-OH 3.21Å; G268-Y270 WeakPolarHBondContact O-CD2 3.3Å; G268-Y270 PolarHBondContact O-N 3.24Å; Y270-K272 PolarHBondContact O-N 3.02Å; Y270-P276 HydrophobicContact CD2-CB 4.18Å; Y270-P276 HydrophobicContact CG-CB 4.44Å; Y270-P282 HydrophobicContact CD1-CG 3.24Å; Y270-P282 HydrophobicContact CD2-CG 4.29Å; Y270-P282 VanDerWaalsContact CE1-CD 3.45Å; Y270-P282 HydrophobicContact CE1-CG 3.54Å; Y270-P282 HydrophobicContact CG-CG 3.64Å; Y270-Y345 VanDerWaalsContact C-CD1 3.43Å; Y270-Y345 CarbonylContact O-C 3.39Å; Y270-Y345 WeakPolarHBondContact O-CA 3.47Å; Y270-N346 PolarHBondContact N-O 3.02Å; Y270-N346 VanDerWaalsContact N-O 3.09Å; Y270-N346 PolarHBondContact O-N 3.28Å; Y270-T349 VanDerWaalsContact CD2-OG1 3.25Å; Y270-T349 WeakPolarHBondContact CD2-OG1 3.47Å; Y270-T349 HydrophobicContact CE2-CG2 4.06Å; Y270-T349 WeakPolarHBondContact CE2-OG1 3.34Å
271P92.2Very high94.3Very high0 Ų027.1 Ų27.10%013%0.126CC..EExtended strand (participates in β ladder)trans-55.3133.2174.2-24.434.6000110.7L273 S274 L288 Y291 V343 Y345P271-L273 HydrophobicContact CB-CD1 4.41Å; P271-L273 HydrophobicContact CB-CD2 4.19Å; P271-L273 HydrophobicContact CB-CG 3.9Å; P271-L273 PolarHBondContact O-N 3.16Å; P271-L273 VanDerWaalsContact O-N 3.13Å; P271-S274 WeakPolarHBondContact O-CB 3.41Å; P271-S274 PolarHBondContact O-N 3.03Å; P271-S274 PolarHBondContact O-OG 2.96Å; P271-L288 HydrophobicContact CG-CD1 4.22Å; P271-Y291 HydrophobicContact CB-CD1 4.22Å; P271-Y291 HydrophobicContact CB-CE1 4.2Å; P271-Y291 HydrophobicContact CG-CD1 3.61Å; P271-Y291 HydrophobicContact CG-CE1 3.36Å; P271-Y291 HydrophobicContact CG-CG 4.37Å; P271-V343 HydrophobicContact CB-CG1 4.15Å; P271-Y345 HydrophobicContact CG-CE1 4.02Å
272K92.7Very high94.3Very high128 Ų12827.2 Ų27.256%0.55713%0.126SC*.G310 helixtrans-55.9-34.1-176.8-175.8175.9178.5179.10113.1Y270 S274 E275 I344 N346Y270-K272 PolarHBondContact O-N 3.02Å; K272-S274 PolarHBondContact O-N 2.99Å; K272-E275 PolarHBondContact O-N 3.47Å; K272-E275 VanDerWaalsContact O-N 3.17Å; K272-I344 VanDerWaalsContact CB-O 3.28Å; K272-I344 WeakPolarHBondContact CB-O 3.34Å; K272-I344 HydrophobicContact CD-CG2 4.27Å; K272-I344 PolarHBondContact N-O 2.63Å; K272-N346 HydrophobicContact CB-CB 4.37Å
273L93.6Very high94.3Very high73 Ų7329.2 Ų29.238%0.38214%0.139SC..G310 helixtrans-59.5-21175.364.589.3000114.3P271 E275 A287 Y291P271-L273 HydrophobicContact CB-CD1 4.41Å; P271-L273 HydrophobicContact CB-CD2 4.19Å; P271-L273 HydrophobicContact CB-CG 3.9Å; P271-L273 PolarHBondContact O-N 3.16Å; P271-L273 VanDerWaalsContact O-N 3.13Å; L273-E275 PolarHBondContact O-N 3.09Å; L273-A287 HydrophobicContact CD1-CB 3.72Å; L273-A287 WeakPolarHBondContact CD1-O 3.36Å; L273-A287 WeakPolarHBondContact O-CB 3.45Å; L273-Y291 HydrophobicContact CD1-CG 4.41Å; L273-Y291 HydrophobicContact CD2-CD2 3.8Å; L273-Y291 HydrophobicContact CD2-CG 3.96Å
274S94.1Very high94.4Very high0 Ų031.6 Ų31.60%015%0.151CC..G310 helixtrans-84.60.6-179.273.70000113.3P271 K272 P282 T283 N284P271-S274 WeakPolarHBondContact O-CB 3.41Å; P271-S274 PolarHBondContact O-N 3.03Å; P271-S274 PolarHBondContact O-OG 2.96Å; K272-S274 PolarHBondContact O-N 2.99Å; S274-P282 WeakPolarHBondContact O-CA 3.42Å; S274-T283 PolarHBondContact O-N 3.3Å; S274-N284 PolarHBondContact O-N 3.27Å
275E96Very high94.5Very high108 Ų10832 Ų3251%0.50515%0.153SC..  trans48.657.6178.2-64.5169.4-14600112.1K272 L273 E277 T283 N284K272-E275 PolarHBondContact O-N 3.47Å; K272-E275 VanDerWaalsContact O-N 3.17Å; L273-E275 PolarHBondContact O-N 3.09Å; E275-E277 PolarHBondContact O-N 3.45Å; E275-T283 PolarHBondContact O-N 3.29Å; E275-T283 PolarHBondContact O-OG1 2.88Å; E275-N284 HydrophobicContact CB-CB 4.07Å; E275-N284 HydrophobicContact CG-CB 4.15Å; E275-N284 PolarHBondContact OE1-ND2 3.19Å
276P96.2Very high94.6Very high2 Ų237.1 Ų37.11%0.01318%0.177CC..EExtended strand (participates in β ladder)trans-65.2132.3-177.526.3-33.9000111.6Y270 G281 N346 N348 T349Y270-P276 HydrophobicContact CD2-CB 4.18Å; Y270-P276 HydrophobicContact CG-CB 4.44Å; P276-G281 CarbonylContact C-O 3.11Å; P276-G281 VanDerWaalsContact CA-O 3.3Å; P276-G281 WeakPolarHBondContact CA-O 3.15Å; P276-N346 HydrophobicContact CG-CB 3.85Å; P276-N348 WeakPolarHBondContact O-CB 3.39Å; P276-N348 PolarHBondContact O-ND2 2.89Å; P276-T349 WeakPolarHBondContact CB-OG1 3.36Å
277E95.7Very high94.7Very high91 Ų9135.8 Ų35.843%0.42518%0.177SC..EExtended strand (participates in β ladder)trans-110.8153.9179.6-76.7-63158.900112.4E275 G279 E280 G281 T283 T349E275-E277 PolarHBondContact O-N 3.45Å; E277-G279 PolarHBondContact O-N 2.81Å; E277-E280 HydrophobicContact CB-CB 4.1Å; E277-E280 PolarHBondContact O-N 3.09Å; E277-G281 PolarHBondContact N-O 2.48Å; E277-G281 PolarHBondContact O-N 2.75Å; E277-G281 VanDerWaalsContact O-N 3.07Å; E277-T283 HydrophobicContact CB-CG2 3.75Å; E277-T283 HydrophobicContact CG-CG2 3.56Å; E277-T349 WeakPolarHBondContact O-CA 3.29Å
278K95.5Very high94.7Very high49 Ų4936.1 Ų36.121%0.21318%0.178CC..THydrogen-bonded Turntrans-57.6119.3-174.7-58.7179.6176.6-171.90111.4E280 N348 S351 C373 F377K278-E280 PolarHBondContact O-N 2.81Å; K278-E280 VanDerWaalsContact O-N 3.15Å; K278-N348 WeakPolarHBondContact CA-O 3.25Å; K278-N348 WeakPolarHBondContact CE-OD1 3.19Å; K278-N348 WeakPolarHBondContact CG-O 3.35Å; K278-S351 WeakPolarHBondContact CD-O 3.49Å; K278-S351 WeakPolarHBondContact CG-O 3.36Å; K278-C373 HydrophobicContact CB-CB 4Å; K278-C373 HydrophobicContact CD-CB 3.46Å; K278-C373 VanDerWaalsContact CD-CB 3.46Å; K278-C373 HydrophobicContact CG-CB 4.31Å; K278-C373 PolarHBondContact NZ-SG 3.04Å; K278-F377 WeakPolarHBondContact O-CB 3.5Å; K278-F377 WeakPolarHBondContact O-CD2 3.23Å
279G93.6Very high94.7Very high0 Ų037 Ų370%018%0.182CC..THydrogen-bonded Turntrans74-16.7-176.300000115.7E277 T349 F377E277-G279 PolarHBondContact O-N 2.81Å; G279-T349 PolarHBondContact N-O 3.41Å; G279-F377 WeakPolarHBondContact O-CE1 3.33Å; G279-F377 WeakPolarHBondContact O-CZ 3.14Å
280E94.4Very high94.7Very high45 Ų4540.4 Ų40.421%0.2120%0.2CC..THydrogen-bonded Turntrans-93.4-33.1-175.7-162.6160163.900113.5K149 E277 K278 T283 F377K149-E280 PolarHBondContact NZ-O 2.76Å; E277-E280 HydrophobicContact CB-CB 4.1Å; E277-E280 PolarHBondContact O-N 3.09Å; K278-E280 PolarHBondContact O-N 2.81Å; K278-E280 VanDerWaalsContact O-N 3.15Å; E280-T283 HydrophobicContact CG-CG2 4.37Å; E280-F377 VanDerWaalsContact CA-CE2 3.44Å; E280-F377 HydrophobicContact CB-CD2 3.98Å; E280-F377 HydrophobicContact CB-CE2 3.28Å; E280-F377 HydrophobicContact CB-CZ 3.9Å; E280-F377 HydrophobicContact CG-CE2 3.6Å; E280-F377 HydrophobicContact CG-CZ 4.09Å
281G95.2Very high94.5Very high0 Ų040.8 Ų40.80%020%0.201CC..EExtended strand (participates in β ladder)trans77.9-154.4-166.100000111.5P276 E277 T283 T349P276-G281 CarbonylContact C-O 3.11Å; P276-G281 VanDerWaalsContact CA-O 3.3Å; P276-G281 WeakPolarHBondContact CA-O 3.15Å; E277-G281 PolarHBondContact N-O 2.48Å; E277-G281 PolarHBondContact O-N 2.75Å; E277-G281 VanDerWaalsContact O-N 3.07Å; G281-T283 PolarHBondContact O-N 3Å; G281-T349 WeakPolarHBondContact CA-OG1 3.37Å
282P96.1Very high94.4Very high4 Ų444.1 Ų44.13%0.02622%0.217CC..EExtended strand (participates in β ladder)trans-55.5131.6-177.9-30.438.4000113.6K149 Y270 S274 L285 L288K149-P282 WeakPolarHBondContact CE-O 3.48Å; K149-P282 PolarHBondContact NZ-O 3.43Å; Y270-P282 HydrophobicContact CD1-CG 3.24Å; Y270-P282 HydrophobicContact CD2-CG 4.29Å; Y270-P282 VanDerWaalsContact CE1-CD 3.45Å; Y270-P282 HydrophobicContact CE1-CG 3.54Å; Y270-P282 HydrophobicContact CG-CG 3.64Å; S274-P282 WeakPolarHBondContact O-CA 3.42Å; P282-L285 HydrophobicContact CB-CD2 4.14Å; P282-L288 HydrophobicContact CB-CD2 3.77Å; P282-L288 HydrophobicContact CG-CD2 3.82Å
283T96.3Very high94.3Very high42 Ų4242.7 Ų42.726%0.25821%0.213SC..SBendtrans-107.5-33.2174.762.40000112.2S274 E275 E277 E280 G281 L285S274-T283 PolarHBondContact O-N 3.3Å; E275-T283 PolarHBondContact O-N 3.29Å; E275-T283 PolarHBondContact O-OG1 2.88Å; E277-T283 HydrophobicContact CB-CG2 3.75Å; E277-T283 HydrophobicContact CG-CG2 3.56Å; E280-T283 HydrophobicContact CG-CG2 4.37Å; G281-T283 PolarHBondContact O-N 3Å; T283-L285 PolarHBondContact O-N 3.07Å; T283-L285 VanDerWaalsContact O-N 3.11Å
284N96.1Very high94Very high50 Ų5045 Ų4527%0.26722%0.222SC..  trans-86.178.4173.4-166.9-22.1000110.7S274 E275 H286 A287 L288S274-N284 PolarHBondContact O-N 3.27Å; E275-N284 HydrophobicContact CB-CB 4.07Å; E275-N284 HydrophobicContact CG-CB 4.15Å; E275-N284 PolarHBondContact OE1-ND2 3.19Å; N284-H286 VanDerWaalsContact C-N 3.3Å; N284-H286 PolarHBondContact O-N 3.12Å; N284-A287 HydrophobicContact CB-CB 4.3Å; N284-A287 PolarHBondContact O-N 3.34Å; N284-A287 WeakPolarHBondContact OD1-CB 3.43Å; N284-A287 PolarHBondContact OD1-N 3.47Å; N284-A287 VanDerWaalsContact OD1-N 3.12Å; N284-L288 PolarHBondContact O-N 3.04Å; N284-L288 VanDerWaalsContact O-N 3.14Å
285L96.5Very high93.4Very high11 Ų1147.8 Ų47.86%0.05823%0.234CC..Hα-helixtrans-67.4-29.7-175.3-57-173.8000113.2L144 L145 Y148 K149 P282 T283 L288 D289L144-L285 HydrophobicContact CB-CB 4.05Å; L144-L285 HydrophobicContact CB-CD1 4.28Å; L144-L285 HydrophobicContact CD1-CB 4.44Å; L145-L285 HydrophobicContact CD2-CD1 3.73Å; L145-L285 HydrophobicContact CG-CD1 4.16Å; Y148-L285 HydrophobicContact CD2-CB 4.42Å; K149-L285 HydrophobicContact CG-CD1 4.25Å; P282-L285 HydrophobicContact CB-CD2 4.14Å; T283-L285 PolarHBondContact O-N 3.07Å; T283-L285 VanDerWaalsContact O-N 3.11Å; L285-L288 PolarHBondContact O-N 2.94Å; L285-D289 WeakPolarHBondContact O-CB 3.42Å; L285-D289 PolarHBondContact O-N 3.37Å
286H94.9Very high92.9Very high110 Ų11045.2 Ų45.251%0.50923%0.232SC..Hα-helixtrans-68.4-45.2177.7-178.661.8000111.5L144 N284 L288 D289 L290L144-H286 HydrophobicContact CD1-CB 4.15Å; N284-H286 VanDerWaalsContact C-N 3.3Å; N284-H286 PolarHBondContact O-N 3.12Å; H286-L288 VanDerWaalsContact C-N 3.31Å; H286-L288 PolarHBondContact O-N 3.39Å; H286-D289 WeakPolarHBondContact O-CB 3.38Å; H286-D289 PolarHBondContact O-N 2.89Å; H286-L290 WeakPolarHBondContact O-CG 3.23Å; H286-L290 PolarHBondContact O-N 3.07Å; H286-L290 VanDerWaalsContact O-N 3.09Å
287A94.3Very high92.4Very high22 Ų2247.9 Ų47.918%0.18225%0.254CS..Hα-helixtrans-62.5-40.8174.700000111.5L273 N284 D289 Y291L273-A287 HydrophobicContact CD1-CB 3.72Å; L273-A287 WeakPolarHBondContact CD1-O 3.36Å; L273-A287 WeakPolarHBondContact O-CB 3.45Å; N284-A287 HydrophobicContact CB-CB 4.3Å; N284-A287 PolarHBondContact O-N 3.34Å; N284-A287 WeakPolarHBondContact OD1-CB 3.43Å; N284-A287 PolarHBondContact OD1-N 3.47Å; N284-A287 VanDerWaalsContact OD1-N 3.12Å; A287-D289 VanDerWaalsContact C-N 3.31Å; A287-D289 PolarHBondContact O-N 3.28Å; A287-Y291 WeakPolarHBondContact O-CB 3.45Å; A287-Y291 PolarHBondContact O-N 3.27Å
288L94Very high91.7Very high6 Ų647.5 Ų47.53%0.03126%0.255CS..Hα-helixtrans-60.3-41.1174.5-176.763.1000112.1Y148 P271 P282 N284 L285 H286 Y291 M292Y148-L288 HydrophobicContact CD1-CD2 3.56Å; Y148-L288 HydrophobicContact CD1-CG 4.2Å; Y148-L288 HydrophobicContact CE1-CD2 3.91Å; Y148-L288 HydrophobicContact CE1-CG 4.03Å; Y148-L288 HydrophobicContact CG-CD2 3.98Å; P271-L288 HydrophobicContact CG-CD1 4.22Å; P282-L288 HydrophobicContact CB-CD2 3.77Å; P282-L288 HydrophobicContact CG-CD2 3.82Å; N284-L288 PolarHBondContact O-N 3.04Å; N284-L288 VanDerWaalsContact O-N 3.14Å; L285-L288 PolarHBondContact O-N 2.94Å; H286-L288 VanDerWaalsContact C-N 3.31Å; H286-L288 PolarHBondContact O-N 3.39Å; L288-Y291 HydrophobicContact CD1-CD1 4.44Å; L288-Y291 PolarHBondContact O-N 3.22Å; L288-M292 HydrophobicContact CD1-CE 3.65Å; L288-M292 HydrophobicContact CD1-CG 4.22Å; L288-M292 HydrophobicContact CG-CE 4.43Å; L288-M292 HydrophobicContact CG-CG 4.35Å; L288-M292 WeakPolarHBondContact O-CB 3.26Å; L288-M292 WeakPolarHBondContact O-CG 3.28Å; L288-M292 PolarHBondContact O-N 3.13Å
289D94.5Very high90.8Very high23 Ų2348.8 Ų48.812%0.12326%0.264CS..Hα-helixtrans-60.7-53.6178.6-161.843.6000111.6L144 K147 Y148 L285 H286 A287 Y291 M292 E293L144-D289 HydrophobicContact CD2-CB 3.81Å; K147-D289 WeakPolarHBondContact CE-OD1 3.4Å; K147-D289 IonicContact NZ-OD1 2.66Å; K147-D289 PolarHBondContact NZ-OD1 2.81Å; Y148-D289 HydrophobicContact CE2-CB 3.8Å; Y148-D289 WeakPolarHBondContact CE2-OD1 3.2Å; Y148-D289 WeakPolarHBondContact OH-CA 3.18Å; Y148-D289 PolarHBondContact OH-OD1 3.48Å; L285-D289 WeakPolarHBondContact O-CB 3.42Å; L285-D289 PolarHBondContact O-N 3.37Å; H286-D289 WeakPolarHBondContact O-CB 3.38Å; H286-D289 PolarHBondContact O-N 2.89Å; A287-D289 VanDerWaalsContact C-N 3.31Å; A287-D289 PolarHBondContact O-N 3.28Å; D289-Y291 VanDerWaalsContact C-N 3.28Å; D289-Y291 PolarHBondContact O-N 3.46Å; D289-M292 PolarHBondContact O-N 3.17Å; D289-M292 VanDerWaalsContact O-N 3.11Å; D289-E293 WeakPolarHBondContact O-CG 3.32Å; D289-E293 PolarHBondContact O-N 2.95Å
290L93Very high90.2Very high75 Ų7553.8 Ų53.839%0.39329%0.294SS..Hα-helixtrans-56.6-41.8176.2-68.1174.1000112.1H286 Q294H286-L290 WeakPolarHBondContact O-CG 3.23Å; H286-L290 PolarHBondContact O-N 3.07Å; H286-L290 VanDerWaalsContact O-N 3.09Å; L290-Q294 VanDerWaalsContact O-CG 3.25Å; L290-Q294 WeakPolarHBondContact O-CG 3.3Å; L290-Q294 PolarHBondContact O-N 3.49Å
291Y90.5Very high89.5Confident17 Ų1758.5 Ų58.57%0.06731%0.314CS..Hα-helixtrans-62.4-47.6176.2168.8-101.3000112.2P271 L273 A287 L288 D289 E293 Q294 Q295 V343 Y345P271-Y291 HydrophobicContact CB-CD1 4.22Å; P271-Y291 HydrophobicContact CB-CE1 4.2Å; P271-Y291 HydrophobicContact CG-CD1 3.61Å; P271-Y291 HydrophobicContact CG-CE1 3.36Å; P271-Y291 HydrophobicContact CG-CG 4.37Å; L273-Y291 HydrophobicContact CD1-CG 4.41Å; L273-Y291 HydrophobicContact CD2-CD2 3.8Å; L273-Y291 HydrophobicContact CD2-CG 3.96Å; A287-Y291 WeakPolarHBondContact O-CB 3.45Å; A287-Y291 PolarHBondContact O-N 3.27Å; L288-Y291 HydrophobicContact CD1-CD1 4.44Å; L288-Y291 PolarHBondContact O-N 3.22Å; D289-Y291 VanDerWaalsContact C-N 3.28Å; D289-Y291 PolarHBondContact O-N 3.46Å; Y291-E293 VanDerWaalsContact C-N 3.32Å; Y291-E293 PolarHBondContact O-N 3.25Å; Y291-Q294 PolarHBondContact O-N 3.25Å; Y291-Q295 HydrophobicContact CD1-CG 4.41Å; Y291-Q295 HydrophobicContact CD2-CG 4.26Å; Y291-Q295 HydrophobicContact CE1-CG 3.87Å; Y291-Q295 HydrophobicContact CE2-CG 3.69Å; Y291-Q295 VanDerWaalsContact CE2-NE2 3.32Å; Y291-Q295 VanDerWaalsContact CZ-CG 3.48Å; Y291-Q295 WeakPolarHBondContact O-CG 3.5Å; Y291-Q295 PolarHBondContact O-N 3.34Å; Y291-V343 HydrophobicContact CE2-CB 4.33Å; Y291-V343 HydrophobicContact CE2-CG1 3.79Å; Y291-V343 HydrophobicContact CE2-CG2 3.61Å; Y291-Y345 PolarHBondContact OH-OH 2.94Å
292M89.4Confident88.5Confident70 Ų7061.6 Ų61.635%0.34533%0.33SS..Hα-helixtrans-65.1-37.7-178.6-69.9-70.8-179.100111.5Y148 L288 D289 Q295 A296Y148-M292 HydrophobicContact CE1-CG 4.28Å; L288-M292 HydrophobicContact CD1-CE 3.65Å; L288-M292 HydrophobicContact CD1-CG 4.22Å; L288-M292 HydrophobicContact CG-CE 4.43Å; L288-M292 HydrophobicContact CG-CG 4.35Å; L288-M292 WeakPolarHBondContact O-CB 3.26Å; L288-M292 WeakPolarHBondContact O-CG 3.28Å; L288-M292 PolarHBondContact O-N 3.13Å; D289-M292 PolarHBondContact O-N 3.17Å; D289-M292 VanDerWaalsContact O-N 3.11Å; M292-Q295 PolarHBondContact O-N 3.39Å; M292-A296 WeakPolarHBondContact O-CB 3.44Å; M292-A296 PolarHBondContact O-N 3.16Å
293E89.9Confident87.6Confident99 Ų9965.7 Ų65.746%0.46335%0.352SS..Hα-helixtrans-64.1-43.7174-71.4-179.5166.400112.2D289 Y291 Q295 A296 A297D289-E293 WeakPolarHBondContact O-CG 3.32Å; D289-E293 PolarHBondContact O-N 2.95Å; Y291-E293 VanDerWaalsContact C-N 3.32Å; Y291-E293 PolarHBondContact O-N 3.25Å; E293-Q295 PolarHBondContact O-N 3.39Å; E293-A296 PolarHBondContact O-N 2.97Å; E293-A297 WeakPolarHBondContact O-CB 3.43Å; E293-A297 PolarHBondContact O-N 3.27Å
294Q87.3Confident86.8Confident122 Ų12266.3 Ų66.357%0.5736%0.358SS*.Hα-helixtrans-62.1-42.4175.2-73.6172.2-0.500112.1L290 Y291 A297 N298L290-Q294 VanDerWaalsContact O-CG 3.25Å; L290-Q294 WeakPolarHBondContact O-CG 3.3Å; L290-Q294 PolarHBondContact O-N 3.49Å; Y291-Q294 PolarHBondContact O-N 3.25Å; Q294-A297 PolarHBondContact O-N 2.95Å; Q294-N298 WeakPolarHBondContact O-CB 3.45Å; Q294-N298 VanDerWaalsContact O-CG 3.24Å; Q294-N298 PolarHBondContact O-N 2.99Å; Q294-N298 PolarHBondContact O-ND2 3.29Å
295Q83.1Confident85.9Confident57 Ų5766.8 Ų66.827%0.26636%0.363SS..Hα-helixtrans-62.7-45.5175.7-69.8-62.3-36.900111.4Y291 M292 E293 A297 N298 D299Y291-Q295 HydrophobicContact CD1-CG 4.41Å; Y291-Q295 HydrophobicContact CD2-CG 4.26Å; Y291-Q295 HydrophobicContact CE1-CG 3.87Å; Y291-Q295 HydrophobicContact CE2-CG 3.69Å; Y291-Q295 VanDerWaalsContact CE2-NE2 3.32Å; Y291-Q295 VanDerWaalsContact CZ-CG 3.48Å; Y291-Q295 WeakPolarHBondContact O-CG 3.5Å; Y291-Q295 PolarHBondContact O-N 3.34Å; M292-Q295 PolarHBondContact O-N 3.39Å; E293-Q295 PolarHBondContact O-N 3.39Å; Q295-A297 VanDerWaalsContact C-N 3.34Å; Q295-A297 PolarHBondContact O-N 3.25Å; Q295-N298 PolarHBondContact O-N 2.94Å; Q295-D299 PolarHBondContact O-N 3.38Å
296A84.4Confident84.7Confident54 Ų5469.8 Ų69.845%0.44638%0.378SS..Hα-helixtrans-61.1-42.2176.700000112.1M292 E293 D299 V300M292-A296 WeakPolarHBondContact O-CB 3.44Å; M292-A296 PolarHBondContact O-N 3.16Å; E293-A296 PolarHBondContact O-N 2.97Å; A296-D299 PolarHBondContact O-N 3.29Å; A296-V300 WeakPolarHBondContact O-CG2 3.41Å; A296-V300 PolarHBondContact O-N 3.08Å
297A85.9Confident83.7Confident59 Ų5969.5 Ų69.549%0.48838%0.38SS..Hα-helixtrans-63.5-41176.200000112.3E293 Q294 Q295 V300 K301E293-A297 WeakPolarHBondContact O-CB 3.43Å; E293-A297 PolarHBondContact O-N 3.27Å; Q294-A297 PolarHBondContact O-N 2.95Å; Q295-A297 VanDerWaalsContact C-N 3.34Å; Q295-A297 PolarHBondContact O-N 3.25Å; A297-V300 PolarHBondContact O-N 3.26Å; A297-K301 WeakPolarHBondContact O-CB 3.36Å; A297-K301 PolarHBondContact O-N 3.02Å
298N80.5Confident82.8Confident83 Ų8374.5 Ų74.544%0.44440%0.4SS..Hα-helixtrans-65.4-41.4176.3-73.8-21.5000112.2Q294 Q295 V300 K301 L302Q294-N298 WeakPolarHBondContact O-CB 3.45Å; Q294-N298 VanDerWaalsContact O-CG 3.24Å; Q294-N298 PolarHBondContact O-N 2.99Å; Q294-N298 PolarHBondContact O-ND2 3.29Å; Q295-N298 PolarHBondContact O-N 2.94Å; N298-V300 PolarHBondContact O-N 2.9Å; N298-K301 PolarHBondContact O-N 2.9Å; N298-L302 WeakPolarHBondContact O-CB 3.11Å; N298-L302 PolarHBondContact O-N 3.14Å
299D77.6Confident81.7Confident76 Ų7679.6 Ų79.641%0.40642%0.42SS..Hα-helixtrans-62.3-42175.7-80.5-15.5000111.5Q295 A296 L302 N303Q295-D299 PolarHBondContact O-N 3.38Å; A296-D299 PolarHBondContact O-N 3.29Å; D299-L302 PolarHBondContact O-N 2.76Å; D299-N303 WeakPolarHBondContact O-CB 3.44Å; D299-N303 PolarHBondContact O-N 3.25Å; D299-N303 PolarHBondContact O-ND2 2.92Å
300V81.3Confident80.5Confident104 Ų10482.6 Ų82.663%0.6344%0.436SS*.Hα-helixtrans-62.9-46.5174.9171.90000110.9A296 A297 N298 L302 N303 S304A296-V300 WeakPolarHBondContact O-CG2 3.41Å; A296-V300 PolarHBondContact O-N 3.08Å; A297-V300 PolarHBondContact O-N 3.26Å; N298-V300 PolarHBondContact O-N 2.9Å; V300-L302 PolarHBondContact O-N 2.88Å; V300-N303 PolarHBondContact O-N 2.94Å; V300-S304 PolarHBondContact O-N 3.14Å
301K79.6Confident79.1Confident145 Ų14585.1 Ų85.163%0.6345%0.445SS*.Hα-helixtrans-60.3-46.1178.3-171.5177.3179.5-177.90111.2A297 N298 N303 S304 V305A297-K301 WeakPolarHBondContact O-CB 3.36Å; A297-K301 PolarHBondContact O-N 3.02Å; N298-K301 PolarHBondContact O-N 2.9Å; K301-N303 PolarHBondContact O-N 3.35Å; K301-S304 PolarHBondContact O-N 3.19Å; K301-S304 PolarHBondContact O-OG 3.49Å; K301-V305 WeakPolarHBondContact O-CG2 3.32Å; K301-V305 PolarHBondContact O-N 3.04Å; K301-V305 VanDerWaalsContact O-N 3.12Å
302L74.4Confident77.5Confident64 Ų6491.3 Ų91.334%0.33548%0.475SS..Hα-helixtrans-60.9-46177.3-177.464000111.8N298 D299 V300 S304 V305 I306 M337N298-L302 WeakPolarHBondContact O-CB 3.11Å; N298-L302 PolarHBondContact O-N 3.14Å; D299-L302 PolarHBondContact O-N 2.76Å; V300-L302 PolarHBondContact O-N 2.88Å; L302-S304 VanDerWaalsContact C-N 3.29Å; L302-S304 PolarHBondContact O-N 3.49Å; L302-V305 PolarHBondContact O-N 2.9Å; L302-I306 HydrophobicContact CD1-CD1 4.3Å; L302-I306 HydrophobicContact CG-CD1 3.99Å; L302-I306 WeakPolarHBondContact O-CG1 3.49Å; L302-I306 PolarHBondContact O-N 2.94Å; L302-M337 HydrophobicContact CD1-CE 4.43Å; L302-M337 HydrophobicContact CD1-SD 4.26Å
303N75.5Confident75.9Confident91 Ų9192.3 Ų92.349%0.48748%0.478SS..Hα-helixtrans-63-36.3177.7-72.8-35.9000111.9D299 V300 K301 I306 N307D299-N303 WeakPolarHBondContact O-CB 3.44Å; D299-N303 PolarHBondContact O-N 3.25Å; D299-N303 PolarHBondContact O-ND2 2.92Å; V300-N303 PolarHBondContact O-N 2.94Å; K301-N303 PolarHBondContact O-N 3.35Å; N303-I306 PolarHBondContact O-N 3.46Å; N303-N307 WeakPolarHBondContact O-CB 3.04Å; N303-N307 PolarHBondContact O-N 3.4Å; N303-N307 PolarHBondContact O-ND2 3.5Å
304S79.8Confident74Confident55 Ų5597.8 Ų97.839%0.38550%0.495SS..Hα-helixtrans-65.4-42176.674.60000112.7V300 K301 L302 N307 Q308V300-S304 PolarHBondContact O-N 3.14Å; K301-S304 PolarHBondContact O-N 3.19Å; K301-S304 PolarHBondContact O-OG 3.49Å; L302-S304 VanDerWaalsContact C-N 3.29Å; L302-S304 PolarHBondContact O-N 3.49Å; S304-N307 PolarHBondContact O-N 3.41Å; S304-Q308 WeakPolarHBondContact O-CG 3.49Å; S304-Q308 PolarHBondContact O-N 2.89Å
