A0A077ZHG0_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZHG0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 322 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
1M49.2Very low55.7Low210 Ų210108.6 Ų108.6100%1.03458%0.575SS**  0-21.90-82.1-166.7-16700112.6I3 C4 F5M1-I3 PolarHBondContact O-N 2.9Å; M1-C4 PolarHBondContact O-N 2.87Å; M1-F5 PolarHBondContact O-N 2.62Å
2D52.7Low56.2Low136 Ų136103.8 Ų103.873%0.72756%0.557SS**Hα-helixtrans-68.7-29.1-169.3-49.8-57.1000115.4F5 S6D2-F5 PolarHBondContact O-N 3.32Å; D2-S6 WeakPolarHBondContact O-CB 3.32Å; D2-S6 PolarHBondContact O-N 3.47Å; D2-S6 PolarHBondContact O-OG 2.93Å
3I57.8Low55.8Low141 Ų141102.2 Ų102.272%0.72354%0.544SS*.Hα-helixtrans-68.7-39.8178.4-57.4174.6000111M1 S6 V7M1-I3 PolarHBondContact O-N 2.9Å; I3-S6 PolarHBondContact O-OG 3.48Å; I3-V7 VanDerWaalsContact O-CG2 3.3Å; I3-V7 WeakPolarHBondContact O-CG2 3.45Å; I3-V7 PolarHBondContact O-N 3.35Å
4C52.8Low56.2Low99 Ų9998.9 Ų98.967%0.66953%0.525SS*.Hα-helixtrans-69.9-39.2178.6-168.70000111.1M1 V7 L8M1-C4 PolarHBondContact O-N 2.87Å; C4-V7 PolarHBondContact O-N 2.92Å; C4-L8 WeakPolarHBondContact O-CB 3.48Å; C4-L8 PolarHBondContact O-N 2.89Å
5F51.1Low56.5Low115 Ų11599.2 Ų99.250%0.50452%0.516SS..Hα-helixtrans-66-44.1178.5-150.7-101.9000112M1 D2 V7 L8 F9M1-F5 PolarHBondContact O-N 2.62Å; D2-F5 PolarHBondContact O-N 3.32Å; F5-V7 PolarHBondContact O-N 3.36Å; F5-L8 WeakPolarHBondContact O-CB 3.24Å; F5-L8 PolarHBondContact O-N 3.04Å; F5-F9 AromaticContact CD1-CD2 3.72Å; F5-F9 HydrophobicContact CD1-CD2 3.72Å; F5-F9 AromaticContact CD1-CE2 3.63Å; F5-F9 HydrophobicContact CD1-CE2 3.63Å; F5-F9 AromaticContact CE1-CD2 3.71Å; F5-F9 HydrophobicContact CE1-CD2 3.71Å; F5-F9 AromaticContact CE1-CE2 3.1Å; F5-F9 HydrophobicContact CE1-CE2 3.1Å; F5-F9 AromaticContact CE1-CZ 3.9Å; F5-F9 HydrophobicContact CE1-CZ 3.9Å; F5-F9 HydrophobicContact CE2-CE2 4.2Å; F5-F9 HydrophobicContact CG-CD2 4.38Å; F5-F9 HydrophobicContact CG-CE2 4.38Å; F5-F9 HydrophobicContact CZ-CD2 4.33Å; F5-F9 AromaticContact CZ-CE2 3.44Å; F5-F9 HydrophobicContact CZ-CE2 3.44Å; F5-F9 VanDerWaalsContact CZ-CE2 3.44Å; F5-F9 HydrophobicContact CZ-CZ 4.18Å; F5-F9 WeakPolarHBondContact O-CD2 3.04Å; F5-F9 PolarHBondContact O-N 2.78Å
6S61.7Low56.6Low67 Ų6795.1 Ų95.147%0.46950%0.497SS..Hα-helixtrans-64.4-37.2177.756.10000113.3D2 I3 F9 K10D2-S6 WeakPolarHBondContact O-CB 3.32Å; D2-S6 PolarHBondContact O-N 3.47Å; D2-S6 PolarHBondContact O-OG 2.93Å; I3-S6 PolarHBondContact O-OG 3.48Å; S6-F9 PolarHBondContact O-N 3Å; S6-K10 PolarHBondContact O-N 3.01Å
7V61.7Low56.9Low90 Ų9095.9 Ų95.955%0.54550%0.5SS..Hα-helixtrans-66.6-41174.3173.80000111.2I3 C4 F5 F9 K10I3-V7 VanDerWaalsContact O-CG2 3.3Å; I3-V7 WeakPolarHBondContact O-CG2 3.45Å; I3-V7 PolarHBondContact O-N 3.35Å; C4-V7 PolarHBondContact O-N 2.92Å; F5-V7 PolarHBondContact O-N 3.36Å; V7-F9 VanDerWaalsContact C-N 3.33Å; V7-F9 PolarHBondContact O-N 2.98Å; V7-K10 WeakPolarHBondContact O-CB 3.4Å; V7-K10 PolarHBondContact O-N 3.35Å
8L48.7Very low57.3Low85 Ų8596.1 Ų96.145%0.44549%0.494SS..Hα-helixtrans-61.9-40.7177.5-161.376.4000111.6C4 F5 K10 S11 I14C4-L8 WeakPolarHBondContact O-CB 3.48Å; C4-L8 PolarHBondContact O-N 2.89Å; F5-L8 WeakPolarHBondContact O-CB 3.24Å; F5-L8 PolarHBondContact O-N 3.04Å; L8-K10 VanDerWaalsContact C-N 3.3Å; L8-K10 PolarHBondContact O-N 2.85Å; L8-S11 PolarHBondContact O-N 3.49Å; L8-I14 HydrophobicContact CD1-CD1 3.64Å; L8-I14 HydrophobicContact CD2-CG2 4.09Å; L8-I14 HydrophobicContact CG-CD1 3.76Å; L8-I14 HydrophobicContact CG-CG1 4.39Å; L8-I14 HydrophobicContact CG-CG2 3.97Å; L8-I14 WeakPolarHBondContact O-CD1 3.38Å
9F52Low57.8Low40 Ų4095.9 Ų95.918%0.17549%0.491CS..Hα-helixtrans-74.4-9.8177.5-90.8-92.1000115.5F5 S6 V7 S11 R15 Y18F5-F9 AromaticContact CD1-CD2 3.72Å; F5-F9 HydrophobicContact CD1-CD2 3.72Å; F5-F9 AromaticContact CD1-CE2 3.63Å; F5-F9 HydrophobicContact CD1-CE2 3.63Å; F5-F9 AromaticContact CE1-CD2 3.71Å; F5-F9 HydrophobicContact CE1-CD2 3.71Å; F5-F9 AromaticContact CE1-CE2 3.1Å; F5-F9 HydrophobicContact CE1-CE2 3.1Å; F5-F9 AromaticContact CE1-CZ 3.9Å; F5-F9 HydrophobicContact CE1-CZ 3.9Å; F5-F9 HydrophobicContact CE2-CE2 4.2Å; F5-F9 HydrophobicContact CG-CD2 4.38Å; F5-F9 HydrophobicContact CG-CE2 4.38Å; F5-F9 HydrophobicContact CZ-CD2 4.33Å; F5-F9 AromaticContact CZ-CE2 3.44Å; F5-F9 HydrophobicContact CZ-CE2 3.44Å; F5-F9 VanDerWaalsContact CZ-CE2 3.44Å; F5-F9 HydrophobicContact CZ-CZ 4.18Å; F5-F9 WeakPolarHBondContact O-CD2 3.04Å; F5-F9 PolarHBondContact O-N 2.78Å; S6-F9 PolarHBondContact O-N 3Å; V7-F9 VanDerWaalsContact C-N 3.33Å; V7-F9 PolarHBondContact O-N 2.98Å; F9-S11 PolarHBondContact O-N 3.1Å; F9-R15 HydrophobicContact CD1-CB 4.06Å; F9-R15 HydrophobicContact CD1-CG 4.09Å; F9-R15 HydrophobicContact CE1-CG 4.41Å; F9-R15 PolarHBondContact O-NH1 3.27Å; F9-Y18 AromaticContact CE1-CD1 3.53Å; F9-Y18 HydrophobicContact CE1-CD1 3.53Å; F9-Y18 HydrophobicContact CE1-CD2 4.44Å; F9-Y18 HydrophobicContact CE1-CE1 4.12Å; F9-Y18 AromaticContact CE1-CG 3.7Å; F9-Y18 HydrophobicContact CE1-CG 3.7Å; F9-Y18 AromaticContact CZ-CD1 3.51Å; F9-Y18 HydrophobicContact CZ-CD1 3.51Å; F9-Y18 AromaticContact CZ-CD2 3.64Å; F9-Y18 HydrophobicContact CZ-CD2 3.64Å; F9-Y18 AromaticContact CZ-CE1 3.9Å; F9-Y18 HydrophobicContact CZ-CE1 3.9Å; F9-Y18 HydrophobicContact CZ-CE2 4.03Å; F9-Y18 AromaticContact CZ-CG 3.35Å; F9-Y18 HydrophobicContact CZ-CG 3.35Å
10K64Low58Low170 Ų17092.4 Ų92.474%0.73947%0.473SS*.Hα-helixtrans-63.7-32.7169.9-77.9-175.9175.1-179.20111.2S6 V7 L8 S12S6-K10 PolarHBondContact O-N 3.01Å; V7-K10 WeakPolarHBondContact O-CB 3.4Å; V7-K10 PolarHBondContact O-N 3.35Å; L8-K10 VanDerWaalsContact C-N 3.3Å; L8-K10 PolarHBondContact O-N 2.85Å; K10-S12 PolarHBondContact O-N 2.86Å
11S61.7Low58.1Low42 Ų4291.3 Ų91.329%0.29447%0.473SS..SBendtrans-67.3118174.4-178.50000110.3L8 F9 H13 I14 R15L8-S11 PolarHBondContact O-N 3.49Å; F9-S11 PolarHBondContact O-N 3.1Å; S11-H13 PolarHBondContact O-N 3.3Å; S11-H13 VanDerWaalsContact O-N 3.15Å; S11-I14 PolarHBondContact O-N 3.03Å; S11-R15 PolarHBondContact O-N 3.41Å; S11-R15 VanDerWaalsContact O-N 3.16Å
12S60.7Low59.1Low51 Ų5185 Ų8536%0.35744%0.443SS..Hα-helixtrans-54.4-31174.354.20000112K10 T16K10-S12 PolarHBondContact O-N 2.86Å; S12-T16 WeakPolarHBondContact O-CB 3.47Å; S12-T16 PolarHBondContact O-N 3.39Å; S12-T16 PolarHBondContact O-OG1 2.8Å
13H51.3Low59.6Low83 Ų8379 Ų7938%0.38441%0.412SS..Hα-helixtrans-68-49.8179.4-54.1-79.9000112.3S11 R15 T16 I17 H133S11-H13 PolarHBondContact O-N 3.3Å; S11-H13 VanDerWaalsContact O-N 3.15Å; H13-R15 VanDerWaalsContact C-N 3.35Å; H13-R15 PolarHBondContact O-N 3.05Å; H13-T16 PolarHBondContact O-N 2.77Å; H13-I17 WeakPolarHBondContact O-CG1 3.46Å; H13-I17 PolarHBondContact O-N 3.46Å; H13-H133 AromaticContact CE1-NE2 3.74Å
14I62Low59.7Low55 Ų5574.4 Ų74.428%0.28239%0.392SS..Hα-helixtrans-66.7-39.9179.5-72.7143.4000110.7L8 S11 T16 I17 Y18L8-I14 HydrophobicContact CD1-CD1 3.64Å; L8-I14 HydrophobicContact CD2-CG2 4.09Å; L8-I14 HydrophobicContact CG-CD1 3.76Å; L8-I14 HydrophobicContact CG-CG1 4.39Å; L8-I14 HydrophobicContact CG-CG2 3.97Å; L8-I14 WeakPolarHBondContact O-CD1 3.38Å; S11-I14 PolarHBondContact O-N 3.03Å; I14-T16 VanDerWaalsContact C-N 3.29Å; I14-T16 PolarHBondContact O-N 3.23Å; I14-I17 PolarHBondContact O-N 2.89Å; I14-Y18 VanDerWaalsContact O-CB 3.28Å; I14-Y18 WeakPolarHBondContact O-CB 3.38Å; I14-Y18 PolarHBondContact O-N 2.8Å
15R60.7Low60.3Low104 Ų10473.1 Ų73.139%0.39238%0.381SS..Hα-helixtrans-60.7-40.6175.5-174.4167.959.4-1182.9111.5F9 S11 H13 Y18 H19F9-R15 HydrophobicContact CD1-CB 4.06Å; F9-R15 HydrophobicContact CD1-CG 4.09Å; F9-R15 HydrophobicContact CE1-CG 4.41Å; F9-R15 PolarHBondContact O-NH1 3.27Å; S11-R15 PolarHBondContact O-N 3.41Å; S11-R15 VanDerWaalsContact O-N 3.16Å; H13-R15 VanDerWaalsContact C-N 3.35Å; H13-R15 PolarHBondContact O-N 3.05Å; R15-Y18 PolarHBondContact O-N 3.33Å; R15-H19 WeakPolarHBondContact CG-NE2 3.25Å; R15-H19 WeakPolarHBondContact O-CB 3.06Å; R15-H19 PolarHBondContact O-CD2 3.12Å; R15-H19 PolarHBondContact O-N 3.47Å
16T57.6Low61.1Low34 Ų3470.3 Ų70.321%0.20937%0.374CS..Hα-helixtrans-64.8-48.6175.9-55.70000111.3S12 H13 I14 Y18 H19 I20S12-T16 WeakPolarHBondContact O-CB 3.47Å; S12-T16 PolarHBondContact O-N 3.39Å; S12-T16 PolarHBondContact O-OG1 2.8Å; H13-T16 PolarHBondContact O-N 2.77Å; I14-T16 VanDerWaalsContact C-N 3.29Å; I14-T16 PolarHBondContact O-N 3.23Å; T16-Y18 VanDerWaalsContact C-N 3.3Å; T16-Y18 PolarHBondContact O-N 2.89Å; T16-H19 PolarHBondContact O-N 3.41Å; T16-I20 HydrophobicContact CG2-CD1 3.82Å; T16-I20 HydrophobicContact CG2-CG1 4.48Å; T16-I20 WeakPolarHBondContact O-CB 3.39Å; T16-I20 WeakPolarHBondContact O-CD1 3.21Å; T16-I20 WeakPolarHBondContact O-CG1 3.16Å; T16-I20 PolarHBondContact O-N 2.92Å
17I61.8Low61.3Low109 Ų10967.6 Ų67.656%0.55935%0.354SS*.Hα-helixtrans-60.2-41.1176.8-66.1167.2000111.1H13 I14 I20 C21H13-I17 WeakPolarHBondContact O-CG1 3.46Å; H13-I17 PolarHBondContact O-N 3.46Å; I14-I17 PolarHBondContact O-N 2.89Å; I17-I20 WeakPolarHBondContact O-CB 3.16Å; I17-I20 PolarHBondContact O-N 3.16Å; I17-C21 WeakPolarHBondContact O-CB 3.33Å; I17-C21 PolarHBondContact O-N 3.14Å
18Y64.1Low61.6Low99 Ų9966.4 Ų66.439%0.38834%0.344SS..Hα-helixtrans-64.8-47.4176.7176.7-97000112F9 I14 R15 T16 I20 C21 L22F9-Y18 AromaticContact CE1-CD1 3.53Å; F9-Y18 HydrophobicContact CE1-CD1 3.53Å; F9-Y18 HydrophobicContact CE1-CD2 4.44Å; F9-Y18 HydrophobicContact CE1-CE1 4.12Å; F9-Y18 AromaticContact CE1-CG 3.7Å; F9-Y18 HydrophobicContact CE1-CG 3.7Å; F9-Y18 AromaticContact CZ-CD1 3.51Å; F9-Y18 HydrophobicContact CZ-CD1 3.51Å; F9-Y18 AromaticContact CZ-CD2 3.64Å; F9-Y18 HydrophobicContact CZ-CD2 3.64Å; F9-Y18 AromaticContact CZ-CE1 3.9Å; F9-Y18 HydrophobicContact CZ-CE1 3.9Å; F9-Y18 HydrophobicContact CZ-CE2 4.03Å; F9-Y18 AromaticContact CZ-CG 3.35Å; F9-Y18 HydrophobicContact CZ-CG 3.35Å; I14-Y18 VanDerWaalsContact O-CB 3.28Å; I14-Y18 WeakPolarHBondContact O-CB 3.38Å; I14-Y18 PolarHBondContact O-N 2.8Å; R15-Y18 PolarHBondContact O-N 3.33Å; T16-Y18 VanDerWaalsContact C-N 3.3Å; T16-Y18 PolarHBondContact O-N 2.89Å; Y18-I20 PolarHBondContact O-N 2.78Å; Y18-C21 PolarHBondContact O-N 3.46Å; Y18-L22 HydrophobicContact CE1-CD2 3.92Å; Y18-L22 VanDerWaalsContact O-CB 3.22Å; Y18-L22 WeakPolarHBondContact O-CB 3.13Å; Y18-L22 PolarHBondContact O-N 3.22Å
19H67.7Low62.6Low92 Ų9265.7 Ų65.743%0.42634%0.343SS..Hα-helixtrans-62.1-34.7175-73.2-58.1000111.8R15 T16 A23R15-H19 WeakPolarHBondContact CG-NE2 3.25Å; R15-H19 WeakPolarHBondContact O-CB 3.06Å; R15-H19 PolarHBondContact O-CD2 3.12Å; R15-H19 PolarHBondContact O-N 3.47Å; T16-H19 PolarHBondContact O-N 3.41Å; H19-A23 WeakPolarHBondContact O-CB 3.44Å; H19-A23 PolarHBondContact O-N 3.46Å
20I61.3Low63.2Low26 Ų2668.3 Ų68.313%0.13336%0.357CS..Hα-helixtrans-64.8-51.1173.6-69.4162.1000110.8T16 I17 Y18 A23 S24 S64 L67T16-I20 HydrophobicContact CG2-CD1 3.82Å; T16-I20 HydrophobicContact CG2-CG1 4.48Å; T16-I20 WeakPolarHBondContact O-CB 3.39Å; T16-I20 WeakPolarHBondContact O-CD1 3.21Å; T16-I20 WeakPolarHBondContact O-CG1 3.16Å; T16-I20 PolarHBondContact O-N 2.92Å; I17-I20 WeakPolarHBondContact O-CB 3.16Å; I17-I20 PolarHBondContact O-N 3.16Å; Y18-I20 PolarHBondContact O-N 2.78Å; I20-A23 PolarHBondContact O-N 3.42Å; I20-S24 VanDerWaalsContact O-CB 3.3Å; I20-S24 WeakPolarHBondContact O-CB 3.36Å; I20-S24 PolarHBondContact O-N 3.33Å; I20-S24 PolarHBondContact O-OG 3.11Å; I20-S64 VanDerWaalsContact CG1-OG 3.32Å; I20-S64 WeakPolarHBondContact CG1-OG 3.09Å; I20-L67 HydrophobicContact CG2-CD2 4.2Å
21C60.3Low63.1Low70 Ų7060.7 Ų60.747%0.47333%0.325SS..Hα-helixtrans-63.8-41.9-179.9-1710000111.4I17 Y18 S24 V25I17-C21 WeakPolarHBondContact O-CB 3.33Å; I17-C21 PolarHBondContact O-N 3.14Å; Y18-C21 PolarHBondContact O-N 3.46Å; C21-S24 WeakPolarHBondContact CA-OG 3.49Å; C21-S24 PolarHBondContact O-N 2.97Å; C21-S24 PolarHBondContact O-OG 3.11Å; C21-V25 WeakPolarHBondContact O-CB 3.41Å; C21-V25 WeakPolarHBondContact O-CG2 3.3Å; C21-V25 PolarHBondContact O-N 2.97Å
22L69Low63.3Low77 Ų7760.9 Ų60.940%0.40332%0.322SS..Hα-helixtrans-66.2-44.9176.5-176.363.8000111.1Y18 T26Y18-L22 HydrophobicContact CE1-CD2 3.92Å; Y18-L22 VanDerWaalsContact O-CB 3.22Å; Y18-L22 WeakPolarHBondContact O-CB 3.13Å; Y18-L22 PolarHBondContact O-N 3.22Å; L22-T26 WeakPolarHBondContact O-CB 3.28Å; L22-T26 PolarHBondContact O-N 3.28Å; L22-T26 PolarHBondContact O-OG1 3.01Å
23A63.8Low63.6Low10 Ų1062.6 Ų62.68%0.08333%0.326CS..Hα-helixtrans-64.1-41.717700000111.4H19 I20 L27H19-A23 WeakPolarHBondContact O-CB 3.44Å; H19-A23 PolarHBondContact O-N 3.46Å; I20-A23 PolarHBondContact O-N 3.42Å; A23-L27 WeakPolarHBondContact O-CB 3.38Å; A23-L27 WeakPolarHBondContact O-CG 3.24Å; A23-L27 PolarHBondContact O-N 3.02Å
24S60.2Low64.2Low44 Ų4459.9 Ų59.931%0.30831%0.314SS..Hα-helixtrans-67.8-42179.270.40000111.9I20 C21 L28I20-S24 VanDerWaalsContact O-CB 3.3Å; I20-S24 WeakPolarHBondContact O-CB 3.36Å; I20-S24 PolarHBondContact O-N 3.33Å; I20-S24 PolarHBondContact O-OG 3.11Å; C21-S24 WeakPolarHBondContact CA-OG 3.49Å; C21-S24 PolarHBondContact O-N 2.97Å; C21-S24 PolarHBondContact O-OG 3.11Å; S24-L28 WeakPolarHBondContact O-CA 3.48Å; S24-L28 WeakPolarHBondContact O-CB 3.4Å; S24-L28 PolarHBondContact O-N 3.38Å
25V66Low64.1Low73 Ų7359.1 Ų59.144%0.44231%0.31SS..Hα-helixtrans-69.2-46175.6172.80000110.9C21 L27 L28 V29C21-V25 WeakPolarHBondContact O-CB 3.41Å; C21-V25 WeakPolarHBondContact O-CG2 3.3Å; C21-V25 PolarHBondContact O-N 2.97Å; V25-L27 VanDerWaalsContact C-N 3.3Å; V25-L27 PolarHBondContact O-N 3.43Å; V25-L28 PolarHBondContact O-N 2.85Å; V25-V29 HydrophobicContact CG1-CG2 4.4Å; V25-V29 WeakPolarHBondContact O-CB 3.13Å; V25-V29 VanDerWaalsContact O-CG2 3.27Å; V25-V29 WeakPolarHBondContact O-CG2 3.49Å; V25-V29 PolarHBondContact O-N 3.05Å
26T67.9Low64.3Low56 Ų5661.3 Ų61.334%0.34432%0.324SS..Hα-helixtrans-62.2-40.4179.3-52.90000110.7L22 M30L22-T26 WeakPolarHBondContact O-CB 3.28Å; L22-T26 PolarHBondContact O-N 3.28Å; L22-T26 PolarHBondContact O-OG1 3.01Å; T26-M30 WeakPolarHBondContact O-CB 3.5Å; T26-M30 PolarHBondContact O-N 3.32Å
27L65.1Low64.5Low9 Ų965.4 Ų65.45%0.04734%0.344CS..Hα-helixtrans-78.6-29.5176-76.1165.7000113.4A23 V25 V29 N31 F54 I68A23-L27 WeakPolarHBondContact O-CB 3.38Å; A23-L27 WeakPolarHBondContact O-CG 3.24Å; A23-L27 PolarHBondContact O-N 3.02Å; V25-L27 VanDerWaalsContact C-N 3.3Å; V25-L27 PolarHBondContact O-N 3.43Å; L27-V29 VanDerWaalsContact C-N 3.34Å; L27-N31 WeakPolarHBondContact O-CA 3.47Å; L27-N31 WeakPolarHBondContact O-CB 3.35Å; L27-N31 PolarHBondContact O-N 3.31Å; L27-N31 PolarHBondContact O-ND2 3.19Å; L27-F54 HydrophobicContact CD1-CD1 3.78Å; L27-F54 HydrophobicContact CD1-CE1 3.75Å; L27-F54 HydrophobicContact CD2-CD1 4.02Å; L27-F54 HydrophobicContact CD2-CE1 4.29Å; L27-F54 HydrophobicContact CD2-CG 4.25Å; L27-F54 HydrophobicContact CG-CD1 4.2Å; L27-F54 HydrophobicContact CG-CE1 4.04Å; L27-I68 HydrophobicContact CD1-CB 4.11Å; L27-I68 HydrophobicContact CD1-CD1 3.11Å; L27-I68 HydrophobicContact CD1-CG1 3.23Å; L27-I68 HydrophobicContact CD1-CG2 3.75Å