305V77Confident72.3Confident59 Ų5999.3 Ų99.336%0.35850%0.501SS..Hα-helixtrans-64.8-44176.21740000111.1K301 L302 N307 Q308 Y309K301-V305 WeakPolarHBondContact O-CG2 3.32Å; K301-V305 PolarHBondContact O-N 3.04Å; K301-V305 VanDerWaalsContact O-N 3.12Å; L302-V305 PolarHBondContact O-N 2.9Å; V305-N307 VanDerWaalsContact C-N 3.32Å; V305-N307 PolarHBondContact O-N 3.37Å; V305-Q308 PolarHBondContact O-N 3.3Å; V305-Y309 WeakPolarHBondContact O-CB 3.29Å; V305-Y309 PolarHBondContact O-N 3.25Å
306I72.3Confident70.6Confident74 Ų74103.8 Ų103.838%0.37952%0.522SS..Hα-helixtrans-60.9-43.4175.9-68.9167.6000110.7L302 N303 Y309 N310L302-I306 HydrophobicContact CD1-CD1 4.3Å; L302-I306 HydrophobicContact CG-CD1 3.99Å; L302-I306 WeakPolarHBondContact O-CG1 3.49Å; L302-I306 PolarHBondContact O-N 2.94Å; N303-I306 PolarHBondContact O-N 3.46Å; I306-Y309 PolarHBondContact O-N 3.27Å; I306-N310 WeakPolarHBondContact O-CB 3.46Å; I306-N310 VanDerWaalsContact O-CG 3.23Å; I306-N310 PolarHBondContact O-N 2.96Å; I306-N310 PolarHBondContact O-ND2 3.35Å
307N74.8Confident68.4Low104 Ų104106.5 Ų106.556%0.55653%0.534SS*.Hα-helixtrans-64.9-40.9178.2-73.8-20.6000112N303 S304 V305 N310 H311N303-N307 WeakPolarHBondContact O-CB 3.04Å; N303-N307 PolarHBondContact O-N 3.4Å; N303-N307 PolarHBondContact O-ND2 3.5Å; S304-N307 PolarHBondContact O-N 3.41Å; V305-N307 VanDerWaalsContact C-N 3.32Å; V305-N307 PolarHBondContact O-N 3.37Å; N307-N310 PolarHBondContact O-N 2.81Å; N307-H311 WeakPolarHBondContact O-CB 3.47Å; N307-H311 PolarHBondContact O-N 3.04Å
308Q75.4Confident66.2Low127 Ų127109 Ų10959%0.59355%0.547SS*.Hα-helixtrans-62.5-45.5174.7-77.5178.6-26.200112.2S304 V305 H311 Q312S304-Q308 WeakPolarHBondContact O-CG 3.49Å; S304-Q308 PolarHBondContact O-N 2.89Å; V305-Q308 PolarHBondContact O-N 3.3Å; Q308-H311 PolarHBondContact O-N 3.18Å; Q308-Q312 PolarHBondContact O-N 3.39Å
309Y69.1Low64.2Low114 Ų114113.5 Ų113.545%0.44757%0.566SS.*Hα-helixtrans-60.1-46.9176.5-179.8-97.2000111.8V305 I306 H311 Q312 H313V305-Y309 WeakPolarHBondContact O-CB 3.29Å; V305-Y309 PolarHBondContact O-N 3.25Å; I306-Y309 PolarHBondContact O-N 3.27Å; Y309-H311 VanDerWaalsContact C-N 3.27Å; Y309-H311 PolarHBondContact O-N 3.3Å; Y309-Q312 PolarHBondContact O-N 2.7Å; Y309-H313 AromaticContact CD2-CD2 3.77Å; Y309-H313 AromaticContact CE1-CD2 3.65Å; Y309-H313 AromaticContact CE2-CD2 3.26Å; Y309-H313 WeakPolarHBondContact CE2-CD2 3.29Å; Y309-H313 AromaticContact CE2-NE2 3.21Å; Y309-H313 WeakPolarHBondContact CE2-NE2 3.33Å; Y309-H313 AromaticContact CZ-CD2 3.19Å; Y309-H313 AromaticContact CZ-NE2 3.33Å; Y309-H313 VanDerWaalsContact CZ-NE2 3.33Å; Y309-H313 PolarHBondContact O-N 2.85Å; Y309-H313 PolarHBondContact OH-CD2 2.78Å; Y309-H313 PolarHBondContact OH-NE2 2.71Å
310N69.2Low62.4Low86 Ų86115.6 Ų115.646%0.4658%0.582SS.*Hα-helixtrans-61.9-35.6176.3-72.4-25.8000111.8I306 N307 R314I306-N310 WeakPolarHBondContact O-CB 3.46Å; I306-N310 VanDerWaalsContact O-CG 3.23Å; I306-N310 PolarHBondContact O-N 2.96Å; I306-N310 PolarHBondContact O-ND2 3.35Å; N307-N310 PolarHBondContact O-N 2.81Å; N310-R314 WeakPolarHBondContact O-CB 3.37Å; N310-R314 PolarHBondContact O-N 3.23Å; N310-R314 VanDerWaalsContact O-N 3.08Å
311H64.4Low60.5Low128 Ų128114.5 Ų114.559%0.59358%0.575SS**Hα-helixtrans-72-36179-143.5-55.4000112.8N307 Q308 Y309N307-H311 WeakPolarHBondContact O-CB 3.47Å; N307-H311 PolarHBondContact O-N 3.04Å; Q308-H311 PolarHBondContact O-N 3.18Å; Y309-H311 VanDerWaalsContact C-N 3.27Å; Y309-H311 PolarHBondContact O-N 3.3Å
312Q57.2Low58.6Low147 Ų147115.1 Ų115.169%0.68759%0.585SS**Hα-helixtrans-70.7-36.8176.3-75179.2-25.600112.2Q308 Y309Q308-Q312 PolarHBondContact O-N 3.39Å; Y309-Q312 PolarHBondContact O-N 2.7Å
313H56Low56.9Low90 Ų90116.7 Ų116.742%0.41760%0.601SS.*Hα-helixtrans-82.7-16.5178.1-81.6-67000114.7Y309 H315Y309-H313 AromaticContact CD2-CD2 3.77Å; Y309-H313 AromaticContact CE1-CD2 3.65Å; Y309-H313 AromaticContact CE2-CD2 3.26Å; Y309-H313 WeakPolarHBondContact CE2-CD2 3.29Å; Y309-H313 AromaticContact CE2-NE2 3.21Å; Y309-H313 WeakPolarHBondContact CE2-NE2 3.33Å; Y309-H313 AromaticContact CZ-CD2 3.19Å; Y309-H313 AromaticContact CZ-NE2 3.33Å; Y309-H313 VanDerWaalsContact CZ-NE2 3.33Å; Y309-H313 PolarHBondContact O-N 2.85Å; Y309-H313 PolarHBondContact OH-CD2 2.78Å; Y309-H313 PolarHBondContact OH-NE2 2.71Å; H313-H315 PolarHBondContact O-N 3.05Å
314R49.5Very low55.3Low215 Ų215115.9 Ų115.981%0.81160%0.6SS**THydrogen-bonded Turntrans-71.3-16.2176-134.9174.5-168.7-178.22.2114.2N310N310-R314 WeakPolarHBondContact O-CB 3.37Å; N310-R314 PolarHBondContact O-N 3.23Å; N310-R314 VanDerWaalsContact O-N 3.08Å
315H51.8Low53.5Low153 Ų153117.7 Ų117.771%0.70860%0.604SS**THydrogen-bonded Turntrans-99.15.5-179.8-77.9-69.1000114.4H313H313-H315 PolarHBondContact O-N 3.05Å
316Q47.1Very low51.7Low152 Ų152123.5 Ų123.571%0.7163%0.627SS**SBendtrans-12769.6171.5-74.8-179.7-13.800109.3
317T37.6Very low50.1Low111 Ų111123.8 Ų123.868%0.68164%0.635SS**  trans-174.480.4162.223.40000110.1
318S39.7Very low48.3Very low111 Ų111122.7 Ų122.778%0.77663%0.633SS**SBendtrans-138.5125.5150.4-157.60000103.8
319E40.3Very low46.6Very low177 Ų177122.9 Ų122.983%0.82764%0.637SS**SBendtrans92.8119.1-171-52.8176.4176.600115.4
320T38.3Very low45.1Very low121 Ų121126.5 Ų126.574%0.74266%0.655SS**  trans72.264.217951.20000119.2
321V40.9Very low43.5Very low80 Ų80128.8 Ų128.849%0.48567%0.667SS.*  trans-88.2-12-175.7173.30000116.1I325V321-I325 HydrophobicContact CG1-CD1 4.01Å; V321-I325 WeakPolarHBondContact O-CD1 3.4Å; V321-I325 WeakPolarHBondContact O-CG1 3.49Å
322N39.8Very low42Very low159 Ų159130.7 Ų130.785%0.8567%0.674SS**SBendtrans-107.1-6.1-168.6-74.9-16.7000118.3
323S39.9Very low40.9Very low96 Ų96128 Ų12867%0.67167%0.669SS**SBendtrans-114.1-12.3-177.859.70000115.5
324V41Very low39.7Very low75 Ų75130.4 Ų130.446%0.45569%0.685SS.*SBendtrans-100.8-21.5-176.2178.90000112.3H326 S327 T328V324-H326 PolarHBondContact O-N 2.65Å; V324-H326 VanDerWaalsContact O-N 3.15Å; V324-S327 PolarHBondContact O-N 2.86Å; V324-S327 PolarHBondContact O-OG 2.81Å; V324-T328 WeakPolarHBondContact CG1-OG1 3.3Å; V324-T328 PolarHBondContact O-N 2.76Å; V324-T328 VanDerWaalsContact O-N 3.13Å; V324-T328 PolarHBondContact O-OG1 2.9Å
325I43Very low39Very low93 Ų93127.1 Ų127.148%0.47768%0.677SS.*Hα-helixtrans-60.6-29.5-179.2-64.7-178.3000112.3V321 L329V321-I325 HydrophobicContact CG1-CD1 4.01Å; V321-I325 WeakPolarHBondContact O-CD1 3.4Å; V321-I325 WeakPolarHBondContact O-CG1 3.49Å; I325-L329 HydrophobicContact CG2-CD1 3.89Å; I325-L329 VanDerWaalsContact O-CD1 3.28Å; I325-L329 WeakPolarHBondContact O-CD1 3.4Å; I325-L329 VanDerWaalsContact O-CG 3.27Å; I325-L329 WeakPolarHBondContact O-CG 3.36Å
326H37.8Very low37.9Very low180 Ų180127.6 Ų127.683%0.83368%0.679SS**Hα-helixtrans-83.9-17.3-179.1-111.6-65000115.2V324V324-H326 PolarHBondContact O-N 2.65Å; V324-H326 VanDerWaalsContact O-N 3.15Å
327S38.6Very low37.2Very low80 Ų80125.8 Ų125.856%0.55967%0.672SS**Hα-helixtrans-102.1-28.4178.261.50000112.9V324V324-S327 PolarHBondContact O-N 2.86Å; V324-S327 PolarHBondContact O-OG 2.81Å
328T37.9Very low36.7Very low82 Ų82128.6 Ų128.650%0.50368%0.675SS.*Hα-helixtrans-85.1-19.3-178.3-36.50000113.6V324 K330 N331V324-T328 WeakPolarHBondContact CG1-OG1 3.3Å; V324-T328 PolarHBondContact O-N 2.76Å; V324-T328 VanDerWaalsContact O-N 3.13Å; V324-T328 PolarHBondContact O-OG1 2.9Å; T328-K330 PolarHBondContact O-N 2.74Å; T328-N331 PolarHBondContact O-N 2.73Å
329L40Very low36.5Very low130 Ų130127.4 Ų127.468%0.68167%0.667SS**THydrogen-bonded Turntrans-71.4-9.9174.2-76.2173000114.1I325I325-L329 HydrophobicContact CG2-CD1 3.89Å; I325-L329 VanDerWaalsContact O-CD1 3.28Å; I325-L329 WeakPolarHBondContact O-CD1 3.4Å; I325-L329 VanDerWaalsContact O-CG 3.27Å; I325-L329 WeakPolarHBondContact O-CG 3.36Å
330K37.5Very low36.3Very low190 Ų190126.9 Ų126.983%0.82667%0.665SS**THydrogen-bonded Turntrans-86-17.1172-95.5-176.9174.1-179.30114.1T328T328-K330 PolarHBondContact O-N 2.74Å
331N36.3Very low36.9Very low134 Ų134126 Ų12672%0.71766%0.659SS**  trans-115.741.1-177.8-73.4-11.4000111.7T328 P333T328-N331 PolarHBondContact O-N 2.73Å; N331-P333 WeakPolarHBondContact O-CD 3.46Å
332K33Very low37.9Very low168 Ų168128.9 Ų128.973%0.7367%0.672SS**  trans-62.1118.3167.2-150.4177.5-169.7-179.60106.3N334K332-N334 PolarHBondContact O-N 3.43Å
333P32.2Very low39.6Very low92 Ų92123.1 Ų123.160%0.59764%0.642SS**  trans-59.5116.2171.225.6-30000105.3N331 F335N331-P333 WeakPolarHBondContact O-CD 3.46Å; P333-F335 PolarHBondContact O-N 3.28Å
334N31.3Very low41.8Very low140 Ų140123.9 Ų123.975%0.74964%0.637SS**  trans-59.986163.3-81.2-12.8000105.7K332 E336K332-N334 PolarHBondContact O-N 3.43Å; N334-E336 HydrophobicContact CB-CG 4.43Å; N334-E336 PolarHBondContact O-N 3.49Å
335F35.1Very low44.1Very low146 Ų146121.2 Ų121.264%0.6462%0.619SS**  trans-73.567.2159.3-161.6-99.8000106.2P333 M337P333-F335 PolarHBondContact O-N 3.28Å; F335-M337 HydrophobicContact CD1-CB 3.87Å; F335-M337 HydrophobicContact CD1-CG 4.44Å; F335-M337 HydrophobicContact CE1-CB 3.55Å; F335-M337 HydrophobicContact CE1-CG 3.63Å; F335-M337 HydrophobicContact CE1-SD 3.8Å; F335-M337 HydrophobicContact CZ-CB 4.36Å; F335-M337 HydrophobicContact CZ-CG 4.09Å; F335-M337 HydrophobicContact CZ-SD 4.37Å; F335-M337 PolarHBondContact O-N 3.17Å
336E29.5Very low46.4Very low162 Ų162119.3 Ų119.376%0.75761%0.61SS**  trans-6680.5155.2-79.9-178165.500105.5N334 K338N334-E336 HydrophobicContact CB-CG 4.43Å; N334-E336 PolarHBondContact O-N 3.49Å; E336-K338 PolarHBondContact O-N 3.44Å
337M31.2Very low49Very low114 Ų114111.3 Ų111.356%0.56257%0.573SS**  trans-62.699.4158.4-149.4-179.183.600104.5L302 F335 S339L302-M337 HydrophobicContact CD1-CE 4.43Å; L302-M337 HydrophobicContact CD1-SD 4.26Å; F335-M337 HydrophobicContact CD1-CB 3.87Å; F335-M337 HydrophobicContact CD1-CG 4.44Å; F335-M337 HydrophobicContact CE1-CB 3.55Å; F335-M337 HydrophobicContact CE1-CG 3.63Å; F335-M337 HydrophobicContact CE1-SD 3.8Å; F335-M337 HydrophobicContact CZ-CB 4.36Å; F335-M337 HydrophobicContact CZ-CG 4.09Å; F335-M337 HydrophobicContact CZ-SD 4.37Å; F335-M337 PolarHBondContact O-N 3.17Å; M337-S339 PolarHBondContact O-N 2.96Å
338K28Very low51.7Low170 Ų170109.3 Ų109.374%0.73956%0.556SS**  trans-45.1116.3170.4-80179.3175.1177.10106.6E336 E340E336-K338 PolarHBondContact O-N 3.44Å; K338-E340 HydrophobicContact CB-CG 4.18Å; K338-E340 PolarHBondContact O-N 3.18Å
339S34.4Very low54.4Low86 Ų86105.4 Ų105.460%0.60153%0.532SS*.  trans-6585.1168.657.20000106.4M337 T341M337-S339 PolarHBondContact O-N 2.96Å; S339-T341 PolarHBondContact O-N 2.8Å
340E37.4Very low57.1Low167 Ų16799.2 Ų99.278%0.7850%0.499SS*.SBendtrans-72.367.6178-78.2-175163.800109.6K338K338-E340 HydrophobicContact CB-CG 4.18Å; K338-E340 PolarHBondContact O-N 3.18Å
341T50.5Low59.8Low101 Ų10191 Ų9162%0.6247%0.466SS*.  trans169.4102.7144.925.40000105.9S339 V343S339-T341 PolarHBondContact O-N 2.8Å; T341-V343 PolarHBondContact O-N 2.65Å
342N61.9Low62.5Low142 Ų14284.7 Ų84.776%0.75943%0.432SS*.  trans-6490.6165.6-83-27.1000107.5I344N342-I344 PolarHBondContact O-N 2.89Å; N342-I344 VanDerWaalsContact O-N 3.09Å
343V75.7Confident65.5Low37 Ų3776.8 Ų76.822%0.22440%0.398CS..  trans-63.9114.5179.3-179.80000107.6P271 Y291 T341 Y345P271-V343 HydrophobicContact CB-CG1 4.15Å; Y291-V343 HydrophobicContact CE2-CB 4.33Å; Y291-V343 HydrophobicContact CE2-CG1 3.79Å; Y291-V343 HydrophobicContact CE2-CG2 3.61Å; T341-V343 PolarHBondContact O-N 2.65Å; V343-Y345 HydrophobicContact CB-CE2 4.18Å; V343-Y345 HydrophobicContact CG1-CD2 4.46Å; V343-Y345 HydrophobicContact CG1-CE2 4Å; V343-Y345 VanDerWaalsContact O-CD2 3.32Å; V343-Y345 WeakPolarHBondContact O-CD2 3.31Å; V343-Y345 PolarHBondContact O-N 3.17Å
344I84.8Confident68.4Low112 Ų11274.2 Ų74.257%0.57438%0.382SS*.  trans-77.7121.3177.9-57.6176.4000108K272 N342K272-I344 VanDerWaalsContact CB-O 3.28Å; K272-I344 WeakPolarHBondContact CB-O 3.34Å; K272-I344 HydrophobicContact CD-CG2 4.27Å; K272-I344 PolarHBondContact N-O 2.63Å; N342-I344 PolarHBondContact O-N 2.89Å; N342-I344 VanDerWaalsContact O-N 3.09Å
345Y89.4Confident71.4Confident20 Ų2068.8 Ų68.88%0.07835%0.353CS..EExtended strand (participates in β ladder)trans-88.8146.2173.4-77.9-88.5000110.9W185 I191 A269 Y270 P271 Y291 V343W185-Y345 HydrophobicContact CH2-CD1 4.33Å; W185-Y345 AromaticContact CH2-CE1 3.33Å; W185-Y345 HydrophobicContact CH2-CE1 3.33Å; W185-Y345 AromaticContact CH2-CZ 3.8Å; W185-Y345 AromaticContact CZ2-CE1 3.56Å; W185-Y345 HydrophobicContact CZ2-CE1 3.56Å; W185-Y345 AromaticContact CZ2-CZ 3.65Å; W185-Y345 WeakPolarHBondContact CZ2-OH 3.36Å; W185-Y345 HydrophobicContact CZ3-CE1 4.44Å; I191-Y345 HydrophobicContact CB-CD2 4.32Å; I191-Y345 HydrophobicContact CD1-CD1 4.38Å; I191-Y345 HydrophobicContact CD1-CE1 4.38Å; I191-Y345 HydrophobicContact CG1-CD1 4.35Å; I191-Y345 HydrophobicContact CG1-CD2 3.91Å; I191-Y345 HydrophobicContact CG1-CE1 4.33Å; I191-Y345 HydrophobicContact CG1-CE2 3.84Å; I191-Y345 HydrophobicContact CG1-CG 4.16Å; I191-Y345 HydrophobicContact CG2-CD2 3.93Å; I191-Y345 HydrophobicContact CG2-CG 3.85Å; A269-Y345 HydrophobicContact CB-CD1 4.11Å; Y270-Y345 VanDerWaalsContact C-CD1 3.43Å; Y270-Y345 CarbonylContact O-C 3.39Å; Y270-Y345 WeakPolarHBondContact O-CA 3.47Å; P271-Y345 HydrophobicContact CG-CE1 4.02Å; Y291-Y345 PolarHBondContact OH-OH 2.94Å; V343-Y345 HydrophobicContact CB-CE2 4.18Å; V343-Y345 HydrophobicContact CG1-CD2 4.46Å; V343-Y345 HydrophobicContact CG1-CE2 4Å; V343-Y345 VanDerWaalsContact O-CD2 3.32Å; V343-Y345 WeakPolarHBondContact O-CD2 3.31Å; V343-Y345 PolarHBondContact O-N 3.17Å
346N91.5Very high74.3Confident53 Ų5371.2 Ų71.228%0.28336%0.358SS..EExtended strand (participates in β ladder)trans-121.5136.7176.2-173.1-10000109.5Y270 K272 P276 N348Y270-N346 PolarHBondContact N-O 3.02Å; Y270-N346 VanDerWaalsContact N-O 3.09Å; Y270-N346 PolarHBondContact O-N 3.28Å; K272-N346 HydrophobicContact CB-CB 4.37Å; P276-N346 HydrophobicContact CG-CB 3.85Å; N346-N348 VanDerWaalsContact OD1-CB 3.32Å; N346-N348 WeakPolarHBondContact OD1-CB 3.45Å; N346-N348 PolarHBondContact OD1-N 2.86Å
347Y93.7Very high77.4Confident12 Ų1264 Ų645%0.04733%0.328CS..  trans-103.113.1179.7-71.1-88.9000113.1I191 T193 P196 I263 A269 T349 I350 S351I191-Y347 WeakPolarHBondContact CG2-OH 3.15Å; T193-Y347 WeakPolarHBondContact CG2-OH 3.33Å; P196-Y347 HydrophobicContact CB-CD2 4.13Å; P196-Y347 HydrophobicContact CB-CE2 4.34Å; P196-Y347 HydrophobicContact CG-CD2 4.28Å; P196-Y347 HydrophobicContact CG-CE2 4.21Å; I263-Y347 HydrophobicContact CB-CD1 4.41Å; I263-Y347 HydrophobicContact CB-CE1 4.35Å; I263-Y347 HydrophobicContact CG1-CD1 3.8Å; I263-Y347 HydrophobicContact CG1-CD2 4.43Å; I263-Y347 HydrophobicContact CG1-CE1 4.24Å; I263-Y347 HydrophobicContact CG1-CG 3.9Å; I263-Y347 HydrophobicContact CG2-CE1 4.29Å; I263-Y347 HydrophobicContact CG2-CE2 4.31Å; A269-Y347 HydrophobicContact CB-CD1 4.2Å; A269-Y347 HydrophobicContact CB-CE1 3.54Å; A269-Y347 HydrophobicContact CB-CE2 4.42Å; Y347-T349 PolarHBondContact O-N 3.31Å; Y347-I350 HydrophobicContact CD1-CG1 4.38Å; Y347-I350 WeakPolarHBondContact O-CD1 3.12Å; Y347-I350 VanDerWaalsContact O-CG1 3.28Å; Y347-I350 WeakPolarHBondContact O-CG1 3.49Å; Y347-I350 PolarHBondContact O-N 3.49Å; Y347-S351 PolarHBondContact O-N 3.5Å
348N94.8Very high80.5Confident37 Ų3759 Ų5920%0.19830%0.303CS..G310 helixtrans-55.2-27.7-178.4-170.748.7000112.9P276 K278 N346 I350 S351P276-N348 WeakPolarHBondContact O-CB 3.39Å; P276-N348 PolarHBondContact O-ND2 2.89Å; K278-N348 WeakPolarHBondContact CA-O 3.25Å; K278-N348 WeakPolarHBondContact CE-OD1 3.19Å; K278-N348 WeakPolarHBondContact CG-O 3.35Å; N346-N348 VanDerWaalsContact OD1-CB 3.32Å; N346-N348 WeakPolarHBondContact OD1-CB 3.45Å; N346-N348 PolarHBondContact OD1-N 2.86Å; N348-I350 PolarHBondContact O-N 3.3Å; N348-S351 WeakPolarHBondContact O-CB 3.15Å; N348-S351 PolarHBondContact O-N 3.43Å
349T95.4Very high83.7Confident0 Ų052.3 Ų52.30%028%0.275CS..G310 helixtrans-51.7-38.8172.7-49.20000113.7T178 Y270 P276 E277 G279 G281 Y347T178-T349 HydrophobicContact CG2-CG2 4.22Å; Y270-T349 VanDerWaalsContact CD2-OG1 3.25Å; Y270-T349 WeakPolarHBondContact CD2-OG1 3.47Å; Y270-T349 HydrophobicContact CE2-CG2 4.06Å; Y270-T349 WeakPolarHBondContact CE2-OG1 3.34Å; P276-T349 WeakPolarHBondContact CB-OG1 3.36Å; E277-T349 WeakPolarHBondContact O-CA 3.29Å; G279-T349 PolarHBondContact N-O 3.41Å; G281-T349 WeakPolarHBondContact CA-OG1 3.37Å; Y347-T349 PolarHBondContact O-N 3.31Å
350I94.9Very high86.6Confident1 Ų154.1 Ų54.11%0.00527%0.272CS..G310 helixtrans-98.40.7-17958.270.9000113.1P172 E259 C262 I263 L267 Y347 N348 N352P172-I350 HydrophobicContact CG-CB 4.13Å; E259-I350 HydrophobicContact CB-CD1 4.19Å; E259-I350 HydrophobicContact CG-CD1 4.26Å; C262-I350 HydrophobicContact CB-CB 4.03Å; C262-I350 HydrophobicContact CB-CD1 4.12Å; C262-I350 HydrophobicContact CB-CG1 3.78Å; C262-I350 HydrophobicContact CB-CG2 4.12Å; I263-I350 HydrophobicContact CG1-CD1 4.12Å; L267-I350 HydrophobicContact CD2-CG2 3.62Å; Y347-I350 HydrophobicContact CD1-CG1 4.38Å; Y347-I350 WeakPolarHBondContact O-CD1 3.12Å; Y347-I350 VanDerWaalsContact O-CG1 3.28Å; Y347-I350 WeakPolarHBondContact O-CG1 3.49Å; Y347-I350 PolarHBondContact O-N 3.49Å; N348-I350 PolarHBondContact O-N 3.3Å; I350-N352 PolarHBondContact O-N 3Å
351S94.3Very high89.4Confident18 Ų1846.8 Ų46.813%0.12624%0.24CC..  trans-67.8103.7176.1-179.80000109.5E259 K278 Y347 N348 C373E259-S351 WeakPolarHBondContact OE1-CA 3.36Å; K278-S351 WeakPolarHBondContact CD-O 3.49Å; K278-S351 WeakPolarHBondContact CG-O 3.36Å; Y347-S351 PolarHBondContact O-N 3.5Å; N348-S351 WeakPolarHBondContact O-CB 3.15Å; N348-S351 PolarHBondContact O-N 3.43Å; S351-C373 WeakPolarHBondContact O-CB 3.5Å
352N94.8Very high91.6Very high0 Ų043.4 Ų43.40%022%0.22CC..  trans-89.6-22.7-179-151.833.3000112.8P172 E259 I350 N372 C373 S374P172-N352 HydrophobicContact CB-CB 4.01Å; E259-N352 WeakPolarHBondContact OE1-CA 3.34Å; E259-N352 PolarHBondContact OE1-N 3.32Å; I350-N352 PolarHBondContact O-N 3Å; N352-N372 PolarHBondContact ND2-OD1 3.32Å; N352-N372 CarbonylContact O-C 2.91Å; N352-N372 WeakPolarHBondContact O-CA 3.49Å; N352-N372 PolarHBondContact O-N 3.46Å; N352-N372 PolarHBondContact OD1-OD1 2.92Å; N352-C373 PolarHBondContact O-N 3.36Å; N352-C373 PolarHBondContact O-SG 2.89Å; N352-C373 PolarHBondContact OD1-N 3.38Å; N352-S374 WeakPolarHBondContact OD1-CB 3.38Å; N352-S374 PolarHBondContact OD1-N 2.98Å; N352-S374 VanDerWaalsContact OD1-N 3.1Å; N352-S374 PolarHBondContact OD1-OG 3.32Å
353L94.2Very high93.2Very high3 Ų337.7 Ų37.72%0.01619%0.19CC..  trans-135126.4-173.2-178.369000112.6Y252 W255 E259 I355 W371Y252-L353 HydrophobicContact CD1-CD1 3.86Å; Y252-L353 HydrophobicContact CD1-CD2 3.27Å; Y252-L353 HydrophobicContact CD1-CG 4.17Å; Y252-L353 HydrophobicContact CE1-CD1 3.61Å; Y252-L353 HydrophobicContact CE1-CD2 3.84Å; Y252-L353 HydrophobicContact CE1-CG 4.29Å; Y252-L353 HydrophobicContact CG-CD2 3.73Å; W255-L353 HydrophobicContact CE3-CB 4.31Å; W255-L353 HydrophobicContact CE3-CD1 4.22Å; W255-L353 HydrophobicContact CZ3-CD1 4.44Å; E259-L353 PolarHBondContact OE1-N 3.16Å; L353-I355 HydrophobicContact CD2-CD1 4.45Å; L353-I355 HydrophobicContact CD2-CG1 3.68Å; L353-I355 HydrophobicContact CG-CG1 4.05Å; L353-W371 HydrophobicContact CD1-CE3 4.26Å
354S94.2Very high94.2Very high38 Ų3836 Ų3627%0.26618%0.18SC..  trans-103.7103.2159.7177.50000109.2G357 C358 S370S354-G357 PolarHBondContact O-N 2.67Å; S354-G357 PolarHBondContact OG-N 3.48Å; S354-C358 PolarHBondContact O-N 3.2Å; S354-C358 PolarHBondContact O-SG 2.71Å; S354-S370 PolarHBondContact N-O 2.91Å
355I94.8Very high94.6Very high26 Ų2634 Ų3413%0.13317%0.165CC..Hα-helixtrans-60.8-50-179.6-64.4151.2000109.9F207 Y252 K256 L353 G357 C358 E359F207-I355 HydrophobicContact CE2-CD1 3.44Å; F207-I355 VanDerWaalsContact CE2-CD1 3.44Å; F207-I355 HydrophobicContact CE2-CG1 4.32Å; F207-I355 HydrophobicContact CZ-CD1 3.49Å; F207-I355 VanDerWaalsContact CZ-CD1 3.49Å; F207-I355 HydrophobicContact CZ-CG1 4.12Å; F207-I355 HydrophobicContact CZ-CG2 4.12Å; Y252-I355 HydrophobicContact CD2-CG1 4.34Å; Y252-I355 HydrophobicContact CD2-CG2 4.41Å; Y252-I355 HydrophobicContact CE2-CG1 4.48Å; Y252-I355 HydrophobicContact CE2-CG2 4.02Å; K256-I355 HydrophobicContact CD-CD1 4.49Å; K256-I355 HydrophobicContact CG-CD1 4.48Å; L353-I355 HydrophobicContact CD2-CD1 4.45Å; L353-I355 HydrophobicContact CD2-CG1 3.68Å; L353-I355 HydrophobicContact CG-CG1 4.05Å; I355-G357 VanDerWaalsContact C-N 3.31Å; I355-G357 PolarHBondContact O-N 2.82Å; I355-C358 PolarHBondContact O-N 3.42Å; I355-C358 VanDerWaalsContact O-N 3.08Å; I355-E359 HydrophobicContact CG2-CG 4.16Å; I355-E359 WeakPolarHBondContact O-CG 3.44Å; I355-E359 PolarHBondContact O-N 3.18Å
356W94.8Very high94.9Very high196 Ų19637.5 Ų37.574%0.74218%0.182SC*.Hα-helixtrans-57-41.8177.3-72.3102.9000112.8F360W356-F360 HydrophobicContact CD2-CD2 4.33Å; W356-F360 HydrophobicContact CD2-CE2 4.39Å; W356-F360 AromaticContact CE3-CD2 3.28Å; W356-F360 HydrophobicContact CE3-CD2 3.28Å; W356-F360 AromaticContact CE3-CE2 3.35Å; W356-F360 HydrophobicContact CE3-CE2 3.35Å; W356-F360 HydrophobicContact CE3-CG 4.35Å; W356-F360 HydrophobicContact CE3-CZ 4.46Å; W356-F360 HydrophobicContact CH2-CE2 4.28Å; W356-F360 AromaticContact CZ3-CD2 3.66Å; W356-F360 HydrophobicContact CZ3-CD2 3.66Å; W356-F360 AromaticContact CZ3-CE2 3.27Å; W356-F360 HydrophobicContact CZ3-CE2 3.27Å; W356-F360 HydrophobicContact CZ3-CZ 4.02Å; W356-F360 WeakPolarHBondContact O-CB 3.32Å; W356-F360 PolarHBondContact O-N 3.38Å
357G95.2Very high95.1Very high12 Ų1235 Ų3512%0.12417%0.168CC..Hα-helixtrans-68.7-33.9176.300000113.4S354 I355 A361 S367 S370S354-G357 PolarHBondContact O-N 2.67Å; S354-G357 PolarHBondContact OG-N 3.48Å; I355-G357 VanDerWaalsContact C-N 3.31Å; I355-G357 PolarHBondContact O-N 2.82Å; G357-A361 WeakPolarHBondContact O-CB 3.44Å; G357-A361 PolarHBondContact O-N 2.74Å; G357-S367 PolarHBondContact O-OG 3.29Å; G357-S370 WeakPolarHBondContact CA-OG 3.42Å
358C95.2Very high95.1Very high8 Ų835.6 Ų35.65%0.05417%0.172CC..Hα-helixtrans-69.8-46.2174.8-66.60000111.6Y252 S354 I355 S370 K453Y252-C358 HydrophobicContact CE1-CB 4.48Å; Y252-C358 WeakPolarHBondContact OH-CB 3.33Å; S354-C358 PolarHBondContact O-N 3.2Å; S354-C358 PolarHBondContact O-SG 2.71Å; I355-C358 PolarHBondContact O-N 3.42Å; I355-C358 VanDerWaalsContact O-N 3.08Å; C358-S370 VanDerWaalsContact SG-C 3.54Å; C358-S370 PolarHBondContact SG-O 3.5Å; C358-S370 VanDerWaalsContact SG-O 3.39Å; C358-K453 PolarHBondContact O-NZ 3.4Å
359E95.4Very high95.1Very high29 Ų2940.5 Ų40.514%0.13619%0.192CC..Hα-helixtrans-70.3-50.5-178.6-65.2-45.8128.600111.7R248 Y252 I355 W450 K453R248-E359 IonicContact CZ-OE1 3.49Å; R248-E359 IonicContact CZ-OE2 3.74Å; R248-E359 IonicContact NH1-OE1 3.66Å; R248-E359 PolarHBondContact NH1-OE1 3.12Å; R248-E359 IonicContact NH1-OE2 2.76Å; R248-E359 PolarHBondContact NH1-OE2 3Å; R248-E359 IonicContact NH2-OE2 2.77Å; Y252-E359 WeakPolarHBondContact CE2-OE1 3.39Å; Y252-E359 VanDerWaalsContact CZ-OE1 3.3Å; Y252-E359 PolarHBondContact OH-OE1 2.86Å; I355-E359 HydrophobicContact CG2-CG 4.16Å; I355-E359 WeakPolarHBondContact O-CG 3.44Å; I355-E359 PolarHBondContact O-N 3.18Å; E359-W450 PolarHBondContact O-NE1 3.34Å; E359-K453 PolarHBondContact O-NZ 3.09Å
360F96.6Very high95.1Very high125 Ų12541.4 Ų41.455%0.54820%0.198SC..Hα-helixtrans-115.6-9.2-161.6-59.7-76.8000115.6W356W356-F360 HydrophobicContact CD2-CD2 4.33Å; W356-F360 HydrophobicContact CD2-CE2 4.39Å; W356-F360 AromaticContact CE3-CD2 3.28Å; W356-F360 HydrophobicContact CE3-CD2 3.28Å; W356-F360 AromaticContact CE3-CE2 3.35Å; W356-F360 HydrophobicContact CE3-CE2 3.35Å; W356-F360 HydrophobicContact CE3-CG 4.35Å; W356-F360 HydrophobicContact CE3-CZ 4.46Å; W356-F360 HydrophobicContact CH2-CE2 4.28Å; W356-F360 AromaticContact CZ3-CD2 3.66Å; W356-F360 HydrophobicContact CZ3-CD2 3.66Å; W356-F360 AromaticContact CZ3-CE2 3.27Å; W356-F360 HydrophobicContact CZ3-CE2 3.27Å; W356-F360 HydrophobicContact CZ3-CZ 4.02Å; W356-F360 WeakPolarHBondContact O-CB 3.32Å; W356-F360 PolarHBondContact O-N 3.38Å
361A96.2Very high95.1Very high12 Ų1244.4 Ų44.410%0.09921%0.209CC..  trans-61.7136.3175.500000110.1G357 T363 E366 S367 K453G357-A361 WeakPolarHBondContact O-CB 3.44Å; G357-A361 PolarHBondContact O-N 2.74Å; A361-T363 VanDerWaalsContact C-N 3.34Å; A361-T363 PolarHBondContact O-N 3.38Å; A361-E366 HydrophobicContact CB-CB 3.74Å; A361-S367 PolarHBondContact O-OG 3.1Å; A361-K453 WeakPolarHBondContact O-CE 3.49Å; A361-K453 PolarHBondContact O-NZ 3.49Å
362P95.4Very high95.2Very high31 Ų3144.3 Ų44.320%0.20121%0.208CC..SBendtrans-76.8-19.6-170.828-34.9000113.6S446 S449 W450P362-S446 WeakPolarHBondContact CB-O 3.28Å; P362-S449 CarbonylContact O-C 3.59Å; P362-S449 VanDerWaalsContact O-CB 3.27Å; P362-S449 WeakPolarHBondContact O-CB 3.25Å; P362-W450 HydrophobicContact CB-CB 4.47Å; P362-W450 WeakPolarHBondContact O-CA 3.3Å; P362-W450 PolarHBondContact O-N 3.19Å
363T96.2Very high95.3Very high22 Ų2244.6 Ų44.614%0.13521%0.209CC..SBendtrans-114.6144.7-172.862.70000111.9A361 R365 E366 S367 E426A361-T363 VanDerWaalsContact C-N 3.34Å; A361-T363 PolarHBondContact O-N 3.38Å; T363-R365 PolarHBondContact O-N 3.43Å; T363-E366 PolarHBondContact O-N 2.88Å; T363-E366 VanDerWaalsContact OG1-CB 3.26Å; T363-E366 WeakPolarHBondContact OG1-CB 3.19Å; T363-E366 WeakPolarHBondContact OG1-CG 3.26Å; T363-E366 PolarHBondContact OG1-N 2.88Å; T363-E366 VanDerWaalsContact OG1-N 3.16Å; T363-E366 PolarHBondContact OG1-OE1 3.14Å; T363-E366 VanDerWaalsContact OG1-OE1 3.09Å; T363-S367 PolarHBondContact O-N 3.17Å; T363-S367 PolarHBondContact O-OG 3.46Å; T363-E426 VanDerWaalsContact C-OE2 3.29Å; T363-E426 WeakPolarHBondContact CA-OE2 3.21Å; T363-E426 VanDerWaalsContact CB-CD 3.46Å; T363-E426 WeakPolarHBondContact CB-OE2 3.46Å; T363-E426 HydrophobicContact CG2-CG 4.41Å
364V96.1Very high95.4Very high2 Ų244.5 Ų44.51%0.01221%0.209CC..Hα-helixtrans-48.5-44.4167.5170.50000109.6E366 M368 I419 A422 L423 E426 K453 V456 F457V364-E366 PolarHBondContact O-N 3.31Å; V364-M368 HydrophobicContact CG1-CG 4.31Å; V364-M368 HydrophobicContact CG1-SD 3.88Å; V364-M368 VanDerWaalsContact O-CB 3.31Å; V364-M368 WeakPolarHBondContact O-CB 3.46Å; V364-M368 WeakPolarHBondContact O-CG 3.47Å; V364-M368 PolarHBondContact O-N 3.2Å; V364-I419 HydrophobicContact CG1-CG2 4.43Å; V364-A422 HydrophobicContact CG2-CB 4.41Å; V364-L423 HydrophobicContact CB-CD2 4.16Å; V364-L423 HydrophobicContact CG1-CD2 3.82Å; V364-L423 HydrophobicContact CG1-CG 4.27Å; V364-E426 WeakPolarHBondContact CA-OE2 3.4Å; V364-E426 WeakPolarHBondContact CB-OE2 3.27Å; V364-E426 PolarHBondContact N-OE2 3.32Å; V364-K453 HydrophobicContact CB-CG 4.45Å; V364-K453 HydrophobicContact CG2-CB 3.92Å; V364-K453 HydrophobicContact CG2-CG 3.91Å; V364-V456 HydrophobicContact CG2-CG1 4.43Å; V364-F457 HydrophobicContact CB-CE1 4.35Å; V364-F457 HydrophobicContact CG1-CE1 3.8Å; V364-F457 HydrophobicContact CG1-CZ 4.32Å; V364-F457 HydrophobicContact CG2-CE1 4.33Å
365R94.4Very high95.5Very high69 Ų6942.9 Ų42.926%0.2620%0.198SC..Hα-helixtrans-62-44.9180-174.5173.3-58.8-73.9-6.5113.5T363 K369 L423T363-R365 PolarHBondContact O-N 3.43Å; R365-K369 WeakPolarHBondContact O-CG 3.31Å; R365-K369 PolarHBondContact O-N 2.84Å; R365-L423 HydrophobicContact CB-CD2 3.88Å
366E94.8Very high95.6Very high93 Ų9343.8 Ų43.844%0.43520%0.201SC..Hα-helixtrans-73.4-41.9-179.5-73.8164.7-137.500111.9A361 T363 V364 M368 K369 S370A361-E366 HydrophobicContact CB-CB 3.74Å; T363-E366 PolarHBondContact O-N 2.88Å; T363-E366 VanDerWaalsContact OG1-CB 3.26Å; T363-E366 WeakPolarHBondContact OG1-CB 3.19Å; T363-E366 WeakPolarHBondContact OG1-CG 3.26Å; T363-E366 PolarHBondContact OG1-N 2.88Å; T363-E366 VanDerWaalsContact OG1-N 3.16Å; T363-E366 PolarHBondContact OG1-OE1 3.14Å; T363-E366 VanDerWaalsContact OG1-OE1 3.09Å; V364-E366 PolarHBondContact O-N 3.31Å; E366-M368 VanDerWaalsContact C-N 3.32Å; E366-M368 PolarHBondContact O-N 2.58Å; E366-K369 PolarHBondContact O-N 3.48Å; E366-S370 PolarHBondContact O-N 3.35Å; E366-S370 VanDerWaalsContact O-N 3.15Å; E366-S370 PolarHBondContact O-OG 3.25Å
367S95.3Very high95.6Very high0 Ų036 Ų360%017%0.173CC..Hα-helixtrans-64.2-38176-63.40000111.6G357 A361 T363 K369 S370 W371 K453 F457G357-S367 PolarHBondContact O-OG 3.29Å; A361-S367 PolarHBondContact O-OG 3.1Å; T363-S367 PolarHBondContact O-N 3.17Å; T363-S367 PolarHBondContact O-OG 3.46Å; S367-K369 VanDerWaalsContact C-N 3.35Å; S367-K369 PolarHBondContact O-N 3.37Å; S367-S370 WeakPolarHBondContact O-CB 3.32Å; S367-S370 PolarHBondContact O-N 2.91Å; S367-S370 VanDerWaalsContact O-N 3.1Å; S367-W371 PolarHBondContact O-N 2.79Å; S367-W371 VanDerWaalsContact O-N 3.14Å; S367-K453 WeakPolarHBondContact OG-CD 3.37Å; S367-F457 VanDerWaalsContact CB-CE2 3.45Å
368M94.2Very high95.8Very high26 Ų2635.5 Ų35.513%0.12817%0.167CC..Hα-helixtrans-58.3-44172.4-78.6175.574.900112.3V364 E366 S370 W371 Q376 M399 I419 F457V364-M368 HydrophobicContact CG1-CG 4.31Å; V364-M368 HydrophobicContact CG1-SD 3.88Å; V364-M368 VanDerWaalsContact O-CB 3.31Å; V364-M368 WeakPolarHBondContact O-CB 3.46Å; V364-M368 WeakPolarHBondContact O-CG 3.47Å; V364-M368 PolarHBondContact O-N 3.2Å; E366-M368 VanDerWaalsContact C-N 3.32Å; E366-M368 PolarHBondContact O-N 2.58Å; M368-S370 PolarHBondContact O-N 3.42Å; M368-W371 PolarHBondContact O-N 3.22Å; M368-W371 VanDerWaalsContact O-O 3.04Å; M368-Q376 WeakPolarHBondContact O-CG 3.05Å; M368-M399 HydrophobicContact CE-CE 3.82Å; M368-M399 HydrophobicContact CE-SD 3.78Å; M368-I419 HydrophobicContact CE-CG2 3.73Å; M368-I419 HydrophobicContact SD-CG2 3.42Å; M368-I419 WeakPolarHBondContact SD-CG2 3.4Å; M368-F457 HydrophobicContact CG-CE1 4.41Å; M368-F457 HydrophobicContact CG-CZ 4Å
369K94.1Very high95.9Very high139 Ų13935.1 Ų35.160%0.60416%0.164SC*.Hα-helixtrans-65.8-22.8177.6-72.4177.5176.6-174.50113.2R365 E366 S367 C373R365-K369 WeakPolarHBondContact O-CG 3.31Å; R365-K369 PolarHBondContact O-N 2.84Å; E366-K369 PolarHBondContact O-N 3.48Å; S367-K369 VanDerWaalsContact C-N 3.35Å; S367-K369 PolarHBondContact O-N 3.37Å; K369-C373 PolarHBondContact O-SG 3.41Å
370S95.9Very high96Very high19 Ų1935.3 Ų35.313%0.13317%0.171CC..Hα-helixtrans-87.3-16.7-179.9-58.30000113S354 G357 C358 E366 S367 M368 C373S354-S370 PolarHBondContact N-O 2.91Å; G357-S370 WeakPolarHBondContact CA-OG 3.42Å; C358-S370 VanDerWaalsContact SG-C 3.54Å; C358-S370 PolarHBondContact SG-O 3.5Å; C358-S370 VanDerWaalsContact SG-O 3.39Å; E366-S370 PolarHBondContact O-N 3.35Å; E366-S370 VanDerWaalsContact O-N 3.15Å; E366-S370 PolarHBondContact O-OG 3.25Å; S367-S370 WeakPolarHBondContact O-CB 3.32Å; S367-S370 PolarHBondContact O-N 2.91Å; S367-S370 VanDerWaalsContact O-N 3.1Å; M368-S370 PolarHBondContact O-N 3.42Å; S370-C373 PolarHBondContact O-SG 3.39Å; S370-C373 VanDerWaalsContact O-SG 3.39Å
371W95.6Very high95.9Very high65 Ų6530.6 Ų30.625%0.24615%0.151CC..SBendtrans-102.1125.8-178.9175.5-91.2000111.1F247 R248 I251 Y252 W255 L353 S367 M368 C373 Q376F247-W371 HydrophobicContact CE1-CH2 4.18Å; F247-W371 HydrophobicContact CE1-CZ2 4.22Å; R248-W371 HydrophobicContact CG-CH2 4.44Å; R248-W371 HydrophobicContact CG-CZ3 4.08Å; I251-W371 HydrophobicContact CB-CH2 3.71Å; I251-W371 HydrophobicContact CB-CZ2 4.44Å; I251-W371 HydrophobicContact CB-CZ3 4.41Å; I251-W371 HydrophobicContact CG1-CH2 3.98Å; I251-W371 HydrophobicContact CG1-CZ2 4.45Å; I251-W371 HydrophobicContact CG2-CH2 3.46Å; I251-W371 VanDerWaalsContact CG2-CH2 3.46Å; I251-W371 HydrophobicContact CG2-CZ2 3.88Å; I251-W371 HydrophobicContact CG2-CZ3 4.11Å; Y252-W371 HydrophobicContact CD1-CZ3 4.17Å; Y252-W371 HydrophobicContact CE1-CE3 4.1Å; Y252-W371 AromaticContact CE1-CZ3 3.66Å; Y252-W371 HydrophobicContact CE1-CZ3 3.66Å; W255-W371 HydrophobicContact CH2-CD2 4.05Å; W255-W371 AromaticContact CH2-CE2 3.5Å; W255-W371 HydrophobicContact CH2-CH2 4.27Å; W255-W371 AromaticContact CH2-CZ2 3.63Å; W255-W371 HydrophobicContact CH2-CZ2 3.63Å; W255-W371 AromaticContact CH2-NE1 3.69Å; W255-W371 AromaticContact CZ3-CD2 3.75Å; W255-W371 HydrophobicContact CZ3-CD2 3.75Å; W255-W371 AromaticContact CZ3-CE2 3.68Å; W255-W371 AromaticContact CZ3-CE3 3.98Å; W255-W371 HydrophobicContact CZ3-CE3 3.98Å; W255-W371 HydrophobicContact CZ3-CG 4.3Å; W255-W371 HydrophobicContact CZ3-CH2 4.14Å; W255-W371 AromaticContact CZ3-CZ2 3.89Å; W255-W371 HydrophobicContact CZ3-CZ2 3.89Å; W255-W371 HydrophobicContact CZ3-CZ3 4.17Å; L353-W371 HydrophobicContact CD1-CE3 4.26Å; S367-W371 PolarHBondContact O-N 2.79Å; S367-W371 VanDerWaalsContact O-N 3.14Å; M368-W371 PolarHBondContact O-N 3.22Å; M368-W371 VanDerWaalsContact O-O 3.04Å; W371-C373 VanDerWaalsContact C-N 3.34Å; W371-C373 PolarHBondContact O-N 3.08Å; W371-Q376 VanDerWaalsContact O-CG 3.29Å; W371-Q376 WeakPolarHBondContact O-CG 3.26Å
372N95.5Very high96Very high16 Ų1630.6 Ų30.69%0.08615%0.149CC..SBendtrans5151.7-179.8-153.3-5.1000112.7W255 N352 S374 V375 Q376W255-N372 HydrophobicContact CH2-CB 3.38Å; W255-N372 HydrophobicContact CZ2-CB 3.96Å; W255-N372 HydrophobicContact CZ3-CB 3.82Å; N352-N372 PolarHBondContact ND2-OD1 3.32Å; N352-N372 CarbonylContact O-C 2.91Å; N352-N372 WeakPolarHBondContact O-CA 3.49Å; N352-N372 PolarHBondContact O-N 3.46Å; N352-N372 PolarHBondContact OD1-OD1 2.92Å; N372-S374 PolarHBondContact O-N 3.17Å; N372-S374 VanDerWaalsContact O-N 3.14Å; N372-V375 HydrophobicContact CB-CB 4.36Å; N372-V375 WeakPolarHBondContact ND2-CG2 3.44Å; N372-V375 PolarHBondContact O-N 2.77Å; N372-V375 VanDerWaalsContact OD1-CG2 3.26Å; N372-V375 WeakPolarHBondContact OD1-CG2 3.19Å; N372-Q376 PolarHBondContact O-N 3.48Å
373C96.9Very high96Very high5 Ų529.7 Ų29.73%0.03414%0.142CC..Hα-helixtrans-55-38.2-167-57.30000112.7K278 S351 N352 K369 S370 W371 Q376 F377K278-C373 HydrophobicContact CB-CB 4Å; K278-C373 HydrophobicContact CD-CB 3.46Å; K278-C373 VanDerWaalsContact CD-CB 3.46Å; K278-C373 HydrophobicContact CG-CB 4.31Å; K278-C373 PolarHBondContact NZ-SG 3.04Å; S351-C373 WeakPolarHBondContact O-CB 3.5Å; N352-C373 PolarHBondContact O-N 3.36Å; N352-C373 PolarHBondContact O-SG 2.89Å; N352-C373 PolarHBondContact OD1-N 3.38Å; K369-C373 PolarHBondContact O-SG 3.41Å; S370-C373 PolarHBondContact O-SG 3.39Å; S370-C373 VanDerWaalsContact O-SG 3.39Å; W371-C373 VanDerWaalsContact C-N 3.34Å; W371-C373 PolarHBondContact O-N 3.08Å; C373-Q376 PolarHBondContact O-N 3.14Å; C373-F377 WeakPolarHBondContact O-CB 3.36Å; C373-F377 PolarHBondContact O-N 3.27Å
374S95.9Very high96.1Very high1 Ų131.1 Ų31.11%0.00715%0.145CC..Hα-helixtrans-66.3-36.9178.664.90000112.9Y173 N352 N372 F377 W378Y173-S374 PolarHBondContact N-OG 3.13Å; Y173-S374 WeakPolarHBondContact O-CB 3.27Å; N352-S374 WeakPolarHBondContact OD1-CB 3.38Å; N352-S374 PolarHBondContact OD1-N 2.98Å; N352-S374 VanDerWaalsContact OD1-N 3.1Å; N352-S374 PolarHBondContact OD1-OG 3.32Å; N372-S374 PolarHBondContact O-N 3.17Å; N372-S374 VanDerWaalsContact O-N 3.14Å; S374-F377 WeakPolarHBondContact O-CB 3.42Å; S374-F377 PolarHBondContact O-N 2.72Å; S374-W378 PolarHBondContact O-N 3.17Å
375V96.7Very high96Very high5 Ų536.6 Ų36.63%0.0317%0.165CC..Hα-helixtrans-75.5-34.5174.9176.20000111L110 N372 F377 W378 L379 W405L110-V375 HydrophobicContact CD1-CG2 3.78Å; N372-V375 HydrophobicContact CB-CB 4.36Å; N372-V375 WeakPolarHBondContact ND2-CG2 3.44Å; N372-V375 PolarHBondContact O-N 2.77Å; N372-V375 VanDerWaalsContact OD1-CG2 3.26Å; N372-V375 WeakPolarHBondContact OD1-CG2 3.19Å; V375-F377 VanDerWaalsContact C-N 3.32Å; V375-F377 PolarHBondContact O-N 3.24Å; V375-W378 WeakPolarHBondContact O-CB 3.42Å; V375-W378 PolarHBondContact O-N 3.09Å; V375-L379 HydrophobicContact CG1-CD1 4.07Å; V375-L379 HydrophobicContact CG1-CG 4.3Å; V375-L379 WeakPolarHBondContact O-CB 3.15Å; V375-L379 WeakPolarHBondContact O-CG 3.31Å; V375-L379 PolarHBondContact O-N 3.34Å; V375-W405 HydrophobicContact CG1-CE3 4.42Å; V375-W405 HydrophobicContact CG1-CH2 4.07Å; V375-W405 HydrophobicContact CG1-CZ3 3.84Å; V375-W405 HydrophobicContact CG2-CH2 4.1Å
376Q96.4Very high96Very high44 Ų4436.6 Ų36.621%0.20617%0.165CC..Hα-helixtrans-62-41.8171.4-66.7-62.6-36.700111.4M368 W371 N372 C373 A380M368-Q376 WeakPolarHBondContact O-CG 3.05Å; W371-Q376 VanDerWaalsContact O-CG 3.29Å; W371-Q376 WeakPolarHBondContact O-CG 3.26Å; N372-Q376 PolarHBondContact O-N 3.48Å; C373-Q376 PolarHBondContact O-N 3.14Å; Q376-A380 WeakPolarHBondContact O-CB 3.44Å; Q376-A380 PolarHBondContact O-N 3.32Å
377F96.7Very high96Very high33 Ų3333.6 Ų33.615%0.14515%0.154CC..Hα-helixtrans-57.1-49.3170.8165.5-88.1000111.3Y173 K278 G279 E280 C373 S374 V375 A380 N381Y173-F377 HydrophobicContact CE1-CD1 4.26Å; Y173-F377 HydrophobicContact CE1-CE1 4.31Å; K278-F377 WeakPolarHBondContact O-CB 3.5Å; K278-F377 WeakPolarHBondContact O-CD2 3.23Å; G279-F377 WeakPolarHBondContact O-CE1 3.33Å; G279-F377 WeakPolarHBondContact O-CZ 3.14Å; E280-F377 VanDerWaalsContact CA-CE2 3.44Å; E280-F377 HydrophobicContact CB-CD2 3.98Å; E280-F377 HydrophobicContact CB-CE2 3.28Å; E280-F377 HydrophobicContact CB-CZ 3.9Å; E280-F377 HydrophobicContact CG-CE2 3.6Å; E280-F377 HydrophobicContact CG-CZ 4.09Å; C373-F377 WeakPolarHBondContact O-CB 3.36Å; C373-F377 PolarHBondContact O-N 3.27Å; S374-F377 WeakPolarHBondContact O-CB 3.42Å; S374-F377 PolarHBondContact O-N 2.72Å; V375-F377 VanDerWaalsContact C-N 3.32Å; V375-F377 PolarHBondContact O-N 3.24Å; F377-A380 PolarHBondContact O-N 3.46Å; F377-N381 WeakPolarHBondContact CD2-ND2 3.35Å; F377-N381 WeakPolarHBondContact CE2-ND2 3.49Å; F377-N381 WeakPolarHBondContact CZ-ND2 3.49Å; F377-N381 WeakPolarHBondContact O-CB 3.24Å; F377-N381 PolarHBondContact O-N 3.02Å; F377-N381 PolarHBondContact O-ND2 3.43Å
378W98Very high95.9Very high1 Ų141.7 Ų41.70%0.00419%0.189CC..Hα-helixtrans-58.3-51179-175.4101.4000112F80 L110 I113 Y173 S374 V375 A380 N381 Y382 F383 V401F80-W378 HydrophobicContact CE2-CH2 4.48Å; F80-W378 AromaticContact CZ-CH2 3.89Å; F80-W378 HydrophobicContact CZ-CH2 3.89Å; L110-W378 HydrophobicContact CD2-CD2 3.65Å; L110-W378 HydrophobicContact CD2-CE3 3.77Å; L110-W378 HydrophobicContact CD2-CG 4.28Å; L110-W378 HydrophobicContact CD2-CH2 3.72Å; L110-W378 HydrophobicContact CD2-CZ2 3.6Å; L110-W378 HydrophobicContact CD2-CZ3 3.82Å; L110-W378 PolarHBondContact O-NE1 3.38Å; I113-W378 HydrophobicContact CB-CZ2 3.81Å; I113-W378 HydrophobicContact CD1-CH2 4.49Å; I113-W378 HydrophobicContact CD1-CZ2 4.27Å; I113-W378 HydrophobicContact CG2-CH2 4.25Å; I113-W378 HydrophobicContact CG2-CZ2 3.52Å; Y173-W378 HydrophobicContact CD1-CB 4.22Å; Y173-W378 AromaticContact CD2-CD1 3.97Å; Y173-W378 HydrophobicContact CE1-CB 4.28Å; Y173-W378 AromaticContact CE1-CD1 3.79Å; Y173-W378 HydrophobicContact CE1-CG 4.46Å; Y173-W378 AromaticContact CE2-CD1 3.54Å; Y173-W378 AromaticContact CZ-CD1 3.45Å; Y173-W378 VanDerWaalsContact CZ-CD1 3.45Å; S374-W378 PolarHBondContact O-N 3.17Å; V375-W378 WeakPolarHBondContact O-CB 3.42Å; V375-W378 PolarHBondContact O-N 3.09Å; W378-A380 VanDerWaalsContact C-N 3.33Å; W378-A380 PolarHBondContact O-N 3.4Å; W378-N381 PolarHBondContact O-N 2.95Å; W378-Y382 HydrophobicContact CB-CD2 4.29Å; W378-Y382 HydrophobicContact CB-CE2 4.41Å; W378-Y382 AromaticContact CD1-CD2 3.41Å; W378-Y382 VanDerWaalsContact CD1-CD2 3.41Å; W378-Y382 AromaticContact CD1-CE2 3.31Å; W378-Y382 AromaticContact CD2-CD2 3.8Å; W378-Y382 HydrophobicContact CD2-CD2 3.8Å; W378-Y382 HydrophobicContact CD2-CE2 4.46Å; W378-Y382 AromaticContact CE2-CD2 3.76Å; W378-Y382 AromaticContact CG-CD2 3.57Å; W378-Y382 HydrophobicContact CG-CD2 3.57Å; W378-Y382 AromaticContact CG-CE2 3.82Å; W378-Y382 HydrophobicContact CG-CE2 3.82Å; W378-Y382 AromaticContact NE1-CD2 3.5Å; W378-Y382 AromaticContact NE1-CE2 3.64Å; W378-Y382 WeakPolarHBondContact O-CB 3.38Å; W378-Y382 VanDerWaalsContact O-CD2 3.24Å; W378-Y382 WeakPolarHBondContact O-CD2 3.46Å; W378-Y382 PolarHBondContact O-N 2.97Å; W378-F383 HydrophobicContact CE3-CD2 4.2Å; W378-F383 HydrophobicContact CE3-CE2 4.17Å; W378-F383 AromaticContact CH2-CD2 3.96Å; W378-F383 HydrophobicContact CH2-CD2 3.96Å; W378-F383 AromaticContact CH2-CE2 3.16Å; W378-F383 HydrophobicContact CH2-CE2 3.16Å; W378-F383 AromaticContact CH2-CZ 3.89Å; W378-F383 HydrophobicContact CH2-CZ 3.89Å; W378-F383 AromaticContact CZ2-CE2 3.86Å; W378-F383 HydrophobicContact CZ2-CE2 3.86Å; W378-F383 AromaticContact CZ3-CD2 3.62Å; W378-F383 HydrophobicContact CZ3-CD2 3.62Å; W378-F383 AromaticContact CZ3-CE2 3.34Å; W378-F383 HydrophobicContact CZ3-CE2 3.34Å; W378-F383 HydrophobicContact CZ3-CZ 4.33Å; W378-V401 HydrophobicContact CZ3-CG1 4.41Å
379L97.7Very high95.9Very high1 Ų142.3 Ų42.31%0.00520%0.199CC..Hα-helixtrans-61.6-42.2178.1-76.2170.9000111.3V375 F383 Y384 T398 V401V375-L379 HydrophobicContact CG1-CD1 4.07Å; V375-L379 HydrophobicContact CG1-CG 4.3Å; V375-L379 WeakPolarHBondContact O-CB 3.15Å; V375-L379 WeakPolarHBondContact O-CG 3.31Å; V375-L379 PolarHBondContact O-N 3.34Å; L379-F383 PolarHBondContact O-N 3.27Å; L379-F383 VanDerWaalsContact O-N 3.12Å; L379-Y384 PolarHBondContact O-N 3.07Å; L379-T398 HydrophobicContact CB-CG2 3.81Å; L379-T398 HydrophobicContact CD1-CG2 4.48Å; L379-T398 HydrophobicContact CD2-CG2 4.13Å; L379-T398 HydrophobicContact CG-CG2 4.37Å; L379-V401 HydrophobicContact CD2-CG1 4.11Å
380A96.7Very high95.9Very high32 Ų3238.8 Ų38.826%0.26419%0.191SC..Iπ-helixtrans-63-47.5179.800000111.9Q376 F377 W378 R385Q376-A380 WeakPolarHBondContact O-CB 3.44Å; Q376-A380 PolarHBondContact O-N 3.32Å; F377-A380 PolarHBondContact O-N 3.46Å; W378-A380 VanDerWaalsContact C-N 3.33Å; W378-A380 PolarHBondContact O-N 3.4Å; A380-R385 VanDerWaalsContact O-CB 3.29Å; A380-R385 WeakPolarHBondContact O-CB 3.44Å; A380-R385 VanDerWaalsContact O-CG 3.26Å; A380-R385 WeakPolarHBondContact O-CG 3.21Å; A380-R385 PolarHBondContact O-N 3.07Å