28L68.3Low64.3Low65 Ų6561.3 Ų61.334%0.3432%0.323SS..Hα-helixtrans-59.8-52.3168.2-176.769.6000108S24 V25 N31 L32S24-L28 WeakPolarHBondContact O-CA 3.48Å; S24-L28 WeakPolarHBondContact O-CB 3.4Å; S24-L28 PolarHBondContact O-N 3.38Å; V25-L28 PolarHBondContact O-N 2.85Å; L28-N31 PolarHBondContact O-N 3.39Å; L28-L32 HydrophobicContact CD1-CD1 4.38Å; L28-L32 HydrophobicContact CD1-CG 4.4Å; L28-L32 HydrophobicContact CG-CD1 3.9Å; L28-L32 HydrophobicContact CG-CG 4.31Å; L28-L32 VanDerWaalsContact O-CB 3.25Å; L28-L32 WeakPolarHBondContact O-CB 3.27Å; L28-L32 WeakPolarHBondContact O-CG 3.06Å; L28-L32 PolarHBondContact O-N 3.36Å
29V68.9Low64.2Low71 Ų7162 Ų6243%0.4334%0.338SS..Hα-helixtrans-61-48.9178.3174.50000111.9V25 L27 N31 L32 I33V25-V29 HydrophobicContact CG1-CG2 4.4Å; V25-V29 WeakPolarHBondContact O-CB 3.13Å; V25-V29 VanDerWaalsContact O-CG2 3.27Å; V25-V29 WeakPolarHBondContact O-CG2 3.49Å; V25-V29 PolarHBondContact O-N 3.05Å; L27-V29 VanDerWaalsContact C-N 3.34Å; V29-N31 PolarHBondContact O-N 3.43Å; V29-L32 PolarHBondContact O-N 2.85Å; V29-I33 HydrophobicContact CG1-CD1 3.76Å; V29-I33 HydrophobicContact CG1-CG1 4.45Å; V29-I33 VanDerWaalsContact O-CG1 3.28Å; V29-I33 WeakPolarHBondContact O-CG1 3.06Å; V29-I33 PolarHBondContact O-N 3.23Å
30M65.5Low63.9Low94 Ų9468.9 Ų68.946%0.46336%0.36SS..Hα-helixtrans-59.1-48.2175.5-92.8-160.4132.600111.2T26 L32 I33 I34T26-M30 WeakPolarHBondContact O-CB 3.5Å; T26-M30 PolarHBondContact O-N 3.32Å; M30-L32 VanDerWaalsContact C-N 3.28Å; M30-L32 PolarHBondContact O-N 2.78Å; M30-I33 PolarHBondContact O-N 2.76Å; M30-I34 HydrophobicContact CB-CD1 4.37Å; M30-I34 WeakPolarHBondContact O-CB 3.23Å; M30-I34 WeakPolarHBondContact O-CD1 3.02Å; M30-I34 WeakPolarHBondContact O-CG1 3.19Å; M30-I34 PolarHBondContact O-N 2.88Å
31N61.5Low63.8Low11 Ų1169.3 Ų69.36%0.05937%0.371CS..Hα-helixtrans-65.2-32.8179.2-73.3-42.1000112.1L27 L28 V29 Q35 K75L27-N31 WeakPolarHBondContact O-CA 3.47Å; L27-N31 WeakPolarHBondContact O-CB 3.35Å; L27-N31 PolarHBondContact O-N 3.31Å; L27-N31 PolarHBondContact O-ND2 3.19Å; L28-N31 PolarHBondContact O-N 3.39Å; V29-N31 PolarHBondContact O-N 3.43Å; N31-Q35 WeakPolarHBondContact O-CB 3.23Å; N31-Q35 PolarHBondContact O-N 3.25Å; N31-K75 PolarHBondContact ND2-NZ 2.88Å
32L64.9Low63.8Low45 Ų4570.2 Ų70.224%0.23638%0.378CS..Hα-helixtrans-67.6-47.4175.3-74.5174.5000110.8L28 V29 M30 Q35 E36 F92 I96L28-L32 HydrophobicContact CD1-CD1 4.38Å; L28-L32 HydrophobicContact CD1-CG 4.4Å; L28-L32 HydrophobicContact CG-CD1 3.9Å; L28-L32 HydrophobicContact CG-CG 4.31Å; L28-L32 VanDerWaalsContact O-CB 3.25Å; L28-L32 WeakPolarHBondContact O-CB 3.27Å; L28-L32 WeakPolarHBondContact O-CG 3.06Å; L28-L32 PolarHBondContact O-N 3.36Å; V29-L32 PolarHBondContact O-N 2.85Å; M30-L32 VanDerWaalsContact C-N 3.28Å; M30-L32 PolarHBondContact O-N 2.78Å; L32-Q35 PolarHBondContact O-N 2.83Å; L32-E36 WeakPolarHBondContact O-CB 3.35Å; L32-E36 PolarHBondContact O-N 2.81Å; L32-F92 HydrophobicContact CD2-CE2 4.3Å; L32-F92 HydrophobicContact CD2-CZ 3.97Å; L32-I96 HydrophobicContact CD2-CD1 4.26Å
33I67.5Low63.6Low88 Ų8874.8 Ų74.845%0.45139%0.39SS..Hα-helixtrans-61.3-46.3175.2-67.7167.2000110.1V29 M30 Q35 E36 L37V29-I33 HydrophobicContact CG1-CD1 3.76Å; V29-I33 HydrophobicContact CG1-CG1 4.45Å; V29-I33 VanDerWaalsContact O-CG1 3.28Å; V29-I33 WeakPolarHBondContact O-CG1 3.06Å; V29-I33 PolarHBondContact O-N 3.23Å; M30-I33 PolarHBondContact O-N 2.76Å; I33-Q35 PolarHBondContact O-N 3.39Å; I33-E36 PolarHBondContact O-N 3.04Å; I33-L37 HydrophobicContact CG2-CD1 3.7Å; I33-L37 HydrophobicContact CG2-CG 4.47Å; I33-L37 WeakPolarHBondContact O-CB 3.06Å; I33-L37 WeakPolarHBondContact O-CD1 3.48Å; I33-L37 VanDerWaalsContact O-CG 3.24Å; I33-L37 WeakPolarHBondContact O-CG 3.49Å; I33-L37 PolarHBondContact O-N 3.35Å
34I63.6Low63.8Low25 Ų2577.6 Ų77.613%0.12840%0.403CS..Hα-helixtrans-61.4-43.2176.6-72.2164.8000110.4M30 L37 I38 F47 L50M30-I34 HydrophobicContact CB-CD1 4.37Å; M30-I34 WeakPolarHBondContact O-CB 3.23Å; M30-I34 WeakPolarHBondContact O-CD1 3.02Å; M30-I34 WeakPolarHBondContact O-CG1 3.19Å; M30-I34 PolarHBondContact O-N 2.88Å; I34-L37 PolarHBondContact O-N 3.39Å; I34-I38 HydrophobicContact CG2-CD1 3.27Å; I34-I38 HydrophobicContact CG2-CG1 4.07Å; I34-I38 WeakPolarHBondContact O-CB 3.31Å; I34-I38 WeakPolarHBondContact O-CG1 3.32Å; I34-I38 PolarHBondContact O-N 2.88Å; I34-F47 HydrophobicContact CG2-CD1 4.41Å; I34-F47 HydrophobicContact CG2-CE1 3.91Å; I34-F47 HydrophobicContact CG2-CE2 4.2Å; I34-F47 HydrophobicContact CG2-CZ 3.8Å; I34-L50 HydrophobicContact CD1-CD1 3.62Å; I34-L50 HydrophobicContact CG1-CD1 4.36Å
35Q61.4Low64.3Low40 Ų4077.6 Ų77.619%0.18741%0.406CS..Hα-helixtrans-64.4-43.1177.5-172.6-178.7-22.900111.6N31 L32 I33 L37 I38 T39 F47N31-Q35 WeakPolarHBondContact O-CB 3.23Å; N31-Q35 PolarHBondContact O-N 3.25Å; L32-Q35 PolarHBondContact O-N 2.83Å; I33-Q35 PolarHBondContact O-N 3.39Å; Q35-L37 VanDerWaalsContact C-N 3.33Å; Q35-L37 PolarHBondContact O-N 2.9Å; Q35-I38 PolarHBondContact O-N 2.81Å; Q35-T39 PolarHBondContact O-N 2.87Å; Q35-T39 PolarHBondContact O-OG1 3.34Å; Q35-F47 HydrophobicContact CB-CZ 3.98Å; Q35-F47 HydrophobicContact CG-CZ 4.48Å
36E64.3Low64.7Low149 Ų14975.3 Ų75.370%0.69640%0.395SS*.Hα-helixtrans-62-40.9176.1-171.3169-171.700111.8L32 I33L32-E36 WeakPolarHBondContact O-CB 3.35Å; L32-E36 PolarHBondContact O-N 2.81Å; I33-E36 PolarHBondContact O-N 3.04Å
37L61.7Low65Low120 Ų12074.3 Ų74.363%0.62839%0.386SS*.Hα-helixtrans-70.1-39.6175.5-70165.7000112.7I33 I34 Q35I33-L37 HydrophobicContact CG2-CD1 3.7Å; I33-L37 HydrophobicContact CG2-CG 4.47Å; I33-L37 WeakPolarHBondContact O-CB 3.06Å; I33-L37 WeakPolarHBondContact O-CD1 3.48Å; I33-L37 VanDerWaalsContact O-CG 3.24Å; I33-L37 WeakPolarHBondContact O-CG 3.49Å; I33-L37 PolarHBondContact O-N 3.35Å; I34-L37 PolarHBondContact O-N 3.39Å; Q35-L37 VanDerWaalsContact C-N 3.33Å; Q35-L37 PolarHBondContact O-N 2.9Å
38I56.8Low65.6Low24 Ų2476.8 Ų76.812%0.12340%0.398CS..Hα-helixtrans-84.6-23.5-172.7-70.8178.3000113.4I34 Q35 R40 G41 W43 A46 F47I34-I38 HydrophobicContact CG2-CD1 3.27Å; I34-I38 HydrophobicContact CG2-CG1 4.07Å; I34-I38 WeakPolarHBondContact O-CB 3.31Å; I34-I38 WeakPolarHBondContact O-CG1 3.32Å; I34-I38 PolarHBondContact O-N 2.88Å; Q35-I38 PolarHBondContact O-N 2.81Å; I38-R40 PolarHBondContact O-N 3.25Å; I38-G41 CarbonylContact O-C 3.36Å; I38-G41 PolarHBondContact O-N 2.84Å; I38-W43 HydrophobicContact CD1-CB 3.96Å; I38-W43 HydrophobicContact CG1-CB 4.29Å; I38-A46 HydrophobicContact CD1-CB 4.06Å; I38-F47 HydrophobicContact CB-CE2 4.17Å; I38-F47 HydrophobicContact CD1-CD2 3.91Å; I38-F47 HydrophobicContact CD1-CE2 3.65Å; I38-F47 HydrophobicContact CD1-CZ 4.34Å; I38-F47 HydrophobicContact CG2-CE2 3.95Å
39T62.5Low66.3Low114 Ų11480.5 Ų80.570%0.69941%0.412SS*.THydrogen-bonded Turntrans-56.7-16.9173.3-47.10000111.4Q35Q35-T39 PolarHBondContact O-N 2.87Å; Q35-T39 PolarHBondContact O-OG1 3.34Å
40R61.1Low67Low236 Ų23681 Ų8189%0.89141%0.412SS*.THydrogen-bonded Turntrans-89-13.5174.3-59.8-173.4178.2-164.3-0.3115.6I38I38-R40 PolarHBondContact O-N 3.25Å
41G58.8Low68Low35 Ų3576.6 Ų76.636%0.36139%0.39SS..SBendtrans-173.9112-178.300000111.7I38 W43I38-G41 CarbonylContact O-C 3.36Å; I38-G41 PolarHBondContact O-N 2.84Å; G41-W43 PolarHBondContact O-N 2.78Å
42S61.7Low69.1Low89 Ų8977.6 Ų77.662%0.62240%0.395SS*.  trans-63.794.7-163.1174.70000115.6
43W64.1Low70.1Confident173 Ų17381.2 Ų81.266%0.65541%0.41SS*.  trans-103.163.8167.5-5795.8000111.9I38 G41 A45 A46 F47I38-W43 HydrophobicContact CD1-CB 3.96Å; I38-W43 HydrophobicContact CG1-CB 4.29Å; G41-W43 PolarHBondContact O-N 2.78Å; W43-A45 PolarHBondContact O-N 2.58Å; W43-A45 VanDerWaalsContact O-N 3.16Å; W43-A46 HydrophobicContact CB-CB 3.73Å; W43-A46 WeakPolarHBondContact O-CB 3.19Å; W43-A46 PolarHBondContact O-N 3.15Å; W43-F47 PolarHBondContact O-N 3.46Å
44I68.1Low70.9Confident68 Ų6878.7 Ų78.735%0.34940%0.397SS..Hα-helixtrans-52.3-36.6171.4-64.7169000110.6A46 F47 I48I44-A46 VanDerWaalsContact C-N 3.31Å; I44-A46 PolarHBondContact O-N 3.49Å; I44-F47 PolarHBondContact O-N 3.45Å; I44-I48 HydrophobicContact CG2-CD1 4.26Å; I44-I48 PolarHBondContact O-N 2.9Å
45A69.6Low71.9Confident45 Ų4577.5 Ų77.537%0.37239%0.39SS..Hα-helixtrans-54.7-43.1173.100000112.5W43 F47 I48 F49W43-A45 PolarHBondContact O-N 2.58Å; W43-A45 VanDerWaalsContact O-N 3.16Å; A45-F47 VanDerWaalsContact C-N 3.33Å; A45-F47 PolarHBondContact O-N 3.04Å; A45-I48 PolarHBondContact O-N 3.23Å; A45-F49 HydrophobicContact CB-CD2 3.96Å; A45-F49 HydrophobicContact CB-CE2 3.97Å; A45-F49 WeakPolarHBondContact O-CD2 3.36Å; A45-F49 PolarHBondContact O-N 2.86Å
46A74.7Confident73Confident25 Ų2580.6 Ų80.621%0.20741%0.407CS..Hα-helixtrans-63.8-37.7179.700000112.1I38 W43 I44 I48 L50I38-A46 HydrophobicContact CD1-CB 4.06Å; W43-A46 HydrophobicContact CB-CB 3.73Å; W43-A46 WeakPolarHBondContact O-CB 3.19Å; W43-A46 PolarHBondContact O-N 3.15Å; I44-A46 VanDerWaalsContact C-N 3.31Å; I44-A46 PolarHBondContact O-N 3.49Å; A46-I48 PolarHBondContact O-N 3.42Å; A46-L50 HydrophobicContact CB-CD1 4.02Å; A46-L50 HydrophobicContact CB-CG 4.45Å; A46-L50 WeakPolarHBondContact O-CB 3.37Å; A46-L50 VanDerWaalsContact O-CG 3.24Å; A46-L50 WeakPolarHBondContact O-CG 3.27Å; A46-L50 PolarHBondContact O-N 2.94Å
47F74.1Confident73.9Confident35 Ų3582.5 Ų82.515%0.15441%0.408CS..Hα-helixtrans-64.6-27.4173.5-83.2-71.5000113.2I34 Q35 I38 W43 I44 A45 P51 Q72I34-F47 HydrophobicContact CG2-CD1 4.41Å; I34-F47 HydrophobicContact CG2-CE1 3.91Å; I34-F47 HydrophobicContact CG2-CE2 4.2Å; I34-F47 HydrophobicContact CG2-CZ 3.8Å; Q35-F47 HydrophobicContact CB-CZ 3.98Å; Q35-F47 HydrophobicContact CG-CZ 4.48Å; I38-F47 HydrophobicContact CB-CE2 4.17Å; I38-F47 HydrophobicContact CD1-CD2 3.91Å; I38-F47 HydrophobicContact CD1-CE2 3.65Å; I38-F47 HydrophobicContact CD1-CZ 4.34Å; I38-F47 HydrophobicContact CG2-CE2 3.95Å; W43-F47 PolarHBondContact O-N 3.46Å; I44-F47 PolarHBondContact O-N 3.45Å; A45-F47 VanDerWaalsContact C-N 3.33Å; A45-F47 PolarHBondContact O-N 3.04Å; F47-P51 WeakPolarHBondContact O-CD 3.45Å; F47-P51 VanDerWaalsContact O-CG 3.23Å; F47-P51 WeakPolarHBondContact O-CG 3.47Å; F47-Q72 PolarHBondContact O-NE2 3.2Å
48I79.1Confident74.9Confident61 Ų6182.9 Ų82.931%0.31341%0.405SS..Hα-helixtrans-82.8-49.8176-61.7173000110.3I44 A45 A46 I52 Q72 V76I44-I48 HydrophobicContact CG2-CD1 4.26Å; I44-I48 PolarHBondContact O-N 2.9Å; A45-I48 PolarHBondContact O-N 3.23Å; A46-I48 PolarHBondContact O-N 3.42Å; I48-I52 HydrophobicContact CG2-CD1 4.06Å; I48-I52 WeakPolarHBondContact O-CD1 3.43Å; I48-I52 VanDerWaalsContact O-CG1 3.22Å; I48-I52 WeakPolarHBondContact O-CG1 3.37Å; I48-Q72 VanDerWaalsContact CA-NE2 3.3Å; I48-Q72 PolarHBondContact O-NE2 3.25Å; I48-V76 HydrophobicContact CG1-CG2 4.31Å
49F83.3Confident76Confident142 Ų14286.9 Ų86.962%0.62343%0.427SS*.Hα-helixtrans-75.3-39.3-173.2-71-67.3000113.9A45 I52 H53A45-F49 HydrophobicContact CB-CD2 3.96Å; A45-F49 HydrophobicContact CB-CE2 3.97Å; A45-F49 WeakPolarHBondContact O-CD2 3.36Å; A45-F49 PolarHBondContact O-N 2.86Å; F49-I52 PolarHBondContact O-N 3.25Å; F49-H53 VanDerWaalsContact O-CB 3.23Å; F49-H53 WeakPolarHBondContact O-CB 3.32Å; F49-H53 PolarHBondContact O-N 3.24Å
50L83.8Confident76.8Confident82 Ų8282.5 Ų82.543%0.42940%0.399SS..Hα-helixtrans-66.1-47.6-173.6-68.5171.5000113.3I34 A46 I52 H53 F54I34-L50 HydrophobicContact CD1-CD1 3.62Å; I34-L50 HydrophobicContact CG1-CD1 4.36Å; A46-L50 HydrophobicContact CB-CD1 4.02Å; A46-L50 HydrophobicContact CB-CG 4.45Å; A46-L50 WeakPolarHBondContact O-CB 3.37Å; A46-L50 VanDerWaalsContact O-CG 3.24Å; A46-L50 WeakPolarHBondContact O-CG 3.27Å; A46-L50 PolarHBondContact O-N 2.94Å; L50-I52 VanDerWaalsContact C-N 3.34Å; L50-I52 PolarHBondContact O-N 2.91Å; L50-H53 PolarHBondContact O-N 3.35Å; L50-F54 WeakPolarHBondContact O-CB 3.21Å; L50-F54 PolarHBondContact O-N 2.95Å
51P84.9Confident77.6Confident2 Ų273 Ų731%0.01337%0.368CS..Hα-helixtrans-64.3-39.1178.1-22.235.4000112.2F47 F54 I55 I68 Q72F47-P51 WeakPolarHBondContact O-CD 3.45Å; F47-P51 VanDerWaalsContact O-CG 3.23Å; F47-P51 WeakPolarHBondContact O-CG 3.47Å; P51-F54 PolarHBondContact O-N 3.35Å; P51-I55 WeakPolarHBondContact O-CB 3.44Å; P51-I55 WeakPolarHBondContact O-CD1 3.32Å; P51-I55 WeakPolarHBondContact O-CG1 3.33Å; P51-I55 PolarHBondContact O-N 3.05Å; P51-I68 HydrophobicContact CB-CG2 3.69Å; P51-Q72 HydrophobicContact CG-CG 4.43Å
52I85.3Confident78.5Confident31 Ų3171.8 Ų71.816%0.15935%0.353CS..Hα-helixtrans-63.7-47.9176-61.5171.3000110I48 F49 L50 F54 I55 L56 Y233 I237I48-I52 HydrophobicContact CG2-CD1 4.06Å; I48-I52 WeakPolarHBondContact O-CD1 3.43Å; I48-I52 VanDerWaalsContact O-CG1 3.22Å; I48-I52 WeakPolarHBondContact O-CG1 3.37Å; F49-I52 PolarHBondContact O-N 3.25Å; L50-I52 VanDerWaalsContact C-N 3.34Å; L50-I52 PolarHBondContact O-N 2.91Å; I52-F54 VanDerWaalsContact C-N 3.29Å; I52-F54 PolarHBondContact O-N 3.47Å; I52-I55 PolarHBondContact O-N 2.85Å; I52-L56 HydrophobicContact CG2-CD1 3.87Å; I52-L56 HydrophobicContact CG2-CG 4.35Å; I52-L56 WeakPolarHBondContact O-CB 3.22Å; I52-L56 VanDerWaalsContact O-CG 3.31Å; I52-L56 WeakPolarHBondContact O-CG 3.36Å; I52-L56 PolarHBondContact O-N 2.89Å; I52-Y233 WeakPolarHBondContact CD1-OH 2.89Å; I52-I237 HydrophobicContact CD1-CD1 4.49Å; I52-I237 HydrophobicContact CG2-CD1 4.5Å
53H85.1Confident79.1Confident121 Ų12167.6 Ų67.656%0.5632%0.324SS*.Hα-helixtrans-59.4-42177.4-176.275.7000111.4F49 L50 L56 R57F49-H53 VanDerWaalsContact O-CB 3.23Å; F49-H53 WeakPolarHBondContact O-CB 3.32Å; F49-H53 PolarHBondContact O-N 3.24Å; L50-H53 PolarHBondContact O-N 3.35Å; H53-L56 PolarHBondContact O-N 2.97Å; H53-R57 WeakPolarHBondContact O-CB 3.41Å; H53-R57 PolarHBondContact O-N 3.24Å
54F85.2Confident79.8Confident36 Ų3659.5 Ų59.516%0.15829%0.293CS..Hα-helixtrans-62.9-46.8176.2-175.2-96.3000112.1L27 L50 P51 I52 L56 R57 F58 L60L27-F54 HydrophobicContact CD1-CD1 3.78Å; L27-F54 HydrophobicContact CD1-CE1 3.75Å; L27-F54 HydrophobicContact CD2-CD1 4.02Å; L27-F54 HydrophobicContact CD2-CE1 4.29Å; L27-F54 HydrophobicContact CD2-CG 4.25Å; L27-F54 HydrophobicContact CG-CD1 4.2Å; L27-F54 HydrophobicContact CG-CE1 4.04Å; L50-F54 WeakPolarHBondContact O-CB 3.21Å; L50-F54 PolarHBondContact O-N 2.95Å; P51-F54 PolarHBondContact O-N 3.35Å; I52-F54 VanDerWaalsContact C-N 3.29Å; I52-F54 PolarHBondContact O-N 3.47Å; F54-L56 VanDerWaalsContact C-N 3.33Å; F54-L56 PolarHBondContact O-N 3.18Å; F54-R57 PolarHBondContact O-N 3.49Å; F54-F58 HydrophobicContact CD1-CD2 4.35Å; F54-F58 AromaticContact CD2-CD2 3.35Å; F54-F58 HydrophobicContact CD2-CD2 3.35Å; F54-F58 AromaticContact CD2-CE2 3.35Å; F54-F58 HydrophobicContact CD2-CE2 3.35Å; F54-F58 HydrophobicContact CE1-CD2 4.33Å; F54-F58 AromaticContact CE2-CD2 3.3Å; F54-F58 HydrophobicContact CE2-CD2 3.3Å; F54-F58 AromaticContact CE2-CE2 3.22Å; F54-F58 HydrophobicContact CE2-CE2 3.22Å; F54-F58 HydrophobicContact CE2-CG 4.24Å; F54-F58 HydrophobicContact CE2-CZ 4.11Å; F54-F58 AromaticContact CG-CD2 3.89Å; F54-F58 HydrophobicContact CG-CD2 3.89Å; F54-F58 HydrophobicContact CG-CE2 4.31Å; F54-F58 AromaticContact CZ-CD2 3.82Å; F54-F58 HydrophobicContact CZ-CD2 3.82Å; F54-F58 HydrophobicContact CZ-CE2 4.13Å; F54-F58 HydrophobicContact CZ-CG 4.4Å; F54-F58 WeakPolarHBondContact O-CB 3.3Å; F54-F58 WeakPolarHBondContact O-CD2 3.42Å; F54-F58 PolarHBondContact O-N 2.82Å; F54-L60 HydrophobicContact CD1-CD1 3.76Å; F54-L60 HydrophobicContact CE1-CD1 3.7Å