381N96.2Very high95.8Very high26 Ų2644.6 Ų44.614%0.13921%0.21CC..Iπ-helixtrans-81.7-32.4-173-78-33.4000114.7F377 W378 R385 R386F377-N381 WeakPolarHBondContact CD2-ND2 3.35Å; F377-N381 WeakPolarHBondContact CE2-ND2 3.49Å; F377-N381 WeakPolarHBondContact CZ-ND2 3.49Å; F377-N381 WeakPolarHBondContact O-CB 3.24Å; F377-N381 PolarHBondContact O-N 3.02Å; F377-N381 PolarHBondContact O-ND2 3.43Å; W378-N381 PolarHBondContact O-N 2.95Å; N381-R385 WeakPolarHBondContact OD1-CD 3.33Å; N381-R385 PolarHBondContact OD1-NH1 3.06Å; N381-R386 PolarHBondContact O-NE 2.74Å
382Y96.8Very high95.5Very high12 Ų1246.5 Ų46.55%0.04723%0.225CC..Iπ-helixtrans-98.2-27.4-174.8-56.1-43.5000113.2F117 Y173 W378 R386F117-Y382 HydrophobicContact CB-CD1 3.33Å; F117-Y382 HydrophobicContact CB-CE1 3.33Å; F117-Y382 HydrophobicContact CB-CG 4.18Å; F117-Y382 HydrophobicContact CD1-CD1 4.08Å; F117-Y382 AromaticContact CD2-CD1 3.66Å; F117-Y382 HydrophobicContact CD2-CD1 3.66Å; F117-Y382 HydrophobicContact CD2-CD2 4.38Å; F117-Y382 HydrophobicContact CD2-CE1 4.38Å; F117-Y382 AromaticContact CD2-CG 3.65Å; F117-Y382 HydrophobicContact CD2-CG 3.65Å; F117-Y382 HydrophobicContact CE2-CD1 4.47Å; F117-Y382 HydrophobicContact CE2-CG 4.2Å; F117-Y382 AromaticContact CG-CD1 3.43Å; F117-Y382 HydrophobicContact CG-CD1 3.43Å; F117-Y382 VanDerWaalsContact CG-CD1 3.43Å; F117-Y382 AromaticContact CG-CE1 4Å; F117-Y382 HydrophobicContact CG-CE1 4Å; F117-Y382 AromaticContact CG-CG 3.95Å; F117-Y382 HydrophobicContact CG-CG 3.95Å; Y173-Y382 PolarHBondContact OH-OH 3.36Å; W378-Y382 HydrophobicContact CB-CD2 4.29Å; W378-Y382 HydrophobicContact CB-CE2 4.41Å; W378-Y382 AromaticContact CD1-CD2 3.41Å; W378-Y382 VanDerWaalsContact CD1-CD2 3.41Å; W378-Y382 AromaticContact CD1-CE2 3.31Å; W378-Y382 AromaticContact CD2-CD2 3.8Å; W378-Y382 HydrophobicContact CD2-CD2 3.8Å; W378-Y382 HydrophobicContact CD2-CE2 4.46Å; W378-Y382 AromaticContact CE2-CD2 3.76Å; W378-Y382 AromaticContact CG-CD2 3.57Å; W378-Y382 HydrophobicContact CG-CD2 3.57Å; W378-Y382 AromaticContact CG-CE2 3.82Å; W378-Y382 HydrophobicContact CG-CE2 3.82Å; W378-Y382 AromaticContact NE1-CD2 3.5Å; W378-Y382 AromaticContact NE1-CE2 3.64Å; W378-Y382 WeakPolarHBondContact O-CB 3.38Å; W378-Y382 VanDerWaalsContact O-CD2 3.24Å; W378-Y382 WeakPolarHBondContact O-CD2 3.46Å; W378-Y382 PolarHBondContact O-N 2.97Å; Y382-R386 WeakPolarHBondContact O-CD 3.23Å
383F97Very high95.5Very high12 Ų1250.1 Ų50.15%0.05324%0.244CC..Iπ-helixtrans-118.9-53.6-177.9-66.6-91.2000113.1V76 F80 I113 W378 L379 C387 W397 V401V76-F383 HydrophobicContact CG2-CZ 4.19Å; F80-F383 HydrophobicContact CE2-CE1 4.16Å; F80-F383 AromaticContact CE2-CZ 3.71Å; F80-F383 HydrophobicContact CE2-CZ 3.71Å; F80-F383 HydrophobicContact CZ-CZ 4.35Å; I113-F383 HydrophobicContact CG2-CE2 4.5Å; W378-F383 HydrophobicContact CE3-CD2 4.2Å; W378-F383 HydrophobicContact CE3-CE2 4.17Å; W378-F383 AromaticContact CH2-CD2 3.96Å; W378-F383 HydrophobicContact CH2-CD2 3.96Å; W378-F383 AromaticContact CH2-CE2 3.16Å; W378-F383 HydrophobicContact CH2-CE2 3.16Å; W378-F383 AromaticContact CH2-CZ 3.89Å; W378-F383 HydrophobicContact CH2-CZ 3.89Å; W378-F383 AromaticContact CZ2-CE2 3.86Å; W378-F383 HydrophobicContact CZ2-CE2 3.86Å; W378-F383 AromaticContact CZ3-CD2 3.62Å; W378-F383 HydrophobicContact CZ3-CD2 3.62Å; W378-F383 AromaticContact CZ3-CE2 3.34Å; W378-F383 HydrophobicContact CZ3-CE2 3.34Å; W378-F383 HydrophobicContact CZ3-CZ 4.33Å; L379-F383 PolarHBondContact O-N 3.27Å; L379-F383 VanDerWaalsContact O-N 3.12Å; F383-C387 WeakPolarHBondContact O-CB 3.26Å; F383-C387 PolarHBondContact O-N 3.38Å; F383-C387 VanDerWaalsContact O-N 3.12Å; F383-W397 HydrophobicContact CD1-CZ2 4.38Å; F383-W397 AromaticContact CD1-NE1 3.88Å; F383-V401 HydrophobicContact CD1-CB 4.32Å; F383-V401 HydrophobicContact CD1-CG1 3.91Å; F383-V401 HydrophobicContact CD1-CG2 3.67Å; F383-V401 HydrophobicContact CD2-CG1 4.12Å; F383-V401 HydrophobicContact CE1-CG1 3.94Å; F383-V401 HydrophobicContact CE1-CG2 4.05Å; F383-V401 HydrophobicContact CE2-CG1 4.21Å; F383-V401 HydrophobicContact CG-CG1 4Å; F383-V401 HydrophobicContact CG-CG2 4.28Å; F383-V401 HydrophobicContact CZ-CG1 4.1Å
384Y96.9Very high95.5Very high53 Ų5352.7 Ų52.721%0.20825%0.253CS..Iπ-helixtrans-65.9-48.5-173.5-176.9-98.1000112.7L379 R394 T398L379-Y384 PolarHBondContact O-N 3.07Å; Y384-R394 HydrophobicContact CD2-CB 3.78Å; Y384-R394 HydrophobicContact CE2-CB 3.61Å; Y384-R394 VanDerWaalsContact O-CZ 3.28Å; Y384-R394 PolarHBondContact O-NE 2.89Å; Y384-R394 PolarHBondContact O-NH2 3.5Å; Y384-T398 WeakPolarHBondContact CA-OG1 3.24Å; Y384-T398 WeakPolarHBondContact CB-OG1 3.33Å
385R95Very high95.4Very high116 Ų11653.3 Ų53.344%0.43826%0.257SS..THydrogen-bonded Turntrans-71.7-27.6-179.3-75174.9175179.7-7.7113.2A380 N381A380-R385 VanDerWaalsContact O-CB 3.29Å; A380-R385 WeakPolarHBondContact O-CB 3.44Å; A380-R385 VanDerWaalsContact O-CG 3.26Å; A380-R385 WeakPolarHBondContact O-CG 3.21Å; A380-R385 PolarHBondContact O-N 3.07Å; N381-R385 WeakPolarHBondContact OD1-CD 3.33Å; N381-R385 PolarHBondContact OD1-NH1 3.06Å
386R94.9Very high95.5Very high70 Ų7056.6 Ų56.626%0.26427%0.274SS..THydrogen-bonded Turntrans-88.5-16.2-177.3-59.2-171-172.7-123.1-2.5113.9D121 N381 Y382 K388D121-R386 IonicContact OD1-CZ 3.82Å; D121-R386 IonicContact OD1-NH1 2.88Å; D121-R386 PolarHBondContact OD1-NH1 3.25Å; D121-R386 IonicContact OD1-NH2 2.68Å; D121-R386 PolarHBondContact OD1-NH2 2.94Å; D121-R386 IonicContact OD2-CZ 2.64Å; D121-R386 IonicContact OD2-NH2 3.37Å; D121-R386 PolarHBondContact OD2-NH2 3.06Å; N381-R386 PolarHBondContact O-NE 2.74Å; Y382-R386 WeakPolarHBondContact O-CD 3.23Å; R386-K388 PolarHBondContact O-N 2.85Å
387C93.7Very high95.5Very high29 Ų2960.1 Ų60.120%0.19629%0.285CS..  trans-74.4109174.2-179.50000110.9F383 A389 R394F383-C387 WeakPolarHBondContact O-CB 3.26Å; F383-C387 PolarHBondContact O-N 3.38Å; F383-C387 VanDerWaalsContact O-N 3.12Å; C387-A389 PolarHBondContact O-N 2.85Å; C387-R394 HydrophobicContact CB-CG 3.99Å; C387-R394 WeakPolarHBondContact O-CD 3.38Å; C387-R394 WeakPolarHBondContact O-CG 3.31Å
388K93.3Very high95.5Very high170 Ų17058.9 Ų58.974%0.73928%0.28SS*.  trans-76.266.6176-63.8-177.3-179.4-179.70111R386 N528R386-K388 PolarHBondContact O-N 2.85Å; K388-N528 WeakPolarHBondContact CE-ND2 3.28Å
389A95Very high95.5Very high39 Ų3959.1 Ų59.132%0.32228%0.282SS..SBendtrans-142.1176.9179.500000112.2C387 I393 R394C387-A389 PolarHBondContact O-N 2.85Å; A389-I393 HydrophobicContact CB-CB 3.82Å; A389-I393 HydrophobicContact CB-CD1 4.46Å; A389-I393 HydrophobicContact CB-CG2 3.58Å; A389-R394 HydrophobicContact CB-CG 4.25Å; A389-R394 WeakPolarHBondContact O-CD 3.37Å; A389-R394 WeakPolarHBondContact O-CG 3.47Å
390S94.1Very high95.5Very high65 Ų6562 Ų6246%0.45530%0.296SS..  trans-61.7157.5174.875.10000111.4N392 I393 R394S390-N392 PolarHBondContact O-N 3.41Å; S390-N392 VanDerWaalsContact O-N 3.14Å; S390-I393 PolarHBondContact O-N 2.79Å; S390-I393 VanDerWaalsContact O-N 3.14Å; S390-I393 WeakPolarHBondContact OG-CG1 3.46Å; S390-R394 VanDerWaalsContact O-CG 3.3Å; S390-R394 WeakPolarHBondContact O-CG 3.33Å; S390-R394 PolarHBondContact O-N 2.63Å
391R92.2Very high95.5Very high141 Ų14160.9 Ų60.953%0.53229%0.286SS..Hα-helixtrans-51.2-40.2-179.3-177-177.6179-175.10.1113.1T395R391-T395 WeakPolarHBondContact O-CB 3.48Å; R391-T395 PolarHBondContact O-N 3.38Å; R391-T395 PolarHBondContact O-OG1 3.2Å
392N91.2Very high95.6Very high105 Ų10559.8 Ų59.856%0.56128%0.281SS*.Hα-helixtrans-71-43.8-178-64.6-8.5000111.2S390 T395 L396S390-N392 PolarHBondContact O-N 3.41Å; S390-N392 VanDerWaalsContact O-N 3.14Å; N392-T395 PolarHBondContact O-N 2.94Å; N392-L396 WeakPolarHBondContact O-CB 3.44Å; N392-L396 PolarHBondContact O-N 3.4Å
393I95Very high95.6Very high93 Ų9359.2 Ų59.248%0.47728%0.279SS..Hα-helixtrans-64-42.9176.5-63.9171.1000110.4A389 S390 T395 L396 W397A389-I393 HydrophobicContact CB-CB 3.82Å; A389-I393 HydrophobicContact CB-CD1 4.46Å; A389-I393 HydrophobicContact CB-CG2 3.58Å; S390-I393 PolarHBondContact O-N 2.79Å; S390-I393 VanDerWaalsContact O-N 3.14Å; S390-I393 WeakPolarHBondContact OG-CG1 3.46Å; I393-T395 VanDerWaalsContact C-N 3.31Å; I393-T395 PolarHBondContact O-N 3.09Å; I393-L396 PolarHBondContact O-N 3.22Å; I393-W397 VanDerWaalsContact O-CB 3.26Å; I393-W397 WeakPolarHBondContact O-CB 3.39Å; I393-W397 PolarHBondContact O-N 2.82Å
394R95.7Very high95.7Very high59 Ų5961.9 Ų61.922%0.22329%0.289CS..Hα-helixtrans-58.3-44.2175.4-68.5169.960.3-175.24.2111.6Y384 C387 A389 S390 W397 T398Y384-R394 HydrophobicContact CD2-CB 3.78Å; Y384-R394 HydrophobicContact CE2-CB 3.61Å; Y384-R394 VanDerWaalsContact O-CZ 3.28Å; Y384-R394 PolarHBondContact O-NE 2.89Å; Y384-R394 PolarHBondContact O-NH2 3.5Å; C387-R394 HydrophobicContact CB-CG 3.99Å; C387-R394 WeakPolarHBondContact O-CD 3.38Å; C387-R394 WeakPolarHBondContact O-CG 3.31Å; A389-R394 HydrophobicContact CB-CG 4.25Å; A389-R394 WeakPolarHBondContact O-CD 3.37Å; A389-R394 WeakPolarHBondContact O-CG 3.47Å; S390-R394 VanDerWaalsContact O-CG 3.3Å; S390-R394 WeakPolarHBondContact O-CG 3.33Å; S390-R394 PolarHBondContact O-N 2.63Å; R394-W397 PolarHBondContact O-N 3.45Å; R394-T398 WeakPolarHBondContact O-CB 3.25Å; R394-T398 PolarHBondContact O-N 3.25Å; R394-T398 PolarHBondContact O-OG1 3.27Å
395T95.5Very high95.7Very high13 Ų1359.8 Ų59.88%0.0828%0.281CS..Hα-helixtrans-64.7-48.1178.6-560000111.2R391 N392 I393 W397 T398 M399 P420 L423R391-T395 WeakPolarHBondContact O-CB 3.48Å; R391-T395 PolarHBondContact O-N 3.38Å; R391-T395 PolarHBondContact O-OG1 3.2Å; N392-T395 PolarHBondContact O-N 2.94Å; I393-T395 VanDerWaalsContact C-N 3.31Å; I393-T395 PolarHBondContact O-N 3.09Å; T395-W397 PolarHBondContact O-N 3.16Å; T395-T398 PolarHBondContact O-N 3.24Å; T395-M399 VanDerWaalsContact O-CG 3.31Å; T395-M399 WeakPolarHBondContact O-CG 3.21Å; T395-M399 PolarHBondContact O-N 3.18Å; T395-P420 HydrophobicContact CG2-CB 4.45Å; T395-P420 HydrophobicContact CG2-CG 4.32Å; T395-L423 HydrophobicContact CG2-CD1 3.59Å
396L96.8Very high95.8Very high75 Ų7556 Ų5639%0.39327%0.268SS..Hα-helixtrans-58.1-47.6176.6179.264.1000111.3N392 I393 T398 M399 L400 L417 P420N392-L396 WeakPolarHBondContact O-CB 3.44Å; N392-L396 PolarHBondContact O-N 3.4Å; I393-L396 PolarHBondContact O-N 3.22Å; L396-T398 PolarHBondContact O-N 2.89Å; L396-M399 PolarHBondContact O-N 2.96Å; L396-L400 HydrophobicContact CG-CD1 4.22Å; L396-L400 WeakPolarHBondContact O-CG 3.41Å; L396-L400 PolarHBondContact O-N 3.15Å; L396-L417 HydrophobicContact CD1-CD2 3.62Å; L396-P420 HydrophobicContact CD1-CG 4.19Å
397W96.9Very high95.7Very high117 Ų11752.7 Ų52.744%0.44326%0.256SS..Hα-helixtrans-58-47.9176.4174.4-117.6000112.1F383 I393 R394 T395 M399 L400 V401F383-W397 HydrophobicContact CD1-CZ2 4.38Å; F383-W397 AromaticContact CD1-NE1 3.88Å; I393-W397 VanDerWaalsContact O-CB 3.26Å; I393-W397 WeakPolarHBondContact O-CB 3.39Å; I393-W397 PolarHBondContact O-N 2.82Å; R394-W397 PolarHBondContact O-N 3.45Å; T395-W397 PolarHBondContact O-N 3.16Å; W397-M399 VanDerWaalsContact C-N 3.33Å; W397-M399 PolarHBondContact O-N 3.38Å; W397-L400 WeakPolarHBondContact O-CB 3.34Å; W397-L400 PolarHBondContact O-N 3.41Å; W397-V401 HydrophobicContact CD2-CG2 4.16Å; W397-V401 HydrophobicContact CE3-CG2 4.49Å; W397-V401 HydrophobicContact CH2-CG2 4.18Å; W397-V401 HydrophobicContact CZ2-CG2 3.81Å; W397-V401 WeakPolarHBondContact O-CG2 3.34Å; W397-V401 PolarHBondContact O-N 2.8Å
398T97.5Very high95.8Very high7 Ų754.6 Ų54.64%0.04326%0.264CS..Hα-helixtrans-64-37.4178.1-580000112.4L379 Y384 R394 T395 L396 V401 S402L379-T398 HydrophobicContact CB-CG2 3.81Å; L379-T398 HydrophobicContact CD1-CG2 4.48Å; L379-T398 HydrophobicContact CD2-CG2 4.13Å; L379-T398 HydrophobicContact CG-CG2 4.37Å; Y384-T398 WeakPolarHBondContact CA-OG1 3.24Å; Y384-T398 WeakPolarHBondContact CB-OG1 3.33Å; R394-T398 WeakPolarHBondContact O-CB 3.25Å; R394-T398 PolarHBondContact O-N 3.25Å; R394-T398 PolarHBondContact O-OG1 3.27Å; T395-T398 PolarHBondContact O-N 3.24Å; L396-T398 PolarHBondContact O-N 2.89Å; T398-V401 PolarHBondContact O-N 3.4Å; T398-S402 WeakPolarHBondContact O-CB 3.41Å; T398-S402 PolarHBondContact O-N 3.27Å
399M97.4Very high95.8Very high7 Ų751.5 Ų51.53%0.03425%0.252CS..Hα-helixtrans-71.6-33.6176.6-66.3-59.997.400112.5M368 T395 L396 W397 S402 A403 F416 I419 P420M368-M399 HydrophobicContact CE-CE 3.82Å; M368-M399 HydrophobicContact CE-SD 3.78Å; T395-M399 VanDerWaalsContact O-CG 3.31Å; T395-M399 WeakPolarHBondContact O-CG 3.21Å; T395-M399 PolarHBondContact O-N 3.18Å; L396-M399 PolarHBondContact O-N 2.96Å; W397-M399 VanDerWaalsContact C-N 3.33Å; W397-M399 PolarHBondContact O-N 3.38Å; M399-S402 WeakPolarHBondContact O-CB 3.35Å; M399-S402 PolarHBondContact O-N 3.43Å; M399-A403 WeakPolarHBondContact O-CB 3.4Å; M399-A403 PolarHBondContact O-N 3.31Å; M399-F416 HydrophobicContact CB-CB 4.38Å; M399-F416 HydrophobicContact SD-CD1 4.26Å; M399-I419 HydrophobicContact CG-CB 4.33Å; M399-I419 HydrophobicContact CG-CG2 4.38Å; M399-I419 HydrophobicContact SD-CB 4.11Å; M399-I419 HydrophobicContact SD-CG1 4.49Å; M399-I419 HydrophobicContact SD-CG2 3.93Å; M399-P420 HydrophobicContact CB-CG 4.28Å; M399-P420 HydrophobicContact CG-CG 4.06Å
400L97.5Very high95.9Very high60 Ų6051.1 Ų51.131%0.31425%0.249SC..Hα-helixtrans-63.1-46.8170.8-78.1167000111.8L396 W397 S402 A403 Y404 Y413 L417L396-L400 HydrophobicContact CG-CD1 4.22Å; L396-L400 WeakPolarHBondContact O-CG 3.41Å; L396-L400 PolarHBondContact O-N 3.15Å; W397-L400 WeakPolarHBondContact O-CB 3.34Å; W397-L400 PolarHBondContact O-N 3.41Å; L400-S402 VanDerWaalsContact C-N 3.29Å; L400-S402 PolarHBondContact O-N 3.22Å; L400-A403 PolarHBondContact O-N 2.98Å; L400-Y404 WeakPolarHBondContact O-CB 3.32Å; L400-Y404 PolarHBondContact O-N 3.27Å; L400-Y413 HydrophobicContact CD2-CD1 4.43Å; L400-L417 HydrophobicContact CD2-CD1 4.13Å; L400-L417 HydrophobicContact CD2-CD2 3.71Å; L400-L417 HydrophobicContact CD2-CG 4.41Å; L400-L417 HydrophobicContact CG-CD2 3.85Å
401V97.8Very high96.1Very high9 Ų948 Ų486%0.05523%0.227CC..Hα-helixtrans-60.4-41.9175.3172.80000110.5F80 W378 L379 F383 W397 T398 W405F80-V401 HydrophobicContact CE2-CG1 4.06Å; F80-V401 HydrophobicContact CZ-CG1 3.84Å; W378-V401 HydrophobicContact CZ3-CG1 4.41Å; L379-V401 HydrophobicContact CD2-CG1 4.11Å; F383-V401 HydrophobicContact CD1-CB 4.32Å; F383-V401 HydrophobicContact CD1-CG1 3.91Å; F383-V401 HydrophobicContact CD1-CG2 3.67Å; F383-V401 HydrophobicContact CD2-CG1 4.12Å; F383-V401 HydrophobicContact CE1-CG1 3.94Å; F383-V401 HydrophobicContact CE1-CG2 4.05Å; F383-V401 HydrophobicContact CE2-CG1 4.21Å; F383-V401 HydrophobicContact CG-CG1 4Å; F383-V401 HydrophobicContact CG-CG2 4.28Å; F383-V401 HydrophobicContact CZ-CG1 4.1Å; W397-V401 HydrophobicContact CD2-CG2 4.16Å; W397-V401 HydrophobicContact CE3-CG2 4.49Å; W397-V401 HydrophobicContact CH2-CG2 4.18Å; W397-V401 HydrophobicContact CZ2-CG2 3.81Å; W397-V401 WeakPolarHBondContact O-CG2 3.34Å; W397-V401 PolarHBondContact O-N 2.8Å; T398-V401 PolarHBondContact O-N 3.4Å; V401-W405 VanDerWaalsContact O-CB 3.3Å; V401-W405 WeakPolarHBondContact O-CB 3.41Å; V401-W405 PolarHBondContact O-N 3.45Å
402S97.6Very high96.3Very high4 Ų443 Ų433%0.02821%0.208CC..Hα-helixtrans-61.2-46.3174.5-174.80000111.9T398 M399 L400 W405 H406 F416T398-S402 WeakPolarHBondContact O-CB 3.41Å; T398-S402 PolarHBondContact O-N 3.27Å; M399-S402 WeakPolarHBondContact O-CB 3.35Å; M399-S402 PolarHBondContact O-N 3.43Å; L400-S402 VanDerWaalsContact C-N 3.29Å; L400-S402 PolarHBondContact O-N 3.22Å; S402-W405 PolarHBondContact O-N 3.08Å; S402-H406 PolarHBondContact O-N 3.45Å; S402-H406 VanDerWaalsContact O-N 3.1Å; S402-H406 PolarHBondContact O-ND1 2.67Å; S402-F416 WeakPolarHBondContact OG-CE1 2.9Å; S402-F416 WeakPolarHBondContact OG-CZ 3.49Å
403A97.7Very high96.6Very high0 Ų040.8 Ų40.80%019%0.193CC..Hα-helixtrans-59.8-50.3177.900000111.9M399 L400 W405 H406 G407 Y413 F416M399-A403 WeakPolarHBondContact O-CB 3.4Å; M399-A403 PolarHBondContact O-N 3.31Å; L400-A403 PolarHBondContact O-N 2.98Å; A403-W405 VanDerWaalsContact C-N 3.31Å; A403-W405 PolarHBondContact O-N 3.15Å; A403-H406 PolarHBondContact O-N 3.38Å; A403-H406 VanDerWaalsContact O-N 3.1Å; A403-G407 PolarHBondContact O-N 2.92Å; A403-G407 VanDerWaalsContact O-O 3.11Å; A403-Y413 HydrophobicContact CB-CD1 3.88Å; A403-Y413 HydrophobicContact CB-CE1 4.09Å; A403-Y413 HydrophobicContact CB-CG 4.15Å; A403-F416 VanDerWaalsContact CA-CD2 3.49Å; A403-F416 HydrophobicContact CB-CB 4Å; A403-F416 HydrophobicContact CB-CD2 3.76Å; A403-F416 HydrophobicContact CB-CG 4.2Å
404Y97.9Very high96.7Very high67 Ų6737.7 Ų37.726%0.26318%0.177SC..Hα-helixtrans-60-41.8178.5-172.1-86000112F80 R87 L400 H406 G407 L408 Y413F80-Y404 HydrophobicContact CB-CD1 4.31Å; F80-Y404 HydrophobicContact CB-CE1 3.75Å; F80-Y404 AromaticContact CD1-CD1 3.87Å; F80-Y404 HydrophobicContact CD1-CD1 3.87Å; F80-Y404 HydrophobicContact CD1-CE1 4Å; F80-Y404 HydrophobicContact CE1-CD1 4.42Å; F80-Y404 HydrophobicContact CG-CD1 4.19Å; F80-Y404 HydrophobicContact CG-CE1 4.11Å; F80-Y404 WeakPolarHBondContact O-CE1 3.32Å; F80-Y404 PolarHBondContact O-OH 2.96Å; F80-Y404 VanDerWaalsContact O-OH 3.14Å; R87-Y404 PolarHBondContact NH1-O 3.48Å; L400-Y404 WeakPolarHBondContact O-CB 3.32Å; L400-Y404 PolarHBondContact O-N 3.27Å; Y404-H406 VanDerWaalsContact C-N 3.31Å; Y404-H406 PolarHBondContact O-N 3.41Å; Y404-G407 PolarHBondContact O-N 3.39Å; Y404-L408 HydrophobicContact CD2-CD2 3.92Å; Y404-L408 HydrophobicContact CE2-CD2 3.58Å; Y404-Y413 WeakPolarHBondContact CD2-OH 3.44Å
405W97.6Very high96.8Very high9 Ų935.1 Ų35.13%0.03417%0.168CC..Hα-helixtrans-58.7-42.9175.5173.163.7000111.2F80 R87 L106 L110 V375 V401 S402 A403F80-W405 HydrophobicContact CE1-CB 4.05Å; R87-W405 VanDerWaalsContact CZ-O 3.22Å; R87-W405 PolarHBondContact NH1-O 3.27Å; R87-W405 PolarHBondContact NH2-O 2.78Å; L106-W405 HydrophobicContact CD1-CD2 3.83Å; L106-W405 HydrophobicContact CD1-CG 3.91Å; L106-W405 HydrophobicContact CD1-CZ2 3.85Å; L106-W405 WeakPolarHBondContact CD1-O 3.43Å; L106-W405 HydrophobicContact CD2-CH2 4.08Å; L106-W405 HydrophobicContact CD2-CZ2 3.56Å; L106-W405 HydrophobicContact CG-CD2 4.36Å; L106-W405 VanDerWaalsContact CG-CE2 3.42Å; L106-W405 HydrophobicContact CG-CH2 4.39Å; L106-W405 HydrophobicContact CG-CZ2 3.43Å; L106-W405 VanDerWaalsContact CG-CZ2 3.43Å; L106-W405 VanDerWaalsContact CG-NE1 3.34Å; L106-W405 PolarHBondContact O-NE1 2.79Å; L110-W405 HydrophobicContact CD1-CH2 4.13Å; L110-W405 HydrophobicContact CD1-CZ2 3.38Å; L110-W405 HydrophobicContact CD2-CD2 4.26Å; L110-W405 HydrophobicContact CD2-CG 4.39Å; L110-W405 HydrophobicContact CD2-CZ2 4.25Å; L110-W405 HydrophobicContact CG-CZ2 3.91Å; V375-W405 HydrophobicContact CG1-CE3 4.42Å; V375-W405 HydrophobicContact CG1-CH2 4.07Å; V375-W405 HydrophobicContact CG1-CZ3 3.84Å; V375-W405 HydrophobicContact CG2-CH2 4.1Å; V401-W405 VanDerWaalsContact O-CB 3.3Å; V401-W405 WeakPolarHBondContact O-CB 3.41Å; V401-W405 PolarHBondContact O-N 3.45Å; S402-W405 PolarHBondContact O-N 3.08Å; A403-W405 VanDerWaalsContact C-N 3.31Å; A403-W405 PolarHBondContact O-N 3.15Å
406H95.7Very high96.9Very high36 Ų3636 Ų3617%0.16717%0.171CC..Hα-helixtrans-69.7-38177.4-71.186.2000113.7R87 S402 A403 Y404 Y412 F416 F464R87-H406 VanDerWaalsContact CZ-O 3.26Å; R87-H406 PolarHBondContact NH2-O 3.17Å; S402-H406 PolarHBondContact O-N 3.45Å; S402-H406 VanDerWaalsContact O-N 3.1Å; S402-H406 PolarHBondContact O-ND1 2.67Å; A403-H406 PolarHBondContact O-N 3.38Å; A403-H406 VanDerWaalsContact O-N 3.1Å; Y404-H406 VanDerWaalsContact C-N 3.31Å; Y404-H406 PolarHBondContact O-N 3.41Å; H406-Y412 HydrophobicContact CB-CD1 3.98Å; H406-Y412 HydrophobicContact CB-CD2 4.35Å; H406-Y412 HydrophobicContact CB-CE1 4.17Å; H406-Y412 HydrophobicContact CB-CG 4.07Å; H406-F416 HydrophobicContact CB-CE2 4.28Å; H406-F416 AromaticContact CE1-CE2 3.77Å; H406-F416 AromaticContact CE1-CZ 3.25Å; H406-F416 WeakPolarHBondContact CE1-CZ 3.42Å; H406-F416 AromaticContact CG-CE2 3.81Å; H406-F416 AromaticContact ND1-CE2 3.36Å; H406-F416 WeakPolarHBondContact ND1-CE2 3.22Å; H406-F416 AromaticContact ND1-CZ 3.35Å; H406-F416 WeakPolarHBondContact ND1-CZ 3.37Å; H406-F416 AromaticContact NE2-CZ 3.89Å; H406-F464 HydrophobicContact CB-CE2 4.34Å; H406-F464 AromaticContact CD2-CE2 3.51Å; H406-F464 AromaticContact CD2-CZ 3.54Å; H406-F464 AromaticContact CG-CE2 3.91Å; H406-F464 AromaticContact NE2-CE2 3.97Å
407G94.1Very high96.9Very high2 Ų235.6 Ų35.62%0.02117%0.168CC..  trans170.3-179.317900000115.4R87 A403 Y404 Y412 Y413R87-G407 VanDerWaalsContact NH1-CA 3.31Å; A403-G407 PolarHBondContact O-N 2.92Å; A403-G407 VanDerWaalsContact O-O 3.11Å; Y404-G407 PolarHBondContact O-N 3.39Å; G407-Y412 VanDerWaalsContact CA-CD2 3.47Å; G407-Y413 WeakPolarHBondContact O-CE2 3.26Å
408L94.7Very high96.9Very high68 Ų6830.2 Ų30.236%0.35615%0.149SC..SBendtrans-100.4-6.1176.9-58.8179.5000112.9R87 T88 Y404R87-L408 HydrophobicContact CB-CD1 4.34Å; T88-L408 HydrophobicContact CG2-CD1 3.6Å; Y404-L408 HydrophobicContact CD2-CD2 3.92Å; Y404-L408 HydrophobicContact CE2-CD2 3.58Å