55I84Confident80.6Confident0 Ų056.2 Ų56.20%028%0.277CS..Hα-helixtrans-57.5-46.6176.8-71162.8000111P51 I52 D59 L60 S65 I68 V69 I237P51-I55 WeakPolarHBondContact O-CB 3.44Å; P51-I55 WeakPolarHBondContact O-CD1 3.32Å; P51-I55 WeakPolarHBondContact O-CG1 3.33Å; P51-I55 PolarHBondContact O-N 3.05Å; I52-I55 PolarHBondContact O-N 2.85Å; I55-D59 PolarHBondContact O-N 3.46Å; I55-L60 HydrophobicContact CG1-CD1 4.07Å; I55-L60 PolarHBondContact O-N 2.88Å; I55-S65 WeakPolarHBondContact CG2-OG 3.46Å; I55-I68 HydrophobicContact CD1-CB 4.04Å; I55-I68 HydrophobicContact CD1-CG2 3.81Å; I55-I68 HydrophobicContact CG1-CB 4.42Å; I55-I68 HydrophobicContact CG1-CD1 4.05Å; I55-I68 HydrophobicContact CG1-CG2 4.2Å; I55-V69 HydrophobicContact CD1-CG2 3.63Å; I55-I237 HydrophobicContact CD1-CG2 3.92Å
56L84.8Confident81.1Confident104 Ų10454.1 Ų54.155%0.54526%0.26SS..Hα-helixtrans-72.5-36.5-178.7-65.6177.1000112.3I52 H53 F54I52-L56 HydrophobicContact CG2-CD1 3.87Å; I52-L56 HydrophobicContact CG2-CG 4.35Å; I52-L56 WeakPolarHBondContact O-CB 3.22Å; I52-L56 VanDerWaalsContact O-CG 3.31Å; I52-L56 WeakPolarHBondContact O-CG 3.36Å; I52-L56 PolarHBondContact O-N 2.89Å; H53-L56 PolarHBondContact O-N 2.97Å; F54-L56 VanDerWaalsContact C-N 3.33Å; F54-L56 PolarHBondContact O-N 3.18Å
57R83.3Confident81.5Confident190 Ų19055.2 Ų55.272%0.71726%0.262SS*.Hα-helixtrans-72.8-38.5-178.2-178.158.9176.7176.90.6112.7H53 F54H53-R57 WeakPolarHBondContact O-CB 3.41Å; H53-R57 PolarHBondContact O-N 3.24Å; F54-R57 PolarHBondContact O-N 3.49Å
58F82.7Confident82Confident128 Ų12854 Ų5456%0.56126%0.257SS*.THydrogen-bonded Turntrans-97.27-177-72-77.8000114.1F54 L60F54-F58 HydrophobicContact CD1-CD2 4.35Å; F54-F58 AromaticContact CD2-CD2 3.35Å; F54-F58 HydrophobicContact CD2-CD2 3.35Å; F54-F58 AromaticContact CD2-CE2 3.35Å; F54-F58 HydrophobicContact CD2-CE2 3.35Å; F54-F58 HydrophobicContact CE1-CD2 4.33Å; F54-F58 AromaticContact CE2-CD2 3.3Å; F54-F58 HydrophobicContact CE2-CD2 3.3Å; F54-F58 AromaticContact CE2-CE2 3.22Å; F54-F58 HydrophobicContact CE2-CE2 3.22Å; F54-F58 HydrophobicContact CE2-CG 4.24Å; F54-F58 HydrophobicContact CE2-CZ 4.11Å; F54-F58 AromaticContact CG-CD2 3.89Å; F54-F58 HydrophobicContact CG-CD2 3.89Å; F54-F58 HydrophobicContact CG-CE2 4.31Å; F54-F58 AromaticContact CZ-CD2 3.82Å; F54-F58 HydrophobicContact CZ-CD2 3.82Å; F54-F58 HydrophobicContact CZ-CE2 4.13Å; F54-F58 HydrophobicContact CZ-CG 4.4Å; F54-F58 WeakPolarHBondContact O-CB 3.3Å; F54-F58 WeakPolarHBondContact O-CD2 3.42Å; F54-F58 PolarHBondContact O-N 2.82Å; F58-L60 VanDerWaalsContact C-N 3.25Å; F58-L60 HydrophobicContact CB-CD2 4.08Å; F58-L60 HydrophobicContact CB-CG 4.2Å; F58-L60 PolarHBondContact O-N 2.63Å
59D80.9Confident82.3Confident108 Ų10851.1 Ų51.158%0.57824%0.242SC*.THydrogen-bonded Turntrans48.147.8179.6-170.720.1000112.2I55 R240I55-D59 PolarHBondContact O-N 3.46Å; D59-R240 VanDerWaalsContact CA-NH2 3.26Å; D59-R240 PolarHBondContact O-NH2 2.79Å; D59-R240 IonicContact OD1-CZ 3.06Å; D59-R240 IonicContact OD1-NH1 2.6Å; D59-R240 PolarHBondContact OD1-NH1 2.95Å; D59-R240 IonicContact OD1-NH2 2.67Å; D59-R240 PolarHBondContact OD1-NH2 2.87Å
60L78.5Confident82.3Confident22 Ų2246.3 Ų46.312%0.11523%0.225CC..  trans-64.6144.1-173.2-67.4-178.6000112.7F54 I55 F58 S65 I68 R240F54-L60 HydrophobicContact CD1-CD1 3.76Å; F54-L60 HydrophobicContact CE1-CD1 3.7Å; I55-L60 HydrophobicContact CG1-CD1 4.07Å; I55-L60 PolarHBondContact O-N 2.88Å; F58-L60 VanDerWaalsContact C-N 3.25Å; F58-L60 HydrophobicContact CB-CD2 4.08Å; F58-L60 HydrophobicContact CB-CG 4.2Å; F58-L60 PolarHBondContact O-N 2.63Å; L60-S65 PolarHBondContact O-OG 3.35Å; L60-I68 HydrophobicContact CD1-CD1 3.27Å; L60-R240 PolarHBondContact O-NH2 2.7Å
61P77.4Confident82.2Confident37 Ų3746 Ų4624%0.2422%0.222CC..  trans-65.4153.2176.829.1-34.8000110.9G63 S64 S65P61-G63 PolarHBondContact O-N 3.47Å; P61-G63 VanDerWaalsContact O-N 3.08Å; P61-S64 PolarHBondContact O-N 3.45Å; P61-S65 PolarHBondContact O-N 3.35Å; P61-S65 PolarHBondContact O-OG 2.82Å
62I78.9Confident82.2Confident9 Ų946.3 Ų46.35%0.04622%0.223CC..Hα-helixtrans-48.4-43.8-173.6-54.5-175.7000112.5S65 A66 L239 R314 L318I62-S65 PolarHBondContact O-N 2.85Å; I62-A66 WeakPolarHBondContact O-CB 3.18Å; I62-A66 PolarHBondContact O-N 3.36Å; I62-L239 HydrophobicContact CD1-CD2 3.86Å; I62-L239 HydrophobicContact CG2-CD2 4.1Å; I62-R314 HydrophobicContact CD1-CB 3.74Å; I62-R314 HydrophobicContact CD1-CG 4.49Å; I62-R314 HydrophobicContact CG1-CB 4.21Å; I62-L318 HydrophobicContact CG2-CB 3.99Å; I62-L318 HydrophobicContact CG2-CD1 3.7Å; I62-L318 HydrophobicContact CG2-CG 4.38Å
63G74.3Confident82Confident1 Ų146.5 Ų46.51%0.0123%0.225CC..Hα-helixtrans-64.8-43.317900000114.1P61 L67P61-G63 PolarHBondContact O-N 3.47Å; P61-G63 VanDerWaalsContact O-N 3.08Å; G63-L67 PolarHBondContact O-N 2.95Å; G63-L67 VanDerWaalsContact O-N 3.09Å
64S78.8Confident81.8Confident2 Ų243.6 Ų43.61%0.01422%0.222CC..Hα-helixtrans-65.6-43174.7-61.40000110.8I20 P61 A66 L67 I68I20-S64 VanDerWaalsContact CG1-OG 3.32Å; I20-S64 WeakPolarHBondContact CG1-OG 3.09Å; P61-S64 PolarHBondContact O-N 3.45Å; S64-A66 PolarHBondContact O-N 2.9Å; S64-L67 PolarHBondContact O-N 3.25Å; S64-I68 VanDerWaalsContact O-CD1 3.27Å; S64-I68 WeakPolarHBondContact O-CD1 3.22Å; S64-I68 WeakPolarHBondContact O-CG1 3.18Å; S64-I68 PolarHBondContact O-N 3.41Å
65S83.3Confident81.2Confident0 Ų044.1 Ų44.10%023%0.225CC..Hα-helixtrans-59.6-47.1177.2-56.10000111.6I55 L60 P61 I62 L67 I68 V69I55-S65 WeakPolarHBondContact CG2-OG 3.46Å; L60-S65 PolarHBondContact O-OG 3.35Å; P61-S65 PolarHBondContact O-N 3.35Å; P61-S65 PolarHBondContact O-OG 2.82Å; I62-S65 PolarHBondContact O-N 2.85Å; S65-L67 PolarHBondContact O-N 3.38Å; S65-I68 PolarHBondContact O-N 3.43Å; S65-V69 WeakPolarHBondContact O-CG2 3.27Å; S65-V69 PolarHBondContact O-N 2.8Å
66A81.9Confident80.8Confident1 Ų146.5 Ų46.51%0.00824%0.239CC..Hα-helixtrans-58.5-48176.800000111.9I62 S64 I68 V69 C70 S238 Y321I62-A66 WeakPolarHBondContact O-CB 3.18Å; I62-A66 PolarHBondContact O-N 3.36Å; S64-A66 PolarHBondContact O-N 2.9Å; A66-I68 VanDerWaalsContact C-N 3.32Å; A66-I68 PolarHBondContact O-N 3.34Å; A66-V69 PolarHBondContact O-N 3.22Å; A66-C70 WeakPolarHBondContact O-CB 3.1Å; A66-C70 PolarHBondContact O-N 3.3Å; A66-C70 PolarHBondContact O-SG 3.36Å; A66-S238 WeakPolarHBondContact CA-OG 3.34Å; A66-S238 WeakPolarHBondContact CB-OG 3.39Å; A66-S238 PolarHBondContact N-OG 2.9Å; A66-Y321 HydrophobicContact CB-CD2 4.25Å
67L81.8Confident80.1Confident48 Ų4848.4 Ų48.425%0.25124%0.239SC..Hα-helixtrans-57.3-45.1178-177.267.6000112.2I20 G63 S64 S65 C70 E71I20-L67 HydrophobicContact CG2-CD2 4.2Å; G63-L67 PolarHBondContact O-N 2.95Å; G63-L67 VanDerWaalsContact O-N 3.09Å; S64-L67 PolarHBondContact O-N 3.25Å; S65-L67 PolarHBondContact O-N 3.38Å; L67-C70 PolarHBondContact O-N 3.06Å; L67-E71 WeakPolarHBondContact O-CB 3.19Å; L67-E71 WeakPolarHBondContact O-CG 3.43Å; L67-E71 PolarHBondContact O-N 3.2Å
68I83.8Confident79.4Confident9 Ų940.7 Ų40.75%0.04622%0.219CC..Hα-helixtrans-66-41.8-178.3-64.9164.5000111.1L27 P51 I55 L60 S64 S65 A66 E71 Q72L27-I68 HydrophobicContact CD1-CB 4.11Å; L27-I68 HydrophobicContact CD1-CD1 3.11Å; L27-I68 HydrophobicContact CD1-CG1 3.23Å; L27-I68 HydrophobicContact CD1-CG2 3.75Å; P51-I68 HydrophobicContact CB-CG2 3.69Å; I55-I68 HydrophobicContact CD1-CB 4.04Å; I55-I68 HydrophobicContact CD1-CG2 3.81Å; I55-I68 HydrophobicContact CG1-CB 4.42Å; I55-I68 HydrophobicContact CG1-CD1 4.05Å; I55-I68 HydrophobicContact CG1-CG2 4.2Å; L60-I68 HydrophobicContact CD1-CD1 3.27Å; S64-I68 VanDerWaalsContact O-CD1 3.27Å; S64-I68 WeakPolarHBondContact O-CD1 3.22Å; S64-I68 WeakPolarHBondContact O-CG1 3.18Å; S64-I68 PolarHBondContact O-N 3.41Å; S65-I68 PolarHBondContact O-N 3.43Å; A66-I68 VanDerWaalsContact C-N 3.32Å; A66-I68 PolarHBondContact O-N 3.34Å; I68-E71 PolarHBondContact O-N 2.98Å; I68-Q72 VanDerWaalsContact O-CB 3.32Å; I68-Q72 WeakPolarHBondContact O-CB 3.48Å; I68-Q72 PolarHBondContact O-N 2.72Å
69V85.8Confident78.6Confident0 Ų038.4 Ų38.40%021%0.21CC..Hα-helixtrans-71.4-39.2-179.8-177.50000110.6I55 S65 A66 E71 Q72 V73 Y233 I234 I237I55-V69 HydrophobicContact CD1-CG2 3.63Å; S65-V69 WeakPolarHBondContact O-CG2 3.27Å; S65-V69 PolarHBondContact O-N 2.8Å; A66-V69 PolarHBondContact O-N 3.22Å; V69-E71 PolarHBondContact O-N 3.37Å; V69-Q72 WeakPolarHBondContact O-CB 3.09Å; V69-Q72 PolarHBondContact O-N 3.06Å; V69-V73 HydrophobicContact CG1-CG2 4.35Å; V69-V73 WeakPolarHBondContact O-CB 3.31Å; V69-V73 VanDerWaalsContact O-CG2 3.31Å; V69-V73 WeakPolarHBondContact O-CG2 3.5Å; V69-V73 PolarHBondContact O-N 3.43Å; V69-Y233 HydrophobicContact CG1-CD1 3.92Å; V69-Y233 HydrophobicContact CG1-CE1 3.48Å; V69-Y233 VanDerWaalsContact CG1-CE1 3.48Å; V69-I234 HydrophobicContact CG1-CB 4.36Å; V69-I234 HydrophobicContact CG1-CG1 3.94Å; V69-I237 HydrophobicContact CG1-CB 4.48Å; V69-I237 HydrophobicContact CG2-CB 3.77Å; V69-I237 HydrophobicContact CG2-CG2 3.38Å
70C84.4Confident77.8Confident42 Ų4235.8 Ų35.828%0.28420%0.203SC..Hα-helixtrans-59.6-47.1173-71.80000111.6A66 L67 Q72 V73 A74A66-C70 WeakPolarHBondContact O-CB 3.1Å; A66-C70 PolarHBondContact O-N 3.3Å; A66-C70 PolarHBondContact O-SG 3.36Å; L67-C70 PolarHBondContact O-N 3.06Å; C70-Q72 VanDerWaalsContact C-N 3.34Å; C70-Q72 PolarHBondContact O-N 3.36Å; C70-V73 PolarHBondContact O-N 2.8Å; C70-A74 VanDerWaalsContact O-CB 3.32Å; C70-A74 WeakPolarHBondContact O-CB 3.43Å; C70-A74 PolarHBondContact O-N 2.75Å
71E82.1Confident76.9Confident75 Ų7539.1 Ų39.135%0.3522%0.221SC..Hα-helixtrans-61.4-40.5174.6-81.8-69147.700112.4L67 I68 V69 K75L67-E71 WeakPolarHBondContact O-CB 3.19Å; L67-E71 WeakPolarHBondContact O-CG 3.43Å; L67-E71 PolarHBondContact O-N 3.2Å; I68-E71 PolarHBondContact O-N 2.98Å; V69-E71 PolarHBondContact O-N 3.37Å; E71-K75 WeakPolarHBondContact O-CB 3.5Å; E71-K75 VanDerWaalsContact O-CG 3.27Å; E71-K75 WeakPolarHBondContact O-CG 3.08Å; E71-K75 PolarHBondContact O-N 2.88Å; E71-K75 WeakPolarHBondContact OE2-CE 3.32Å; E71-K75 IonicContact OE2-NZ 3.67Å
72Q83.2Confident76.1Confident8 Ų842.4 Ų42.44%0.03723%0.231CC..Hα-helixtrans-60.8-52.2174.9173.2-171.465.200111.2F47 I48 P51 I68 V69 C70 A74 K75 V76 Y233F47-Q72 PolarHBondContact O-NE2 3.2Å; I48-Q72 VanDerWaalsContact CA-NE2 3.3Å; I48-Q72 PolarHBondContact O-NE2 3.25Å; P51-Q72 HydrophobicContact CG-CG 4.43Å; I68-Q72 VanDerWaalsContact O-CB 3.32Å; I68-Q72 WeakPolarHBondContact O-CB 3.48Å; I68-Q72 PolarHBondContact O-N 2.72Å; V69-Q72 WeakPolarHBondContact O-CB 3.09Å; V69-Q72 PolarHBondContact O-N 3.06Å; C70-Q72 VanDerWaalsContact C-N 3.34Å; C70-Q72 PolarHBondContact O-N 3.36Å; Q72-A74 VanDerWaalsContact C-N 3.35Å; Q72-A74 PolarHBondContact O-N 3.38Å; Q72-K75 PolarHBondContact O-N 3.38Å; Q72-V76 WeakPolarHBondContact O-CG2 3.38Å; Q72-V76 PolarHBondContact O-N 3.31Å; Q72-Y233 PolarHBondContact OE1-OH 3.39Å
73V81.4Confident74.9Confident35 Ų3548.6 Ų48.621%0.21226%0.261CS..Hα-helixtrans-59.4-46.5179.4169.10000110.5V69 C70 K75 V76 W77 V230 Y233 I234V69-V73 HydrophobicContact CG1-CG2 4.35Å; V69-V73 WeakPolarHBondContact O-CB 3.31Å; V69-V73 VanDerWaalsContact O-CG2 3.31Å; V69-V73 WeakPolarHBondContact O-CG2 3.5Å; V69-V73 PolarHBondContact O-N 3.43Å; C70-V73 PolarHBondContact O-N 2.8Å; V73-K75 VanDerWaalsContact C-N 3.3Å; V73-K75 PolarHBondContact O-N 2.96Å; V73-V76 PolarHBondContact O-N 2.92Å; V73-W77 WeakPolarHBondContact O-CB 3.36Å; V73-W77 PolarHBondContact O-N 3.18Å; V73-V230 HydrophobicContact CG1-CG1 3.72Å; V73-Y233 HydrophobicContact CG2-CD1 3.91Å; V73-Y233 HydrophobicContact CG2-CE1 3.82Å; V73-I234 HydrophobicContact CG2-CG1 4.29Å
74A80.7Confident73.8Confident60 Ų6057 Ų5750%0.49630%0.298SS..Hα-helixtrans-58.8-41.2178.500000112.1C70 Q72 G78C70-A74 VanDerWaalsContact O-CB 3.32Å; C70-A74 WeakPolarHBondContact O-CB 3.43Å; C70-A74 PolarHBondContact O-N 2.75Å; Q72-A74 VanDerWaalsContact C-N 3.35Å; Q72-A74 PolarHBondContact O-N 3.38Å; A74-G78 PolarHBondContact O-N 3.13Å
75K74Confident72.6Confident47 Ų4762 Ų6220%0.20433%0.328CS..Hα-helixtrans-71.1-43.8178.2-74.2172.3-169.6170.60113N31 E71 Q72 V73 W77 G78 H79N31-K75 PolarHBondContact ND2-NZ 2.88Å; E71-K75 WeakPolarHBondContact O-CB 3.5Å; E71-K75 VanDerWaalsContact O-CG 3.27Å; E71-K75 WeakPolarHBondContact O-CG 3.08Å; E71-K75 PolarHBondContact O-N 2.88Å; E71-K75 WeakPolarHBondContact OE2-CE 3.32Å; E71-K75 IonicContact OE2-NZ 3.67Å; Q72-K75 PolarHBondContact O-N 3.38Å; V73-K75 VanDerWaalsContact C-N 3.3Å; V73-K75 PolarHBondContact O-N 2.96Å; K75-W77 VanDerWaalsContact C-N 3.27Å; K75-W77 PolarHBondContact O-N 3.23Å; K75-G78 PolarHBondContact O-N 3.37Å; K75-H79 WeakPolarHBondContact O-CB 3.49Å; K75-H79 PolarHBondContact O-N 3.46Å
76V74.9Confident70.9Confident51 Ų5171.6 Ų71.631%0.30937%0.369SS..Hα-helixtrans-58.1-45.1175.3171.10000109.7I48 Q72 V73 H79 A80I48-V76 HydrophobicContact CG1-CG2 4.31Å; Q72-V76 WeakPolarHBondContact O-CG2 3.38Å; Q72-V76 PolarHBondContact O-N 3.31Å; V73-V76 PolarHBondContact O-N 2.92Å; V76-H79 PolarHBondContact O-N 3.5Å; V76-A80 PolarHBondContact O-N 3.47Å
77W70.1Confident69.6Low144 Ų14478.3 Ų78.355%0.54541%0.406SS..Hα-helixtrans-64.2-45176.2-164.2-105.7000112.5V73 K75 H79 A80 L81 L226V73-W77 WeakPolarHBondContact O-CB 3.36Å; V73-W77 PolarHBondContact O-N 3.18Å; K75-W77 VanDerWaalsContact C-N 3.27Å; K75-W77 PolarHBondContact O-N 3.23Å; W77-H79 VanDerWaalsContact C-N 3.32Å; W77-H79 PolarHBondContact O-N 3.01Å; W77-A80 PolarHBondContact O-N 3.39Å; W77-L81 WeakPolarHBondContact O-CG 3.35Å; W77-L81 PolarHBondContact O-N 2.86Å; W77-L226 HydrophobicContact CH2-CD2 3.64Å; W77-L226 HydrophobicContact CZ3-CD2 3.99Å
78G68.3Low68.6Low28 Ų2879.4 Ų79.429%0.28943%0.428SS..Hα-helixtrans-60.6-38.2176.300000113.1A74 K75 L81 K82A74-G78 PolarHBondContact O-N 3.13Å; K75-G78 PolarHBondContact O-N 3.37Å; G78-L81 PolarHBondContact O-N 3Å; G78-K82 WeakPolarHBondContact O-CG 3.41Å; G78-K82 PolarHBondContact O-N 3.05Å
79H66.2Low67.5Low80 Ų8085.2 Ų85.237%0.3747%0.468SS..Hα-helixtrans-66.4-45.5174.8-173.982000111.8K75 V76 W77 L81 K82 M83K75-H79 WeakPolarHBondContact O-CB 3.49Å; K75-H79 PolarHBondContact O-N 3.46Å; V76-H79 PolarHBondContact O-N 3.5Å; W77-H79 VanDerWaalsContact C-N 3.32Å; W77-H79 PolarHBondContact O-N 3.01Å; H79-L81 PolarHBondContact O-N 3.26Å; H79-K82 PolarHBondContact O-N 3.46Å; H79-K82 VanDerWaalsContact O-N 3.11Å; H79-M83 PolarHBondContact O-N 3.24Å; H79-M83 VanDerWaalsContact O-N 3.11Å
80A63.1Low66.7Low52 Ų5288.1 Ų88.143%0.4349%0.487SS..Hα-helixtrans-58.2-36.1175.700000112.4V76 W77V76-A80 PolarHBondContact O-N 3.47Å; W77-A80 PolarHBondContact O-N 3.39Å