409H94.7Very high96.9Very high105 Ų10530.5 Ų30.549%0.48615%0.15SC..SBendtrans-65.1138.2175.2-67.8-67.7000111.3G411 Y412 Y413 L467H409-G411 VanDerWaalsContact C-N 3.26Å; H409-G411 PolarHBondContact O-N 2.66Å; H409-Y412 HydrophobicContact CB-CD2 3.94Å; H409-Y412 HydrophobicContact CB-CE2 4.02Å; H409-Y412 PolarHBondContact O-N 2.87Å; H409-Y413 WeakPolarHBondContact O-CD2 3.16Å; H409-L467 HydrophobicContact CB-CB 4.03Å; H409-L467 WeakPolarHBondContact CB-O 3.47Å
410A97Very high96.9Very high32 Ų3231.2 Ų31.226%0.26416%0.155SC..Hα-helixtrans-59.3-35.2-173.500000113.5Y412 Y413 L414 L467 W469A410-Y412 VanDerWaalsContact C-N 3.26Å; A410-Y412 PolarHBondContact O-N 2.95Å; A410-Y413 PolarHBondContact O-N 3.31Å; A410-L414 WeakPolarHBondContact O-CG 3.37Å; A410-L414 PolarHBondContact O-N 3.47Å; A410-L467 PolarHBondContact N-O 3.08Å; A410-W469 HydrophobicContact CB-CB 3.83Å; A410-W469 HydrophobicContact CB-CE3 4.3Å
411G97Very high96.8Very high0 Ų030.5 Ų30.50%015%0.151CC..Hα-helixtrans-55.1-37.3177.900000113.1H409 Y413 L414 S415 G463 L467H409-G411 VanDerWaalsContact C-N 3.26Å; H409-G411 PolarHBondContact O-N 2.66Å; G411-Y413 PolarHBondContact O-N 3.24Å; G411-L414 PolarHBondContact O-N 3.49Å; G411-S415 WeakPolarHBondContact O-CB 3.16Å; G411-S415 PolarHBondContact O-N 3.31Å; G411-S415 PolarHBondContact O-OG 2.56Å; G411-G463 CarbonylContact C-O 3.52Å; G411-G463 WeakPolarHBondContact CA-O 3.5Å; G411-L467 VanDerWaalsContact CA-O 3.3Å; G411-L467 WeakPolarHBondContact CA-O 3.41Å; G411-L467 PolarHBondContact N-O 3.08Å
412Y97.1Very high96.8Very high34 Ų3430.1 Ų30.113%0.13315%0.149CC..Hα-helixtrans-62.2-46.4174.4-62.8-48.9000111.8H406 G407 H409 A410 S415 F416 F464 L467H406-Y412 HydrophobicContact CB-CD1 3.98Å; H406-Y412 HydrophobicContact CB-CD2 4.35Å; H406-Y412 HydrophobicContact CB-CE1 4.17Å; H406-Y412 HydrophobicContact CB-CG 4.07Å; G407-Y412 VanDerWaalsContact CA-CD2 3.47Å; H409-Y412 HydrophobicContact CB-CD2 3.94Å; H409-Y412 HydrophobicContact CB-CE2 4.02Å; H409-Y412 PolarHBondContact O-N 2.87Å; A410-Y412 VanDerWaalsContact C-N 3.26Å; A410-Y412 PolarHBondContact O-N 2.95Å; Y412-S415 PolarHBondContact O-N 3.24Å; Y412-F416 WeakPolarHBondContact O-CD2 3.21Å; Y412-F416 PolarHBondContact O-N 2.87Å; Y412-F464 AromaticContact CD1-CD2 3.59Å; Y412-F464 HydrophobicContact CD1-CD2 3.59Å; Y412-F464 AromaticContact CD1-CE2 3.63Å; Y412-F464 HydrophobicContact CD1-CE2 3.63Å; Y412-F464 HydrophobicContact CD1-CG 4.16Å; Y412-F464 HydrophobicContact CD1-CZ 4.23Å; Y412-F464 HydrophobicContact CE1-CD1 4.28Å; Y412-F464 AromaticContact CE1-CD2 3.88Å; Y412-F464 HydrophobicContact CE1-CD2 3.88Å; Y412-F464 HydrophobicContact CE1-CE1 4.08Å; Y412-F464 AromaticContact CE1-CE2 3.67Å; Y412-F464 HydrophobicContact CE1-CE2 3.67Å; Y412-F464 HydrophobicContact CE1-CG 4.17Å; Y412-F464 AromaticContact CE1-CZ 3.78Å; Y412-F464 HydrophobicContact CE1-CZ 3.78Å; Y412-L467 HydrophobicContact CD1-CD2 4.4Å; Y412-L467 HydrophobicContact CE1-CD2 3.58Å; Y412-L467 HydrophobicContact CE2-CD2 3.86Å; Y412-L467 WeakPolarHBondContact OH-CD2 3.11Å
413Y98.2Very high96.8Very high59 Ų5930.4 Ų30.423%0.23115%0.15CC..Hα-helixtrans-65.3-45.4178.4-64.3-95.4000110.8L400 A403 Y404 G407 H409 A410 G411 S415 F416 L417L400-Y413 HydrophobicContact CD2-CD1 4.43Å; A403-Y413 HydrophobicContact CB-CD1 3.88Å; A403-Y413 HydrophobicContact CB-CE1 4.09Å; A403-Y413 HydrophobicContact CB-CG 4.15Å; Y404-Y413 WeakPolarHBondContact CD2-OH 3.44Å; G407-Y413 WeakPolarHBondContact O-CE2 3.26Å; H409-Y413 WeakPolarHBondContact O-CD2 3.16Å; A410-Y413 PolarHBondContact O-N 3.31Å; G411-Y413 PolarHBondContact O-N 3.24Å; Y413-S415 VanDerWaalsContact C-N 3.3Å; Y413-S415 PolarHBondContact O-N 3.48Å; Y413-F416 PolarHBondContact O-N 2.96Å; Y413-L417 WeakPolarHBondContact O-CB 3.49Å; Y413-L417 WeakPolarHBondContact O-CG 3.45Å; Y413-L417 PolarHBondContact O-N 3.22Å
414L97.2Very high96.7Very high29 Ų2933 Ų3315%0.15217%0.166CC..Hα-helixtrans-54.3-46.8175-72.2175.8000111.1A410 G411 V418 W469 T472 I473 W476A410-L414 WeakPolarHBondContact O-CG 3.37Å; A410-L414 PolarHBondContact O-N 3.47Å; G411-L414 PolarHBondContact O-N 3.49Å; L414-V418 WeakPolarHBondContact O-CG2 3.48Å; L414-V418 PolarHBondContact O-N 3.49Å; L414-W469 HydrophobicContact CD1-CE3 3.85Å; L414-W469 HydrophobicContact CD1-CZ3 4.22Å; L414-W469 HydrophobicContact CD2-CE3 4.18Å; L414-W469 HydrophobicContact CD2-CZ3 3.7Å; L414-W469 HydrophobicContact CG-CE3 4.27Å; L414-W469 HydrophobicContact CG-CZ3 4.27Å; L414-T472 HydrophobicContact CB-CG2 4.46Å; L414-T472 HydrophobicContact CD1-CG2 3.61Å; L414-I473 HydrophobicContact CD1-CD1 4.25Å; L414-I473 HydrophobicContact CD1-CG1 4.47Å; L414-W476 HydrophobicContact CB-CH2 3.74Å; L414-W476 HydrophobicContact CB-CZ3 4.04Å; L414-W476 HydrophobicContact CD2-CZ3 4.13Å; L414-W476 HydrophobicContact CG-CZ3 4.48Å
415S97.2Very high96.7Very high4 Ų429.9 Ų29.93%0.02815%0.154CC..Hα-helixtrans-68.6-48.4-179.5-620000114.2G411 Y412 Y413 C460 G463 F464G411-S415 WeakPolarHBondContact O-CB 3.16Å; G411-S415 PolarHBondContact O-N 3.31Å; G411-S415 PolarHBondContact O-OG 2.56Å; Y412-S415 PolarHBondContact O-N 3.24Å; Y413-S415 VanDerWaalsContact C-N 3.3Å; Y413-S415 PolarHBondContact O-N 3.48Å; S415-C460 VanDerWaalsContact CB-O 3.23Å; S415-C460 WeakPolarHBondContact CB-O 3.15Å; S415-C460 PolarHBondContact O-SG 2.98Å; S415-C460 VanDerWaalsContact O-SG 3.35Å; S415-C460 PolarHBondContact OG-O 3.44Å; S415-G463 WeakPolarHBondContact OG-CA 3.41Å; S415-F464 PolarHBondContact OG-N 2.91Å
416F97Very high96.6Very high33 Ų3330.6 Ų30.615%0.14516%0.157CC..Hα-helixtrans-73.8-31.2-176.2-77.2-69.3000112.4M399 S402 A403 H406 Y412 Y413 V418 I419 P420 F464M399-F416 HydrophobicContact CB-CB 4.38Å; M399-F416 HydrophobicContact SD-CD1 4.26Å; S402-F416 WeakPolarHBondContact OG-CE1 2.9Å; S402-F416 WeakPolarHBondContact OG-CZ 3.49Å; A403-F416 VanDerWaalsContact CA-CD2 3.49Å; A403-F416 HydrophobicContact CB-CB 4Å; A403-F416 HydrophobicContact CB-CD2 3.76Å; A403-F416 HydrophobicContact CB-CG 4.2Å; H406-F416 HydrophobicContact CB-CE2 4.28Å; H406-F416 AromaticContact CE1-CE2 3.77Å; H406-F416 AromaticContact CE1-CZ 3.25Å; H406-F416 WeakPolarHBondContact CE1-CZ 3.42Å; H406-F416 AromaticContact CG-CE2 3.81Å; H406-F416 AromaticContact ND1-CE2 3.36Å; H406-F416 WeakPolarHBondContact ND1-CE2 3.22Å; H406-F416 AromaticContact ND1-CZ 3.35Å; H406-F416 WeakPolarHBondContact ND1-CZ 3.37Å; H406-F416 AromaticContact NE2-CZ 3.89Å; Y412-F416 WeakPolarHBondContact O-CD2 3.21Å; Y412-F416 PolarHBondContact O-N 2.87Å; Y413-F416 PolarHBondContact O-N 2.96Å; F416-V418 VanDerWaalsContact C-N 3.31Å; F416-V418 PolarHBondContact O-N 3.35Å; F416-I419 WeakPolarHBondContact O-CB 3.42Å; F416-I419 PolarHBondContact O-N 3.13Å; F416-P420 VanDerWaalsContact O-CD 3.23Å; F416-P420 WeakPolarHBondContact O-CD 3.23Å; F416-F464 HydrophobicContact CE2-CD2 4Å; F416-F464 AromaticContact CE2-CE2 3.85Å; F416-F464 HydrophobicContact CE2-CE2 3.85Å; F416-F464 HydrophobicContact CZ-CD2 4.29Å; F416-F464 AromaticContact CZ-CE2 3.99Å; F416-F464 HydrophobicContact CZ-CE2 3.99Å
417L96.6Very high96.6Very high65 Ų6531.2 Ų31.234%0.3417%0.169SC..Hα-helixtrans-79.3-12.3-179.8-62.1179.6000113.8L396 L400 Y413 I419 P420L396-L417 HydrophobicContact CD1-CD2 3.62Å; L400-L417 HydrophobicContact CD2-CD1 4.13Å; L400-L417 HydrophobicContact CD2-CD2 3.71Å; L400-L417 HydrophobicContact CD2-CG 4.41Å; L400-L417 HydrophobicContact CG-CD2 3.85Å; Y413-L417 WeakPolarHBondContact O-CB 3.49Å; Y413-L417 WeakPolarHBondContact O-CG 3.45Å; Y413-L417 PolarHBondContact O-N 3.22Å; L417-I419 VanDerWaalsContact C-N 3.3Å; L417-P420 WeakPolarHBondContact O-CD 3.1Å
418V97.3Very high96.7Very high5 Ų531.2 Ų31.23%0.0317%0.168CC..Hα-helixtrans-70.4-28.4165.3172.80000111.3L414 F416 L421 A422 Y459 W476 L487L414-V418 WeakPolarHBondContact O-CG2 3.48Å; L414-V418 PolarHBondContact O-N 3.49Å; F416-V418 VanDerWaalsContact C-N 3.31Å; F416-V418 PolarHBondContact O-N 3.35Å; V418-L421 WeakPolarHBondContact O-CB 3.41Å; V418-L421 PolarHBondContact O-N 2.68Å; V418-A422 WeakPolarHBondContact O-CB 3.01Å; V418-A422 PolarHBondContact O-N 3.25Å; V418-Y459 HydrophobicContact CG2-CE1 4.46Å; V418-W476 HydrophobicContact CG2-CH2 3.91Å; V418-L487 HydrophobicContact CG1-CD1 4.43Å
419I97.2Very high96.7Very high12 Ų1228.6 Ų28.66%0.06216%0.155CC..Hα-helixtrans-62.7-45.7-175.3-59.5-61.6000113.3V364 M368 M399 F416 L417 L421 A422 L423 V456 F457V364-I419 HydrophobicContact CG1-CG2 4.43Å; M368-I419 HydrophobicContact CE-CG2 3.73Å; M368-I419 HydrophobicContact SD-CG2 3.42Å; M368-I419 WeakPolarHBondContact SD-CG2 3.4Å; M399-I419 HydrophobicContact CG-CB 4.33Å; M399-I419 HydrophobicContact CG-CG2 4.38Å; M399-I419 HydrophobicContact SD-CB 4.11Å; M399-I419 HydrophobicContact SD-CG1 4.49Å; M399-I419 HydrophobicContact SD-CG2 3.93Å; F416-I419 WeakPolarHBondContact O-CB 3.42Å; F416-I419 PolarHBondContact O-N 3.13Å; L417-I419 VanDerWaalsContact C-N 3.3Å; I419-L421 VanDerWaalsContact C-N 3.3Å; I419-L421 PolarHBondContact O-N 3.37Å; I419-A422 PolarHBondContact O-N 2.93Å; I419-A422 VanDerWaalsContact O-N 3.17Å; I419-L423 HydrophobicContact CG2-CD1 4.05Å; I419-L423 HydrophobicContact CG2-CG 4.28Å; I419-L423 WeakPolarHBondContact O-CG 3.32Å; I419-L423 PolarHBondContact O-N 3.37Å; I419-V456 HydrophobicContact CD1-CG1 4.49Å; I419-F457 HydrophobicContact CD1-CE1 4.26Å
420P96.9Very high96.6Very high22 Ų2229.6 Ų29.614%0.14316%0.158CC..Hα-helixtrans-55.8-42.8172.6-26.734.7000113.1T395 L396 M399 F416 L417 L423 V424T395-P420 HydrophobicContact CG2-CB 4.45Å; T395-P420 HydrophobicContact CG2-CG 4.32Å; L396-P420 HydrophobicContact CD1-CG 4.19Å; M399-P420 HydrophobicContact CB-CG 4.28Å; M399-P420 HydrophobicContact CG-CG 4.06Å; F416-P420 VanDerWaalsContact O-CD 3.23Å; F416-P420 WeakPolarHBondContact O-CD 3.23Å; L417-P420 WeakPolarHBondContact O-CD 3.1Å; P420-L423 PolarHBondContact O-N 3.43Å; P420-V424 WeakPolarHBondContact O-CG2 3.34Å; P420-V424 PolarHBondContact O-N 3.33Å
421L97.2Very high96.4Very high45 Ų4529.9 Ų29.924%0.23616%0.155CC..Hα-helixtrans-62.6-44.9175.1176.164.4000111V418 I419 L423 V424 G425 L487 I488 I491V418-L421 WeakPolarHBondContact O-CB 3.41Å; V418-L421 PolarHBondContact O-N 2.68Å; I419-L421 VanDerWaalsContact C-N 3.3Å; I419-L421 PolarHBondContact O-N 3.37Å; L421-L423 VanDerWaalsContact C-N 3.33Å; L421-L423 PolarHBondContact O-N 2.98Å; L421-V424 PolarHBondContact O-N 3.13Å; L421-G425 PolarHBondContact O-N 2.99Å; L421-L487 HydrophobicContact CD2-CB 4.32Å; L421-L487 HydrophobicContact CD2-CD1 4.27Å; L421-L487 HydrophobicContact CG-CB 4.15Å; L421-L487 HydrophobicContact CG-CD1 4.15Å; L421-I488 HydrophobicContact CD1-CG1 4.25Å; L421-I488 HydrophobicContact CD2-CG1 4.26Å; L421-I491 HydrophobicContact CD1-CD1 3.63Å
422A97.7Very high96.2Very high1 Ų130.8 Ų30.81%0.00816%0.16CC..Hα-helixtrans-62.5-37.4178.100000112.9V364 V418 I419 V424 G425 E426 V456 L487V364-A422 HydrophobicContact CG2-CB 4.41Å; V418-A422 WeakPolarHBondContact O-CB 3.01Å; V418-A422 PolarHBondContact O-N 3.25Å; I419-A422 PolarHBondContact O-N 2.93Å; I419-A422 VanDerWaalsContact O-N 3.17Å; A422-V424 VanDerWaalsContact C-N 3.34Å; A422-G425 PolarHBondContact O-N 2.94Å; A422-E426 VanDerWaalsContact O-CB 3.22Å; A422-E426 WeakPolarHBondContact O-CB 3.33Å; A422-E426 PolarHBondContact O-N 3.12Å; A422-V456 HydrophobicContact CB-CG1 3.59Å; A422-V456 HydrophobicContact CB-CG2 4.15Å; A422-L487 HydrophobicContact CB-CD1 3.95Å; A422-L487 HydrophobicContact CB-CD2 4.39Å
423L97.1Very high95.8Very high11 Ų1129.7 Ų29.76%0.05816%0.156CC..Hα-helixtrans-68.5-31.8176.4-71.3171.8000112.8V364 R365 T395 I419 P420 L421 A427V364-L423 HydrophobicContact CB-CD2 4.16Å; V364-L423 HydrophobicContact CG1-CD2 3.82Å; V364-L423 HydrophobicContact CG1-CG 4.27Å; R365-L423 HydrophobicContact CB-CD2 3.88Å; T395-L423 HydrophobicContact CG2-CD1 3.59Å; I419-L423 HydrophobicContact CG2-CD1 4.05Å; I419-L423 HydrophobicContact CG2-CG 4.28Å; I419-L423 WeakPolarHBondContact O-CG 3.32Å; I419-L423 PolarHBondContact O-N 3.37Å; P420-L423 PolarHBondContact O-N 3.43Å; L421-L423 VanDerWaalsContact C-N 3.33Å; L421-L423 PolarHBondContact O-N 2.98Å; L423-A427 PolarHBondContact O-N 2.86Å
424V96.5Very high95.3Very high55 Ų5529.4 Ų29.433%0.33316%0.158SC..Hα-helixtrans-73.6-47.1172-179.50000109.8P420 L421 A422 E426 A427 S428 I491P420-V424 WeakPolarHBondContact O-CG2 3.34Å; P420-V424 PolarHBondContact O-N 3.33Å; L421-V424 PolarHBondContact O-N 3.13Å; A422-V424 VanDerWaalsContact C-N 3.34Å; V424-E426 VanDerWaalsContact C-N 3.33Å; V424-E426 PolarHBondContact O-N 3.34Å; V424-A427 WeakPolarHBondContact O-CB 3.37Å; V424-A427 PolarHBondContact O-N 3.46Å; V424-S428 PolarHBondContact O-N 3.34Å; V424-S428 PolarHBondContact O-OG 3.04Å; V424-I491 HydrophobicContact CB-CD1 4.1Å; V424-I491 HydrophobicContact CG1-CD1 3.75Å; V424-I491 HydrophobicContact CG1-CG1 4Å
425G97Very high94.9Very high0 Ų030.9 Ų30.90%017%0.166CC..Hα-helixtrans-61.3-36.6177.700000113.7L421 A422 S428 L429L421-G425 PolarHBondContact O-N 2.99Å; A422-G425 PolarHBondContact O-N 2.94Å; G425-S428 WeakPolarHBondContact O-CB 3.3Å; G425-S428 PolarHBondContact O-N 3.13Å; G425-L429 WeakPolarHBondContact O-CB 3.34Å; G425-L429 PolarHBondContact O-N 2.69Å
426E96.3Very high94.4Very high24 Ų2433.3 Ų33.311%0.11218%0.182CC..Hα-helixtrans-62.3-43.4170.9169.4-177.8101.700112T363 V364 A422 V424 S428 L429 K430T363-E426 VanDerWaalsContact C-OE2 3.29Å; T363-E426 WeakPolarHBondContact CA-OE2 3.21Å; T363-E426 VanDerWaalsContact CB-CD 3.46Å; T363-E426 WeakPolarHBondContact CB-OE2 3.46Å; T363-E426 HydrophobicContact CG2-CG 4.41Å; V364-E426 WeakPolarHBondContact CA-OE2 3.4Å; V364-E426 WeakPolarHBondContact CB-OE2 3.27Å; V364-E426 PolarHBondContact N-OE2 3.32Å; A422-E426 VanDerWaalsContact O-CB 3.22Å; A422-E426 WeakPolarHBondContact O-CB 3.33Å; A422-E426 PolarHBondContact O-N 3.12Å; V424-E426 VanDerWaalsContact C-N 3.33Å; V424-E426 PolarHBondContact O-N 3.34Å; E426-S428 VanDerWaalsContact C-N 3.31Å; E426-L429 PolarHBondContact O-N 3.38Å; E426-K430 WeakPolarHBondContact O-CB 3.08Å; E426-K430 PolarHBondContact O-N 2.84Å
427A95Very high93.7Very high49 Ų4933.3 Ų33.341%0.40519%0.188SC..Hα-helixtrans-64.1-40.717700000110.9L423 V424 K430 N431L423-A427 PolarHBondContact O-N 2.86Å; V424-A427 WeakPolarHBondContact O-CB 3.37Å; V424-A427 PolarHBondContact O-N 3.46Å; A427-K430 PolarHBondContact O-N 3.24Å; A427-N431 VanDerWaalsContact O-CG 3.24Å; A427-N431 PolarHBondContact O-N 3.05Å; A427-N431 PolarHBondContact O-ND2 3.44Å
428S95.7Very high93Very high2 Ų236.6 Ų36.61%0.01421%0.207CC..Hα-helixtrans-61.7-47.6173.3-60.70000111.9V424 G425 E426 K430 N431 L432 E494V424-S428 PolarHBondContact O-N 3.34Å; V424-S428 PolarHBondContact O-OG 3.04Å; G425-S428 WeakPolarHBondContact O-CB 3.3Å; G425-S428 PolarHBondContact O-N 3.13Å; E426-S428 VanDerWaalsContact C-N 3.31Å; S428-K430 VanDerWaalsContact C-N 3.35Å; S428-K430 PolarHBondContact O-N 3.25Å; S428-N431 PolarHBondContact O-N 3.32Å; S428-L432 VanDerWaalsContact O-CG 3.25Å; S428-L432 WeakPolarHBondContact O-CG 3.12Å; S428-L432 PolarHBondContact O-N 3.17Å; S428-E494 VanDerWaalsContact CA-OE2 3.26Å; S428-E494 WeakPolarHBondContact CA-OE2 3.39Å; S428-E494 WeakPolarHBondContact CB-OE2 3.16Å; S428-E494 PolarHBondContact OG-OE2 3.27Å
429L95.2Very high92.6Very high14 Ų1441.6 Ų41.67%0.07324%0.241CC..Hα-helixtrans-55.4-50.4174.5176.764.2000110.7G425 E426 N431 L432 M433 I448 L452 L490G425-L429 WeakPolarHBondContact O-CB 3.34Å; G425-L429 PolarHBondContact O-N 2.69Å; E426-L429 PolarHBondContact O-N 3.38Å; L429-N431 VanDerWaalsContact C-N 3.29Å; L429-N431 PolarHBondContact O-N 3.4Å; L429-L432 WeakPolarHBondContact O-CB 3.47Å; L429-L432 PolarHBondContact O-N 3.39Å; L429-L432 VanDerWaalsContact O-N 3.16Å; L429-M433 HydrophobicContact CD1-CG 3.78Å; L429-M433 HydrophobicContact CD1-SD 3.87Å; L429-M433 HydrophobicContact CD2-SD 4.39Å; L429-M433 HydrophobicContact CG-CG 4.12Å; L429-M433 HydrophobicContact CG-SD 3.94Å; L429-M433 WeakPolarHBondContact O-CB 3.46Å; L429-M433 VanDerWaalsContact O-CG 3.23Å; L429-M433 WeakPolarHBondContact O-CG 3.48Å; L429-M433 PolarHBondContact O-N 2.92Å; L429-I448 HydrophobicContact CD1-CG2 4.17Å; L429-I448 HydrophobicContact CD2-CG2 4.19Å; L429-L452 HydrophobicContact CB-CD2 4.38Å; L429-L452 HydrophobicContact CD2-CB 4.22Å; L429-L452 HydrophobicContact CD2-CD2 3.61Å; L429-L490 HydrophobicContact CB-CD1 4.23Å; L429-L490 HydrophobicContact CB-CD2 4.42Å; L429-L490 HydrophobicContact CD1-CD2 4.02Å
430K92.5Very high92.1Very high125 Ų12543.8 Ų43.854%0.54325%0.253SS..Hα-helixtrans-56.5-44.1178.7-177176.2-179.81740111.9E426 A427 S428 M433 N434E426-K430 WeakPolarHBondContact O-CB 3.08Å; E426-K430 PolarHBondContact O-N 2.84Å; A427-K430 PolarHBondContact O-N 3.24Å; S428-K430 VanDerWaalsContact C-N 3.35Å; S428-K430 PolarHBondContact O-N 3.25Å; K430-M433 PolarHBondContact O-N 3.45Å; K430-N434 PolarHBondContact O-N 2.99Å; K430-N434 PolarHBondContact O-ND2 2.85Å
431N91.9Very high91.8Very high39 Ų3947.3 Ų47.321%0.20928%0.276CS..Hα-helixtrans-64.9-41.3178.5-69.6-25.1000112.2A427 S428 L429 N434 E494 R498 F506A427-N431 VanDerWaalsContact O-CG 3.24Å; A427-N431 PolarHBondContact O-N 3.05Å; A427-N431 PolarHBondContact O-ND2 3.44Å; S428-N431 PolarHBondContact O-N 3.32Å; L429-N431 VanDerWaalsContact C-N 3.29Å; L429-N431 PolarHBondContact O-N 3.4Å; N431-N434 PolarHBondContact O-N 2.97Å; N431-E494 HydrophobicContact CB-CG 4.29Å; N431-E494 PolarHBondContact ND2-OE1 2.76Å; N431-R498 PolarHBondContact ND2-NH2 3.33Å; N431-R498 VanDerWaalsContact ND2-NH2 3.13Å; N431-F506 HydrophobicContact CB-CD1 4.42Å
432L92.8Very high91.4Very high18 Ų1852.5 Ų52.59%0.09431%0.31CS..Hα-helixtrans-64-45.9175.5-69.5168.6000111.7S428 L429 N434 L435 L490 F493 E494 L497S428-L432 VanDerWaalsContact O-CG 3.25Å; S428-L432 WeakPolarHBondContact O-CG 3.12Å; S428-L432 PolarHBondContact O-N 3.17Å; L429-L432 WeakPolarHBondContact O-CB 3.47Å; L429-L432 PolarHBondContact O-N 3.39Å; L429-L432 VanDerWaalsContact O-N 3.16Å; L432-N434 VanDerWaalsContact C-N 3.27Å; L432-N434 PolarHBondContact O-N 2.89Å; L432-L435 VanDerWaalsContact O-CB 3.27Å; L432-L435 WeakPolarHBondContact O-CB 3.27Å; L432-L435 PolarHBondContact O-N 3.01Å; L432-L490 HydrophobicContact CD1-CD2 3.87Å; L432-F493 HydrophobicContact CD1-CD1 3.79Å; L432-F493 HydrophobicContact CD2-CD1 3.57Å; L432-F493 HydrophobicContact CD2-CE1 3.78Å; L432-F493 HydrophobicContact CG-CD1 4.32Å; L432-E494 HydrophobicContact CD1-CB 4.33Å; L432-E494 HydrophobicContact CD2-CB 4.15Å; L432-E494 HydrophobicContact CG-CB 4.12Å; L432-E494 HydrophobicContact CG-CG 4.46Å; L432-L497 HydrophobicContact CD2-CD1 3.54Å
433M90.1Very high91Very high11 Ų1154.5 Ų54.55%0.05433%0.33CS..Hα-helixtrans-65.2-31.8179.7-66.6-163.886.700112.4L429 K430 L435 C436 A437 L440 V445 I448L429-M433 HydrophobicContact CD1-CG 3.78Å; L429-M433 HydrophobicContact CD1-SD 3.87Å; L429-M433 HydrophobicContact CD2-SD 4.39Å; L429-M433 HydrophobicContact CG-CG 4.12Å; L429-M433 HydrophobicContact CG-SD 3.94Å; L429-M433 WeakPolarHBondContact O-CB 3.46Å; L429-M433 VanDerWaalsContact O-CG 3.23Å; L429-M433 WeakPolarHBondContact O-CG 3.48Å; L429-M433 PolarHBondContact O-N 2.92Å; K430-M433 PolarHBondContact O-N 3.45Å; M433-L435 PolarHBondContact O-N 2.77Å; M433-C436 CarbonylContact O-C 3.58Å; M433-C436 PolarHBondContact O-N 2.98Å; M433-A437 WeakPolarHBondContact O-CA 3.16Å; M433-A437 WeakPolarHBondContact O-CB 3.33Å; M433-A437 PolarHBondContact O-N 2.97Å; M433-L440 HydrophobicContact CE-CD1 3.99Å; M433-V445 HydrophobicContact CB-CG1 4.11Å; M433-V445 HydrophobicContact CB-CG2 4.26Å; M433-V445 HydrophobicContact CE-CB 4.07Å; M433-V445 HydrophobicContact CE-CG1 4.3Å; M433-V445 HydrophobicContact CE-CG2 3.95Å; M433-V445 HydrophobicContact SD-CB 4.25Å; M433-V445 HydrophobicContact SD-CG1 3.84Å; M433-V445 HydrophobicContact SD-CG2 4.5Å; M433-I448 HydrophobicContact CE-CB 3.76Å; M433-I448 HydrophobicContact CE-CD1 3.44Å; M433-I448 VanDerWaalsContact CE-CD1 3.44Å; M433-I448 HydrophobicContact CE-CG1 4.11Å; M433-I448 HydrophobicContact CE-CG2 4.07Å; M433-I448 HydrophobicContact SD-CB 4.05Å; M433-I448 HydrophobicContact SD-CG2 3.99Å
434N87.3Confident90.7Very high53 Ų5355.2 Ų55.228%0.28334%0.336SS..Hα-helixtrans-64-22174-73.2-19.2000113.4K430 N431 L432 C436K430-N434 PolarHBondContact O-N 2.99Å; K430-N434 PolarHBondContact O-ND2 2.85Å; N431-N434 PolarHBondContact O-N 2.97Å; L432-N434 VanDerWaalsContact C-N 3.27Å; L432-N434 PolarHBondContact O-N 2.89Å; N434-C436 VanDerWaalsContact C-N 3.33Å
435L87.8Confident90.5Very high60 Ų6054.5 Ų54.531%0.31433%0.332SS..Hα-helixtrans-71.8-28.9175.9-59.4176.2000112.3L432 M433 L497 L501 A505 F506L432-L435 VanDerWaalsContact O-CB 3.27Å; L432-L435 WeakPolarHBondContact O-CB 3.27Å; L432-L435 PolarHBondContact O-N 3.01Å; M433-L435 PolarHBondContact O-N 2.77Å; L435-L497 HydrophobicContact CD1-CD1 3.91Å; L435-L501 HydrophobicContact CD1-CD1 4.11Å; L435-A505 HydrophobicContact CD2-CB 4.35Å; L435-A505 VanDerWaalsContact CD2-O 3.23Å; L435-A505 WeakPolarHBondContact CD2-O 3.25Å; L435-F506 HydrophobicContact CD1-CD1 4.37Å; L435-F506 HydrophobicContact CD1-CE1 3.81Å; L435-F506 HydrophobicContact CD1-CZ 4.16Å; L435-F506 HydrophobicContact CD2-CD1 3.95Å; L435-F506 HydrophobicContact CD2-CE1 4.18Å; L435-F506 HydrophobicContact CD2-CG 4.2Å; L435-F506 HydrophobicContact CG-CD1 4.35Å; L435-F506 HydrophobicContact CG-CE1 4.29Å