81L61Low66.1Low93 Ų9389.1 Ų89.149%0.48750%0.498SS..Hα-helixtrans-72.6-39.6174.3-69.1173.1000112.9W77 G78 H79 M83 K84W77-L81 WeakPolarHBondContact O-CG 3.35Å; W77-L81 PolarHBondContact O-N 2.86Å; G78-L81 PolarHBondContact O-N 3Å; H79-L81 PolarHBondContact O-N 3.26Å; L81-M83 VanDerWaalsContact C-N 3.33Å; L81-M83 PolarHBondContact O-N 3.34Å; L81-K84 WeakPolarHBondContact O-CB 3.41Å; L81-K84 PolarHBondContact O-N 3.27Å; L81-K84 VanDerWaalsContact O-N 3.14Å
82K59.3Low65.6Low105 Ų10591.4 Ų91.446%0.45751%0.507SS..Hα-helixtrans-61.7-37177.6-80.2179.4-179.2-179.50112.8G78 H79 K84 V85G78-K82 WeakPolarHBondContact O-CG 3.41Å; G78-K82 PolarHBondContact O-N 3.05Å; H79-K82 PolarHBondContact O-N 3.46Å; H79-K82 VanDerWaalsContact O-N 3.11Å; K82-K84 PolarHBondContact O-N 3.35Å; K82-V85 PolarHBondContact O-N 3.09Å
83M54.5Low65.5Low139 Ų13999 Ų9969%0.68554%0.54SS*.THydrogen-bonded Turntrans-56.9-20.6176.1-72.4-171.970.900113.4H79 L81H79-M83 PolarHBondContact O-N 3.24Å; H79-M83 VanDerWaalsContact O-N 3.11Å; L81-M83 VanDerWaalsContact C-N 3.33Å; L81-M83 PolarHBondContact O-N 3.34Å
84K51.7Low65.3Low178 Ų17899.4 Ų99.477%0.77454%0.541SS*.THydrogen-bonded Turntrans-84.7-18.2176.6-68.1-173.3176.3-178.80114.3L81 K82L81-K84 WeakPolarHBondContact O-CB 3.41Å; L81-K84 PolarHBondContact O-N 3.27Å; L81-K84 VanDerWaalsContact O-N 3.14Å; K82-K84 PolarHBondContact O-N 3.35Å
85V52.9Low64.9Low108 Ų10898.9 Ų98.966%0.65553%0.528SS*.  trans-104.499.6-173.8-175.50000110.1K82 N87K82-V85 PolarHBondContact O-N 3.09Å; V85-N87 VanDerWaalsContact C-N 3.34Å; V85-N87 PolarHBondContact O-N 2.84Å
86K48.8Very low64.9Low200 Ų20099 Ų9987%0.8753%0.53SS*.  trans-79.55.9-174.1-90-173.3176.2-177.90116.5
87N52.7Low65.2Low143 Ų14399.2 Ų99.277%0.76553%0.526SS*.SBendtrans-107.1118.7-171.9-68.8-7.9000111.7V85V85-N87 VanDerWaalsContact C-N 3.34Å; V85-N87 PolarHBondContact O-N 2.84Å
88G62.1Low65.6Low70 Ų7094.6 Ų94.672%0.72251%0.51SS*.  trans35.3106.4163.100000117.1P90G88-P90 WeakPolarHBondContact O-CD 3.35Å; G88-P90 VanDerWaalsContact O-N 3.15Å
89C61.5Low66Low131 Ų13197.2 Ų97.289%0.88552%0.516SS*.PPolyproline II helixtrans-57.4119.6175.2-77.90000111
90P67.1Low66.7Low62 Ų6297.3 Ų97.340%0.40352%0.516SS..PPolyproline II helixtrans-65.9153.417326.8-32.9000110.7G88 N94 Y106G88-P90 WeakPolarHBondContact O-CD 3.35Å; G88-P90 VanDerWaalsContact O-N 3.15Å; P90-N94 HydrophobicContact CB-CB 4.39Å; P90-Y106 WeakPolarHBondContact CB-OH 3.39Å; P90-Y106 HydrophobicContact CG-CE1 4.32Å; P90-Y106 WeakPolarHBondContact CG-OH 3.49Å
91A72.1Confident67.6Low63 Ų6395.2 Ų95.252%0.52150%0.499SS..PPolyproline II helixtrans-55.4141.8175.300000110.9K93 N94A91-K93 PolarHBondContact O-N 3.36Å; A91-N94 WeakPolarHBondContact O-CB 3.37Å; A91-N94 PolarHBondContact O-N 2.8Å
92F72.1Confident68.5Low122 Ų12292.4 Ų92.454%0.53549%0.486SS..Hα-helixtrans-50.6-36.9-177.1177.6-108.4000113.3L32 N94 F95 I96L32-F92 HydrophobicContact CD2-CE2 4.3Å; L32-F92 HydrophobicContact CD2-CZ 3.97Å; F92-N94 VanDerWaalsContact C-N 3.31Å; F92-N94 PolarHBondContact O-N 3.45Å; F92-F95 WeakPolarHBondContact O-CB 3.46Å; F92-F95 PolarHBondContact O-N 3.39Å; F92-F95 VanDerWaalsContact O-N 3.1Å; F92-I96 HydrophobicContact CD1-CG1 4.32Å; F92-I96 HydrophobicContact CE1-CD1 4.22Å; F92-I96 HydrophobicContact CE1-CG1 3.9Å; F92-I96 HydrophobicContact CE2-CD1 4.14Å; F92-I96 HydrophobicContact CE2-CG1 4.37Å; F92-I96 HydrophobicContact CZ-CD1 3.76Å; F92-I96 HydrophobicContact CZ-CG1 3.93Å; F92-I96 PolarHBondContact O-N 3.27Å; F92-I96 VanDerWaalsContact O-N 3.12Å
93K80.8Confident69.3Low167 Ų16789.2 Ų89.273%0.72648%0.476SS*.Hα-helixtrans-55.1-40.6174.2-177.1-179.3176.7-178.30113.5A91 F95 I96 Y97A91-K93 PolarHBondContact O-N 3.36Å; K93-F95 VanDerWaalsContact C-N 3.3Å; K93-F95 PolarHBondContact O-N 3.37Å; K93-I96 PolarHBondContact O-N 3.32Å; K93-Y97 PolarHBondContact O-N 3.37Å
94N77Confident70Confident45 Ų4591.1 Ų91.124%0.24149%0.488CS..Hα-helixtrans-72.1-28.9-179.2-63.1-4000111.4P90 A91 F92 F98 Y106 N108P90-N94 HydrophobicContact CB-CB 4.39Å; A91-N94 WeakPolarHBondContact O-CB 3.37Å; A91-N94 PolarHBondContact O-N 2.8Å; F92-N94 VanDerWaalsContact C-N 3.31Å; F92-N94 PolarHBondContact O-N 3.45Å; N94-F98 WeakPolarHBondContact O-CB 3.49Å; N94-F98 PolarHBondContact O-N 2.89Å; N94-Y106 WeakPolarHBondContact CB-OH 3.46Å; N94-N108 PolarHBondContact ND2-OD1 3Å
95F72.1Confident70.9Confident48 Ų4887.4 Ų87.421%0.21148%0.475CS..Hα-helixtrans-68.7-45.4173.6176.9-102.7000111.3F92 K93 Y97 F98 L99F92-F95 WeakPolarHBondContact O-CB 3.46Å; F92-F95 PolarHBondContact O-N 3.39Å; F92-F95 VanDerWaalsContact O-N 3.1Å; K93-F95 VanDerWaalsContact C-N 3.3Å; K93-F95 PolarHBondContact O-N 3.37Å; F95-Y97 VanDerWaalsContact C-N 3.32Å; F95-Y97 PolarHBondContact O-N 2.88Å; F95-F98 PolarHBondContact O-N 3.29Å; F95-L99 PolarHBondContact O-N 2.96Å
96I75.2Confident71.7Confident50 Ų5086.3 Ų86.326%0.25646%0.46SS..Hα-helixtrans-61.1-42.9175.2-61-59.2000111.1L32 F92 K93 F98 L99 F100L32-I96 HydrophobicContact CD2-CD1 4.26Å; F92-I96 HydrophobicContact CD1-CG1 4.32Å; F92-I96 HydrophobicContact CE1-CD1 4.22Å; F92-I96 HydrophobicContact CE1-CG1 3.9Å; F92-I96 HydrophobicContact CE2-CD1 4.14Å; F92-I96 HydrophobicContact CE2-CG1 4.37Å; F92-I96 HydrophobicContact CZ-CD1 3.76Å; F92-I96 HydrophobicContact CZ-CG1 3.93Å; F92-I96 PolarHBondContact O-N 3.27Å; F92-I96 VanDerWaalsContact O-N 3.12Å; K93-I96 PolarHBondContact O-N 3.32Å; I96-F98 PolarHBondContact O-N 2.98Å; I96-L99 WeakPolarHBondContact O-CB 3.31Å; I96-L99 PolarHBondContact O-N 3.5Å; I96-F100 HydrophobicContact CG2-CD2 4.36Å; I96-F100 HydrophobicContact CG2-CE2 4.11Å; I96-F100 VanDerWaalsContact O-CD2 3.3Å; I96-F100 WeakPolarHBondContact O-CD2 3.31Å
97Y80Confident72.8Confident56 Ų5684 Ų8422%0.2245%0.445CS..Hα-helixtrans-60.7-43175.3175.7-114.2000112.5K93 F95 F100 A101 Y110 L183K93-Y97 PolarHBondContact O-N 3.37Å; F95-Y97 VanDerWaalsContact C-N 3.32Å; F95-Y97 PolarHBondContact O-N 2.88Å; Y97-F100 PolarHBondContact O-N 2.99Å; Y97-A101 PolarHBondContact O-N 3.44Å; Y97-Y110 AromaticContact CE1-CD2 3.57Å; Y97-Y110 HydrophobicContact CE1-CD2 3.57Å; Y97-Y110 HydrophobicContact CE1-CE2 4.09Å; Y97-L183 HydrophobicContact CD2-CD2 4.06Å; Y97-L183 HydrophobicContact CE2-CD1 4.33Å; Y97-L183 HydrophobicContact CE2-CD2 3.94Å
98F78.9Confident73.9Confident46 Ų4681.3 Ų81.320%0.20243%0.431CS..Hα-helixtrans-65.7-35.6177.4176.1-114.1000113.3N94 F95 I96 F100 A101 T103 Y106 Y110N94-F98 WeakPolarHBondContact O-CB 3.49Å; N94-F98 PolarHBondContact O-N 2.89Å; F95-F98 PolarHBondContact O-N 3.29Å; I96-F98 PolarHBondContact O-N 2.98Å; F98-F100 PolarHBondContact O-N 3.25Å; F98-A101 PolarHBondContact O-N 3.04Å; F98-T103 VanDerWaalsContact CE2-O 3.32Å; F98-T103 WeakPolarHBondContact CE2-O 3.39Å; F98-Y106 HydrophobicContact CB-CD2 3.79Å; F98-Y106 HydrophobicContact CB-CE2 3.92Å; F98-Y106 AromaticContact CD1-CD2 3.88Å; F98-Y106 HydrophobicContact CD1-CD2 3.88Å; F98-Y106 AromaticContact CD2-CD2 3.77Å; F98-Y106 HydrophobicContact CD2-CD2 3.77Å; F98-Y106 HydrophobicContact CE1-CD2 4.4Å; F98-Y106 VanDerWaalsContact CE2-CA 3.45Å; F98-Y106 HydrophobicContact CE2-CD2 4.31Å; F98-Y106 AromaticContact CG-CD2 3.53Å; F98-Y106 HydrophobicContact CG-CD2 3.53Å; F98-Y106 HydrophobicContact CG-CE2 4.18Å; F98-Y110 VanDerWaalsContact CD2-OH 3.31Å; F98-Y110 WeakPolarHBondContact CD2-OH 3.24Å; F98-Y110 WeakPolarHBondContact CE2-OH 3.42Å
99L76.3Confident74.7Confident83 Ų8384.7 Ų84.744%0.43543%0.432SS..Hα-helixtrans-57.6-35.2178.8-177.365.2000112.4F95 I96F95-L99 PolarHBondContact O-N 2.96Å; I96-L99 WeakPolarHBondContact O-CB 3.31Å; I96-L99 PolarHBondContact O-N 3.5Å
100F82.2Confident75.7Confident82 Ų8279.1 Ų79.136%0.3639%0.392SS..Hα-helixtrans-92-12.9177.8-66.8-67000113.3I96 Y97 F98 F179 L183I96-F100 HydrophobicContact CG2-CD2 4.36Å; I96-F100 HydrophobicContact CG2-CE2 4.11Å; I96-F100 VanDerWaalsContact O-CD2 3.3Å; I96-F100 WeakPolarHBondContact O-CD2 3.31Å; Y97-F100 PolarHBondContact O-N 2.99Å; F98-F100 PolarHBondContact O-N 3.25Å; F100-F179 HydrophobicContact CB-CD1 3.93Å; F100-F179 HydrophobicContact CB-CE1 4.36Å; F100-F179 AromaticContact CD1-CD1 3.56Å; F100-F179 HydrophobicContact CD1-CD1 3.56Å; F100-F179 AromaticContact CD1-CE1 3.13Å; F100-F179 HydrophobicContact CD1-CE1 3.13Å; F100-F179 HydrophobicContact CD1-CG 4.48Å; F100-F179 AromaticContact CD1-CZ 3.76Å; F100-F179 HydrophobicContact CD1-CZ 3.76Å; F100-F179 HydrophobicContact CE1-CD1 4.45Å; F100-F179 AromaticContact CE1-CE1 3.6Å; F100-F179 HydrophobicContact CE1-CE1 3.6Å; F100-F179 AromaticContact CE1-CZ 3.93Å; F100-F179 HydrophobicContact CE1-CZ 3.93Å; F100-F179 HydrophobicContact CG-CD1 4.11Å; F100-F179 HydrophobicContact CG-CE1 4.02Å; F100-F179 WeakPolarHBondContact O-CB 3.49Å; F100-L183 HydrophobicContact CB-CD1 3.86Å; F100-L183 WeakPolarHBondContact O-CD1 3.29Å
101A81.5Confident76.3Confident8 Ų878.7 Ų78.77%0.06639%0.389CS..SBendtrans-73127.8178.100000109.4Y97 F98 T103 Y110 L183 F185Y97-A101 PolarHBondContact O-N 3.44Å; F98-A101 PolarHBondContact O-N 3.04Å; A101-T103 PolarHBondContact O-N 3.49Å; A101-Y110 HydrophobicContact CB-CD2 4.37Å; A101-Y110 HydrophobicContact CB-CE2 3.99Å; A101-L183 HydrophobicContact CB-CD1 4.19Å; A101-F185 HydrophobicContact CB-CE2 4.41Å
102P80Confident76.8Confident34 Ų3484.4 Ų84.422%0.22140%0.397CS..SBendtrans-76.750.6-176.434.7-39.4000111.9M176 A180 F185P102-M176 HydrophobicContact CB-CB 4.19Å; P102-M176 HydrophobicContact CB-CE 3.85Å; P102-A180 HydrophobicContact CG-CB 3.81Å; P102-F185 HydrophobicContact CG-CD1 4.25Å; P102-F185 HydrophobicContact CG-CG 4.2Å
103T76.3Confident77.2Confident39 Ų3982.7 Ų82.724%0.23939%0.388CS..  trans-139.6143.2-178.663.50000112.6F98 A101 I105 Y110 F185F98-T103 VanDerWaalsContact CE2-O 3.32Å; F98-T103 WeakPolarHBondContact CE2-O 3.39Å; A101-T103 PolarHBondContact O-N 3.49Å; T103-I105 VanDerWaalsContact C-N 3.34Å; T103-I105 PolarHBondContact OG1-O 3.05Å; T103-Y110 HydrophobicContact CG2-CE1 4.38Å; T103-Y110 PolarHBondContact OG1-OH 3.21Å; T103-F185 HydrophobicContact CG2-CE1 3.77Å; T103-F185 HydrophobicContact CG2-CE2 3.79Å; T103-F185 HydrophobicContact CG2-CZ 3.19Å
104L69.2Low77Confident179 Ų17979 Ų7994%0.93738%0.383SS*.SBendtrans-79.8-16.4174.8-62.7174.4000113.3
105I69.9Low76.7Confident100 Ų10085.2 Ų85.251%0.51340%0.403SS..SBendtrans-102.5114.2-175.8-58.7174.7000109.2T103 Y110T103-I105 VanDerWaalsContact C-N 3.34Å; T103-I105 PolarHBondContact OG1-O 3.05Å; I105-Y110 PolarHBondContact O-OH 3.29Å
106Y70.6Confident76.8Confident84 Ų8486.7 Ų86.733%0.32941%0.412SS..  trans-63.6130.7176.6178.1-103.6000113P90 N94 F98 N108 Y110P90-Y106 WeakPolarHBondContact CB-OH 3.39Å; P90-Y106 HydrophobicContact CG-CE1 4.32Å; P90-Y106 WeakPolarHBondContact CG-OH 3.49Å; N94-Y106 WeakPolarHBondContact CB-OH 3.46Å; F98-Y106 HydrophobicContact CB-CD2 3.79Å; F98-Y106 HydrophobicContact CB-CE2 3.92Å; F98-Y106 AromaticContact CD1-CD2 3.88Å; F98-Y106 HydrophobicContact CD1-CD2 3.88Å; F98-Y106 AromaticContact CD2-CD2 3.77Å; F98-Y106 HydrophobicContact CD2-CD2 3.77Å; F98-Y106 HydrophobicContact CE1-CD2 4.4Å; F98-Y106 VanDerWaalsContact CE2-CA 3.45Å; F98-Y106 HydrophobicContact CE2-CD2 4.31Å; F98-Y106 AromaticContact CG-CD2 3.53Å; F98-Y106 HydrophobicContact CG-CD2 3.53Å; F98-Y106 HydrophobicContact CG-CE2 4.18Å; Y106-N108 PolarHBondContact OH-OD1 3.23Å; Y106-Y110 WeakPolarHBondContact CA-OH 3.19Å
107R71.7Confident77.1Confident151 Ų15189 Ų8957%0.5743%0.425SS*.  trans-142.2147.3165.8-63.1-173.2171.3-167-4.1109.6I109 Y110R107-I109 VanDerWaalsContact C-N 3.27Å; R107-I109 PolarHBondContact O-N 3.02Å; R107-Y110 HydrophobicContact CB-CD1 4.23Å; R107-Y110 HydrophobicContact CB-CE1 3.74Å; R107-Y110 HydrophobicContact CB-CE2 4.22Å; R107-Y110 HydrophobicContact CG-CE1 3.98Å; R107-Y110 PolarHBondContact N-OH 3.47Å; R107-Y110 WeakPolarHBondContact O-CE2 3.22Å
108N75.5Confident77.5Confident88 Ų8887.6 Ų87.647%0.47142%0.422SS..SBendtrans-64.6-32.6176.2-72.5-53000112.7N94 Y106N94-N108 PolarHBondContact ND2-OD1 3Å; Y106-N108 PolarHBondContact OH-OD1 3.23Å
109I78Confident77.9Confident141 Ų14189 Ų8972%0.72344%0.442SS*.  trans-141.8132.3-175.9-55.3173.7000108.3R107R107-I109 VanDerWaalsContact C-N 3.27Å; R107-I109 PolarHBondContact O-N 3.02Å
110Y82.1Confident78.6Confident13 Ų1390.9 Ų90.95%0.05145%0.447CS..  trans-111.1150.6172.7-63.3-85.6000110.9Y97 F98 A101 T103 I105 Y106 R107 F185Y97-Y110 AromaticContact CE1-CD2 3.57Å; Y97-Y110 HydrophobicContact CE1-CD2 3.57Å; Y97-Y110 HydrophobicContact CE1-CE2 4.09Å; F98-Y110 VanDerWaalsContact CD2-OH 3.31Å; F98-Y110 WeakPolarHBondContact CD2-OH 3.24Å; F98-Y110 WeakPolarHBondContact CE2-OH 3.42Å; A101-Y110 HydrophobicContact CB-CD2 4.37Å; A101-Y110 HydrophobicContact CB-CE2 3.99Å; T103-Y110 HydrophobicContact CG2-CE1 4.38Å; T103-Y110 PolarHBondContact OG1-OH 3.21Å; I105-Y110 PolarHBondContact O-OH 3.29Å; Y106-Y110 WeakPolarHBondContact CA-OH 3.19Å; R107-Y110 HydrophobicContact CB-CD1 4.23Å; R107-Y110 HydrophobicContact CB-CE1 3.74Å; R107-Y110 HydrophobicContact CB-CE2 4.22Å; R107-Y110 HydrophobicContact CG-CE1 3.98Å; R107-Y110 PolarHBondContact N-OH 3.47Å; R107-Y110 WeakPolarHBondContact O-CE2 3.22Å; Y110-F185 VanDerWaalsContact CB-CE2 3.41Å; Y110-F185 AromaticContact CD1-CE2 3.36Å; Y110-F185 HydrophobicContact CD1-CE2 3.36Å; Y110-F185 AromaticContact CD1-CZ 3.57Å; Y110-F185 HydrophobicContact CD1-CZ 3.57Å; Y110-F185 HydrophobicContact CD2-CD2 4.43Å; Y110-F185 AromaticContact CD2-CE2 3.76Å; Y110-F185 HydrophobicContact CD2-CE2 3.76Å; Y110-F185 AromaticContact CE1-CE2 3.98Å; Y110-F185 HydrophobicContact CE1-CE2 3.98Å; Y110-F185 HydrophobicContact CE1-CZ 4.14Å; Y110-F185 HydrophobicContact CE2-CE2 4.36Å; Y110-F185 HydrophobicContact CG-CD2 4.08Å; Y110-F185 AromaticContact CG-CE2 3.24Å; Y110-F185 HydrophobicContact CG-CE2 3.24Å; Y110-F185 AromaticContact CG-CZ 3.93Å; Y110-F185 HydrophobicContact CG-CZ 3.93Å
111P80.9Confident78.9Confident53 Ų5387.6 Ų87.634%0.34443%0.432SS..  trans-58.6143.7174.226.1-34.4000110.1G186 I189 I190P111-G186 WeakPolarHBondContact O-CA 3.39Å; P111-G186 PolarHBondContact O-N 3.31Å; P111-I189 HydrophobicContact CB-CD1 4.43Å; P111-I190 HydrophobicContact CG-CD1 4.1Å; P111-I190 HydrophobicContact CG-CG1 4.42Å
112R83.1Confident79.2Confident184 Ų18490.7 Ų90.769%0.69445%0.445SS*.BIsolated β-bridgetrans-118.9143.5-178.1-69.1-177-69177.1-0.3112.8R184R112-R184 CarbonylContact C-O 3.46Å; R112-R184 WeakPolarHBondContact CA-O 3.48Å; R112-R184 HydrophobicContact CB-CB 4.24Å; R112-R184 HydrophobicContact CG-CB 4.42Å
113Y80.2Confident79.7Confident85 Ų8595 Ų9533%0.33346%0.463SS..  trans-109.3157.8178.6-163.5-109.2000112.3R115 R184 I189Y113-R115 HydrophobicContact CD1-CB 4.04Å; Y113-R115 HydrophobicContact CD1-CG 4.46Å; Y113-R115 HydrophobicContact CE1-CB 3.75Å; Y113-R115 HydrophobicContact CE1-CG 3.78Å; Y113-R184 PolarHBondContact N-O 2.81Å; Y113-R184 WeakPolarHBondContact O-CB 3.28Å; Y113-R184 WeakPolarHBondContact O-CD 3.38Å; Y113-I189 HydrophobicContact CD2-CD1 4.14Å; Y113-I189 HydrophobicContact CD2-CG1 3.96Å
114S75.9Confident80.4Confident91 Ų9194.7 Ų94.764%0.63646%0.459SS*.SBendtrans-88.6-28.7-171.663.80000115
115R72Confident81.4Confident174 Ų17487.3 Ų87.366%0.65742%0.42SS*.  trans-84.5143.9-178.5-59.3-173.4179.1-176.9-2.1111.1Y113Y113-R115 HydrophobicContact CD1-CB 4.04Å; Y113-R115 HydrophobicContact CD1-CG 4.46Å; Y113-R115 HydrophobicContact CE1-CB 3.75Å; Y113-R115 HydrophobicContact CE1-CG 3.78Å
116I72.8Confident82.2Confident79 Ų7986.7 Ų86.741%0.40542%0.418SS..  trans-132.5117.8-176.4-53.1175.7000108.3V118 E181 R184I116-V118 HydrophobicContact CG2-CB 4.22Å; I116-V118 HydrophobicContact CG2-CG2 3.42Å; I116-V118 VanDerWaalsContact CG2-CG2 3.42Å; I116-E181 WeakPolarHBondContact CA-OE2 3.36Å; I116-R184 HydrophobicContact CD1-CG 4.28Å; I116-R184 VanDerWaalsContact CD1-NE 3.34Å; I116-R184 HydrophobicContact CG1-CG 4.21Å
117L82.8Confident83Confident100 Ų10085.5 Ų85.552%0.52443%0.425SS..  trans-123.942.6175.3-72.4171.4000112.2A119 K120 E181L117-A119 PolarHBondContact O-N 2.6Å; L117-K120 PolarHBondContact O-N 3.43Å; L117-E181 PolarHBondContact N-OE2 3.45Å
118V87.1Confident83.7Confident26 Ų2678.7 Ų78.716%0.15840%0.4CS..Hα-helixtrans-58.1-43.3-176.1173.60000112.9I116 K120 H121 F122 E181 M182I116-V118 HydrophobicContact CG2-CB 4.22Å; I116-V118 HydrophobicContact CG2-CG2 3.42Å; I116-V118 VanDerWaalsContact CG2-CG2 3.42Å; V118-K120 VanDerWaalsContact C-N 3.27Å; V118-K120 PolarHBondContact O-N 3.27Å; V118-H121 PolarHBondContact O-N 2.67Å; V118-F122 HydrophobicContact CG1-CD2 3.47Å; V118-F122 VanDerWaalsContact CG1-CD2 3.47Å; V118-F122 HydrophobicContact CG1-CE2 3.26Å; V118-F122 WeakPolarHBondContact O-CD2 3.4Å; V118-F122 PolarHBondContact O-N 2.8Å; V118-E181 HydrophobicContact CG2-CB 3.5Å; V118-M182 HydrophobicContact CB-CG 4.43Å; V118-M182 HydrophobicContact CG1-CG 3.79Å; V118-M182 HydrophobicContact CG1-SD 4.38Å; V118-M182 HydrophobicContact CG2-CB 4.42Å; V118-M182 HydrophobicContact CG2-CG 3.65Å
119A88.5Confident84.1Confident74 Ų7477.1 Ų77.161%0.61239%0.394SS*.Hα-helixtrans-61.4-34.9-176.300000112.9L117 H121 F122 M123L117-A119 PolarHBondContact O-N 2.6Å; A119-H121 VanDerWaalsContact C-N 3.35Å; A119-H121 PolarHBondContact O-N 3.33Å; A119-F122 PolarHBondContact O-N 3.41Å; A119-M123 VanDerWaalsContact O-CG 3.3Å; A119-M123 WeakPolarHBondContact O-CG 3.48Å; A119-M123 PolarHBondContact O-N 3.1Å
120K89.6Confident84.3Confident124 Ų12477.3 Ų77.354%0.53939%0.39SS..Hα-helixtrans-59.6-47.1177.6-176.4-171.6175-164.10111L117 V118 M123 E124L117-K120 PolarHBondContact O-N 3.43Å; V118-K120 VanDerWaalsContact C-N 3.27Å; V118-K120 PolarHBondContact O-N 3.27Å; K120-M123 PolarHBondContact O-N 3.43Å; K120-E124 WeakPolarHBondContact CE-OE1 3.26Å; K120-E124 IonicContact NZ-OE1 3.83Å; K120-E124 WeakPolarHBondContact O-CG 3.3Å; K120-E124 PolarHBondContact O-N 3.46Å
121H88.6Confident84.3Confident12 Ų1282.4 Ų82.46%0.05641%0.41CS..Hα-helixtrans-69-37.5-178.6-66-53.2000112.7V118 A119 M123 E124 I125 A178V118-H121 PolarHBondContact O-N 2.67Å; A119-H121 VanDerWaalsContact C-N 3.35Å; A119-H121 PolarHBondContact O-N 3.33Å; H121-M123 VanDerWaalsContact C-N 3.33Å; H121-M123 PolarHBondContact O-N 3.29Å; H121-E124 IonicContact CE1-OE2 3.85Å; H121-E124 IonicContact CG-OE2 3.91Å; H121-E124 IonicContact ND1-OE1 3.98Å; H121-E124 IonicContact ND1-OE2 2.94Å; H121-E124 PolarHBondContact ND1-OE2 3.26Å; H121-E124 WeakPolarHBondContact O-CB 3.39Å; H121-E124 PolarHBondContact O-N 3.36Å; H121-I125 WeakPolarHBondContact O-CD1 3.43Å; H121-I125 VanDerWaalsContact O-CG1 3.31Å; H121-I125 WeakPolarHBondContact O-CG1 3.48Å; H121-I125 PolarHBondContact O-N 3.37Å; H121-A178 HydrophobicContact CB-CB 3.82Å
122F89.3Confident84.1Confident74 Ų7479.9 Ų79.933%0.32539%0.393SS..Hα-helixtrans-64.2-37.9172-77.9-64.1000112.5V118 A119 I125 L126 W175 A178 M182V118-F122 HydrophobicContact CG1-CD2 3.47Å; V118-F122 VanDerWaalsContact CG1-CD2 3.47Å; V118-F122 HydrophobicContact CG1-CE2 3.26Å; V118-F122 WeakPolarHBondContact O-CD2 3.4Å; V118-F122 PolarHBondContact O-N 2.8Å; A119-F122 PolarHBondContact O-N 3.41Å; F122-I125 HydrophobicContact CD1-CD1 4.16Å; F122-I125 PolarHBondContact O-N 3.18Å; F122-L126 WeakPolarHBondContact O-CG 3.49Å; F122-L126 PolarHBondContact O-N 3.34Å; F122-W175 HydrophobicContact CE1-CZ3 4.09Å; F122-A178 HydrophobicContact CE2-CB 4.34Å; F122-A178 HydrophobicContact CZ-CB 4.31Å; F122-M182 HydrophobicContact CE2-CE 4.43Å; F122-M182 HydrophobicContact CE2-SD 4.25Å; F122-M182 HydrophobicContact CZ-CE 4.06Å; F122-M182 HydrophobicContact CZ-SD 4.29Å
123M90.6Very high83.7Confident125 Ų12572.9 Ų72.962%0.61637%0.368SS*.Hα-helixtrans-65.2-38.9173.5-71-60.8-63.300112.3A119 K120 H121 L126 A127A119-M123 VanDerWaalsContact O-CG 3.3Å; A119-M123 WeakPolarHBondContact O-CG 3.48Å; A119-M123 PolarHBondContact O-N 3.1Å; K120-M123 PolarHBondContact O-N 3.43Å; H121-M123 VanDerWaalsContact C-N 3.33Å; H121-M123 PolarHBondContact O-N 3.29Å; M123-L126 PolarHBondContact O-N 2.86Å; M123-L126 HydrophobicContact SD-CD1 4.27Å; M123-A127 WeakPolarHBondContact O-CB 3.36Å; M123-A127 PolarHBondContact O-N 3.16Å
124E90.9Very high83.3Confident31 Ų3173.8 Ų73.815%0.14538%0.375CS..Hα-helixtrans-60.2-44.4173.1-72.6165.7-176.300111.5K120 H121 A127 C128 Y169 S174K120-E124 WeakPolarHBondContact CE-OE1 3.26Å; K120-E124 IonicContact NZ-OE1 3.83Å; K120-E124 WeakPolarHBondContact O-CG 3.3Å; K120-E124 PolarHBondContact O-N 3.46Å; H121-E124 IonicContact CE1-OE2 3.85Å; H121-E124 IonicContact CG-OE2 3.91Å; H121-E124 IonicContact ND1-OE1 3.98Å; H121-E124 IonicContact ND1-OE2 2.94Å; H121-E124 PolarHBondContact ND1-OE2 3.26Å; H121-E124 WeakPolarHBondContact O-CB 3.39Å; H121-E124 PolarHBondContact O-N 3.36Å; E124-A127 PolarHBondContact O-N 3.33Å; E124-C128 PolarHBondContact O-N 2.92Å; E124-C128 PolarHBondContact O-SG 3.41Å; E124-Y169 HydrophobicContact CB-CE1 4.26Å; E124-S174 WeakPolarHBondContact CB-OG 3.39Å; E124-S174 PolarHBondContact OE2-OG 3.28Å
125I88.7Confident83.1Confident25 Ų2570.8 Ų70.813%0.12835%0.352CS..Hα-helixtrans-62-47.9176.7-66.8154.5000110.7H121 F122 A127 C128 V129 W175H121-I125 WeakPolarHBondContact O-CD1 3.43Å; H121-I125 VanDerWaalsContact O-CG1 3.31Å; H121-I125 WeakPolarHBondContact O-CG1 3.48Å; H121-I125 PolarHBondContact O-N 3.37Å; F122-I125 HydrophobicContact CD1-CD1 4.16Å; F122-I125 PolarHBondContact O-N 3.18Å; I125-A127 VanDerWaalsContact C-N 3.33Å; I125-A127 PolarHBondContact O-N 3.08Å; I125-C128 WeakPolarHBondContact O-CB 3.42Å; I125-C128 PolarHBondContact O-N 3Å; I125-V129 WeakPolarHBondContact O-CG2 3.43Å; I125-V129 PolarHBondContact O-N 3.44Å; I125-W175 HydrophobicContact CD1-CB 4.23Å; I125-W175 HydrophobicContact CD1-CE3 3.75Å
126L88Confident82.7Confident87 Ų8763 Ų6346%0.45532%0.323SS..Hα-helixtrans-59.5-45.1177.3-71.3173.8000111.1F122 M123 C128 V129 F130F122-L126 WeakPolarHBondContact O-CG 3.49Å; F122-L126 PolarHBondContact O-N 3.34Å; M123-L126 PolarHBondContact O-N 2.86Å; M123-L126 HydrophobicContact SD-CD1 4.27Å; L126-C128 VanDerWaalsContact C-N 3.32Å; L126-C128 PolarHBondContact O-N 3.19Å; L126-V129 PolarHBondContact O-N 3.26Å; L126-F130 HydrophobicContact CB-CD2 4.44Å; L126-F130 HydrophobicContact CB-CE2 4.36Å; L126-F130 WeakPolarHBondContact O-CD2 3.01Å; L126-F130 PolarHBondContact O-N 3.49Å
127A87.6Confident82.4Confident58 Ų5864 Ų6448%0.47933%0.326SS..Hα-helixtrans-59.5-42.2176.100000112M123 E124 I125 F130 Y131M123-A127 WeakPolarHBondContact O-CB 3.36Å; M123-A127 PolarHBondContact O-N 3.16Å; E124-A127 PolarHBondContact O-N 3.33Å; I125-A127 VanDerWaalsContact C-N 3.33Å; I125-A127 PolarHBondContact O-N 3.08Å; A127-F130 PolarHBondContact O-N 3.33Å; A127-Y131 VanDerWaalsContact O-CB 3.24Å; A127-Y131 WeakPolarHBondContact O-CB 3.43Å; A127-Y131 PolarHBondContact O-N 3.45Å
128C86Confident81.2Confident8 Ų864.2 Ų64.25%0.05433%0.328CS..Hα-helixtrans-62-45175.8-68.10000111.6E124 I125 L126 S132 L166 A170E124-C128 PolarHBondContact O-N 2.92Å; E124-C128 PolarHBondContact O-SG 3.41Å; I125-C128 WeakPolarHBondContact O-CB 3.42Å; I125-C128 PolarHBondContact O-N 3Å; L126-C128 VanDerWaalsContact C-N 3.32Å; L126-C128 PolarHBondContact O-N 3.19Å; C128-S132 VanDerWaalsContact O-CB 3.3Å; C128-S132 WeakPolarHBondContact O-CB 3.21Å; C128-S132 PolarHBondContact O-N 3.28Å; C128-S132 PolarHBondContact O-OG 3.45Å; C128-L166 HydrophobicContact CB-CD2 4.48Å; C128-A170 HydrophobicContact CB-CB 3.96Å
129V83.3Confident79.9Confident56 Ų5667.9 Ų67.934%0.33934%0.342SS..Hα-helixtrans-63.3-43.7177.6172.90000111.6I125 L126 S132 H133 F316I125-V129 WeakPolarHBondContact O-CG2 3.43Å; I125-V129 PolarHBondContact O-N 3.44Å; L126-V129 PolarHBondContact O-N 3.26Å; V129-S132 PolarHBondContact O-OG 3.36Å; V129-S132 VanDerWaalsContact O-OG 3.11Å; V129-H133 WeakPolarHBondContact O-CB 3.26Å; V129-H133 PolarHBondContact O-N 3.32Å; V129-H133 VanDerWaalsContact O-N 3.09Å; V129-F316 HydrophobicContact CG1-CZ 4.39Å; V129-F316 WeakPolarHBondContact O-CZ 2.97Å
130F83.4Confident78.1Confident144 Ų14465.4 Ų65.463%0.63232%0.32SS*.Hα-helixtrans-67.5-43.8178.1-77.3-63.1000112.6L126 A127 H133 H134L126-F130 HydrophobicContact CB-CD2 4.44Å; L126-F130 HydrophobicContact CB-CE2 4.36Å; L126-F130 WeakPolarHBondContact O-CD2 3.01Å; L126-F130 PolarHBondContact O-N 3.49Å; A127-F130 PolarHBondContact O-N 3.33Å; F130-H133 PolarHBondContact O-N 3.34Å; F130-H134 PolarHBondContact O-N 3.46Å; F130-H134 VanDerWaalsContact O-N 3.09Å
131Y80.4Confident76.3Confident121 Ų12169 Ų6948%0.47533%0.33SS..Hα-helixtrans-68.9-43.7-177.4-177.7-116.7000111.9A127 H133 H134 L135 L166A127-Y131 VanDerWaalsContact O-CB 3.24Å; A127-Y131 WeakPolarHBondContact O-CB 3.43Å; A127-Y131 PolarHBondContact O-N 3.45Å; Y131-H133 PolarHBondContact O-N 2.67Å; Y131-H134 WeakPolarHBondContact O-CB 3.41Å; Y131-H134 PolarHBondContact O-N 2.77Å; Y131-L135 HydrophobicContact CD1-CD1 4.13Å; Y131-L135 HydrophobicContact CE1-CD1 3.72Å; Y131-L135 HydrophobicContact CE1-CG 4.27Å; Y131-L135 WeakPolarHBondContact O-CG 3.42Å; Y131-L135 PolarHBondContact O-N 2.86Å; Y131-L166 HydrophobicContact CD1-CD1 3.4Å; Y131-L166 VanDerWaalsContact CD1-CD1 3.4Å; Y131-L166 HydrophobicContact CD1-CD2 3.93Å; Y131-L166 HydrophobicContact CD1-CG 4.27Å; Y131-L166 HydrophobicContact CE1-CD1 3.86Å
132S77.6Confident74.6Confident0 Ų073.2 Ų73.20%035%0.353CS..Hα-helixtrans-61.2-44.817450.70000111.1C128 V129 H134 L135 F136 F316C128-S132 VanDerWaalsContact O-CB 3.3Å; C128-S132 WeakPolarHBondContact O-CB 3.21Å; C128-S132 PolarHBondContact O-N 3.28Å; C128-S132 PolarHBondContact O-OG 3.45Å; V129-S132 PolarHBondContact O-OG 3.36Å; V129-S132 VanDerWaalsContact O-OG 3.11Å; S132-H134 VanDerWaalsContact C-N 3.29Å; S132-H134 PolarHBondContact O-N 3.46Å; S132-L135 WeakPolarHBondContact O-CB 3.46Å; S132-L135 PolarHBondContact O-N 2.82Å; S132-F136 WeakPolarHBondContact O-CD2 3.11Å; S132-F136 PolarHBondContact O-N 3.4Å; S132-F136 VanDerWaalsContact O-N 3.08Å; S132-F316 WeakPolarHBondContact OG-CE2 3.34Å; S132-F316 WeakPolarHBondContact OG-CZ 3.48Å
133H74.2Confident72.7Confident36 Ų3677 Ų7717%0.16737%0.372CS..Hα-helixtrans-53.7-43.6173.7-178.757.4000113.2H13 V129 F130 Y131 F136 Q137 L313 F316H13-H133 AromaticContact CE1-NE2 3.74Å; V129-H133 WeakPolarHBondContact O-CB 3.26Å; V129-H133 PolarHBondContact O-N 3.32Å; V129-H133 VanDerWaalsContact O-N 3.09Å; F130-H133 PolarHBondContact O-N 3.34Å; Y131-H133 PolarHBondContact O-N 2.67Å; H133-F136 PolarHBondContact O-N 3.2Å; H133-Q137 PolarHBondContact CE1-NE2 2.81Å; H133-Q137 PolarHBondContact NE2-NE2 3.4Å; H133-Q137 PolarHBondContact O-N 3.2Å; H133-L313 VanDerWaalsContact CE1-CD1 3.49Å; H133-L313 WeakPolarHBondContact CE1-CD1 3.38Å; H133-L313 WeakPolarHBondContact ND1-CD1 3.35Å; H133-F316 HydrophobicContact CB-CD1 4.44Å; H133-F316 HydrophobicContact CB-CE1 3.84Å; H133-F316 HydrophobicContact CB-CZ 4.14Å
134H71.5Confident71Confident104 Ų10477.9 Ų77.948%0.48138%0.384SS..Hα-helixtrans-62.9-41.8176.6-177.971.1000112.4F130 Y131 S132 F136 Q137 N138F130-H134 PolarHBondContact O-N 3.46Å; F130-H134 VanDerWaalsContact O-N 3.09Å; Y131-H134 WeakPolarHBondContact O-CB 3.41Å; Y131-H134 PolarHBondContact O-N 2.77Å; S132-H134 VanDerWaalsContact C-N 3.29Å; S132-H134 PolarHBondContact O-N 3.46Å; H134-F136 VanDerWaalsContact C-N 3.27Å; H134-F136 PolarHBondContact O-N 3.2Å; H134-Q137 PolarHBondContact O-N 2.95Å; H134-N138 PolarHBondContact O-ND2 3.37Å
135L71.7Confident69.9Low29 Ų2979.1 Ų79.115%0.15240%0.396CS..Hα-helixtrans-58.8-39.2175-68.4173.7000111.9Y131 S132 M162 L166Y131-L135 HydrophobicContact CD1-CD1 4.13Å; Y131-L135 HydrophobicContact CE1-CD1 3.72Å; Y131-L135 HydrophobicContact CE1-CG 4.27Å; Y131-L135 WeakPolarHBondContact O-CG 3.42Å; Y131-L135 PolarHBondContact O-N 2.86Å; S132-L135 WeakPolarHBondContact O-CB 3.46Å; S132-L135 PolarHBondContact O-N 2.82Å; L135-M162 HydrophobicContact CD1-CB 3.85Å; L135-L166 HydrophobicContact CD1-CD1 3.98Å
136F65.3Low69.2Low9 Ų988.1 Ų88.14%0.03943%0.428CS..Hα-helixtrans-69.3-36.4-178.7-78.2-75.6000114.3S132 H133 H134 N138 C163 Y284 F316 V319S132-F136 WeakPolarHBondContact O-CD2 3.11Å; S132-F136 PolarHBondContact O-N 3.4Å; S132-F136 VanDerWaalsContact O-N 3.08Å; H133-F136 PolarHBondContact O-N 3.2Å; H134-F136 VanDerWaalsContact C-N 3.27Å; H134-F136 PolarHBondContact O-N 3.2Å; F136-N138 PolarHBondContact O-N 3.35Å; F136-C163 HydrophobicContact CE2-CB 3.85Å; F136-C163 WeakPolarHBondContact CE2-SG 3.46Å; F136-C163 HydrophobicContact CZ-CB 3.7Å; F136-C163 WeakPolarHBondContact CZ-SG 3.47Å; F136-Y284 AromaticContact CD1-CE2 3.87Å; F136-Y284 HydrophobicContact CD1-CE2 3.87Å; F136-Y284 AromaticContact CD1-CZ 3.99Å; F136-Y284 WeakPolarHBondContact CD1-OH 3.24Å; F136-Y284 HydrophobicContact CE1-CD2 4.15Å; F136-Y284 AromaticContact CE1-CE2 3.4Å; F136-Y284 HydrophobicContact CE1-CE2 3.4Å; F136-Y284 VanDerWaalsContact CE1-CE2 3.4Å; F136-Y284 AromaticContact CE1-CZ 3.94Å; F136-F316 HydrophobicContact CB-CB 4.45Å; F136-F316 HydrophobicContact CD1-CB 4.14Å; F136-F316 HydrophobicContact CD2-CB 3.53Å; F136-F316 HydrophobicContact CD2-CD1 4.48Å; F136-F316 AromaticContact CD2-CD2 3.14Å; F136-F316 HydrophobicContact CD2-CD2 3.14Å; F136-F316 AromaticContact CD2-CE2 3.88Å; F136-F316 HydrophobicContact CD2-CE2 3.88Å; F136-F316 AromaticContact CD2-CG 3.45Å; F136-F316 HydrophobicContact CD2-CG 3.45Å; F136-F316 VanDerWaalsContact CD2-CG 3.45Å; F136-F316 HydrophobicContact CE1-CB 4.31Å; F136-F316 HydrophobicContact CE2-CB 3.82Å; F136-F316 AromaticContact CE2-CD2 2.95Å; F136-F316 HydrophobicContact CE2-CD2 2.95Å; F136-F316 AromaticContact CE2-CE2 3.68Å; F136-F316 HydrophobicContact CE2-CE2 3.68Å; F136-F316 AromaticContact CE2-CG 3.7Å; F136-F316 HydrophobicContact CE2-CG 3.7Å; F136-F316 HydrophobicContact CG-CB 3.77Å; F136-F316 HydrophobicContact CG-CD2 4.21Å; F136-F316 HydrophobicContact CG-CG 4.17Å; F136-F316 HydrophobicContact CZ-CB 4.18Å; F136-F316 AromaticContact CZ-CD2 3.83Å; F136-F316 HydrophobicContact CZ-CD2 3.83Å; F136-F316 HydrophobicContact CZ-CG 4.47Å; F136-V319 HydrophobicContact CE1-CG2 4.45Å; F136-V319 HydrophobicContact CZ-CB 4.03Å; F136-V319 HydrophobicContact CZ-CG1 4.23Å; F136-V319 HydrophobicContact CZ-CG2 4.21Å