436C87.1Confident90.3Very high55 Ų5557.6 Ų57.637%0.37235%0.354SS..Hα-helixtrans-1198.3-177.657.20000113.6M433 N434 D438 S439 L440M433-C436 CarbonylContact O-C 3.58Å; M433-C436 PolarHBondContact O-N 2.98Å; N434-C436 VanDerWaalsContact C-N 3.33Å; C436-D438 PolarHBondContact O-N 2.7Å; C436-S439 PolarHBondContact O-N 3.13Å; C436-L440 PolarHBondContact O-N 2.79Å
437A81.9Confident90.2Very high33 Ų3362.3 Ų62.327%0.27337%0.374SS..G310 helixtrans-56.4-38.8-173.900000112.7M433 S439 L440M433-A437 WeakPolarHBondContact O-CA 3.16Å; M433-A437 WeakPolarHBondContact O-CB 3.33Å; M433-A437 PolarHBondContact O-N 2.97Å; A437-S439 PolarHBondContact O-N 2.76Å; A437-L440 PolarHBondContact O-N 2.57Å
438D82.2Confident90.2Very high135 Ų13563.2 Ų63.272%0.72237%0.371SS*.G310 helixtrans-69.1-16-179.6-57.7-32.9000112.5C436 K507C436-D438 PolarHBondContact O-N 2.7Å; D438-K507 IonicContact OD1-NZ 2.72Å; D438-K507 IonicContact OD2-NZ 2.89Å; D438-K507 PolarHBondContact OD2-NZ 3.26Å
439S88.7Confident90.2Very high109 Ų10963.7 Ų63.776%0.76238%0.375SS*.G310 helixtrans-102.9-5.7-179.9-51.60000113.7C436 A437C436-S439 PolarHBondContact O-N 3.13Å; A437-S439 PolarHBondContact O-N 2.76Å
440L87.7Confident90.3Very high58 Ų5866.1 Ų66.130%0.30438%0.383SS..SBendtrans-97.9146-177.6-71.3171.6000111M433 C436 A437 V445M433-L440 HydrophobicContact CE-CD1 3.99Å; C436-L440 PolarHBondContact O-N 2.79Å; A437-L440 PolarHBondContact O-N 2.57Å; L440-V445 HydrophobicContact CD1-CG2 4.44Å
441P90.1Very high90.5Very high96 Ų9663.2 Ų63.262%0.62337%0.373SS*.PPolyproline II helixtrans-55.2145.1170.5-23.932.4000111.9G443 S444P441-G443 PolarHBondContact O-N 3.27Å; P441-S444 WeakPolarHBondContact CD-OG 3.37Å; P441-S444 VanDerWaalsContact O-CB 3.25Å; P441-S444 WeakPolarHBondContact O-CB 3.31Å; P441-S444 PolarHBondContact O-N 3.44Å; P441-S444 PolarHBondContact O-OG 2.89Å
442T88.7Confident90.8Very high154 Ų15462.4 Ų62.495%0.94537%0.368SS*.THydrogen-bonded Turntrans-50.6129.3177.2-52.50000111.1
443G89.5Confident91Very high43 Ų4361.6 Ų61.644%0.44336%0.364SS..THydrogen-bonded Turntrans88.8-10.718000000115.6P441 V445 S446 F447P441-G443 PolarHBondContact O-N 3.27Å; G443-V445 VanDerWaalsContact C-N 3.27Å; G443-V445 PolarHBondContact O-N 3.17Å; G443-S446 PolarHBondContact O-N 3.48Å; G443-S446 VanDerWaalsContact O-N 3.14Å; G443-F447 PolarHBondContact O-N 3.46Å
444S91.3Very high91.3Very high26 Ų2661.6 Ų61.618%0.18236%0.364CS..Hα-helixtrans-57.9-38.5179.2-57.10000112.8P441 F447 I448P441-S444 WeakPolarHBondContact CD-OG 3.37Å; P441-S444 VanDerWaalsContact O-CB 3.25Å; P441-S444 WeakPolarHBondContact O-CB 3.31Å; P441-S444 PolarHBondContact O-N 3.44Å; P441-S444 PolarHBondContact O-OG 2.89Å; S444-F447 PolarHBondContact O-N 3.24Å; S444-I448 WeakPolarHBondContact O-CB 3.11Å; S444-I448 WeakPolarHBondContact O-CG1 3.26Å; S444-I448 PolarHBondContact O-N 3.36Å
445V91Very high91.8Very high40 Ų4061.5 Ų61.524%0.24236%0.36CS..Hα-helixtrans-59.4-48.9176.2-177.20000111.8M433 L440 G443 S449M433-V445 HydrophobicContact CB-CG1 4.11Å; M433-V445 HydrophobicContact CB-CG2 4.26Å; M433-V445 HydrophobicContact CE-CB 4.07Å; M433-V445 HydrophobicContact CE-CG1 4.3Å; M433-V445 HydrophobicContact CE-CG2 3.95Å; M433-V445 HydrophobicContact SD-CB 4.25Å; M433-V445 HydrophobicContact SD-CG1 3.84Å; M433-V445 HydrophobicContact SD-CG2 4.5Å; L440-V445 HydrophobicContact CD1-CG2 4.44Å; G443-V445 VanDerWaalsContact C-N 3.27Å; G443-V445 PolarHBondContact O-N 3.17Å; V445-S449 VanDerWaalsContact O-CB 3.31Å; V445-S449 WeakPolarHBondContact O-CB 3.37Å; V445-S449 PolarHBondContact O-N 3.35Å; V445-S449 PolarHBondContact O-OG 2.81Å
446S92.7Very high92.3Very high65 Ų6558.7 Ų58.746%0.45535%0.345SS..Hα-helixtrans-65.5-42.3178.6-56.80000111.5P362 G443 W450P362-S446 WeakPolarHBondContact CB-O 3.28Å; G443-S446 PolarHBondContact O-N 3.48Å; G443-S446 VanDerWaalsContact O-N 3.14Å; S446-W450 WeakPolarHBondContact O-CB 3.44Å; S446-W450 PolarHBondContact O-N 3.37Å
447F95Very high92.8Very high123 Ų12357.6 Ų57.654%0.53933%0.334SS..Hα-helixtrans-65.4-45.3179.5178.6-104.8000112.7G443 S444 W450 L451G443-F447 PolarHBondContact O-N 3.46Å; S444-F447 PolarHBondContact O-N 3.24Å; F447-W450 HydrophobicContact CD2-CE3 4.06Å; F447-W450 HydrophobicContact CD2-CZ3 4.41Å; F447-W450 AromaticContact CE2-CE3 3.97Å; F447-W450 HydrophobicContact CE2-CE3 3.97Å; F447-W450 AromaticContact CE2-CZ3 3.88Å; F447-W450 HydrophobicContact CE2-CZ3 3.88Å; F447-W450 WeakPolarHBondContact O-CB 3.45Å; F447-W450 PolarHBondContact O-N 2.91Å; F447-L451 WeakPolarHBondContact O-CB 3.35Å; F447-L451 PolarHBondContact O-N 2.83Å
448I95.4Very high93.5Very high69 Ų6956.2 Ų56.235%0.35432%0.322SS..Hα-helixtrans-66.6-42.2178.6-68.8168.2000110.5L429 M433 S444 W450 L451 L452L429-I448 HydrophobicContact CD1-CG2 4.17Å; L429-I448 HydrophobicContact CD2-CG2 4.19Å; M433-I448 HydrophobicContact CE-CB 3.76Å; M433-I448 HydrophobicContact CE-CD1 3.44Å; M433-I448 VanDerWaalsContact CE-CD1 3.44Å; M433-I448 HydrophobicContact CE-CG1 4.11Å; M433-I448 HydrophobicContact CE-CG2 4.07Å; M433-I448 HydrophobicContact SD-CB 4.05Å; M433-I448 HydrophobicContact SD-CG2 3.99Å; S444-I448 WeakPolarHBondContact O-CB 3.11Å; S444-I448 WeakPolarHBondContact O-CG1 3.26Å; S444-I448 PolarHBondContact O-N 3.36Å; I448-W450 VanDerWaalsContact C-N 3.33Å; I448-W450 PolarHBondContact O-N 3.48Å; I448-L451 PolarHBondContact O-N 3.36Å; I448-L452 PolarHBondContact O-N 3.43Å
449S95.8Very high94.3Very high12 Ų1249.8 Ų49.88%0.08429%0.288CS..Hα-helixtrans-60.6-45.5174.5-57.80000111P362 V445 L451 L452 K453P362-S449 CarbonylContact O-C 3.59Å; P362-S449 VanDerWaalsContact O-CB 3.27Å; P362-S449 WeakPolarHBondContact O-CB 3.25Å; V445-S449 VanDerWaalsContact O-CB 3.31Å; V445-S449 WeakPolarHBondContact O-CB 3.37Å; V445-S449 PolarHBondContact O-N 3.35Å; V445-S449 PolarHBondContact O-OG 2.81Å; S449-L451 VanDerWaalsContact C-N 3.34Å; S449-L451 PolarHBondContact O-N 3.02Å; S449-L452 PolarHBondContact O-N 3.39Å; S449-K453 WeakPolarHBondContact O-CB 3.29Å; S449-K453 PolarHBondContact O-N 2.95Å
450W97.4Very high94.7Very high64 Ų6445.1 Ų45.124%0.24226%0.255CS..Hα-helixtrans-59.4-44.9177.2172.885.6000111.8E359 P362 S446 F447 I448 K453 M454E359-W450 PolarHBondContact O-NE1 3.34Å; P362-W450 HydrophobicContact CB-CB 4.47Å; P362-W450 WeakPolarHBondContact O-CA 3.3Å; P362-W450 PolarHBondContact O-N 3.19Å; S446-W450 WeakPolarHBondContact O-CB 3.44Å; S446-W450 PolarHBondContact O-N 3.37Å; F447-W450 HydrophobicContact CD2-CE3 4.06Å; F447-W450 HydrophobicContact CD2-CZ3 4.41Å; F447-W450 AromaticContact CE2-CE3 3.97Å; F447-W450 HydrophobicContact CE2-CE3 3.97Å; F447-W450 AromaticContact CE2-CZ3 3.88Å; F447-W450 HydrophobicContact CE2-CZ3 3.88Å; F447-W450 WeakPolarHBondContact O-CB 3.45Å; F447-W450 PolarHBondContact O-N 2.91Å; I448-W450 VanDerWaalsContact C-N 3.33Å; I448-W450 PolarHBondContact O-N 3.48Å; W450-K453 PolarHBondContact O-N 2.9Å; W450-M454 HydrophobicContact CD2-CG 4.16Å; W450-M454 HydrophobicContact CH2-CG 4.44Å; W450-M454 HydrophobicContact CZ2-CG 3.86Å; W450-M454 WeakPolarHBondContact O-CG 3.37Å; W450-M454 PolarHBondContact O-N 2.97Å
451L96.8Very high95.2Very high65 Ų6542.7 Ų42.734%0.3424%0.243SC..Hα-helixtrans-61.5-47.3178.3-175.965.8000110.8F447 I448 S449 K453 M454 R455F447-L451 WeakPolarHBondContact O-CB 3.35Å; F447-L451 PolarHBondContact O-N 2.83Å; I448-L451 PolarHBondContact O-N 3.36Å; S449-L451 VanDerWaalsContact C-N 3.34Å; S449-L451 PolarHBondContact O-N 3.02Å; L451-K453 PolarHBondContact O-N 3.38Å; L451-M454 PolarHBondContact O-N 3.03Å; L451-R455 WeakPolarHBondContact O-CG 3.44Å; L451-R455 PolarHBondContact O-N 2.9Å
452L97.4Very high95.5Very high21 Ų2138.1 Ų38.111%0.1121%0.213CC..Hα-helixtrans-57.9-49.2175177.864.6000110.8L429 I448 S449 M454 R455 V456 I486 L487 L490L429-L452 HydrophobicContact CB-CD2 4.38Å; L429-L452 HydrophobicContact CD2-CB 4.22Å; L429-L452 HydrophobicContact CD2-CD2 3.61Å; I448-L452 PolarHBondContact O-N 3.43Å; S449-L452 PolarHBondContact O-N 3.39Å; L452-M454 VanDerWaalsContact C-N 3.34Å; L452-M454 PolarHBondContact O-N 3.48Å; L452-R455 PolarHBondContact O-N 3.44Å; L452-V456 HydrophobicContact CD1-CG2 4.32Å; L452-V456 HydrophobicContact CG-CG2 4.46Å; L452-V456 WeakPolarHBondContact O-CG2 3.47Å; L452-V456 PolarHBondContact O-N 3.45Å; L452-I486 HydrophobicContact CD1-CG2 3.88Å; L452-L487 HydrophobicContact CD1-CD2 4.05Å; L452-L487 HydrophobicContact CD2-CD2 4.26Å; L452-L487 HydrophobicContact CG-CD2 4.48Å; L452-L490 HydrophobicContact CD1-CD1 4.47Å; L452-L490 HydrophobicContact CD2-CD1 3.83Å
453K97.1Very high95.9Very high1 Ų130.8 Ų30.80%0.00417%0.168CC..Hα-helixtrans-56.4-45.7178.3170.9-85.3-54.2-168.40112C358 E359 A361 V364 S367 S449 W450 L451 V456 F457C358-K453 PolarHBondContact O-NZ 3.4Å; E359-K453 PolarHBondContact O-NZ 3.09Å; A361-K453 WeakPolarHBondContact O-CE 3.49Å; A361-K453 PolarHBondContact O-NZ 3.49Å; V364-K453 HydrophobicContact CB-CG 4.45Å; V364-K453 HydrophobicContact CG2-CB 3.92Å; V364-K453 HydrophobicContact CG2-CG 3.91Å; S367-K453 WeakPolarHBondContact OG-CD 3.37Å; S449-K453 WeakPolarHBondContact O-CB 3.29Å; S449-K453 PolarHBondContact O-N 2.95Å; W450-K453 PolarHBondContact O-N 2.9Å; L451-K453 PolarHBondContact O-N 3.38Å; K453-V456 PolarHBondContact O-N 3.2Å; K453-F457 HydrophobicContact CD-CD2 3.98Å; K453-F457 HydrophobicContact CD-CE2 4.03Å; K453-F457 HydrophobicContact CD-CG 4.45Å; K453-F457 HydrophobicContact CG-CE2 4.4Å; K453-F457 HydrophobicContact CG-CZ 4.4Å; K453-F457 PolarHBondContact O-N 2.86Å
454M97.4Very high96.2Very high11 Ų1130.8 Ų30.85%0.05416%0.156CC..Hα-helixtrans-62.1-46.2179.2-72.5-61.2-75.900111.3F244 W450 L451 L452 V456 F457 E458F244-M454 HydrophobicContact CE1-CE 4.31Å; W450-M454 HydrophobicContact CD2-CG 4.16Å; W450-M454 HydrophobicContact CH2-CG 4.44Å; W450-M454 HydrophobicContact CZ2-CG 3.86Å; W450-M454 WeakPolarHBondContact O-CG 3.37Å; W450-M454 PolarHBondContact O-N 2.97Å; L451-M454 PolarHBondContact O-N 3.03Å; L452-M454 VanDerWaalsContact C-N 3.34Å; L452-M454 PolarHBondContact O-N 3.48Å; M454-V456 VanDerWaalsContact C-N 3.32Å; M454-V456 PolarHBondContact O-N 2.86Å; M454-F457 PolarHBondContact O-N 3.27Å; M454-E458 WeakPolarHBondContact O-CB 3.48Å; M454-E458 VanDerWaalsContact O-CD 3.29Å; M454-E458 WeakPolarHBondContact O-CG 3.29Å; M454-E458 PolarHBondContact O-N 3.29Å
455R97.4Very high96.4Very high52 Ų5231.2 Ų31.220%0.19616%0.156CC..Hα-helixtrans-60.3-40.4176.3-66.1-57.487.796-0.9112.6M241 L451 L452 E458 Y459 I483M241-R455 PolarHBondContact SD-NH2 3.07Å; L451-R455 WeakPolarHBondContact O-CG 3.44Å; L451-R455 PolarHBondContact O-N 2.9Å; L452-R455 PolarHBondContact O-N 3.44Å; R455-E458 IonicContact CZ-OE1 3.73Å; R455-E458 IonicContact CZ-OE2 3.67Å; R455-E458 VanDerWaalsContact CZ-OE2 3.26Å; R455-E458 IonicContact NE-OE1 3.64Å; R455-E458 IonicContact NE-OE2 3.79Å; R455-E458 PolarHBondContact NE-OE2 3.15Å; R455-E458 VanDerWaalsContact NH2-CD 3.3Å; R455-E458 IonicContact NH2-OE1 3.6Å; R455-E458 PolarHBondContact NH2-OE1 3.46Å; R455-E458 IonicContact NH2-OE2 2.72Å; R455-E458 PolarHBondContact NH2-OE2 3.18Å; R455-E458 VanDerWaalsContact NH2-OE2 3.08Å; R455-Y459 WeakPolarHBondContact O-CB 3.21Å; R455-Y459 PolarHBondContact O-N 3.3Å; R455-I483 HydrophobicContact CB-CD1 3.71Å; R455-I483 HydrophobicContact CG-CD1 4.47Å
456V97.9Very high96.7Very high0 Ų029.4 Ų29.40%015%0.145CC..Hα-helixtrans-61.9-48.2175.1170.60000111V364 I419 A422 L452 K453 M454 Y459 C460 I483 L487V364-V456 HydrophobicContact CG2-CG1 4.43Å; I419-V456 HydrophobicContact CD1-CG1 4.49Å; A422-V456 HydrophobicContact CB-CG1 3.59Å; A422-V456 HydrophobicContact CB-CG2 4.15Å; L452-V456 HydrophobicContact CD1-CG2 4.32Å; L452-V456 HydrophobicContact CG-CG2 4.46Å; L452-V456 WeakPolarHBondContact O-CG2 3.47Å; L452-V456 PolarHBondContact O-N 3.45Å; K453-V456 PolarHBondContact O-N 3.2Å; M454-V456 VanDerWaalsContact C-N 3.32Å; M454-V456 PolarHBondContact O-N 2.86Å; V456-Y459 PolarHBondContact O-N 3.02Å; V456-C460 WeakPolarHBondContact O-CB 3.48Å; V456-C460 PolarHBondContact O-N 3.07Å; V456-C460 PolarHBondContact O-SG 2.94Å; V456-I483 HydrophobicContact CG2-CG2 3.87Å; V456-L487 HydrophobicContact CG2-CD1 4.17Å; V456-L487 HydrophobicContact CG2-CD2 4.15Å; V456-L487 HydrophobicContact CG2-CG 4.48Å
457F97.6Very high96.7Very high32 Ų3228.7 Ų28.714%0.1414%0.136CC..Hα-helixtrans-67.4-40.1-176.5-796.7000113.2F244 V364 S367 M368 I419 K453 M454 Y459 C460 C461F244-F457 HydrophobicContact CE1-CB 3.87Å; F244-F457 HydrophobicContact CE2-CB 4.28Å; F244-F457 HydrophobicContact CZ-CB 3.57Å; F244-F457 HydrophobicContact CZ-CD2 4.17Å; F244-F457 HydrophobicContact CZ-CG 4.37Å; V364-F457 HydrophobicContact CB-CE1 4.35Å; V364-F457 HydrophobicContact CG1-CE1 3.8Å; V364-F457 HydrophobicContact CG1-CZ 4.32Å; V364-F457 HydrophobicContact CG2-CE1 4.33Å; S367-F457 VanDerWaalsContact CB-CE2 3.45Å; M368-F457 HydrophobicContact CG-CE1 4.41Å; M368-F457 HydrophobicContact CG-CZ 4Å; I419-F457 HydrophobicContact CD1-CE1 4.26Å; K453-F457 HydrophobicContact CD-CD2 3.98Å; K453-F457 HydrophobicContact CD-CE2 4.03Å; K453-F457 HydrophobicContact CD-CG 4.45Å; K453-F457 HydrophobicContact CG-CE2 4.4Å; K453-F457 HydrophobicContact CG-CZ 4.4Å; K453-F457 PolarHBondContact O-N 2.86Å; M454-F457 PolarHBondContact O-N 3.27Å; F457-Y459 VanDerWaalsContact C-N 3.33Å; F457-C460 PolarHBondContact O-N 3.4Å; F457-C461 VanDerWaalsContact O-CB 3.23Å; F457-C461 WeakPolarHBondContact O-CB 3.26Å; F457-C461 PolarHBondContact O-N 3.25Å
458E97.5Very high96.7Very high5 Ų525.3 Ų25.32%0.02312%0.123CC..Hα-helixtrans-60.1-45.9173.6-71.2163.4-178.300111.2M240 M241 F244 M454 R455 C461 M462M240-E458 HydrophobicContact CE-CB 3.75Å; M240-E458 HydrophobicContact CG-CB 3.65Å; M240-E458 HydrophobicContact SD-CB 3.99Å; M241-E458 WeakPolarHBondContact CG-OE2 3.47Å; F244-E458 HydrophobicContact CB-CB 4.25Å; F244-E458 HydrophobicContact CB-CG 3.76Å; F244-E458 HydrophobicContact CD1-CB 4.29Å; F244-E458 HydrophobicContact CD1-CG 3.3Å; F244-E458 HydrophobicContact CE1-CG 4.12Å; F244-E458 HydrophobicContact CG-CB 4.39Å; F244-E458 HydrophobicContact CG-CG 3.77Å; M454-E458 WeakPolarHBondContact O-CB 3.48Å; M454-E458 VanDerWaalsContact O-CD 3.29Å; M454-E458 WeakPolarHBondContact O-CG 3.29Å; M454-E458 PolarHBondContact O-N 3.29Å; R455-E458 IonicContact CZ-OE1 3.73Å; R455-E458 IonicContact CZ-OE2 3.67Å; R455-E458 VanDerWaalsContact CZ-OE2 3.26Å; R455-E458 IonicContact NE-OE1 3.64Å; R455-E458 IonicContact NE-OE2 3.79Å; R455-E458 PolarHBondContact NE-OE2 3.15Å; R455-E458 VanDerWaalsContact NH2-CD 3.3Å; R455-E458 IonicContact NH2-OE1 3.6Å; R455-E458 PolarHBondContact NH2-OE1 3.46Å; R455-E458 IonicContact NH2-OE2 2.72Å; R455-E458 PolarHBondContact NH2-OE2 3.18Å; R455-E458 VanDerWaalsContact NH2-OE2 3.08Å; E458-C461 WeakPolarHBondContact O-CB 3.34Å; E458-C461 PolarHBondContact O-N 3.07Å; E458-C461 VanDerWaalsContact O-N 3.15Å; E458-M462 WeakPolarHBondContact O-CG 3.4Å; E458-M462 PolarHBondContact O-N 3.39Å; E458-M462 VanDerWaalsContact O-N 3.08Å
459Y97.6Very high96.7Very high0 Ų029 Ų290%013%0.133CC..Hα-helixtrans-62.3-44.6177.6-174.2-96.2000112.7M240 V418 R455 V456 F457 C461 M462 W476 I479 I483 H484M240-Y459 WeakPolarHBondContact SD-CA 3.45Å; M240-Y459 PolarHBondContact SD-N 3.36Å; V418-Y459 HydrophobicContact CG2-CE1 4.46Å; R455-Y459 WeakPolarHBondContact O-CB 3.21Å; R455-Y459 PolarHBondContact O-N 3.3Å; V456-Y459 PolarHBondContact O-N 3.02Å; F457-Y459 VanDerWaalsContact C-N 3.33Å; Y459-C461 VanDerWaalsContact C-N 3.34Å; Y459-M462 PolarHBondContact O-N 3.32Å; Y459-W476 AromaticContact CD1-CE2 3.89Å; Y459-W476 HydrophobicContact CD1-CH2 4.42Å; Y459-W476 AromaticContact CD1-CZ2 3.81Å; Y459-W476 HydrophobicContact CD1-CZ2 3.81Å; Y459-W476 AromaticContact CD2-CD1 3.89Å; Y459-W476 AromaticContact CD2-NE1 3.81Å; Y459-W476 AromaticContact CE1-CD2 3.67Å; Y459-W476 HydrophobicContact CE1-CD2 3.67Å; Y459-W476 AromaticContact CE1-CE2 3.36Å; Y459-W476 AromaticContact CE1-CE3 4Å; Y459-W476 HydrophobicContact CE1-CE3 4Å; Y459-W476 HydrophobicContact CE1-CG 4.24Å; Y459-W476 AromaticContact CE1-CH2 3.76Å; Y459-W476 HydrophobicContact CE1-CH2 3.76Å; Y459-W476 AromaticContact CE1-CZ2 3.43Å; Y459-W476 HydrophobicContact CE1-CZ2 3.43Å; Y459-W476 VanDerWaalsContact CE1-CZ2 3.43Å; Y459-W476 HydrophobicContact CE1-CZ3 4.03Å; Y459-W476 AromaticContact CE1-NE1 3.78Å; Y459-W476 HydrophobicContact CE2-CB 4.17Å; Y459-W476 AromaticContact CE2-CD1 3.33Å; Y459-W476 AromaticContact CE2-CD2 3.94Å; Y459-W476 HydrophobicContact CE2-CD2 3.94Å; Y459-W476 AromaticContact CE2-CE2 3.93Å; Y459-W476 AromaticContact CE2-CG 3.59Å; Y459-W476 HydrophobicContact CE2-CG 3.59Å; Y459-W476 AromaticContact CE2-NE1 3.56Å; Y459-W476 AromaticContact CZ-CD1 3.54Å; Y459-W476 AromaticContact CZ-CD2 3.28Å; Y459-W476 AromaticContact CZ-CE2 3.38Å; Y459-W476 AromaticContact CZ-CE3 3.79Å; Y459-W476 AromaticContact CZ-CG 3.41Å; Y459-W476 VanDerWaalsContact CZ-CG 3.41Å; Y459-W476 AromaticContact CZ-CZ2 3.97Å; Y459-W476 AromaticContact CZ-NE1 3.55Å; Y459-W476 PolarHBondContact O-NE1 3.05Å; Y459-W476 WeakPolarHBondContact OH-CB 3.41Å; Y459-I479 HydrophobicContact CD2-CD1 3.7Å; Y459-I479 HydrophobicContact CE2-CD1 3.71Å; Y459-I479 HydrophobicContact CE2-CG1 4.39Å; Y459-I483 HydrophobicContact CD1-CB 4.11Å; Y459-I483 HydrophobicContact CD1-CG1 4.49Å; Y459-I483 HydrophobicContact CD1-CG2 4.32Å; Y459-I483 HydrophobicContact CD2-CB 3.96Å; Y459-I483 HydrophobicContact CD2-CG1 3.63Å; Y459-I483 HydrophobicContact CE1-CB 4.46Å; Y459-I483 HydrophobicContact CE2-CB 4.33Å; Y459-I483 HydrophobicContact CE2-CG1 4.34Å; Y459-I483 HydrophobicContact CG-CB 3.83Å; Y459-I483 HydrophobicContact CG-CG1 3.72Å; Y459-I483 HydrophobicContact CG-CG2 4.27Å; Y459-H484 AromaticContact CE1-CE1 3.37Å; Y459-H484 WeakPolarHBondContact CE1-CE1 3.44Å; Y459-H484 AromaticContact CE1-ND1 3.42Å; Y459-H484 WeakPolarHBondContact CE1-ND1 3.4Å; Y459-H484 AromaticContact CZ-CE1 3.72Å; Y459-H484 AromaticContact CZ-ND1 3.41Å; Y459-H484 PolarHBondContact OH-CE1 3.16Å; Y459-H484 PolarHBondContact OH-ND1 2.92Å
460C97.6Very high96.8Very high11 Ų1135.9 Ų35.97%0.07416%0.164CC..Hα-helixtrans-65-37172.7-65.90000111.8S415 V456 F457 M462 G463 F464S415-C460 VanDerWaalsContact CB-O 3.23Å; S415-C460 WeakPolarHBondContact CB-O 3.15Å; S415-C460 PolarHBondContact O-SG 2.98Å; S415-C460 VanDerWaalsContact O-SG 3.35Å; S415-C460 PolarHBondContact OG-O 3.44Å; V456-C460 WeakPolarHBondContact O-CB 3.48Å; V456-C460 PolarHBondContact O-N 3.07Å; V456-C460 PolarHBondContact O-SG 2.94Å; F457-C460 PolarHBondContact O-N 3.4Å; C460-M462 VanDerWaalsContact C-N 3.3Å; C460-M462 PolarHBondContact O-N 3.31Å; C460-G463 PolarHBondContact O-N 3.3Å; C460-F464 PolarHBondContact O-N 2.66Å
461C97.3Very high96.7Very high6 Ų634.1 Ų34.14%0.04116%0.16CC..Hα-helixtrans-62.9-38.3179.3-178.30000111.6F244 F457 E458 Y459 G463 F464 L465F244-C461 HydrophobicContact CB-CB 4.29Å; F244-C461 HydrophobicContact CD2-CB 3.43Å; F244-C461 VanDerWaalsContact CD2-CB 3.43Å; F244-C461 HydrophobicContact CE2-CB 4.07Å; F244-C461 HydrophobicContact CG-CB 4.17Å; F457-C461 VanDerWaalsContact O-CB 3.23Å; F457-C461 WeakPolarHBondContact O-CB 3.26Å; F457-C461 PolarHBondContact O-N 3.25Å; E458-C461 WeakPolarHBondContact O-CB 3.34Å; E458-C461 PolarHBondContact O-N 3.07Å; E458-C461 VanDerWaalsContact O-N 3.15Å; Y459-C461 VanDerWaalsContact C-N 3.34Å; C461-G463 PolarHBondContact O-N 2.67Å; C461-F464 WeakPolarHBondContact O-CB 3.31Å; C461-F464 PolarHBondContact O-N 3.11Å; C461-F464 VanDerWaalsContact O-N 3.08Å; C461-L465 WeakPolarHBondContact O-CB 3.44Å; C461-L465 WeakPolarHBondContact O-CG 3.27Å; C461-L465 PolarHBondContact O-N 2.97Å; C461-L465 WeakPolarHBondContact SG-CD1 3.15Å
462M97.2Very high96.7Very high0 Ų031 Ų310%014%0.144CC..Hα-helixtrans-59.3-46.8176-67.6-56-57.800112.2V223 M240 I243 E458 Y459 C460 F464 L465 L466 Y475V223-M462 HydrophobicContact CB-CE 4.35Å; V223-M462 HydrophobicContact CG1-CE 3.82Å; V223-M462 HydrophobicContact CG2-CE 3.99Å; M240-M462 HydrophobicContact CB-CG 3.75Å; M240-M462 HydrophobicContact CB-SD 3.89Å; M240-M462 HydrophobicContact CG-CG 3.5Å; M240-M462 VanDerWaalsContact CG-CG 3.5Å; M240-M462 HydrophobicContact CG-SD 4.12Å; M240-M462 HydrophobicContact SD-CG 3.69Å; I243-M462 HydrophobicContact CB-SD 4.2Å; I243-M462 HydrophobicContact CG2-SD 3.86Å; E458-M462 WeakPolarHBondContact O-CG 3.4Å; E458-M462 PolarHBondContact O-N 3.39Å; E458-M462 VanDerWaalsContact O-N 3.08Å; Y459-M462 PolarHBondContact O-N 3.32Å; C460-M462 VanDerWaalsContact C-N 3.3Å; C460-M462 PolarHBondContact O-N 3.31Å; M462-F464 VanDerWaalsContact C-N 3.28Å; M462-F464 PolarHBondContact O-N 2.9Å; M462-L465 PolarHBondContact O-N 3.21Å; M462-L466 HydrophobicContact CE-CD1 4.19Å; M462-L466 VanDerWaalsContact O-CB 3.28Å; M462-L466 WeakPolarHBondContact O-CB 3.39Å; M462-L466 VanDerWaalsContact O-CG 3.26Å; M462-L466 WeakPolarHBondContact O-CG 3.47Å; M462-L466 PolarHBondContact O-N 3.31Å; M462-Y475 HydrophobicContact CB-CD1 3.78Å; M462-Y475 HydrophobicContact CB-CE1 3.75Å; M462-Y475 HydrophobicContact CE-CD1 4.04Å; M462-Y475 HydrophobicContact CE-CD2 4.23Å; M462-Y475 HydrophobicContact CE-CE1 3.97Å; M462-Y475 HydrophobicContact CE-CE2 4.12Å; M462-Y475 HydrophobicContact CE-CG 4.21Å; M462-Y475 HydrophobicContact CG-CD1 4.02Å; M462-Y475 HydrophobicContact CG-CE1 3.49Å; M462-Y475 VanDerWaalsContact CG-CE1 3.49Å; M462-Y475 HydrophobicContact SD-CE1 4.43Å