137Q65Low68.8Low101 Ų10188.5 Ų88.547%0.47244%0.438SS..Hα-helixtrans-61.2-31-178.1-69.6-170.43.200112.4H133 H134 F139 S140H133-Q137 PolarHBondContact CE1-NE2 2.81Å; H133-Q137 PolarHBondContact NE2-NE2 3.4Å; H133-Q137 PolarHBondContact O-N 3.2Å; H134-Q137 PolarHBondContact O-N 2.95Å; Q137-F139 PolarHBondContact O-N 3.23Å; Q137-S140 PolarHBondContact O-OG 3.08Å
138N59.1Low68.3Low105 Ų10587.4 Ų87.456%0.56143%0.427SS*.THydrogen-bonded Turntrans-78.5-13.8-169.6-68.3-34.5000115.4H134 F136H134-N138 PolarHBondContact O-ND2 3.37Å; F136-N138 PolarHBondContact O-N 3.35Å
139F59Low67.9Low103 Ų10389 Ų8945%0.45243%0.433SS..THydrogen-bonded Turntrans-111.925.1-168-96.1-87.9000116.4Q137 R141 G155 P159Q137-F139 PolarHBondContact O-N 3.23Å; F139-R141 PolarHBondContact O-N 2.9Å; F139-G155 VanDerWaalsContact CE1-O 3.27Å; F139-G155 WeakPolarHBondContact CE1-O 3.49Å; F139-P159 HydrophobicContact CD2-CB 4.27Å; F139-P159 HydrophobicContact CD2-CG 3.96Å; F139-P159 HydrophobicContact CE1-CG 4.45Å; F139-P159 HydrophobicContact CE2-CB 4.36Å; F139-P159 HydrophobicContact CE2-CG 3.9Å; F139-P159 HydrophobicContact CG-CG 4.26Å; F139-P159 HydrophobicContact CZ-CG 4.15Å
140S51.7Low67.8Low22 Ų2291 Ų9115%0.15444%0.441CS..  trans-97.724.5-162.5-41.70000116.8Q137 R308 N312Q137-S140 PolarHBondContact O-OG 3.08Å; S140-R308 PolarHBondContact O-NH1 3.47Å; S140-N312 WeakPolarHBondContact CB-ND2 3.33Å; S140-N312 PolarHBondContact OG-ND2 2.93Å
141R51.7Low67.8Low200 Ų20090.1 Ų90.176%0.75544%0.442SS*.  trans-139.682.8-166-62.5-177.4179.4178.8-0.2111.9F139F139-R141 PolarHBondContact O-N 2.9Å
142D51.3Low67.7Low100 Ų10085.2 Ų85.254%0.53543%0.426SS..  trans-154.4146.4162.2-90.8-39.5000115
143H50.6Low67.8Low154 Ų15485.4 Ų85.471%0.71343%0.428SS*.  trans-84.9176.4-170.9-46.3-61000113.3S148 R289H143-S148 WeakPolarHBondContact O-CB 3.42Å; H143-R289 PolarHBondContact O-NH1 3.05Å
144V54.7Low68.2Low143 Ų14390.1 Ų90.187%0.86745%0.448SS*.SBendtrans-95.4101.8-167.2-175.90000111.1
145S68.3Low68.7Low57 Ų5786.7 Ų86.740%0.39944%0.441SS..  trans-157.5160.6158.184.30000110.1S147 S148 F149S145-S147 PolarHBondContact O-N 3.4Å; S145-S148 CarbonylContact O-C 3.47Å; S145-S148 WeakPolarHBondContact O-CA 3.38Å; S145-S148 WeakPolarHBondContact O-CB 3.37Å; S145-S148 PolarHBondContact O-N 3.19Å; S145-S148 VanDerWaalsContact O-N 3.12Å; S145-S148 WeakPolarHBondContact OG-CB 3.17Å; S145-S148 PolarHBondContact OG-N 2.98Å; S145-S148 PolarHBondContact OG-OG 3.23Å; S145-F149 PolarHBondContact O-N 3.04Å
146W72.9Confident69.1Low213 Ų21385.5 Ų85.581%0.80744%0.435SS*.Hα-helixtrans-61.5-40.1177.4-88.7108.2000113.1S148 F149 L150W146-S148 VanDerWaalsContact C-N 3.28Å; W146-S148 PolarHBondContact O-N 3.48Å; W146-F149 HydrophobicContact CE3-CD1 4.33Å; W146-F149 HydrophobicContact CZ3-CD1 4.26Å; W146-F149 WeakPolarHBondContact O-CB 3.38Å; W146-F149 PolarHBondContact O-N 3.37Å; W146-F149 VanDerWaalsContact O-N 3.14Å; W146-L150 PolarHBondContact O-N 3.42Å
147S79.1Confident70.1Confident95 Ų9586.1 Ų86.166%0.66444%0.439SS*.Hα-helixtrans-63.6-38.7173.2-53.60000110.9S145 F149 L151S145-S147 PolarHBondContact O-N 3.4Å; S147-F149 VanDerWaalsContact C-N 3.32Å; S147-L151 VanDerWaalsContact O-CB 3.29Å; S147-L151 WeakPolarHBondContact O-CB 3.3Å; S147-L151 PolarHBondContact O-N 2.94Å
148S77Confident70.8Confident35 Ų3587.4 Ų87.425%0.24545%0.448CS..Hα-helixtrans-66.9-32.3173.2-52.30000112.2H143 S145 W146 S152H143-S148 WeakPolarHBondContact O-CB 3.42Å; S145-S148 CarbonylContact O-C 3.47Å; S145-S148 WeakPolarHBondContact O-CA 3.38Å; S145-S148 WeakPolarHBondContact O-CB 3.37Å; S145-S148 PolarHBondContact O-N 3.19Å; S145-S148 VanDerWaalsContact O-N 3.12Å; S145-S148 WeakPolarHBondContact OG-CB 3.17Å; S145-S148 PolarHBondContact OG-N 2.98Å; S145-S148 PolarHBondContact OG-OG 3.23Å; W146-S148 VanDerWaalsContact C-N 3.28Å; W146-S148 PolarHBondContact O-N 3.48Å; S148-S152 WeakPolarHBondContact O-CB 3.26Å; S148-S152 PolarHBondContact O-N 3.49Å
149F78.8Confident71.8Confident43 Ų4383.1 Ų83.119%0.18943%0.427CS..Hα-helixtrans-65.5-50.8175.1174.2-98.3000111.1S145 W146 S147 S152 A153 C285 A286S145-F149 PolarHBondContact O-N 3.04Å; W146-F149 HydrophobicContact CE3-CD1 4.33Å; W146-F149 HydrophobicContact CZ3-CD1 4.26Å; W146-F149 WeakPolarHBondContact O-CB 3.38Å; W146-F149 PolarHBondContact O-N 3.37Å; W146-F149 VanDerWaalsContact O-N 3.14Å; S147-F149 VanDerWaalsContact C-N 3.32Å; F149-S152 PolarHBondContact O-N 3.49Å; F149-A153 VanDerWaalsContact O-CB 3.25Å; F149-A153 WeakPolarHBondContact O-CB 3.49Å; F149-A153 PolarHBondContact O-N 3.3Å; F149-C285 HydrophobicContact CE2-CB 4.28Å; F149-A286 HydrophobicContact CE2-CB 4.28Å; F149-A286 HydrophobicContact CZ-CB 4.42Å
150L80.6Confident72.9Confident96 Ų9678.4 Ų78.450%0.50341%0.407SS..Hα-helixtrans-62.4-45.9178.7-71.7173.2000111.2W146 S152 A153 F154W146-L150 PolarHBondContact O-N 3.42Å; L150-S152 VanDerWaalsContact C-N 3.32Å; L150-S152 PolarHBondContact O-N 3.46Å; L150-A153 PolarHBondContact O-N 2.83Å; L150-F154 WeakPolarHBondContact O-CD2 3.49Å; L150-F154 PolarHBondContact O-N 3.07Å
151L83.2Confident74.4Confident126 Ų12677.5 Ų77.566%0.6640%0.4SS*.Hα-helixtrans-59.7-44.4177.2-176.361.3000111.6S147 G155S147-L151 VanDerWaalsContact O-CB 3.29Å; S147-L151 WeakPolarHBondContact O-CB 3.3Å; S147-L151 PolarHBondContact O-N 2.94Å; L151-G155 PolarHBondContact O-N 3.41Å
152S78.6Confident75.9Confident18 Ų1871.6 Ų71.613%0.12638%0.382CS..Hα-helixtrans-66.7-42.6176.8177.50000111.8S148 F149 L150 G155 C156 C285 R289S148-S152 WeakPolarHBondContact O-CB 3.26Å; S148-S152 PolarHBondContact O-N 3.49Å; F149-S152 PolarHBondContact O-N 3.49Å; L150-S152 VanDerWaalsContact C-N 3.32Å; L150-S152 PolarHBondContact O-N 3.46Å; S152-G155 CarbonylContact O-C 3.58Å; S152-G155 PolarHBondContact O-N 3Å; S152-C156 WeakPolarHBondContact O-CB 3.4Å; S152-C156 PolarHBondContact O-N 3.39Å; S152-C156 PolarHBondContact O-SG 2.93Å; S152-C285 PolarHBondContact OG-SG 3.42Å; S152-R289 PolarHBondContact OG-NH2 2.71Å
153A80.3Confident77.4Confident5 Ų567 Ų674%0.04136%0.357CS..Hα-helixtrans-60.8-47.6177.300000111F149 L150 C156 V157 I282 C285F149-A153 VanDerWaalsContact O-CB 3.25Å; F149-A153 WeakPolarHBondContact O-CB 3.49Å; F149-A153 PolarHBondContact O-N 3.3Å; L150-A153 PolarHBondContact O-N 2.83Å; A153-C156 PolarHBondContact O-N 3.22Å; A153-C156 VanDerWaalsContact O-N 3.16Å; A153-V157 WeakPolarHBondContact O-CG2 2.78Å; A153-V157 PolarHBondContact O-N 2.76Å; A153-I282 HydrophobicContact CB-CG1 4.46Å; A153-C285 HydrophobicContact CB-CB 4.25Å
154F82.7Confident78.9Confident135 Ų13561.5 Ų61.559%0.59233%0.331SS*.Hα-helixtrans-63.9-40.6174.3-75.5-61.5000112.4L150 C156 V157 L278L150-F154 WeakPolarHBondContact O-CD2 3.49Å; L150-F154 PolarHBondContact O-N 3.07Å; F154-C156 PolarHBondContact O-N 3.44Å; F154-V157 WeakPolarHBondContact O-CB 3.28Å; F154-V157 PolarHBondContact O-N 3.44Å; F154-L278 HydrophobicContact CD1-CD2 4.29Å; F154-L278 HydrophobicContact CE1-CD2 3.99Å
155G81Confident80.4Confident32 Ų3257.9 Ų57.933%0.3331%0.306SS..Hα-helixtrans-60.9-30173.300000113.2F139 L151 S152 P159F139-G155 VanDerWaalsContact CE1-O 3.27Å; F139-G155 WeakPolarHBondContact CE1-O 3.49Å; L151-G155 PolarHBondContact O-N 3.41Å; S152-G155 CarbonylContact O-C 3.58Å; S152-G155 PolarHBondContact O-N 3Å; G155-P159 WeakPolarHBondContact O-CD 3.29Å
156C81.2Confident81.2Confident4 Ų456.7 Ų56.73%0.02730%0.295CS..Hα-helixtrans-84.1-14.1178.6-700000114.5S152 A153 F154 L158 P159 A160 Y284S152-C156 WeakPolarHBondContact O-CB 3.4Å; S152-C156 PolarHBondContact O-N 3.39Å; S152-C156 PolarHBondContact O-SG 2.93Å; A153-C156 PolarHBondContact O-N 3.22Å; A153-C156 VanDerWaalsContact O-N 3.16Å; F154-C156 PolarHBondContact O-N 3.44Å; C156-L158 PolarHBondContact O-N 2.91Å; C156-P159 VanDerWaalsContact O-CD 3.31Å; C156-P159 WeakPolarHBondContact O-CD 3.42Å; C156-P159 WeakPolarHBondContact O-CG 3.4Å; C156-A160 WeakPolarHBondContact O-CB 3.17Å; C156-A160 PolarHBondContact O-N 2.99Å; C156-Y284 HydrophobicContact CB-CD1 3.83Å
157V84.5Confident81.6Confident22 Ų2246.8 Ų46.813%0.13326%0.258CS..Hα-helixtrans-56.2-50.9-177.6171.20000111.8A153 F154 S161 M277 L278A153-V157 WeakPolarHBondContact O-CG2 2.78Å; A153-V157 PolarHBondContact O-N 2.76Å; F154-V157 WeakPolarHBondContact O-CB 3.28Å; F154-V157 PolarHBondContact O-N 3.44Å; V157-S161 WeakPolarHBondContact O-CB 3.32Å; V157-S161 PolarHBondContact O-N 3.21Å; V157-S161 PolarHBondContact O-OG 3.08Å; V157-M277 HydrophobicContact CG1-CB 4.1Å; V157-L278 HydrophobicContact CG2-CD2 3.94Å
158L80.8Confident81.8Confident127 Ų12745.9 Ų45.967%0.66524%0.243SC*.Hα-helixtrans-64.1-54.6-179.3-71.2177.2000113C156 A160 S161 M162C156-L158 PolarHBondContact O-N 2.91Å; L158-A160 PolarHBondContact O-N 2.64Å; L158-S161 WeakPolarHBondContact CA-OG 3.36Å; L158-S161 PolarHBondContact O-N 2.87Å; L158-S161 PolarHBondContact O-OG 3.2Å; L158-M162 VanDerWaalsContact O-CG 3.32Å; L158-M162 WeakPolarHBondContact O-CG 3.38Å; L158-M162 PolarHBondContact O-N 2.71Å
159P79.6Confident82.2Confident16 Ų1648.5 Ų48.510%0.10425%0.248CC..Hα-helixtrans-64.3-40.9179.324.5-34.3000112.4F139 G155 C156 S161 M162 C163F139-P159 HydrophobicContact CD2-CB 4.27Å; F139-P159 HydrophobicContact CD2-CG 3.96Å; F139-P159 HydrophobicContact CE1-CG 4.45Å; F139-P159 HydrophobicContact CE2-CB 4.36Å; F139-P159 HydrophobicContact CE2-CG 3.9Å; F139-P159 HydrophobicContact CG-CG 4.26Å; F139-P159 HydrophobicContact CZ-CG 4.15Å; G155-P159 WeakPolarHBondContact O-CD 3.29Å; C156-P159 VanDerWaalsContact O-CD 3.31Å; C156-P159 WeakPolarHBondContact O-CD 3.42Å; C156-P159 WeakPolarHBondContact O-CG 3.4Å; P159-S161 PolarHBondContact O-N 2.96Å; P159-M162 PolarHBondContact O-N 3.3Å; P159-C163 WeakPolarHBondContact O-CB 3.41Å; P159-C163 PolarHBondContact O-N 3.4Å; P159-C163 PolarHBondContact O-SG 3.36Å
160A82Confident82.5Confident4 Ų447 Ų473%0.03324%0.243CC..Hα-helixtrans-62.8-43.9177.900000111.4C156 L158 M162 C163 Y164 N280 Y284C156-A160 WeakPolarHBondContact O-CB 3.17Å; C156-A160 PolarHBondContact O-N 2.99Å; L158-A160 PolarHBondContact O-N 2.64Å; A160-M162 PolarHBondContact O-N 2.95Å; A160-C163 PolarHBondContact O-N 3.24Å; A160-Y164 WeakPolarHBondContact O-CB 3.25Å; A160-Y164 PolarHBondContact O-N 3.03Å; A160-N280 HydrophobicContact CB-CB 4.25Å; A160-Y284 HydrophobicContact CB-CG 4.38Å
161S83.6Confident82.6Confident3 Ų345.4 Ų45.42%0.02124%0.237CC..Hα-helixtrans-62.8-38.5174.9610000113.2V157 L158 P159 Y164 L165 M277V157-S161 WeakPolarHBondContact O-CB 3.32Å; V157-S161 PolarHBondContact O-N 3.21Å; V157-S161 PolarHBondContact O-OG 3.08Å; L158-S161 WeakPolarHBondContact CA-OG 3.36Å; L158-S161 PolarHBondContact O-N 2.87Å; L158-S161 PolarHBondContact O-OG 3.2Å; P159-S161 PolarHBondContact O-N 2.96Å; S161-Y164 PolarHBondContact O-N 3.49Å; S161-L165 WeakPolarHBondContact O-CG 3.23Å; S161-L165 PolarHBondContact O-N 3.25Å; S161-M277 WeakPolarHBondContact CB-SD 3.18Å
162M82.6Confident82.5Confident76 Ų7644.1 Ų44.137%0.37423%0.23SC..Hα-helixtrans-65.9-45.5175.1-70.2-56.710600111L135 L158 P159 A160 Y164 L165 L166L135-M162 HydrophobicContact CD1-CB 3.85Å; L158-M162 VanDerWaalsContact O-CG 3.32Å; L158-M162 WeakPolarHBondContact O-CG 3.38Å; L158-M162 PolarHBondContact O-N 2.71Å; P159-M162 PolarHBondContact O-N 3.3Å; A160-M162 PolarHBondContact O-N 2.95Å; M162-Y164 VanDerWaalsContact C-N 3.31Å; M162-Y164 PolarHBondContact O-N 3.16Å; M162-L165 HydrophobicContact CE-CD1 3.9Å; M162-L165 PolarHBondContact O-N 3.15Å; M162-L166 WeakPolarHBondContact O-CB 3.42Å; M162-L166 WeakPolarHBondContact O-CD1 3.48Å; M162-L166 WeakPolarHBondContact O-CG 3.47Å; M162-L166 PolarHBondContact O-N 3.44Å
163C82.3Confident82.8Confident2 Ų247.3 Ų47.31%0.01424%0.243CC..Hα-helixtrans-60.4-41.4175.3-67.50000111.8F136 P159 A160 L166 T167 V319F136-C163 HydrophobicContact CE2-CB 3.85Å; F136-C163 WeakPolarHBondContact CE2-SG 3.46Å; F136-C163 HydrophobicContact CZ-CB 3.7Å; F136-C163 WeakPolarHBondContact CZ-SG 3.47Å; P159-C163 WeakPolarHBondContact O-CB 3.41Å; P159-C163 PolarHBondContact O-N 3.4Å; P159-C163 PolarHBondContact O-SG 3.36Å; A160-C163 PolarHBondContact O-N 3.24Å; C163-L166 PolarHBondContact O-N 3.46Å; C163-T167 WeakPolarHBondContact O-CB 3.41Å; C163-T167 PolarHBondContact O-N 3.37Å; C163-T167 PolarHBondContact O-OG1 3.39Å; C163-V319 HydrophobicContact CB-CG1 3.76Å
164Y82.9Confident83.1Confident40 Ų4047 Ų4716%0.15724%0.241CC..Hα-helixtrans-59.3-52.3172.8177.1-92.5000111.4A160 S161 M162 L166 T167 F168 I276 N280A160-Y164 WeakPolarHBondContact O-CB 3.25Å; A160-Y164 PolarHBondContact O-N 3.03Å; S161-Y164 PolarHBondContact O-N 3.49Å; M162-Y164 VanDerWaalsContact C-N 3.31Å; M162-Y164 PolarHBondContact O-N 3.16Å; Y164-L166 VanDerWaalsContact C-N 3.33Å; Y164-L166 PolarHBondContact O-N 3.44Å; Y164-T167 VanDerWaalsContact O-CB 3.3Å; Y164-T167 WeakPolarHBondContact O-CB 3.42Å; Y164-T167 PolarHBondContact O-N 3.21Å; Y164-T167 VanDerWaalsContact O-N 3.09Å; Y164-F168 HydrophobicContact CD1-CD2 4.04Å; Y164-F168 HydrophobicContact CD1-CE2 4.23Å; Y164-F168 HydrophobicContact CD2-CD2 4.05Å; Y164-F168 AromaticContact CD2-CE2 3.66Å; Y164-F168 HydrophobicContact CD2-CE2 3.66Å; Y164-F168 AromaticContact CE1-CD2 3.76Å; Y164-F168 HydrophobicContact CE1-CD2 3.76Å; Y164-F168 AromaticContact CE1-CE2 3.69Å; Y164-F168 HydrophobicContact CE1-CE2 3.69Å; Y164-F168 HydrophobicContact CE1-CG 4.41Å; Y164-F168 HydrophobicContact CE1-CZ 4.22Å; Y164-F168 AromaticContact CE2-CD2 3.83Å; Y164-F168 HydrophobicContact CE2-CD2 3.83Å; Y164-F168 AromaticContact CE2-CE2 3.07Å; Y164-F168 HydrophobicContact CE2-CE2 3.07Å; Y164-F168 AromaticContact CE2-CZ 3.73Å; Y164-F168 HydrophobicContact CE2-CZ 3.73Å; Y164-F168 HydrophobicContact CG-CD2 4.17Å; Y164-F168 HydrophobicContact CG-CE2 4.21Å; Y164-F168 AromaticContact CZ-CD2 3.65Å; Y164-F168 AromaticContact CZ-CE2 3.06Å; Y164-F168 AromaticContact CZ-CZ 3.43Å; Y164-F168 VanDerWaalsContact CZ-CZ 3.43Å; Y164-F168 VanDerWaalsContact O-CD2 3.29Å; Y164-F168 WeakPolarHBondContact O-CD2 3.26Å; Y164-F168 PolarHBondContact O-N 2.85Å; Y164-F168 VanDerWaalsContact OH-CE2 3.3Å; Y164-F168 WeakPolarHBondContact OH-CE2 3.19Å; Y164-F168 WeakPolarHBondContact OH-CZ 3.39Å; Y164-I276 HydrophobicContact CE1-CG2 3.93Å; Y164-N280 WeakPolarHBondContact CD2-OD1 3.44Å
165L85.5Confident83.3Confident67 Ų6746.3 Ų46.335%0.35123%0.234SC..Hα-helixtrans-61.3-40178.9-71.6175.6000112.9S161 M162 T167 F168 Y169 W273 M277S161-L165 WeakPolarHBondContact O-CG 3.23Å; S161-L165 PolarHBondContact O-N 3.25Å; M162-L165 HydrophobicContact CE-CD1 3.9Å; M162-L165 PolarHBondContact O-N 3.15Å; L165-T167 VanDerWaalsContact C-N 3.29Å; L165-T167 PolarHBondContact O-N 3.35Å; L165-F168 PolarHBondContact O-N 3.3Å; L165-Y169 VanDerWaalsContact O-CB 3.31Å; L165-Y169 WeakPolarHBondContact O-CB 3.14Å; L165-Y169 PolarHBondContact O-N 3.25Å; L165-W273 HydrophobicContact CD2-CZ3 4.24Å; L165-M277 HydrophobicContact CD1-CE 4.08Å; L165-M277 HydrophobicContact CD2-CE 4.3Å; L165-M277 HydrophobicContact CG-CE 4.19Å