463G96.3Very high96.7Very high0 Ų032.2 Ų32.20%015%0.15CC..Hα-helixtrans-63.1-34.6173.900000113.2G411 S415 C460 C461 L467G411-G463 CarbonylContact C-O 3.52Å; G411-G463 WeakPolarHBondContact CA-O 3.5Å; S415-G463 WeakPolarHBondContact OG-CA 3.41Å; C460-G463 PolarHBondContact O-N 3.3Å; C461-G463 PolarHBondContact O-N 2.67Å; G463-L467 PolarHBondContact O-N 3.35Å
464F96.4Very high96.7Very high44 Ų4434.2 Ų34.219%0.19317%0.166CC..Hα-helixtrans-71.1-34-178.7-173.5-81.5000111.7F247 H406 Y412 S415 F416 C460 C461 M462 L467F247-F464 HydrophobicContact CZ-CD1 4.31Å; F247-F464 HydrophobicContact CZ-CE1 4.1Å; H406-F464 HydrophobicContact CB-CE2 4.34Å; H406-F464 AromaticContact CD2-CE2 3.51Å; H406-F464 AromaticContact CD2-CZ 3.54Å; H406-F464 AromaticContact CG-CE2 3.91Å; H406-F464 AromaticContact NE2-CE2 3.97Å; Y412-F464 AromaticContact CD1-CD2 3.59Å; Y412-F464 HydrophobicContact CD1-CD2 3.59Å; Y412-F464 AromaticContact CD1-CE2 3.63Å; Y412-F464 HydrophobicContact CD1-CE2 3.63Å; Y412-F464 HydrophobicContact CD1-CG 4.16Å; Y412-F464 HydrophobicContact CD1-CZ 4.23Å; Y412-F464 HydrophobicContact CE1-CD1 4.28Å; Y412-F464 AromaticContact CE1-CD2 3.88Å; Y412-F464 HydrophobicContact CE1-CD2 3.88Å; Y412-F464 HydrophobicContact CE1-CE1 4.08Å; Y412-F464 AromaticContact CE1-CE2 3.67Å; Y412-F464 HydrophobicContact CE1-CE2 3.67Å; Y412-F464 HydrophobicContact CE1-CG 4.17Å; Y412-F464 AromaticContact CE1-CZ 3.78Å; Y412-F464 HydrophobicContact CE1-CZ 3.78Å; S415-F464 PolarHBondContact OG-N 2.91Å; F416-F464 HydrophobicContact CE2-CD2 4Å; F416-F464 AromaticContact CE2-CE2 3.85Å; F416-F464 HydrophobicContact CE2-CE2 3.85Å; F416-F464 HydrophobicContact CZ-CD2 4.29Å; F416-F464 AromaticContact CZ-CE2 3.99Å; F416-F464 HydrophobicContact CZ-CE2 3.99Å; C460-F464 PolarHBondContact O-N 2.66Å; C461-F464 WeakPolarHBondContact O-CB 3.31Å; C461-F464 PolarHBondContact O-N 3.11Å; C461-F464 VanDerWaalsContact O-N 3.08Å; M462-F464 VanDerWaalsContact C-N 3.28Å; M462-F464 PolarHBondContact O-N 2.9Å; F464-L467 VanDerWaalsContact O-CD2 3.26Å; F464-L467 WeakPolarHBondContact O-CD2 3.3Å
465L96.2Very high96.7Very high35 Ų3533.7 Ų33.718%0.18316%0.164CC..Hα-helixtrans-87.2-32.9-179.6-68.3176.5000113.3V220 I243 F247 C461 M462V220-L465 HydrophobicContact CG1-CB 4.14Å; V220-L465 HydrophobicContact CG2-CB 4.12Å; V220-L465 HydrophobicContact CG2-CD1 3.88Å; V220-L465 HydrophobicContact CG2-CG 4.49Å; I243-L465 HydrophobicContact CG2-CD1 3.53Å; F247-L465 HydrophobicContact CB-CD1 4.16Å; F247-L465 HydrophobicContact CD2-CD1 4.49Å; F247-L465 HydrophobicContact CD2-CD2 3.68Å; F247-L465 HydrophobicContact CE2-CD2 3.9Å; F247-L465 HydrophobicContact CG-CD1 4.33Å; F247-L465 HydrophobicContact CG-CD2 4.26Å; C461-L465 WeakPolarHBondContact O-CB 3.44Å; C461-L465 WeakPolarHBondContact O-CG 3.27Å; C461-L465 PolarHBondContact O-N 2.97Å; C461-L465 WeakPolarHBondContact SG-CD1 3.15Å; M462-L465 PolarHBondContact O-N 3.21Å
466L96.1Very high96.7Very high1 Ų131.4 Ų31.41%0.00516%0.155CC..Hα-helixtrans-75.6-26.6178.7-71.4172.3000112.5V220 V223 R224 M462 D468 Y475V220-L466 HydrophobicContact CG1-CD2 3.87Å; V223-L466 HydrophobicContact CG1-CD1 4.43Å; V223-L466 HydrophobicContact CG1-CD2 4.42Å; R224-L466 HydrophobicContact CG-CD2 4.2Å; R224-L466 PolarHBondContact NH2-O 2.82Å; M462-L466 HydrophobicContact CE-CD1 4.19Å; M462-L466 VanDerWaalsContact O-CB 3.28Å; M462-L466 WeakPolarHBondContact O-CB 3.39Å; M462-L466 VanDerWaalsContact O-CG 3.26Å; M462-L466 WeakPolarHBondContact O-CG 3.47Å; M462-L466 PolarHBondContact O-N 3.31Å; L466-D468 PolarHBondContact O-N 2.66Å; L466-D468 VanDerWaalsContact O-OD2 3.12Å; L466-Y475 HydrophobicContact CD1-CG 4.2Å
467L94.4Very high96.7Very high51 Ų5134.3 Ų34.327%0.26718%0.176SC..  trans65.7-51.2174.9-54.8173.4000115.4H409 A410 G411 Y412 G463 F464H409-L467 HydrophobicContact CB-CB 4.03Å; H409-L467 WeakPolarHBondContact CB-O 3.47Å; A410-L467 PolarHBondContact N-O 3.08Å; G411-L467 VanDerWaalsContact CA-O 3.3Å; G411-L467 WeakPolarHBondContact CA-O 3.41Å; G411-L467 PolarHBondContact N-O 3.08Å; Y412-L467 HydrophobicContact CD1-CD2 4.4Å; Y412-L467 HydrophobicContact CE1-CD2 3.58Å; Y412-L467 HydrophobicContact CE2-CD2 3.86Å; Y412-L467 WeakPolarHBondContact OH-CD2 3.11Å; G463-L467 PolarHBondContact O-N 3.35Å; F464-L467 VanDerWaalsContact O-CD2 3.26Å; F464-L467 WeakPolarHBondContact O-CD2 3.3Å
468D94Very high96.7Very high52 Ų5233.4 Ų33.428%0.27817%0.173SC..SBendtrans-84.6155.5-176.167.581.6000112.5R224 L466 E470 T471 T472R224-D468 IonicContact CZ-OD2 3.17Å; R224-D468 IonicContact NH1-OD2 2.7Å; R224-D468 PolarHBondContact NH1-OD2 2.91Å; R224-D468 IonicContact NH2-OD2 2.79Å; L466-D468 PolarHBondContact O-N 2.66Å; L466-D468 VanDerWaalsContact O-OD2 3.12Å; D468-E470 PolarHBondContact OD1-N 3Å; D468-T471 VanDerWaalsContact OD1-CB 3.32Å; D468-T471 WeakPolarHBondContact OD1-CB 3.06Å; D468-T471 VanDerWaalsContact OD1-CG2 3.31Å; D468-T471 WeakPolarHBondContact OD1-CG2 3.47Å; D468-T471 PolarHBondContact OD1-N 3.22Å; D468-T471 PolarHBondContact OD1-OG1 3.47Å; D468-T471 PolarHBondContact OD2-OG1 3.39Å; D468-T472 VanDerWaalsContact O-CB 3.25Å; D468-T472 WeakPolarHBondContact O-CB 3.38Å; D468-T472 PolarHBondContact O-N 2.72Å; D468-T472 PolarHBondContact O-OG1 2.85Å
469W96.2Very high96.7Very high147 Ų14733.2 Ų33.256%0.55717%0.172SC*.Hα-helixtrans-63.5-48.1-178.3172-90.9000111.6A410 L414 T472 I473A410-W469 HydrophobicContact CB-CB 3.83Å; A410-W469 HydrophobicContact CB-CE3 4.3Å; L414-W469 HydrophobicContact CD1-CE3 3.85Å; L414-W469 HydrophobicContact CD1-CZ3 4.22Å; L414-W469 HydrophobicContact CD2-CE3 4.18Å; L414-W469 HydrophobicContact CD2-CZ3 3.7Å; L414-W469 HydrophobicContact CG-CE3 4.27Å; L414-W469 HydrophobicContact CG-CZ3 4.27Å; W469-T472 PolarHBondContact O-N 3.25Å; W469-I473 HydrophobicContact CD2-CG1 3.94Å; W469-I473 HydrophobicContact CE3-CG1 4.42Å; W469-I473 HydrophobicContact CG-CG1 4.33Å; W469-I473 HydrophobicContact CH2-CD1 4.33Å; W469-I473 HydrophobicContact CH2-CG1 4.45Å; W469-I473 HydrophobicContact CZ2-CD1 4.23Å; W469-I473 HydrophobicContact CZ2-CG1 3.97Å; W469-I473 WeakPolarHBondContact O-CB 3.45Å; W469-I473 VanDerWaalsContact O-CG1 3.24Å; W469-I473 WeakPolarHBondContact O-CG1 3.2Å; W469-I473 PolarHBondContact O-N 3.17Å
470E96.6Very high96.6Very high155 Ų15540.7 Ų40.772%0.72420%0.202SC*.Hα-helixtrans-64.6-49.1-170.3-65.7179.8-176.900111.8D468 I473 A474D468-E470 PolarHBondContact OD1-N 3Å; E470-I473 PolarHBondContact O-N 3.3Å; E470-A474 WeakPolarHBondContact O-CB 3.42Å; E470-A474 PolarHBondContact O-N 3.19Å
471T95.7Very high96.6Very high28 Ų2843.5 Ų43.517%0.17221%0.213CC..Hα-helixtrans-71-35.6179.961.40000112.2R224 D468 A474 Y475R224-T471 HydrophobicContact CG-CG2 4.45Å; D468-T471 VanDerWaalsContact OD1-CB 3.32Å; D468-T471 WeakPolarHBondContact OD1-CB 3.06Å; D468-T471 VanDerWaalsContact OD1-CG2 3.31Å; D468-T471 WeakPolarHBondContact OD1-CG2 3.47Å; D468-T471 PolarHBondContact OD1-N 3.22Å; D468-T471 PolarHBondContact OD1-OG1 3.47Å; D468-T471 PolarHBondContact OD2-OG1 3.39Å; T471-A474 PolarHBondContact O-N 2.92Å; T471-Y475 WeakPolarHBondContact O-CB 3.02Å; T471-Y475 PolarHBondContact O-N 3.43Å
472T97.1Very high96.6Very high0 Ų044.3 Ų44.30%022%0.219CC..Hα-helixtrans-63.1-48175.3-59.20000110.8L414 D468 W469 Y475 W476L414-T472 HydrophobicContact CB-CG2 4.46Å; L414-T472 HydrophobicContact CD1-CG2 3.61Å; D468-T472 VanDerWaalsContact O-CB 3.25Å; D468-T472 WeakPolarHBondContact O-CB 3.38Å; D468-T472 PolarHBondContact O-N 2.72Å; D468-T472 PolarHBondContact O-OG1 2.85Å; W469-T472 PolarHBondContact O-N 3.25Å; T472-Y475 PolarHBondContact O-N 3.12Å; T472-W476 HydrophobicContact CG2-CD2 3.97Å; T472-W476 HydrophobicContact CG2-CE3 4.28Å; T472-W476 HydrophobicContact CG2-CH2 4.41Å; T472-W476 HydrophobicContact CG2-CZ2 4.08Å; T472-W476 HydrophobicContact CG2-CZ3 4.5Å; T472-W476 WeakPolarHBondContact O-CB 3.42Å; T472-W476 PolarHBondContact O-N 2.93Å
473I97.5Very high96.6Very high45 Ų4544.5 Ų44.523%0.23122%0.22CC..Hα-helixtrans-68.3-39.9179-66.4-60.4000111.2L414 W469 E470 Y475 W476 S477 F481L414-I473 HydrophobicContact CD1-CD1 4.25Å; L414-I473 HydrophobicContact CD1-CG1 4.47Å; W469-I473 HydrophobicContact CD2-CG1 3.94Å; W469-I473 HydrophobicContact CE3-CG1 4.42Å; W469-I473 HydrophobicContact CG-CG1 4.33Å; W469-I473 HydrophobicContact CH2-CD1 4.33Å; W469-I473 HydrophobicContact CH2-CG1 4.45Å; W469-I473 HydrophobicContact CZ2-CD1 4.23Å; W469-I473 HydrophobicContact CZ2-CG1 3.97Å; W469-I473 WeakPolarHBondContact O-CB 3.45Å; W469-I473 VanDerWaalsContact O-CG1 3.24Å; W469-I473 WeakPolarHBondContact O-CG1 3.2Å; W469-I473 PolarHBondContact O-N 3.17Å; E470-I473 PolarHBondContact O-N 3.3Å; I473-Y475 VanDerWaalsContact C-N 3.34Å; I473-Y475 PolarHBondContact O-N 2.8Å; I473-W476 HydrophobicContact CD1-CE3 4.3Å; I473-W476 PolarHBondContact O-N 2.84Å; I473-S477 WeakPolarHBondContact O-CB 3.37Å; I473-S477 PolarHBondContact O-N 3.36Å; I473-F481 HydrophobicContact CD1-CE1 4.39Å; I473-F481 HydrophobicContact CG2-CZ 4.29Å
474A97Very high96.7Very high43 Ų4346.6 Ų46.636%0.35523%0.229SC..Hα-helixtrans-59.2-46.6174.500000111.2E470 T471 S477 S478E470-A474 WeakPolarHBondContact O-CB 3.42Å; E470-A474 PolarHBondContact O-N 3.19Å; T471-A474 PolarHBondContact O-N 2.92Å; A474-S477 PolarHBondContact O-N 3.33Å; A474-S478 PolarHBondContact O-N 3.28Å
475Y97.5Very high96.8Very high0 Ų049.6 Ų49.60%025%0.246CC..Hα-helixtrans-61.8-50.4176.5179.2-101.6000111.6V223 F228 Y229 R236 M240 M462 L466 T471 T472 I473 S477 S478 I479V223-Y475 HydrophobicContact CG1-CD2 3.31Å; V223-Y475 HydrophobicContact CG1-CE2 3.93Å; V223-Y475 HydrophobicContact CG1-CG 3.96Å; F228-Y475 AromaticContact CE1-CD2 3.7Å; F228-Y475 HydrophobicContact CE1-CD2 3.7Å; F228-Y475 AromaticContact CE1-CE2 3.6Å; F228-Y475 HydrophobicContact CE1-CE2 3.6Å; F228-Y475 HydrophobicContact CZ-CD2 4.2Å; F228-Y475 AromaticContact CZ-CE2 3.65Å; F228-Y475 HydrophobicContact CZ-CE2 3.65Å; Y229-Y475 PolarHBondContact OH-N 3.29Å; R236-Y475 PolarHBondContact O-OH 2.77Å; M240-Y475 HydrophobicContact CB-CE1 4.42Å; M240-Y475 WeakPolarHBondContact CB-OH 3.31Å; M240-Y475 HydrophobicContact SD-CE1 4.1Å; M462-Y475 HydrophobicContact CB-CD1 3.78Å; M462-Y475 HydrophobicContact CB-CE1 3.75Å; M462-Y475 HydrophobicContact CE-CD1 4.04Å; M462-Y475 HydrophobicContact CE-CD2 4.23Å; M462-Y475 HydrophobicContact CE-CE1 3.97Å; M462-Y475 HydrophobicContact CE-CE2 4.12Å; M462-Y475 HydrophobicContact CE-CG 4.21Å; M462-Y475 HydrophobicContact CG-CD1 4.02Å; M462-Y475 HydrophobicContact CG-CE1 3.49Å; M462-Y475 VanDerWaalsContact CG-CE1 3.49Å; M462-Y475 HydrophobicContact SD-CE1 4.43Å; L466-Y475 HydrophobicContact CD1-CG 4.2Å; T471-Y475 WeakPolarHBondContact O-CB 3.02Å; T471-Y475 PolarHBondContact O-N 3.43Å; T472-Y475 PolarHBondContact O-N 3.12Å; I473-Y475 VanDerWaalsContact C-N 3.34Å; I473-Y475 PolarHBondContact O-N 2.8Å; Y475-S477 VanDerWaalsContact C-N 3.31Å; Y475-S477 PolarHBondContact O-N 3.34Å; Y475-S478 WeakPolarHBondContact O-CB 3.19Å; Y475-S478 PolarHBondContact O-N 3.18Å; Y475-S478 VanDerWaalsContact O-N 3.11Å; Y475-S478 PolarHBondContact O-OG 2.61Å; Y475-I479 HydrophobicContact CE1-CD1 3.9Å; Y475-I479 PolarHBondContact O-N 3.46Å
476W97.7Very high96.9Very high4 Ų451.8 Ų51.82%0.01526%0.257CS..Hα-helixtrans-62.6-36.2179.1-73.7-4.5000113.2L414 V418 Y459 T472 I473 I479 Y480 F481 H484L414-W476 HydrophobicContact CB-CH2 3.74Å; L414-W476 HydrophobicContact CB-CZ3 4.04Å; L414-W476 HydrophobicContact CD2-CZ3 4.13Å; L414-W476 HydrophobicContact CG-CZ3 4.48Å; V418-W476 HydrophobicContact CG2-CH2 3.91Å; Y459-W476 AromaticContact CD1-CE2 3.89Å; Y459-W476 HydrophobicContact CD1-CH2 4.42Å; Y459-W476 AromaticContact CD1-CZ2 3.81Å; Y459-W476 HydrophobicContact CD1-CZ2 3.81Å; Y459-W476 AromaticContact CD2-CD1 3.89Å; Y459-W476 AromaticContact CD2-NE1 3.81Å; Y459-W476 AromaticContact CE1-CD2 3.67Å; Y459-W476 HydrophobicContact CE1-CD2 3.67Å; Y459-W476 AromaticContact CE1-CE2 3.36Å; Y459-W476 AromaticContact CE1-CE3 4Å; Y459-W476 HydrophobicContact CE1-CE3 4Å; Y459-W476 HydrophobicContact CE1-CG 4.24Å; Y459-W476 AromaticContact CE1-CH2 3.76Å; Y459-W476 HydrophobicContact CE1-CH2 3.76Å; Y459-W476 AromaticContact CE1-CZ2 3.43Å; Y459-W476 HydrophobicContact CE1-CZ2 3.43Å; Y459-W476 VanDerWaalsContact CE1-CZ2 3.43Å; Y459-W476 HydrophobicContact CE1-CZ3 4.03Å; Y459-W476 AromaticContact CE1-NE1 3.78Å; Y459-W476 HydrophobicContact CE2-CB 4.17Å; Y459-W476 AromaticContact CE2-CD1 3.33Å; Y459-W476 AromaticContact CE2-CD2 3.94Å; Y459-W476 HydrophobicContact CE2-CD2 3.94Å; Y459-W476 AromaticContact CE2-CE2 3.93Å; Y459-W476 AromaticContact CE2-CG 3.59Å; Y459-W476 HydrophobicContact CE2-CG 3.59Å; Y459-W476 AromaticContact CE2-NE1 3.56Å; Y459-W476 AromaticContact CZ-CD1 3.54Å; Y459-W476 AromaticContact CZ-CD2 3.28Å; Y459-W476 AromaticContact CZ-CE2 3.38Å; Y459-W476 AromaticContact CZ-CE3 3.79Å; Y459-W476 AromaticContact CZ-CG 3.41Å; Y459-W476 VanDerWaalsContact CZ-CG 3.41Å; Y459-W476 AromaticContact CZ-CZ2 3.97Å; Y459-W476 AromaticContact CZ-NE1 3.55Å; Y459-W476 PolarHBondContact O-NE1 3.05Å; Y459-W476 WeakPolarHBondContact OH-CB 3.41Å; T472-W476 HydrophobicContact CG2-CD2 3.97Å; T472-W476 HydrophobicContact CG2-CE3 4.28Å; T472-W476 HydrophobicContact CG2-CH2 4.41Å; T472-W476 HydrophobicContact CG2-CZ2 4.08Å; T472-W476 HydrophobicContact CG2-CZ3 4.5Å; T472-W476 WeakPolarHBondContact O-CB 3.42Å; T472-W476 PolarHBondContact O-N 2.93Å; I473-W476 HydrophobicContact CD1-CE3 4.3Å; I473-W476 PolarHBondContact O-N 2.84Å; W476-I479 CarbonylContact O-C 3.53Å; W476-I479 VanDerWaalsContact O-CG1 3.3Å; W476-I479 WeakPolarHBondContact O-CG1 3.32Å; W476-I479 PolarHBondContact O-N 3.36Å; W476-Y480 PolarHBondContact O-N 3.22Å; W476-F481 HydrophobicContact CB-CD1 3.82Å; W476-F481 HydrophobicContact CB-CE1 3.63Å; W476-F481 HydrophobicContact CB-CZ 4.32Å; W476-F481 HydrophobicContact CE3-CD1 4.48Å; W476-F481 HydrophobicContact CE3-CE1 4.32Å; W476-F481 PolarHBondContact O-N 3.43Å; W476-H484 AromaticContact CE3-CE1 3.95Å; W476-H484 AromaticContact CZ3-CE1 3.63Å
477S97.5Very high97Very high61 Ų6151.8 Ų51.843%0.42726%0.257SS..Hα-helixtrans-64.7-39.7173.1-174.60000111.7I473 A474 Y475 I479 Y480I473-S477 WeakPolarHBondContact O-CB 3.37Å; I473-S477 PolarHBondContact O-N 3.36Å; A474-S477 PolarHBondContact O-N 3.33Å; Y475-S477 VanDerWaalsContact C-N 3.31Å; Y475-S477 PolarHBondContact O-N 3.34Å; S477-I479 PolarHBondContact O-N 2.95Å; S477-Y480 WeakPolarHBondContact O-CA 3.26Å; S477-Y480 PolarHBondContact O-N 3.29Å
478S96.9Very high97.2Very high14 Ų1453.1 Ų53.110%0.09826%0.264CS..Hα-helixtrans-64-22.1177.883.70000114.2R236 A474 Y475R236-S478 PolarHBondContact NE-O 2.82Å; R236-S478 PolarHBondContact NH2-O 3.4Å; A474-S478 PolarHBondContact O-N 3.28Å; Y475-S478 WeakPolarHBondContact O-CB 3.19Å; Y475-S478 PolarHBondContact O-N 3.18Å; Y475-S478 VanDerWaalsContact O-N 3.11Å; Y475-S478 PolarHBondContact O-OG 2.61Å
479I97.3Very high97.4Very high0 Ų052.3 Ų52.30%027%0.268CS..THydrogen-bonded Turntrans-105.919.617262.8171.2000111.9F233 R236 M240 Y459 Y475 W476 S477 F481 C482F233-I479 HydrophobicContact CE2-CB 4.07Å; F233-I479 HydrophobicContact CE2-CG2 4.46Å; R236-I479 HydrophobicContact CB-CG2 4.08Å; M240-I479 HydrophobicContact SD-CD1 4.47Å; Y459-I479 HydrophobicContact CD2-CD1 3.7Å; Y459-I479 HydrophobicContact CE2-CD1 3.71Å; Y459-I479 HydrophobicContact CE2-CG1 4.39Å; Y475-I479 HydrophobicContact CE1-CD1 3.9Å; Y475-I479 PolarHBondContact O-N 3.46Å; W476-I479 CarbonylContact O-C 3.53Å; W476-I479 VanDerWaalsContact O-CG1 3.3Å; W476-I479 WeakPolarHBondContact O-CG1 3.32Å; W476-I479 PolarHBondContact O-N 3.36Å; S477-I479 PolarHBondContact O-N 2.95Å; I479-F481 PolarHBondContact O-N 3.36Å; I479-C482 VanDerWaalsContact O-CB 3.31Å; I479-C482 WeakPolarHBondContact O-CB 3.4Å; I479-C482 PolarHBondContact O-N 3.04Å; I479-C482 VanDerWaalsContact O-N 3.15Å; I479-C482 PolarHBondContact O-SG 2.83Å
480Y97.2Very high97.4Very high158 Ų15846.9 Ų46.962%0.6225%0.249SC*.THydrogen-bonded Turntrans56.830.4174.5-54-76.8000114.7F233 W476 S477 C482 I485F233-Y480 AromaticContact CD2-CD2 3.83Å; F233-Y480 HydrophobicContact CD2-CD2 3.83Å; F233-Y480 AromaticContact CD2-CE2 3.94Å; F233-Y480 HydrophobicContact CD2-CE2 3.94Å; F233-Y480 AromaticContact CE2-CD2 3.98Å; F233-Y480 HydrophobicContact CE2-CD2 3.98Å; W476-Y480 PolarHBondContact O-N 3.22Å; S477-Y480 WeakPolarHBondContact O-CA 3.26Å; S477-Y480 PolarHBondContact O-N 3.29Å; Y480-C482 PolarHBondContact O-N 2.95Å; Y480-I485 WeakPolarHBondContact O-CD1 3.13Å
481F97.5Very high97.5Very high69 Ų6941.2 Ų41.230%0.30322%0.224SC..THydrogen-bonded Turntrans49.332.3-175.1-59.6-90000113I473 W476 I479 I483 H484 I485I473-F481 HydrophobicContact CD1-CE1 4.39Å; I473-F481 HydrophobicContact CG2-CZ 4.29Å; W476-F481 HydrophobicContact CB-CD1 3.82Å; W476-F481 HydrophobicContact CB-CE1 3.63Å; W476-F481 HydrophobicContact CB-CZ 4.32Å; W476-F481 HydrophobicContact CE3-CD1 4.48Å; W476-F481 HydrophobicContact CE3-CE1 4.32Å; W476-F481 PolarHBondContact O-N 3.43Å; I479-F481 PolarHBondContact O-N 3.36Å; F481-I483 PolarHBondContact O-N 3.48Å; F481-H484 HydrophobicContact CB-CB 4.41Å; F481-H484 WeakPolarHBondContact O-CB 3.32Å; F481-H484 PolarHBondContact O-N 2.98Å; F481-I485 PolarHBondContact O-N 3.19Å; F481-I485 VanDerWaalsContact O-N 3.09Å
482C96.9Very high97.6Very high24 Ų2445 Ų4516%0.16224%0.242CC..Hα-helixtrans-53-36.9-167.460.80000113.6I479 Y480 I485 I486I479-C482 VanDerWaalsContact O-CB 3.31Å; I479-C482 WeakPolarHBondContact O-CB 3.4Å; I479-C482 PolarHBondContact O-N 3.04Å; I479-C482 VanDerWaalsContact O-N 3.15Å; I479-C482 PolarHBondContact O-SG 2.83Å; Y480-C482 PolarHBondContact O-N 2.95Å; C482-I485 PolarHBondContact O-N 3.41Å; C482-I486 WeakPolarHBondContact O-CB 3.38Å; C482-I486 WeakPolarHBondContact O-CD1 3.37Å; C482-I486 WeakPolarHBondContact O-CG1 3.49Å; C482-I486 PolarHBondContact O-N 3.36Å
483I97.5Very high97.5Very high4 Ų450 Ų502%0.02126%0.264CS..Hα-helixtrans-70.3-41.1179.7-54.9-45.8000112R455 V456 Y459 F481 I485 I486 L487R455-I483 HydrophobicContact CB-CD1 3.71Å; R455-I483 HydrophobicContact CG-CD1 4.47Å; V456-I483 HydrophobicContact CG2-CG2 3.87Å; Y459-I483 HydrophobicContact CD1-CB 4.11Å; Y459-I483 HydrophobicContact CD1-CG1 4.49Å; Y459-I483 HydrophobicContact CD1-CG2 4.32Å; Y459-I483 HydrophobicContact CD2-CB 3.96Å; Y459-I483 HydrophobicContact CD2-CG1 3.63Å; Y459-I483 HydrophobicContact CE1-CB 4.46Å; Y459-I483 HydrophobicContact CE2-CB 4.33Å; Y459-I483 HydrophobicContact CE2-CG1 4.34Å; Y459-I483 HydrophobicContact CG-CB 3.83Å; Y459-I483 HydrophobicContact CG-CG1 3.72Å; Y459-I483 HydrophobicContact CG-CG2 4.27Å; F481-I483 PolarHBondContact O-N 3.48Å; I483-I485 VanDerWaalsContact C-N 3.33Å; I483-I485 PolarHBondContact O-N 3.03Å; I483-I486 HydrophobicContact CD1-CD1 4.33Å; I483-I486 PolarHBondContact O-N 3.45Å; I483-L487 HydrophobicContact CG2-CD1 4.14Å; I483-L487 HydrophobicContact CG2-CG 4.39Å; I483-L487 WeakPolarHBondContact O-CB 3.25Å; I483-L487 VanDerWaalsContact O-CG 3.26Å; I483-L487 WeakPolarHBondContact O-CG 3.48Å; I483-L487 PolarHBondContact O-N 2.83Å
484H98.1Very high97.4Very high43 Ų4348.6 Ų48.620%0.19926%0.256CS..Hα-helixtrans-60.9-44.8172.8-75.599.4000111.1Y459 W476 F481 I486 L487 I488Y459-H484 AromaticContact CE1-CE1 3.37Å; Y459-H484 WeakPolarHBondContact CE1-CE1 3.44Å; Y459-H484 AromaticContact CE1-ND1 3.42Å; Y459-H484 WeakPolarHBondContact CE1-ND1 3.4Å; Y459-H484 AromaticContact CZ-CE1 3.72Å; Y459-H484 AromaticContact CZ-ND1 3.41Å; Y459-H484 PolarHBondContact OH-CE1 3.16Å; Y459-H484 PolarHBondContact OH-ND1 2.92Å; W476-H484 AromaticContact CE3-CE1 3.95Å; W476-H484 AromaticContact CZ3-CE1 3.63Å; F481-H484 HydrophobicContact CB-CB 4.41Å; F481-H484 WeakPolarHBondContact O-CB 3.32Å; F481-H484 PolarHBondContact O-N 2.98Å; H484-I486 PolarHBondContact O-N 3.47Å; H484-L487 PolarHBondContact O-N 2.86Å; H484-I488 WeakPolarHBondContact O-CB 3.47Å; H484-I488 VanDerWaalsContact O-CG1 3.29Å; H484-I488 WeakPolarHBondContact O-CG1 3.23Å; H484-I488 PolarHBondContact O-N 3.34Å
485I98.1Very high97.3Very high108 Ų10849.4 Ų49.455%0.55426%0.259SS*.Hα-helixtrans-60.8-45.4178.6-63.8175.5000110.6Y480 F481 C482 I483 G489Y480-I485 WeakPolarHBondContact O-CD1 3.13Å; F481-I485 PolarHBondContact O-N 3.19Å; F481-I485 VanDerWaalsContact O-N 3.09Å; C482-I485 PolarHBondContact O-N 3.41Å; I483-I485 VanDerWaalsContact C-N 3.33Å; I483-I485 PolarHBondContact O-N 3.03Å; I485-G489 WeakPolarHBondContact O-CA 3.36Å; I485-G489 PolarHBondContact O-N 2.98Å