166L86.3Confident83.5Confident31 Ų3148.3 Ų48.316%0.16224%0.236CC..Hα-helixtrans-63.5-37.6175.3-71.3162.9000111.7C128 Y131 L135 M162 C163 Y164 Y169 A170C128-L166 HydrophobicContact CB-CD2 4.48Å; Y131-L166 HydrophobicContact CD1-CD1 3.4Å; Y131-L166 VanDerWaalsContact CD1-CD1 3.4Å; Y131-L166 HydrophobicContact CD1-CD2 3.93Å; Y131-L166 HydrophobicContact CD1-CG 4.27Å; Y131-L166 HydrophobicContact CE1-CD1 3.86Å; L135-L166 HydrophobicContact CD1-CD1 3.98Å; M162-L166 WeakPolarHBondContact O-CB 3.42Å; M162-L166 WeakPolarHBondContact O-CD1 3.48Å; M162-L166 WeakPolarHBondContact O-CG 3.47Å; M162-L166 PolarHBondContact O-N 3.44Å; C163-L166 PolarHBondContact O-N 3.46Å; Y164-L166 VanDerWaalsContact C-N 3.33Å; Y164-L166 PolarHBondContact O-N 3.44Å; L166-Y169 PolarHBondContact O-N 3.24Å; L166-A170 WeakPolarHBondContact O-CB 3.31Å; L166-A170 PolarHBondContact O-N 3.5Å
167T82.1Confident83.7Confident5 Ų550 Ų503%0.03125%0.245CC..Hα-helixtrans-64.1-51.2176.3-60.70000110.9C163 Y164 L165 Y169 A170 V171 V319 L320C163-T167 WeakPolarHBondContact O-CB 3.41Å; C163-T167 PolarHBondContact O-N 3.37Å; C163-T167 PolarHBondContact O-OG1 3.39Å; Y164-T167 VanDerWaalsContact O-CB 3.3Å; Y164-T167 WeakPolarHBondContact O-CB 3.42Å; Y164-T167 PolarHBondContact O-N 3.21Å; Y164-T167 VanDerWaalsContact O-N 3.09Å; L165-T167 VanDerWaalsContact C-N 3.29Å; L165-T167 PolarHBondContact O-N 3.35Å; T167-Y169 VanDerWaalsContact C-N 3.27Å; T167-Y169 PolarHBondContact O-N 2.8Å; T167-A170 PolarHBondContact O-N 3.47Å; T167-V171 HydrophobicContact CG2-CG2 4.45Å; T167-V171 WeakPolarHBondContact O-CB 3.31Å; T167-V171 WeakPolarHBondContact O-CG2 3.33Å; T167-V171 PolarHBondContact O-N 2.82Å; T167-V319 WeakPolarHBondContact CG2-O 3.12Å; T167-V319 PolarHBondContact OG1-O 3.39Å; T167-L320 WeakPolarHBondContact CG2-O 3.29Å; T167-L320 WeakPolarHBondContact OG1-CA 3.41Å
168F81.7Confident83.9Confident77 Ų7749 Ų4934%0.33824%0.239SC..Hα-helixtrans-57.9-43.4176.6-88.3-103.4000111.5Y164 L165 L172Y164-F168 HydrophobicContact CD1-CD2 4.04Å; Y164-F168 HydrophobicContact CD1-CE2 4.23Å; Y164-F168 HydrophobicContact CD2-CD2 4.05Å; Y164-F168 AromaticContact CD2-CE2 3.66Å; Y164-F168 HydrophobicContact CD2-CE2 3.66Å; Y164-F168 AromaticContact CE1-CD2 3.76Å; Y164-F168 HydrophobicContact CE1-CD2 3.76Å; Y164-F168 AromaticContact CE1-CE2 3.69Å; Y164-F168 HydrophobicContact CE1-CE2 3.69Å; Y164-F168 HydrophobicContact CE1-CG 4.41Å; Y164-F168 HydrophobicContact CE1-CZ 4.22Å; Y164-F168 AromaticContact CE2-CD2 3.83Å; Y164-F168 HydrophobicContact CE2-CD2 3.83Å; Y164-F168 AromaticContact CE2-CE2 3.07Å; Y164-F168 HydrophobicContact CE2-CE2 3.07Å; Y164-F168 AromaticContact CE2-CZ 3.73Å; Y164-F168 HydrophobicContact CE2-CZ 3.73Å; Y164-F168 HydrophobicContact CG-CD2 4.17Å; Y164-F168 HydrophobicContact CG-CE2 4.21Å; Y164-F168 AromaticContact CZ-CD2 3.65Å; Y164-F168 AromaticContact CZ-CE2 3.06Å; Y164-F168 AromaticContact CZ-CZ 3.43Å; Y164-F168 VanDerWaalsContact CZ-CZ 3.43Å; Y164-F168 VanDerWaalsContact O-CD2 3.29Å; Y164-F168 WeakPolarHBondContact O-CD2 3.26Å; Y164-F168 PolarHBondContact O-N 2.85Å; Y164-F168 VanDerWaalsContact OH-CE2 3.3Å; Y164-F168 WeakPolarHBondContact OH-CE2 3.19Å; Y164-F168 WeakPolarHBondContact OH-CZ 3.39Å; L165-F168 PolarHBondContact O-N 3.3Å; F168-L172 HydrophobicContact CD1-CD1 3.57Å; F168-L172 HydrophobicContact CE1-CD1 3.94Å; F168-L172 VanDerWaalsContact O-CB 3.31Å; F168-L172 WeakPolarHBondContact O-CB 3.31Å; F168-L172 PolarHBondContact O-N 3.44Å
169Y85.5Confident84.2Confident90 Ų9044.6 Ų44.635%0.35321%0.214SC..Iπ-helixtrans-65-47.9176.4-176.6-96000111.7E124 L165 L166 T167 V171 H173 S174E124-Y169 HydrophobicContact CB-CE1 4.26Å; L165-Y169 VanDerWaalsContact O-CB 3.31Å; L165-Y169 WeakPolarHBondContact O-CB 3.14Å; L165-Y169 PolarHBondContact O-N 3.25Å; L166-Y169 PolarHBondContact O-N 3.24Å; T167-Y169 VanDerWaalsContact C-N 3.27Å; T167-Y169 PolarHBondContact O-N 2.8Å; Y169-V171 PolarHBondContact O-N 3.22Å; Y169-H173 HydrophobicContact CD2-CB 3.97Å; Y169-H173 AromaticContact CD2-CD2 3.95Å; Y169-H173 HydrophobicContact CE2-CB 4.24Å; Y169-H173 AromaticContact CE2-CD2 3.31Å; Y169-H173 WeakPolarHBondContact CE2-CD2 3.38Å; Y169-H173 AromaticContact CE2-CG 3.86Å; Y169-H173 AromaticContact CE2-NE2 3.94Å; Y169-H173 HydrophobicContact CG-CB 4.46Å; Y169-H173 AromaticContact CZ-CD2 3.68Å; Y169-H173 CarbonylContact O-C 3.57Å; Y169-H173 WeakPolarHBondContact O-CA 3.45Å; Y169-H173 WeakPolarHBondContact O-CB 3.31Å; Y169-H173 PolarHBondContact O-N 3Å; Y169-H173 VanDerWaalsContact O-N 3.15Å; Y169-S174 VanDerWaalsContact CE1-OG 3.31Å; Y169-S174 WeakPolarHBondContact CE1-OG 3.48Å; Y169-S174 PolarHBondContact O-N 2.94Å
170A86.5Confident84.5Confident10 Ų1044 Ų448%0.08321%0.211CC..Iπ-helixtrans-61.4-44.5-179.700000111.9C128 L166 T167 W175C128-A170 HydrophobicContact CB-CB 3.96Å; L166-A170 WeakPolarHBondContact O-CB 3.31Å; L166-A170 PolarHBondContact O-N 3.5Å; T167-A170 PolarHBondContact O-N 3.47Å; A170-W175 WeakPolarHBondContact O-CB 3.24Å; A170-W175 PolarHBondContact O-N 3.15Å
171V81.4Confident84.8Confident64 Ų6444.4 Ų44.439%0.38821%0.212SC..Iπ-helixtrans-84.5-57.5-174.8179.50000112.3T167 Y169 W175 M176T167-V171 HydrophobicContact CG2-CG2 4.45Å; T167-V171 WeakPolarHBondContact O-CB 3.31Å; T167-V171 WeakPolarHBondContact O-CG2 3.33Å; T167-V171 PolarHBondContact O-N 2.82Å; Y169-V171 PolarHBondContact O-N 3.22Å; V171-W175 WeakPolarHBondContact O-CB 3.45Å; V171-M176 PolarHBondContact O-N 2.79Å
172L82Confident85Confident99 Ų9948.3 Ų48.352%0.51823%0.231SC..Iπ-helixtrans-79.8-30.3-172.4-60.3-179.7000112.5F168 M176F168-L172 HydrophobicContact CD1-CD1 3.57Å; F168-L172 HydrophobicContact CE1-CD1 3.94Å; F168-L172 VanDerWaalsContact O-CB 3.31Å; F168-L172 WeakPolarHBondContact O-CB 3.31Å; F168-L172 PolarHBondContact O-N 3.44Å; L172-M176 HydrophobicContact CD2-SD 4.28Å; L172-M176 WeakPolarHBondContact O-CB 3.24Å
173H83.5Confident85.2Confident84 Ų8446.4 Ų46.439%0.38922%0.222SC..Iπ-helixtrans-95.1-72.6180-170.983.9000111Y169 N177Y169-H173 HydrophobicContact CD2-CB 3.97Å; Y169-H173 AromaticContact CD2-CD2 3.95Å; Y169-H173 HydrophobicContact CE2-CB 4.24Å; Y169-H173 AromaticContact CE2-CD2 3.31Å; Y169-H173 WeakPolarHBondContact CE2-CD2 3.38Å; Y169-H173 AromaticContact CE2-CG 3.86Å; Y169-H173 AromaticContact CE2-NE2 3.94Å; Y169-H173 HydrophobicContact CG-CB 4.46Å; Y169-H173 AromaticContact CZ-CD2 3.68Å; Y169-H173 CarbonylContact O-C 3.57Å; Y169-H173 WeakPolarHBondContact O-CA 3.45Å; Y169-H173 WeakPolarHBondContact O-CB 3.31Å; Y169-H173 PolarHBondContact O-N 3Å; Y169-H173 VanDerWaalsContact O-N 3.15Å; H173-N177 PolarHBondContact CE1-ND2 3.49Å; H173-N177 PolarHBondContact NE2-ND2 3.46Å; H173-N177 WeakPolarHBondContact O-CB 3.08Å; H173-N177 PolarHBondContact O-N 2.85Å; H173-N177 PolarHBondContact O-ND2 3Å
174S87.8Confident85.3Confident0 Ų052.1 Ų52.10%024%0.243CC..Iπ-helixtrans-69.6-42.2-169.3-60.40000113E124 Y169 N177 A178E124-S174 WeakPolarHBondContact CB-OG 3.39Å; E124-S174 PolarHBondContact OE2-OG 3.28Å; Y169-S174 VanDerWaalsContact CE1-OG 3.31Å; Y169-S174 WeakPolarHBondContact CE1-OG 3.48Å; Y169-S174 PolarHBondContact O-N 2.94Å; S174-N177 PolarHBondContact O-N 3.42Å; S174-A178 WeakPolarHBondContact O-CB 3.3Å; S174-A178 PolarHBondContact O-N 3.24Å
175W86.7Confident85.2Confident119 Ų11950.8 Ų50.845%0.45124%0.239SC..Iπ-helixtrans-68.6-48.4179.9-177.3-99.8000112.4F122 I125 A170 V171 N177 A178 F179F122-W175 HydrophobicContact CE1-CZ3 4.09Å; I125-W175 HydrophobicContact CD1-CB 4.23Å; I125-W175 HydrophobicContact CD1-CE3 3.75Å; A170-W175 WeakPolarHBondContact O-CB 3.24Å; A170-W175 PolarHBondContact O-N 3.15Å; V171-W175 WeakPolarHBondContact O-CB 3.45Å; W175-N177 VanDerWaalsContact C-N 3.31Å; W175-N177 PolarHBondContact O-N 3.28Å; W175-A178 WeakPolarHBondContact O-CB 3.37Å; W175-A178 PolarHBondContact O-N 2.96Å; W175-F179 HydrophobicContact CD2-CD2 4.44Å; W175-F179 AromaticContact CD2-CE2 3.94Å; W175-F179 HydrophobicContact CD2-CE2 3.94Å; W175-F179 AromaticContact CE2-CE2 3.38Å; W175-F179 HydrophobicContact CG-CD2 4.45Å; W175-F179 HydrophobicContact CG-CE2 4.37Å; W175-F179 HydrophobicContact CH2-CE2 4.22Å; W175-F179 AromaticContact CZ2-CE2 3.54Å; W175-F179 HydrophobicContact CZ2-CE2 3.54Å; W175-F179 HydrophobicContact CZ2-CZ 4.02Å; W175-F179 AromaticContact NE1-CD2 3.93Å; W175-F179 AromaticContact NE1-CE2 3.45Å; W175-F179 WeakPolarHBondContact O-CD2 3.39Å; W175-F179 PolarHBondContact O-N 2.83Å; W175-F179 VanDerWaalsContact O-N 3.13Å
176M84.8Confident84.7Confident74 Ų7447.6 Ų47.637%0.36522%0.222SC..Hα-helixtrans-61.2-39.3174.4-65.2-171.777.500112.1P102 V171 L172 F179 A180P102-M176 HydrophobicContact CB-CB 4.19Å; P102-M176 HydrophobicContact CB-CE 3.85Å; V171-M176 PolarHBondContact O-N 2.79Å; L172-M176 HydrophobicContact CD2-SD 4.28Å; L172-M176 WeakPolarHBondContact O-CB 3.24Å; M176-F179 PolarHBondContact O-N 2.9Å; M176-A180 WeakPolarHBondContact O-CB 3.37Å; M176-A180 PolarHBondContact O-N 3.27Å
177N86.5Confident83.9Confident40 Ų4048.5 Ų48.521%0.21423%0.227CC..Hα-helixtrans-68-36.1175.5-73-26.3000112.6H173 S174 W175 F179 A180 E181H173-N177 PolarHBondContact CE1-ND2 3.49Å; H173-N177 PolarHBondContact NE2-ND2 3.46Å; H173-N177 WeakPolarHBondContact O-CB 3.08Å; H173-N177 PolarHBondContact O-N 2.85Å; H173-N177 PolarHBondContact O-ND2 3Å; S174-N177 PolarHBondContact O-N 3.42Å; W175-N177 VanDerWaalsContact C-N 3.31Å; W175-N177 PolarHBondContact O-N 3.28Å; N177-F179 VanDerWaalsContact C-N 3.32Å; N177-F179 PolarHBondContact O-N 2.94Å; N177-A180 WeakPolarHBondContact O-CB 3.35Å; N177-A180 PolarHBondContact O-N 3.46Å; N177-E181 WeakPolarHBondContact O-CB 3.49Å; N177-E181 VanDerWaalsContact O-CG 3.26Å; N177-E181 WeakPolarHBondContact O-CG 3.45Å; N177-E181 PolarHBondContact O-N 2.93Å
178A88.2Confident83.3Confident0 Ų053.1 Ų53.10%024%0.243CC..Hα-helixtrans-59.9-44.3174.400000111H121 F122 S174 W175 E181 M182H121-A178 HydrophobicContact CB-CB 3.82Å; F122-A178 HydrophobicContact CE2-CB 4.34Å; F122-A178 HydrophobicContact CZ-CB 4.31Å; S174-A178 WeakPolarHBondContact O-CB 3.3Å; S174-A178 PolarHBondContact O-N 3.24Å; W175-A178 WeakPolarHBondContact O-CB 3.37Å; W175-A178 PolarHBondContact O-N 2.96Å; A178-E181 PolarHBondContact O-N 3.03Å; A178-M182 WeakPolarHBondContact O-CG 3.21Å; A178-M182 PolarHBondContact O-N 2.87Å
179F87Confident82.6Confident36 Ų3652.7 Ų52.716%0.15824%0.244CC..Hα-helixtrans-67.3-39.5173.6-81.5-72.6000113.3F100 W175 M176 N177 E181 M182 L183F100-F179 HydrophobicContact CB-CD1 3.93Å; F100-F179 HydrophobicContact CB-CE1 4.36Å; F100-F179 AromaticContact CD1-CD1 3.56Å; F100-F179 HydrophobicContact CD1-CD1 3.56Å; F100-F179 AromaticContact CD1-CE1 3.13Å; F100-F179 HydrophobicContact CD1-CE1 3.13Å; F100-F179 HydrophobicContact CD1-CG 4.48Å; F100-F179 AromaticContact CD1-CZ 3.76Å; F100-F179 HydrophobicContact CD1-CZ 3.76Å; F100-F179 HydrophobicContact CE1-CD1 4.45Å; F100-F179 AromaticContact CE1-CE1 3.6Å; F100-F179 HydrophobicContact CE1-CE1 3.6Å; F100-F179 AromaticContact CE1-CZ 3.93Å; F100-F179 HydrophobicContact CE1-CZ 3.93Å; F100-F179 HydrophobicContact CG-CD1 4.11Å; F100-F179 HydrophobicContact CG-CE1 4.02Å; F100-F179 WeakPolarHBondContact O-CB 3.49Å; W175-F179 HydrophobicContact CD2-CD2 4.44Å; W175-F179 AromaticContact CD2-CE2 3.94Å; W175-F179 HydrophobicContact CD2-CE2 3.94Å; W175-F179 AromaticContact CE2-CE2 3.38Å; W175-F179 HydrophobicContact CG-CD2 4.45Å; W175-F179 HydrophobicContact CG-CE2 4.37Å; W175-F179 HydrophobicContact CH2-CE2 4.22Å; W175-F179 AromaticContact CZ2-CE2 3.54Å; W175-F179 HydrophobicContact CZ2-CE2 3.54Å; W175-F179 HydrophobicContact CZ2-CZ 4.02Å; W175-F179 AromaticContact NE1-CD2 3.93Å; W175-F179 AromaticContact NE1-CE2 3.45Å; W175-F179 WeakPolarHBondContact O-CD2 3.39Å; W175-F179 PolarHBondContact O-N 2.83Å; W175-F179 VanDerWaalsContact O-N 3.13Å; M176-F179 PolarHBondContact O-N 2.9Å; N177-F179 VanDerWaalsContact C-N 3.32Å; N177-F179 PolarHBondContact O-N 2.94Å; F179-E181 VanDerWaalsContact C-N 3.27Å; F179-E181 PolarHBondContact O-N 3.25Å; F179-M182 HydrophobicContact CB-CE 4.43Å; F179-M182 HydrophobicContact CD1-CE 3.36Å; F179-M182 HydrophobicContact CD2-CE 4.25Å; F179-M182 HydrophobicContact CE1-CE 3.41Å; F179-M182 VanDerWaalsContact CE1-CE 3.41Å; F179-M182 HydrophobicContact CE2-CE 4.27Å; F179-M182 HydrophobicContact CG-CE 3.8Å; F179-M182 HydrophobicContact CZ-CE 3.9Å; F179-M182 PolarHBondContact O-N 3.36Å; F179-L183 WeakPolarHBondContact O-CB 3.5Å; F179-L183 WeakPolarHBondContact O-CG 3.26Å; F179-L183 PolarHBondContact O-N 3.35Å
180A85.6Confident81.7Confident4 Ų451.5 Ų51.53%0.03324%0.243CC..Hα-helixtrans-53.1-49.7172.400000110.1P102 M176 N177 L183 R184 F185P102-A180 HydrophobicContact CG-CB 3.81Å; M176-A180 WeakPolarHBondContact O-CB 3.37Å; M176-A180 PolarHBondContact O-N 3.27Å; N177-A180 WeakPolarHBondContact O-CB 3.35Å; N177-A180 PolarHBondContact O-N 3.46Å; A180-L183 CarbonylContact O-C 3.39Å; A180-L183 PolarHBondContact O-N 2.89Å; A180-R184 CarbonylContact O-C 3.56Å; A180-R184 WeakPolarHBondContact O-CA 3.03Å; A180-R184 PolarHBondContact O-N 3.39Å; A180-F185 HydrophobicContact CB-CB 4.14Å; A180-F185 WeakPolarHBondContact O-CB 3.49Å; A180-F185 PolarHBondContact O-N 2.95Å
181E87.3Confident80.5Confident11 Ų1156 Ų565%0.05127%0.265CS..Hα-helixtrans-68.5-40.3-179.2-68.3-74.9161.200112.6I116 L117 V118 N177 A178 F179 L183 R184 R188I116-E181 WeakPolarHBondContact CA-OE2 3.36Å; L117-E181 PolarHBondContact N-OE2 3.45Å; V118-E181 HydrophobicContact CG2-CB 3.5Å; N177-E181 WeakPolarHBondContact O-CB 3.49Å; N177-E181 VanDerWaalsContact O-CG 3.26Å; N177-E181 WeakPolarHBondContact O-CG 3.45Å; N177-E181 PolarHBondContact O-N 2.93Å; A178-E181 PolarHBondContact O-N 3.03Å; F179-E181 VanDerWaalsContact C-N 3.27Å; F179-E181 PolarHBondContact O-N 3.25Å; E181-L183 PolarHBondContact O-N 3.21Å; E181-R184 PolarHBondContact O-N 2.98Å; E181-R188 IonicContact OE1-CZ 2.99Å; E181-R188 IonicContact OE1-NH1 2.77Å; E181-R188 PolarHBondContact OE1-NH1 2.84Å; E181-R188 IonicContact OE1-NH2 2.67Å; E181-R188 PolarHBondContact OE1-NH2 2.84Å
182M88.3Confident79.6Confident85 Ų8557.2 Ų57.242%0.41927%0.274SS..Hα-helixtrans-63.3-40.9176-76-171.4-69.900112.2V118 F122 A178 F179 R184V118-M182 HydrophobicContact CB-CG 4.43Å; V118-M182 HydrophobicContact CG1-CG 3.79Å; V118-M182 HydrophobicContact CG1-SD 4.38Å; V118-M182 HydrophobicContact CG2-CB 4.42Å; V118-M182 HydrophobicContact CG2-CG 3.65Å; F122-M182 HydrophobicContact CE2-CE 4.43Å; F122-M182 HydrophobicContact CE2-SD 4.25Å; F122-M182 HydrophobicContact CZ-CE 4.06Å; F122-M182 HydrophobicContact CZ-SD 4.29Å; A178-M182 WeakPolarHBondContact O-CG 3.21Å; A178-M182 PolarHBondContact O-N 2.87Å; F179-M182 HydrophobicContact CB-CE 4.43Å; F179-M182 HydrophobicContact CD1-CE 3.36Å; F179-M182 HydrophobicContact CD2-CE 4.25Å; F179-M182 HydrophobicContact CE1-CE 3.41Å; F179-M182 VanDerWaalsContact CE1-CE 3.41Å; F179-M182 HydrophobicContact CE2-CE 4.27Å; F179-M182 HydrophobicContact CG-CE 3.8Å; F179-M182 HydrophobicContact CZ-CE 3.9Å; F179-M182 PolarHBondContact O-N 3.36Å; M182-R184 PolarHBondContact O-N 3.19Å