486I97.8Very high97.2Very high81 Ų8154.9 Ų54.942%0.41528%0.283SS..Hα-helixtrans-61.6-49177.3-70.7163.4000110.9L452 C482 I483 H484 G489 L490L452-I486 HydrophobicContact CD1-CG2 3.88Å; C482-I486 WeakPolarHBondContact O-CB 3.38Å; C482-I486 WeakPolarHBondContact O-CD1 3.37Å; C482-I486 WeakPolarHBondContact O-CG1 3.49Å; C482-I486 PolarHBondContact O-N 3.36Å; I483-I486 HydrophobicContact CD1-CD1 4.33Å; I483-I486 PolarHBondContact O-N 3.45Å; H484-I486 PolarHBondContact O-N 3.47Å; I486-G489 PolarHBondContact O-N 3.49Å; I486-L490 HydrophobicContact CG2-CD1 4.05Å; I486-L490 VanDerWaalsContact O-CG 3.28Å; I486-L490 WeakPolarHBondContact O-CG 3.28Å; I486-L490 PolarHBondContact O-N 3.33Å
487L98.3Very high97Very high0 Ų056.2 Ų56.20%029%0.291CS..Hα-helixtrans-62.8-47.6-178.4-69.7175.8000112.1V418 L421 A422 L452 V456 I483 H484 L490 I491V418-L487 HydrophobicContact CG1-CD1 4.43Å; L421-L487 HydrophobicContact CD2-CB 4.32Å; L421-L487 HydrophobicContact CD2-CD1 4.27Å; L421-L487 HydrophobicContact CG-CB 4.15Å; L421-L487 HydrophobicContact CG-CD1 4.15Å; A422-L487 HydrophobicContact CB-CD1 3.95Å; A422-L487 HydrophobicContact CB-CD2 4.39Å; L452-L487 HydrophobicContact CD1-CD2 4.05Å; L452-L487 HydrophobicContact CD2-CD2 4.26Å; L452-L487 HydrophobicContact CG-CD2 4.48Å; V456-L487 HydrophobicContact CG2-CD1 4.17Å; V456-L487 HydrophobicContact CG2-CD2 4.15Å; V456-L487 HydrophobicContact CG2-CG 4.48Å; I483-L487 HydrophobicContact CG2-CD1 4.14Å; I483-L487 HydrophobicContact CG2-CG 4.39Å; I483-L487 WeakPolarHBondContact O-CB 3.25Å; I483-L487 VanDerWaalsContact O-CG 3.26Å; I483-L487 WeakPolarHBondContact O-CG 3.48Å; I483-L487 PolarHBondContact O-N 2.83Å; H484-L487 PolarHBondContact O-N 2.86Å; L487-L490 PolarHBondContact O-N 3.31Å; L487-I491 WeakPolarHBondContact O-CD1 3.31Å; L487-I491 VanDerWaalsContact O-CG1 3.29Å; L487-I491 WeakPolarHBondContact O-CG1 3.17Å; L487-I491 PolarHBondContact O-N 2.84Å
488I98.3Very high96.7Very high79 Ų7957.7 Ų57.741%0.40529%0.287SS..Hα-helixtrans-65.7-41.7177.9-67168.4000110.2L421 H484 L490 I491 I492L421-I488 HydrophobicContact CD1-CG1 4.25Å; L421-I488 HydrophobicContact CD2-CG1 4.26Å; H484-I488 WeakPolarHBondContact O-CB 3.47Å; H484-I488 VanDerWaalsContact O-CG1 3.29Å; H484-I488 WeakPolarHBondContact O-CG1 3.23Å; H484-I488 PolarHBondContact O-N 3.34Å; I488-L490 PolarHBondContact O-N 2.91Å; I488-I491 PolarHBondContact O-N 2.93Å; I488-I492 HydrophobicContact CG2-CD1 3.58Å; I488-I492 HydrophobicContact CG2-CG1 4.15Å; I488-I492 WeakPolarHBondContact O-CG1 3.45Å; I488-I492 PolarHBondContact O-N 2.77Å
489G98.2Very high96.4Very high36 Ų3664.3 Ų64.337%0.37132%0.32SS..Hα-helixtrans-58.5-43.6176.600000112.6I485 I486 I491 I492 F493I485-G489 WeakPolarHBondContact O-CA 3.36Å; I485-G489 PolarHBondContact O-N 2.98Å; I486-G489 PolarHBondContact O-N 3.49Å; G489-I491 VanDerWaalsContact C-N 3.35Å; G489-I491 PolarHBondContact O-N 3.03Å; G489-I492 PolarHBondContact O-N 2.92Å; G489-F493 WeakPolarHBondContact O-CB 3.37Å; G489-F493 PolarHBondContact O-N 3.37Å
490L97.5Very high96.2Very high32 Ų3269.3 Ų69.317%0.16835%0.346CS..Hα-helixtrans-60.1-43.3174.7-72.9166.6000112.1L429 L432 L452 I486 L487 I488 E494L429-L490 HydrophobicContact CB-CD1 4.23Å; L429-L490 HydrophobicContact CB-CD2 4.42Å; L429-L490 HydrophobicContact CD1-CD2 4.02Å; L432-L490 HydrophobicContact CD1-CD2 3.87Å; L452-L490 HydrophobicContact CD1-CD1 4.47Å; L452-L490 HydrophobicContact CD2-CD1 3.83Å; I486-L490 HydrophobicContact CG2-CD1 4.05Å; I486-L490 VanDerWaalsContact O-CG 3.28Å; I486-L490 WeakPolarHBondContact O-CG 3.28Å; I486-L490 PolarHBondContact O-N 3.33Å; L487-L490 PolarHBondContact O-N 3.31Å; I488-L490 PolarHBondContact O-N 2.91Å; L490-E494 WeakPolarHBondContact O-CB 3.36Å; L490-E494 PolarHBondContact O-N 3.14Å
491I97.3Very high95.8Very high36 Ų3664.7 Ų64.719%0.18533%0.331CS..Hα-helixtrans-67.1-46.8-179.7-64.1165.9000111.1L421 V424 L487 I488 G489 S495L421-I491 HydrophobicContact CD1-CD1 3.63Å; V424-I491 HydrophobicContact CB-CD1 4.1Å; V424-I491 HydrophobicContact CG1-CD1 3.75Å; V424-I491 HydrophobicContact CG1-CG1 4Å; L487-I491 WeakPolarHBondContact O-CD1 3.31Å; L487-I491 VanDerWaalsContact O-CG1 3.29Å; L487-I491 WeakPolarHBondContact O-CG1 3.17Å; L487-I491 PolarHBondContact O-N 2.84Å; I488-I491 PolarHBondContact O-N 2.93Å; G489-I491 VanDerWaalsContact C-N 3.35Å; G489-I491 PolarHBondContact O-N 3.03Å; I491-S495 WeakPolarHBondContact O-CB 3.23Å; I491-S495 PolarHBondContact O-N 3.32Å; I491-S495 PolarHBondContact O-OG 3.22Å
492I97.7Very high95.1Very high107 Ų10765.6 Ų65.655%0.54935%0.345SS..Hα-helixtrans-64.9-44.2178.8-67.7175.2000110I488 G489 S495 F496I488-I492 HydrophobicContact CG2-CD1 3.58Å; I488-I492 HydrophobicContact CG2-CG1 4.15Å; I488-I492 WeakPolarHBondContact O-CG1 3.45Å; I488-I492 PolarHBondContact O-N 2.77Å; G489-I492 PolarHBondContact O-N 2.92Å; I492-S495 PolarHBondContact O-N 2.86Å; I492-F496 WeakPolarHBondContact O-CB 3.27Å; I492-F496 PolarHBondContact O-N 2.93Å
493F96.6Very high94.3Very high107 Ų10768.5 Ų68.547%0.46937%0.37SS..Hα-helixtrans-64.3-43.9-179.6-176.2-118.3000112.1L432 G489 S495 F496 L497L432-F493 HydrophobicContact CD1-CD1 3.79Å; L432-F493 HydrophobicContact CD2-CD1 3.57Å; L432-F493 HydrophobicContact CD2-CE1 3.78Å; L432-F493 HydrophobicContact CG-CD1 4.32Å; G489-F493 WeakPolarHBondContact O-CB 3.37Å; G489-F493 PolarHBondContact O-N 3.37Å; F493-S495 VanDerWaalsContact C-N 3.34Å; F493-S495 PolarHBondContact O-N 2.99Å; F493-F496 PolarHBondContact O-N 3.42Å; F493-L497 HydrophobicContact CD1-CD1 4.23Å; F493-L497 HydrophobicContact CE1-CD1 3.69Å; F493-L497 HydrophobicContact CE1-CG 4.39Å; F493-L497 HydrophobicContact CE2-CD1 4.33Å; F493-L497 HydrophobicContact CE2-CD2 4.39Å; F493-L497 HydrophobicContact CE2-CG 4.22Å; F493-L497 HydrophobicContact CZ-CD1 3.74Å; F493-L497 HydrophobicContact CZ-CD2 4.37Å; F493-L497 HydrophobicContact CZ-CG 4.13Å; F493-L497 WeakPolarHBondContact O-CG 3.14Å; F493-L497 PolarHBondContact O-N 2.64Å
494E95.2Very high93.3Very high15 Ų1579.2 Ų79.27%0.0741%0.41CS..Hα-helixtrans-59.1-46.3172-173.1-148.9177.700111.3S428 N431 L432 L490 F496 L497 R498 F506S428-E494 VanDerWaalsContact CA-OE2 3.26Å; S428-E494 WeakPolarHBondContact CA-OE2 3.39Å; S428-E494 WeakPolarHBondContact CB-OE2 3.16Å; S428-E494 PolarHBondContact OG-OE2 3.27Å; N431-E494 HydrophobicContact CB-CG 4.29Å; N431-E494 PolarHBondContact ND2-OE1 2.76Å; L432-E494 HydrophobicContact CD1-CB 4.33Å; L432-E494 HydrophobicContact CD2-CB 4.15Å; L432-E494 HydrophobicContact CG-CB 4.12Å; L432-E494 HydrophobicContact CG-CG 4.46Å; L490-E494 WeakPolarHBondContact O-CB 3.36Å; L490-E494 PolarHBondContact O-N 3.14Å; E494-F496 VanDerWaalsContact C-N 3.33Å; E494-F496 PolarHBondContact O-N 3.3Å; E494-L497 PolarHBondContact O-N 3.24Å; E494-R498 VanDerWaalsContact O-CG 3.32Å; E494-R498 WeakPolarHBondContact O-CG 3.32Å; E494-R498 PolarHBondContact O-N 3.36Å; E494-R498 IonicContact OE1-CZ 3.61Å; E494-R498 IonicContact OE1-NE 3.08Å; E494-R498 PolarHBondContact OE1-NE 2.86Å; E494-R498 IonicContact OE1-NH2 3.17Å; E494-R498 PolarHBondContact OE1-NH2 3.32Å; E494-F506 HydrophobicContact CG-CE1 4.38Å
495S94Very high92.3Very high60 Ų6078.9 Ų78.942%0.4242%0.415SS..Hα-helixtrans-61.4-41.6179.4-59.40000111.8I491 I492 F493 R498 L499I491-S495 WeakPolarHBondContact O-CB 3.23Å; I491-S495 PolarHBondContact O-N 3.32Å; I491-S495 PolarHBondContact O-OG 3.22Å; I492-S495 PolarHBondContact O-N 2.86Å; F493-S495 VanDerWaalsContact C-N 3.34Å; F493-S495 PolarHBondContact O-N 2.99Å; S495-R498 WeakPolarHBondContact O-CB 3.4Å; S495-R498 PolarHBondContact O-N 3.25Å; S495-L499 PolarHBondContact O-N 3.41Å
496F95Very high91Very high115 Ų11574 Ų7450%0.50439%0.39SS..Hα-helixtrans-63.5-46.5175.1175.8-104.6000112I492 F493 E494 R498 L499 I500I492-F496 WeakPolarHBondContact O-CB 3.27Å; I492-F496 PolarHBondContact O-N 2.93Å; F493-F496 PolarHBondContact O-N 3.42Å; E494-F496 VanDerWaalsContact C-N 3.33Å; E494-F496 PolarHBondContact O-N 3.3Å; F496-R498 VanDerWaalsContact C-N 3.26Å; F496-R498 PolarHBondContact O-N 3.45Å; F496-L499 WeakPolarHBondContact O-CB 3.43Å; F496-L499 PolarHBondContact O-N 2.88Å; F496-I500 HydrophobicContact CD1-CD1 3.91Å; F496-I500 HydrophobicContact CD2-CD1 4.32Å; F496-I500 HydrophobicContact CE1-CD1 3.31Å; F496-I500 HydrophobicContact CE2-CD1 3.78Å; F496-I500 HydrophobicContact CG-CD1 4.4Å; F496-I500 HydrophobicContact CZ-CD1 3.26Å; F496-I500 PolarHBondContact O-N 2.81Å
497L93.7Very high89.4Confident31 Ų3176.3 Ų76.316%0.16240%0.397CS..Hα-helixtrans-63.5-32.2176.6-71.7-176.2000112.5L432 L435 F493 E494 L499 I500 L501 F506L432-L497 HydrophobicContact CD2-CD1 3.54Å; L435-L497 HydrophobicContact CD1-CD1 3.91Å; F493-L497 HydrophobicContact CD1-CD1 4.23Å; F493-L497 HydrophobicContact CE1-CD1 3.69Å; F493-L497 HydrophobicContact CE1-CG 4.39Å; F493-L497 HydrophobicContact CE2-CD1 4.33Å; F493-L497 HydrophobicContact CE2-CD2 4.39Å; F493-L497 HydrophobicContact CE2-CG 4.22Å; F493-L497 HydrophobicContact CZ-CD1 3.74Å; F493-L497 HydrophobicContact CZ-CD2 4.37Å; F493-L497 HydrophobicContact CZ-CG 4.13Å; F493-L497 WeakPolarHBondContact O-CG 3.14Å; F493-L497 PolarHBondContact O-N 2.64Å; E494-L497 PolarHBondContact O-N 3.24Å; L497-L499 PolarHBondContact O-N 3.27Å; L497-I500 PolarHBondContact O-N 3.26Å; L497-L501 HydrophobicContact CB-CD1 4.3Å; L497-L501 HydrophobicContact CD2-CD1 4.42Å; L497-L501 WeakPolarHBondContact O-CB 3.41Å; L497-L501 PolarHBondContact O-N 3.1Å; L497-F506 HydrophobicContact CB-CZ 3.8Å
498R91.5Very high87.3Confident93 Ų9380.9 Ų80.935%0.35142%0.42SS..Hα-helixtrans-65.8-22.8173.6-73.7174.9177.6-70.8-3113.8N431 E494 S495 F496 F506 I508N431-R498 PolarHBondContact ND2-NH2 3.33Å; N431-R498 VanDerWaalsContact ND2-NH2 3.13Å; E494-R498 VanDerWaalsContact O-CG 3.32Å; E494-R498 WeakPolarHBondContact O-CG 3.32Å; E494-R498 PolarHBondContact O-N 3.36Å; E494-R498 IonicContact OE1-CZ 3.61Å; E494-R498 IonicContact OE1-NE 3.08Å; E494-R498 PolarHBondContact OE1-NE 2.86Å; E494-R498 IonicContact OE1-NH2 3.17Å; E494-R498 PolarHBondContact OE1-NH2 3.32Å; S495-R498 WeakPolarHBondContact O-CB 3.4Å; S495-R498 PolarHBondContact O-N 3.25Å; F496-R498 VanDerWaalsContact C-N 3.26Å; F496-R498 PolarHBondContact O-N 3.45Å; R498-F506 HydrophobicContact CB-CE2 4.29Å; R498-F506 HydrophobicContact CB-CZ 4.39Å; R498-F506 HydrophobicContact CG-CD2 4.21Å; R498-F506 HydrophobicContact CG-CE1 4.07Å; R498-F506 HydrophobicContact CG-CE2 3.65Å; R498-F506 HydrophobicContact CG-CZ 3.56Å; R498-I508 VanDerWaalsContact NH1-CD1 3.29Å
499L91.8Very high84.3Confident152 Ų15280.6 Ų80.680%0.79643%0.429SS*.Hα-helixtrans-79.1-27.9173.5-64170.5000112.2S495 F496 L497S495-L499 PolarHBondContact O-N 3.41Å; F496-L499 WeakPolarHBondContact O-CB 3.43Å; F496-L499 PolarHBondContact O-N 2.88Å; L497-L499 PolarHBondContact O-N 3.27Å
500I91.6Very high81.1Confident105 Ų10584.3 Ų84.354%0.53845%0.447SS..Hα-helixtrans-98-42.3-173.6-62.3172.4000112.1F496 L497F496-I500 HydrophobicContact CD1-CD1 3.91Å; F496-I500 HydrophobicContact CD2-CD1 4.32Å; F496-I500 HydrophobicContact CE1-CD1 3.31Å; F496-I500 HydrophobicContact CE2-CD1 3.78Å; F496-I500 HydrophobicContact CG-CD1 4.4Å; F496-I500 HydrophobicContact CZ-CD1 3.26Å; F496-I500 PolarHBondContact O-N 2.81Å; L497-I500 PolarHBondContact O-N 3.26Å
501L89.5Confident77.9Confident61 Ų6188 Ų8832%0.31948%0.476SS..SBendtrans-90.6143.8-175-62.7175.5000110.9L435 L497 A505 F506L435-L501 HydrophobicContact CD1-CD1 4.11Å; L497-L501 HydrophobicContact CB-CD1 4.3Å; L497-L501 HydrophobicContact CD2-CD1 4.42Å; L497-L501 WeakPolarHBondContact O-CB 3.41Å; L497-L501 PolarHBondContact O-N 3.1Å; L501-A505 HydrophobicContact CB-CB 4Å; L501-A505 HydrophobicContact CD1-CB 4.45Å; L501-F506 HydrophobicContact CB-CE2 4.03Å; L501-F506 HydrophobicContact CD1-CE2 4.4Å; L501-F506 HydrophobicContact CD1-CZ 4.46Å
502P83.5Confident74.5Confident89 Ų8994 Ų9458%0.57851%0.507SS*.  trans-61.9147.6174.627.2-34.1000110.1R504 A505P502-R504 PolarHBondContact O-N 2.77Å; P502-A505 HydrophobicContact CG-CB 4.35Å; P502-A505 VanDerWaalsContact O-CB 3.26Å; P502-A505 WeakPolarHBondContact O-CB 3.42Å; P502-A505 PolarHBondContact O-N 3.26Å
503A78.5Confident71.1Confident84 Ų8494.8 Ų94.869%0.69451%0.513SS*.THydrogen-bonded Turntrans-53.8-25.5-179.300000113.9A505A503-A505 VanDerWaalsContact C-N 3.3Å; A503-A505 PolarHBondContact O-N 3.06Å
504R77.8Confident67.8Low230 Ų23095.6 Ų95.687%0.86853%0.532SS*.THydrogen-bonded Turntrans-66.2-26.6175.1-64.8-177.7-178175.10.6114P502P502-R504 PolarHBondContact O-N 2.77Å
505A75.9Confident64.6Low36 Ų3698.5 Ų98.530%0.29855%0.554SS.*THydrogen-bonded Turntrans-66.5-42.6-178.700000110.9L435 L501 P502 A503 K507L435-A505 HydrophobicContact CD2-CB 4.35Å; L435-A505 VanDerWaalsContact CD2-O 3.23Å; L435-A505 WeakPolarHBondContact CD2-O 3.25Å; L501-A505 HydrophobicContact CB-CB 4Å; L501-A505 HydrophobicContact CD1-CB 4.45Å; P502-A505 HydrophobicContact CG-CB 4.35Å; P502-A505 VanDerWaalsContact O-CB 3.26Å; P502-A505 WeakPolarHBondContact O-CB 3.42Å; P502-A505 PolarHBondContact O-N 3.26Å; A503-A505 VanDerWaalsContact C-N 3.3Å; A503-A505 PolarHBondContact O-N 3.06Å; A505-K507 PolarHBondContact O-N 2.85Å
506F72.6Confident61.4Low6 Ų6100.6 Ų100.63%0.02656%0.564CS.*THydrogen-bonded Turntrans-71.6102.4163.3-57.4-90.2000105.3N431 L435 E494 L497 R498 L501 I508N431-F506 HydrophobicContact CB-CD1 4.42Å; L435-F506 HydrophobicContact CD1-CD1 4.37Å; L435-F506 HydrophobicContact CD1-CE1 3.81Å; L435-F506 HydrophobicContact CD1-CZ 4.16Å; L435-F506 HydrophobicContact CD2-CD1 3.95Å; L435-F506 HydrophobicContact CD2-CE1 4.18Å; L435-F506 HydrophobicContact CD2-CG 4.2Å; L435-F506 HydrophobicContact CG-CD1 4.35Å; L435-F506 HydrophobicContact CG-CE1 4.29Å; E494-F506 HydrophobicContact CG-CE1 4.38Å; L497-F506 HydrophobicContact CB-CZ 3.8Å; R498-F506 HydrophobicContact CB-CE2 4.29Å; R498-F506 HydrophobicContact CB-CZ 4.39Å; R498-F506 HydrophobicContact CG-CD2 4.21Å; R498-F506 HydrophobicContact CG-CE1 4.07Å; R498-F506 HydrophobicContact CG-CE2 3.65Å; R498-F506 HydrophobicContact CG-CZ 3.56Å; L501-F506 HydrophobicContact CB-CE2 4.03Å; L501-F506 HydrophobicContact CD1-CE2 4.4Å; L501-F506 HydrophobicContact CD1-CZ 4.46Å; F506-I508 HydrophobicContact CB-CD1 3.81Å; F506-I508 HydrophobicContact CB-CG1 3.8Å; F506-I508 PolarHBondContact O-N 3.18Å
507K62.5Low58.3Low129 Ų129101.8 Ų101.856%0.56158%0.58SS**THydrogen-bonded Turntrans-61.454.1172.8-62.3177.1-174.1170.60110.8D438 A505 A509D438-K507 IonicContact OD1-NZ 2.72Å; D438-K507 IonicContact OD2-NZ 2.89Å; D438-K507 PolarHBondContact OD2-NZ 3.26Å; A505-K507 PolarHBondContact O-N 2.85Å; K507-A509 VanDerWaalsContact C-N 3.31Å; K507-A509 PolarHBondContact O-N 3.34Å
508I53.8Low55.2Low95 Ų95102.7 Ų102.749%0.48759%0.589SS.*  trans-72.797.8171.4-60.7170.4000102.4R498 F506 P510R498-I508 VanDerWaalsContact NH1-CD1 3.29Å; F506-I508 HydrophobicContact CB-CD1 3.81Å; F506-I508 HydrophobicContact CB-CG1 3.8Å; F506-I508 PolarHBondContact O-N 3.18Å; I508-P510 VanDerWaalsContact O-N 3.11Å
509A36.1Very low52.1Low73 Ų73101.9 Ų101.960%0.60360%0.598SS**  trans-45.6125.3165.500000106.6K507 S511K507-A509 VanDerWaalsContact C-N 3.31Å; K507-A509 PolarHBondContact O-N 3.34Å; A509-S511 PolarHBondContact O-N 2.94Å; A509-S511 VanDerWaalsContact O-N 3.07Å
510P30.4Very low49Very low114 Ų114103 Ų10374%0.7460%0.604SS**  trans-52.5127.2171.224.4-31.8000105I508 L512I508-P510 VanDerWaalsContact O-N 3.11Å; P510-L512 VanDerWaalsContact C-N 3.35Å; P510-L512 PolarHBondContact O-N 3.2Å
511S30.1Very low46Very low110 Ų110101.9 Ų101.977%0.76961%0.605SS**  trans-45.3105.117950.10000107.7A509 N513A509-S511 PolarHBondContact O-N 2.94Å; A509-S511 VanDerWaalsContact O-N 3.07Å; S511-N513 PolarHBondContact O-N 3.25Å
512L27.5Very low43.3Very low161 Ų161102.5 Ų102.584%0.84362%0.615SS**  trans-52122.9167.5-103.7139.1000104.5P510 S514P510-L512 VanDerWaalsContact C-N 3.35Å; P510-L512 PolarHBondContact O-N 3.2Å; L512-S514 PolarHBondContact O-N 2.67Å
513N25.8Very low40.7Very low125 Ų125102.7 Ų102.767%0.66861%0.611SS**  trans-35.2136.7-177.4-75.6-33.5000111.1S511 S515S511-N513 PolarHBondContact O-N 3.25Å; N513-S515 PolarHBondContact O-N 3.31Å
514S28.1Very low38.7Very low124 Ų124100.5 Ų100.587%0.86759%0.586SS**THydrogen-bonded Turntrans-50.681.4160.253.50000110.3L512L512-S514 PolarHBondContact O-N 2.67Å
515S27.1Very low36.6Very low76 Ų7692.7 Ų92.753%0.53156%0.559SS.*THydrogen-bonded Turntrans-1652.7172.740.60000115.9N513N513-S515 PolarHBondContact O-N 3.31Å
516T27.1Very low34.6Very low103 Ų10394.4 Ų94.463%0.63256%0.563SS**SBendtrans-142.612.1-178.76.30000117.6
517V29.2Very low32.6Very low140 Ų14098.3 Ų98.385%0.84859%0.587SS**SBendtrans-126.99163.8-172.90000111.8
518S28.1Very low31.1Very low51 Ų5196.3 Ų96.336%0.35758%0.582SS.*SBendtrans-83-16.4164.947.20000113L520S518-L520 PolarHBondContact O-N 3.04Å
519S26.8Very low30Very low76 Ų7698.1 Ų98.153%0.53159%0.593SS.*THydrogen-bonded Turntrans-96.268.1-17260.60000113
520L26.8Very low29.6Very low176 Ų176101.3 Ų101.392%0.92160%0.6SS**THydrogen-bonded Turntrans-177.8-13.4149.2-96.2148.2000115.3S518S518-L520 PolarHBondContact O-N 3.04Å
521S29.2Very low29.5Very low80 Ų80105.4 Ų105.456%0.55961%0.606SS**THydrogen-bonded Turntrans-146.81.8172.460.70000115.4
522S31.7Very low29.5Very low75 Ų75107.2 Ų107.252%0.52461%0.612SS.*SBendtrans-99.7-12.6-167.8-54.80000114.8
523D30.2Very low29.5Very low93 Ų93103 Ų10350%0.49761%0.607SS.*SBendtrans-11619.4-179.7-66.8-37.1000113.4
524M36.5Very low29.6Very low37 Ų37104.4 Ų104.418%0.18262%0.615CS.*SBendtrans-84.8-14.5-170.7-156.8156.283.900115.2L145L145-M524 HydrophobicContact CD1-CG 3.98Å; L145-M524 HydrophobicContact CD2-CE 4.15Å; L145-M524 HydrophobicContact CD2-CG 4.06Å; L145-M524 HydrophobicContact CD2-SD 4.22Å
525F33.8Very low29.6Very low66 Ų66110.6 Ų110.629%0.28962%0.619SS.*SBendtrans-143.88-176.5-76.2-82.3000116.1R124 I125 L145R124-F525 VanDerWaalsContact CZ-O 3.31Å; R124-F525 PolarHBondContact NH1-O 2.82Å; R124-F525 PolarHBondContact NH2-O 2.94Å; I125-F525 HydrophobicContact CD1-CD1 4.34Å; I125-F525 HydrophobicContact CD1-CE1 3.69Å; L145-F525 HydrophobicContact CD2-CE1 4.49Å; L145-F525 HydrophobicContact CD2-CE2 4.14Å; L145-F525 HydrophobicContact CD2-CZ 3.73Å
526I33.5Very low29.9Very low73 Ų73111.7 Ų111.737%0.37463%0.627SS.*  trans-143.183.2175.7-51.1-178.3000109.9
527V29.8Very low30.1Very low88 Ų88111.9 Ų111.953%0.53363%0.632SS.*  trans-93.698.2150.9179.60000105.7N529V527-N529 PolarHBondContact O-N 3.29Å
528N32.2Very low30.4Very low87 Ų87112.2 Ų112.247%0.46564%0.635SS.*  trans-76.1108.8168.2-89.4-28.2000107.8K388K388-N528 WeakPolarHBondContact CE-ND2 3.28Å
529N29.4Very low30.5Very low133 Ų133117.2 Ų117.271%0.71166%0.657SS**  trans-109.771.9161-106.80.2000108.7V527V527-N529 PolarHBondContact O-N 3.29Å
530D28.7Very low31Very low139 Ų139122.2 Ų122.274%0.74367%0.671SS**  trans-105.175160.1-71.9-30.6000107.7
531K28.2Very low31.4Very low200 Ų200117.7 Ų117.787%0.8765%0.654SS**  trans-138.669.4159.4-81.6-163.3178.5-178.30108.4
532V30.2Very low31.9Very low148 Ų148121.8 Ų121.890%0.89766%0.664SS**  trans-141.1119.7164.8-178.60000108.4
533G27.5Very low32.2Very low72 Ų72126.7 Ų126.774%0.74268%0.679SS**  trans10170.3153.700000117.3
534D28.5Very low32.5Very low155 Ų155133.2 Ų133.283%0.82970%0.696SS**  trans-140.975.2139.1-139.2-0.9000110.3
535R27Very low32.7Very low254 Ų254136 Ų13696%0.95872%0.717SS**  trans-141.182.2158-79.5-168.3-178.9-174.70.5106.3
536S33.9Very low33Very low99 Ų99139.5 Ų139.569%0.69274%0.739SS**  trans-117.7126.2162.568.40000109.5
537S31.1Very low33.3Very low107 Ų107144.2 Ų144.275%0.74875%0.753SS**  trans-59.4130179.3470000112.7
538T34.6Very low33.9Very low147 Ų147147.2 Ų147.290%0.90276%0.759SS**  trans-114.498.415431.20000108.8
539L31.3Very low34.4Very low156 Ų156147.7 Ų147.782%0.81777%0.769SS**  trans-79.7118159.5-97.4144000107.1
540H37Very low35.1Very low182 Ų182151 Ų15184%0.84378%0.777SS**  trans-160107.8148.7-100-60.2000111.8
541S35.8Very low36Very low80 Ų80157.3 Ų157.356%0.55981%0.805SS**  trans29.3115.6139.560.40000120.6
542H38.3Very low36.4Very low166 Ų166155.2 Ų155.277%0.76980%0.802SS**  169.8142.198.4-97.5-70.6000112.7
543H38.5Very low36.8Very low179 Ų179155.5 Ų155.583%0.82980%0.797SS**  trans72101.1156.8-81.8-59.6000122.7
544R36.3Very low37.3Very low230 Ų230160.2 Ų160.287%0.86880%0.8SS**  trans-51177.6148.3-89.6-169-176.5-167.12.2114.6
545P40.6Very low37.8Very low94 Ų94160.5 Ų160.561%0.6180%0.798SS**  cis-145-173.9-37.840.8-22.5000113.9
546N41.2Very low38.5Very low141 Ų141154.6 Ų154.675%0.75479%0.788SS**  trans74.2136.3156.3-73-20000116.6
547Y40.2Very low38.8Very low172 Ų172158.3 Ų158.368%0.67580%0.795SS**  cis-168.4152.632.3-143.8-132.6000110.3
548K41.4Very low39.3Very low150 Ų150162 Ų16265%0.65280%0.798SS**  trans43.7117.1146.2-69.7-173.1-174.7169.10120
549S43Very low39.7Very low98 Ų98163.2 Ų163.269%0.68579%0.79SS**  106.5127.670.479.80000112.6
550K44.3Very low40.4Very low203 Ų203163.8 Ų163.888%0.88379%0.788SS**  trans67.596.3154.1-64.6-177.3174.3-175.40118.5
551M48.1Very low40.7Very low270 Ų270162.1 Ų162.1100%1.3378%0.783SS**  -156.6097-115.4-179.9-178.100109.3

Retrieved 551 of 551 residues in 1212 ms (Link to these results)

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