183L86.2Confident78.5Confident37 Ų3757.5 Ų57.519%0.19428%0.276CS..THydrogen-bonded Turntrans-80.7-3.4175.1-63.1179.3000113Y97 F100 A101 F179 A180 E181 F185Y97-L183 HydrophobicContact CD2-CD2 4.06Å; Y97-L183 HydrophobicContact CE2-CD1 4.33Å; Y97-L183 HydrophobicContact CE2-CD2 3.94Å; F100-L183 HydrophobicContact CB-CD1 3.86Å; F100-L183 WeakPolarHBondContact O-CD1 3.29Å; A101-L183 HydrophobicContact CB-CD1 4.19Å; F179-L183 WeakPolarHBondContact O-CB 3.5Å; F179-L183 WeakPolarHBondContact O-CG 3.26Å; F179-L183 PolarHBondContact O-N 3.35Å; A180-L183 CarbonylContact O-C 3.39Å; A180-L183 PolarHBondContact O-N 2.89Å; E181-L183 PolarHBondContact O-N 3.21Å; L183-F185 PolarHBondContact O-N 2.79Å
184R84.6Confident77.3Confident121 Ų12158.6 Ų58.646%0.45728%0.277SS..THydrogen-bonded Turntrans53.432.5-171.2-62.1-176-175.1-168.5-1112.3R112 Y113 I116 A180 E181 M182 G186R112-R184 CarbonylContact C-O 3.46Å; R112-R184 WeakPolarHBondContact CA-O 3.48Å; R112-R184 HydrophobicContact CB-CB 4.24Å; R112-R184 HydrophobicContact CG-CB 4.42Å; Y113-R184 PolarHBondContact N-O 2.81Å; Y113-R184 WeakPolarHBondContact O-CB 3.28Å; Y113-R184 WeakPolarHBondContact O-CD 3.38Å; I116-R184 HydrophobicContact CD1-CG 4.28Å; I116-R184 VanDerWaalsContact CD1-NE 3.34Å; I116-R184 HydrophobicContact CG1-CG 4.21Å; A180-R184 CarbonylContact O-C 3.56Å; A180-R184 WeakPolarHBondContact O-CA 3.03Å; A180-R184 PolarHBondContact O-N 3.39Å; E181-R184 PolarHBondContact O-N 2.98Å; M182-R184 PolarHBondContact O-N 3.19Å; R184-G186 PolarHBondContact O-N 3.44Å
185F81.6Confident75.9Confident13 Ų1363 Ų636%0.05731%0.308CS..BIsolated β-bridgetrans-56.7128.1-176.1-164.6-89.5000110.9A101 P102 T103 Y110 A180 L183 D187A101-F185 HydrophobicContact CB-CE2 4.41Å; P102-F185 HydrophobicContact CG-CD1 4.25Å; P102-F185 HydrophobicContact CG-CG 4.2Å; T103-F185 HydrophobicContact CG2-CE1 3.77Å; T103-F185 HydrophobicContact CG2-CE2 3.79Å; T103-F185 HydrophobicContact CG2-CZ 3.19Å; Y110-F185 VanDerWaalsContact CB-CE2 3.41Å; Y110-F185 AromaticContact CD1-CE2 3.36Å; Y110-F185 HydrophobicContact CD1-CE2 3.36Å; Y110-F185 AromaticContact CD1-CZ 3.57Å; Y110-F185 HydrophobicContact CD1-CZ 3.57Å; Y110-F185 HydrophobicContact CD2-CD2 4.43Å; Y110-F185 AromaticContact CD2-CE2 3.76Å; Y110-F185 HydrophobicContact CD2-CE2 3.76Å; Y110-F185 AromaticContact CE1-CE2 3.98Å; Y110-F185 HydrophobicContact CE1-CE2 3.98Å; Y110-F185 HydrophobicContact CE1-CZ 4.14Å; Y110-F185 HydrophobicContact CE2-CE2 4.36Å; Y110-F185 HydrophobicContact CG-CD2 4.08Å; Y110-F185 AromaticContact CG-CE2 3.24Å; Y110-F185 HydrophobicContact CG-CE2 3.24Å; Y110-F185 AromaticContact CG-CZ 3.93Å; Y110-F185 HydrophobicContact CG-CZ 3.93Å; A180-F185 HydrophobicContact CB-CB 4.14Å; A180-F185 WeakPolarHBondContact O-CB 3.49Å; A180-F185 PolarHBondContact O-N 2.95Å; L183-F185 PolarHBondContact O-N 2.79Å; F185-D187 VanDerWaalsContact C-N 3.28Å; F185-D187 HydrophobicContact CD1-CB 3.85Å; F185-D187 HydrophobicContact CE1-CB 4.04Å; F185-D187 PolarHBondContact O-N 3.28Å
186G75Confident74.6Confident0 Ų060.3 Ų60.30%032%0.316CS..  trans-8840-172.800000114.3P111 R184 R188 I189 I190P111-G186 WeakPolarHBondContact O-CA 3.39Å; P111-G186 PolarHBondContact O-N 3.31Å; R184-G186 PolarHBondContact O-N 3.44Å; G186-R188 PolarHBondContact O-N 3.35Å; G186-I189 WeakPolarHBondContact O-CB 3.21Å; G186-I189 PolarHBondContact O-N 2.88Å; G186-I190 PolarHBondContact O-N 2.86Å
187D70.4Confident73.1Confident49 Ų4965.9 Ų65.926%0.26234%0.339SS..Hα-helixtrans-55.5-39.517266-33000111.4F185 I189 I190 L191F185-D187 VanDerWaalsContact C-N 3.28Å; F185-D187 HydrophobicContact CD1-CB 3.85Å; F185-D187 HydrophobicContact CE1-CB 4.04Å; F185-D187 PolarHBondContact O-N 3.28Å; D187-I189 PolarHBondContact O-N 3.39Å; D187-I190 CarbonylContact O-C 3.55Å; D187-I190 WeakPolarHBondContact O-CA 3.45Å; D187-I190 WeakPolarHBondContact O-CB 3.25Å; D187-I190 PolarHBondContact O-N 3.16Å; D187-L191 WeakPolarHBondContact O-CG 3.35Å; D187-L191 PolarHBondContact O-N 3.3Å
188R68.4Low71.4Confident102 Ų10267.6 Ų67.639%0.38535%0.346SS..Hα-helixtrans-60.6-24.6175-65.8-176.4179.6143.57.5114.4E181 G186 P192E181-R188 IonicContact OE1-CZ 2.99Å; E181-R188 IonicContact OE1-NH1 2.77Å; E181-R188 PolarHBondContact OE1-NH1 2.84Å; E181-R188 IonicContact OE1-NH2 2.67Å; E181-R188 PolarHBondContact OE1-NH2 2.84Å; G186-R188 PolarHBondContact O-N 3.35Å; R188-P192 WeakPolarHBondContact O-CD 3.44Å
189I66.1Low69.8Low68 Ų6872.7 Ų72.735%0.34937%0.37SS..Hα-helixtrans-77.3-38.7173.2-55.1171.4000109.2P111 Y113 G186 D187 L193P111-I189 HydrophobicContact CB-CD1 4.43Å; Y113-I189 HydrophobicContact CD2-CD1 4.14Å; Y113-I189 HydrophobicContact CD2-CG1 3.96Å; G186-I189 WeakPolarHBondContact O-CB 3.21Å; G186-I189 PolarHBondContact O-N 2.88Å; D187-I189 PolarHBondContact O-N 3.39Å; I189-L193 HydrophobicContact CG2-CD1 4.31Å; I189-L193 VanDerWaalsContact O-CD1 3.32Å; I189-L193 WeakPolarHBondContact O-CD1 3.43Å
190I66.8Low68.2Low66 Ų6676.8 Ų76.834%0.33839%0.393SS..Hα-helixtrans-73-35.9-178.3-61.6168.7000111.6P111 G186 D187 L193 W194P111-I190 HydrophobicContact CG-CD1 4.1Å; P111-I190 HydrophobicContact CG-CG1 4.42Å; G186-I190 PolarHBondContact O-N 2.86Å; D187-I190 CarbonylContact O-C 3.55Å; D187-I190 WeakPolarHBondContact O-CA 3.45Å; D187-I190 WeakPolarHBondContact O-CB 3.25Å; D187-I190 PolarHBondContact O-N 3.16Å; I190-L193 CarbonylContact O-C 3.54Å; I190-L193 WeakPolarHBondContact O-CA 3.26Å; I190-L193 WeakPolarHBondContact O-CB 3.44Å; I190-L193 PolarHBondContact O-N 2.74Å; I190-L193 VanDerWaalsContact O-N 3.1Å; I190-W194 WeakPolarHBondContact O-CB 3.49Å; I190-W194 PolarHBondContact O-N 3.4Å
191L63Low66.5Low103 Ų10383 Ų8354%0.53942%0.421SS..Hα-helixtrans-58.1-49.1-175-75.5167.9000113.5D187 L193 W194 S195D187-L191 WeakPolarHBondContact O-CG 3.35Å; D187-L191 PolarHBondContact O-N 3.3Å; L191-L193 VanDerWaalsContact C-N 3.32Å; L191-L193 PolarHBondContact O-N 2.92Å; L191-W194 WeakPolarHBondContact O-CB 3.49Å; L191-W194 PolarHBondContact O-N 3.1Å; L191-S195 PolarHBondContact O-N 2.94Å; L191-S195 PolarHBondContact O-OG 3.37Å
192P60.7Low64.7Low90 Ų9086.7 Ų86.758%0.58443%0.434SS*.Hα-helixtrans-63.3-35173.2-22.733.2000113.6R188 W194R188-P192 WeakPolarHBondContact O-CD 3.44Å; P192-W194 VanDerWaalsContact C-N 3.33Å
193L60.2Low63Low105 Ų10587.5 Ų87.555%0.5544%0.44SS..Hα-helixtrans-66.7-36176.5-77.9160000111.9I189 I190 L191 K197I189-L193 HydrophobicContact CG2-CD1 4.31Å; I189-L193 VanDerWaalsContact O-CD1 3.32Å; I189-L193 WeakPolarHBondContact O-CD1 3.43Å; I190-L193 CarbonylContact O-C 3.54Å; I190-L193 WeakPolarHBondContact O-CA 3.26Å; I190-L193 WeakPolarHBondContact O-CB 3.44Å; I190-L193 PolarHBondContact O-N 2.74Å; I190-L193 VanDerWaalsContact O-N 3.1Å; L191-L193 VanDerWaalsContact C-N 3.32Å; L191-L193 PolarHBondContact O-N 2.92Å; L193-K197 PolarHBondContact O-N 3.03Å
194W57.7Low61.2Low108 Ų10894.2 Ų94.241%0.40946%0.463SS..Iπ-helixtrans-66.3-47.3179.4-175.4-74.1000111.3I190 L191 P192 G196I190-W194 WeakPolarHBondContact O-CB 3.49Å; I190-W194 PolarHBondContact O-N 3.4Å; L191-W194 WeakPolarHBondContact O-CB 3.49Å; L191-W194 PolarHBondContact O-N 3.1Å; P192-W194 VanDerWaalsContact C-N 3.33Å; W194-G196 PolarHBondContact O-N 3.23Å
195S59.4Low59.5Low93 Ų9393 Ų9365%0.6547%0.465SS*.Iπ-helixtrans-65.5-21.9-178.1-51.90000114.3L191L191-S195 PolarHBondContact O-N 2.94Å; L191-S195 PolarHBondContact O-OG 3.37Å
196G58.2Low58Low61 Ų6199.6 Ų99.663%0.62949%0.494SS*.Iπ-helixtrans-105.8-37.4-170.600000116.8W194W194-G196 PolarHBondContact O-N 3.23Å
197K53.6Low56.9Low192 Ų192105 Ų10584%0.83552%0.523SS*.Iπ-helixtrans-137.6-19.3-167.5-67-174.8179.5179.60116.1L193L193-K197 PolarHBondContact O-N 3.03Å
198M51.9Low55.9Low75 Ų75111 Ų11137%0.36955%0.547SS..Iπ-helixtrans-89.2-22.3-177.9-86.6-149.676.600115L200 H201 R202M198-L200 VanDerWaalsContact C-N 3.31Å; M198-L200 PolarHBondContact O-N 3Å; M198-H201 PolarHBondContact O-N 3.24Å; M198-R202 HydrophobicContact CE-CG 4.1Å; M198-R202 VanDerWaalsContact CE-NE 3.29Å; M198-R202 PolarHBondContact O-N 3.39Å
199E53.9Low55Low107 Ų107114.8 Ų114.850%0.557%0.566SS.*Hα-helixtrans-54.9-45.2-175.4-79.9-151140.100112.6H201 R202 L203E199-H201 VanDerWaalsContact C-N 3.31Å; E199-H201 PolarHBondContact O-N 3.24Å; E199-R202 PolarHBondContact O-N 3.18Å; E199-L203 HydrophobicContact CB-CD1 4.37Å; E199-L203 WeakPolarHBondContact O-CB 3.4Å; E199-L203 WeakPolarHBondContact O-CD1 3.42Å; E199-L203 VanDerWaalsContact O-CG 3.26Å; E199-L203 WeakPolarHBondContact O-CG 3.47Å; E199-L203 PolarHBondContact O-N 2.73Å; E199-L203 VanDerWaalsContact O-N 3.08Å
200L53.2Low54.2Low123 Ų123116.7 Ų116.764%0.64458%0.577SS**Hα-helixtrans-64.6-33-173.1-153.282.6000113.4M198M198-L200 VanDerWaalsContact C-N 3.31Å; M198-L200 PolarHBondContact O-N 3Å
201H50.2Low53.3Low133 Ų133120.8 Ų120.862%0.61660%0.6SS**Hα-helixtrans-84.5-35.2-177-167.584.1000112.6M198 E199 L205M198-H201 PolarHBondContact O-N 3.24Å; E199-H201 VanDerWaalsContact C-N 3.31Å; E199-H201 PolarHBondContact O-N 3.24Å; H201-L205 PolarHBondContact O-N 3.43Å
202R50.2Low52.6Low89 Ų89118.3 Ų118.334%0.33660%0.599SS.*Hα-helixtrans-76.1-36.1177.7-84.3-174.7-171.4-108.53.1113M198 E199 R204 L205 F206M198-R202 HydrophobicContact CE-CG 4.1Å; M198-R202 VanDerWaalsContact CE-NE 3.29Å; M198-R202 PolarHBondContact O-N 3.39Å; E199-R202 PolarHBondContact O-N 3.18Å; R202-R204 VanDerWaalsContact C-N 3.26Å; R202-R204 PolarHBondContact O-N 3.07Å; R202-L205 PolarHBondContact O-N 3.07Å; R202-L205 VanDerWaalsContact O-N 3.16Å; R202-F206 PolarHBondContact O-N 3.45Å
203L52.7Low52.4Low103 Ų103122.8 Ų122.854%0.53962%0.616SS.*Hα-helixtrans-55.5-44.4175.4-75.8164.5000110.8E199 L205 F206 D207E199-L203 HydrophobicContact CB-CD1 4.37Å; E199-L203 WeakPolarHBondContact O-CB 3.4Å; E199-L203 WeakPolarHBondContact O-CD1 3.42Å; E199-L203 VanDerWaalsContact O-CG 3.26Å; E199-L203 WeakPolarHBondContact O-CG 3.47Å; E199-L203 PolarHBondContact O-N 2.73Å; E199-L203 VanDerWaalsContact O-N 3.08Å; L203-L205 PolarHBondContact O-N 3.37Å; L203-F206 PolarHBondContact O-N 2.95Å; L203-D207 PolarHBondContact O-N 3.32Å
204R47.8Very low52.1Low177 Ų177121.4 Ų121.467%0.66861%0.614SS**Hα-helixtrans-67.4-31.3178.1-68.9-179.8-178.8-178.51114.6R202R202-R204 VanDerWaalsContact C-N 3.26Å; R202-R204 PolarHBondContact O-N 3.07Å
205L49.4Very low52.6Low97 Ų97118.3 Ų118.351%0.50862%0.616SS.*Hα-helixtrans-76.5-33.3176.4-96.4150.6000112.1H201 R202 L203 K208 F209H201-L205 PolarHBondContact O-N 3.43Å; R202-L205 PolarHBondContact O-N 3.07Å; R202-L205 VanDerWaalsContact O-N 3.16Å; L203-L205 PolarHBondContact O-N 3.37Å; L205-K208 PolarHBondContact O-N 2.9Å; L205-F209 PolarHBondContact O-N 3.26Å
206F49.9Very low53.3Low150 Ų150121.4 Ų121.466%0.65862%0.618SS**Hα-helixtrans-68.6-41.2176.3-113.1-87.6000112.3R202 L203 K208 F209R202-F206 PolarHBondContact O-N 3.45Å; L203-F206 PolarHBondContact O-N 2.95Å; F206-K208 PolarHBondContact O-N 3.06Å; F206-F209 PolarHBondContact O-N 2.84Å
207D50.2Low54.3Low115 Ų115122.7 Ų122.762%0.61561%0.611SS**Hα-helixtrans-60.3-36.5176-74.5-25.5000111.8L203 F209 N210L203-D207 PolarHBondContact O-N 3.32Å; D207-F209 VanDerWaalsContact C-N 3.33Å; D207-F209 PolarHBondContact O-N 2.83Å; D207-N210 PolarHBondContact O-N 2.92Å
208K49.5Very low55.5Low175 Ų175118.6 Ų118.676%0.76160%0.597SS**Hα-helixtrans-74-18.9-178.3-130.4175.5-174.51800114.5L205 F206L205-K208 PolarHBondContact O-N 2.9Å; F206-K208 PolarHBondContact O-N 3.06Å
209F51Low56.8Low181 Ų181117.4 Ų117.479%0.79460%0.598SS**THydrogen-bonded Turntrans-85.2-11.8179.6-129.4-86.4000112.9L205 F206 D207L205-F209 PolarHBondContact O-N 3.26Å; F206-F209 PolarHBondContact O-N 2.84Å; D207-F209 VanDerWaalsContact C-N 3.33Å; D207-F209 PolarHBondContact O-N 2.83Å
210N49.6Very low57.8Low108 Ų108117.8 Ų117.858%0.57860%0.598SS**SBendtrans-83.3-4.5-175.1-94-29.7000114.8D207 G212D207-N210 PolarHBondContact O-N 2.92Å; N210-G212 VanDerWaalsContact C-N 3.3Å; N210-G212 PolarHBondContact O-N 2.71Å
211D47.2Very low59.2Low152 Ų152114.5 Ų114.581%0.81358%0.58SS**SBendtrans-93.338.7-176.2-69.8-20.3000113.1
212G49.1Very low60.5Low51 Ų51110.7 Ų110.753%0.52657%0.572SS.*SBendtrans-12999.3-165.200000117N210 C214N210-G212 VanDerWaalsContact C-N 3.3Å; N210-G212 PolarHBondContact O-N 2.71Å; G212-C214 PolarHBondContact O-N 2.75Å
213I54.9Low61.9Low184 Ų184111.4 Ų111.494%0.94459%0.586SS**SBendtrans81-30143.4-49.6172.2000119.1
214C54.9Low63.4Low75 Ų75109.4 Ų109.451%0.50757%0.573SS.*SBendtrans-136.8144.4176.4-134.60000112.6G212 K216G212-C214 PolarHBondContact O-N 2.75Å; C214-K216 PolarHBondContact O-N 3.43Å
215G68Low65Low44 Ų44105.9 Ų105.945%0.45456%0.563SS.*  trans-51.1134.817900000110.9N217 I218 A219G215-N217 PolarHBondContact O-N 3.22Å; G215-I218 WeakPolarHBondContact O-CB 3.24Å; G215-I218 PolarHBondContact O-N 2.87Å; G215-A219 PolarHBondContact O-N 3.25Å
216K74.9Confident66.6Low157 Ų157105.2 Ų105.268%0.68356%0.559SS**Hα-helixtrans-48.6-32.1-172.6-66.9-178.3178.5179.90113.7C214 K220C214-K216 PolarHBondContact O-N 3.43Å; K216-K220 VanDerWaalsContact O-CG 3.24Å; K216-K220 WeakPolarHBondContact O-CG 3.43Å; K216-K220 PolarHBondContact O-N 3.16Å
217N77.7Confident68.3Low89 Ų8999.7 Ų99.748%0.47654%0.539SS..Hα-helixtrans-76.3-37.1178.3-65.6-14.5000113.2G215 K220 M221 L258G215-N217 PolarHBondContact O-N 3.22Å; N217-K220 PolarHBondContact O-N 2.92Å; N217-M221 WeakPolarHBondContact O-CG 3.47Å; N217-M221 PolarHBondContact O-N 2.97Å; N217-L258 HydrophobicContact CB-CD2 4.34Å
218I79.2Confident70.1Confident106 Ų10694.2 Ų94.254%0.54451%0.51SS..Hα-helixtrans-64.4-45.1177.3-60173.3000109.4G215 K220 M221 A222G215-I218 WeakPolarHBondContact O-CB 3.24Å; G215-I218 PolarHBondContact O-N 2.87Å; I218-K220 PolarHBondContact O-N 3.47Å; I218-M221 PolarHBondContact O-N 3.34Å; I218-A222 WeakPolarHBondContact O-CB 3.19Å; I218-A222 PolarHBondContact O-N 3.45Å
219A79.1Confident71.8Confident49 Ų4988.9 Ų88.941%0.40549%0.492SS..Hα-helixtrans-60.4-44.5176.500000112.1G215 A222 V223G215-A219 PolarHBondContact O-N 3.25Å; A219-A222 PolarHBondContact O-N 3.44Å; A219-V223 WeakPolarHBondContact O-CG2 3.42Å; A219-V223 PolarHBondContact O-N 3.17Å; A219-V223 VanDerWaalsContact O-N 3.08Å
220K76Confident73.5Confident115 Ų11582.2 Ų82.250%0.547%0.466SS..Hα-helixtrans-59-48.5174.7-73.4171.3-175.6-1770111.8K216 N217 I218 A222 V223 F224K216-K220 VanDerWaalsContact O-CG 3.24Å; K216-K220 WeakPolarHBondContact O-CG 3.43Å; K216-K220 PolarHBondContact O-N 3.16Å; N217-K220 PolarHBondContact O-N 2.92Å; I218-K220 PolarHBondContact O-N 3.47Å; K220-A222 VanDerWaalsContact C-N 3.33Å; K220-A222 PolarHBondContact O-N 3.43Å; K220-V223 PolarHBondContact O-N 2.96Å; K220-F224 VanDerWaalsContact O-CD2 3.24Å; K220-F224 WeakPolarHBondContact O-CD2 3.5Å; K220-F224 PolarHBondContact O-N 2.88Å
221M81.5Confident75.4Confident54 Ų5480 Ų8027%0.26645%0.452SS..Hα-helixtrans-64-37.9179.4-72.7-54.6-63.800112.4N217 I218 V223 F224 F225 F251 A254 L258N217-M221 WeakPolarHBondContact O-CG 3.47Å; N217-M221 PolarHBondContact O-N 2.97Å; I218-M221 PolarHBondContact O-N 3.34Å; M221-V223 VanDerWaalsContact C-N 3.34Å; M221-V223 PolarHBondContact O-N 3.47Å; M221-F224 PolarHBondContact O-N 2.9Å; M221-F225 VanDerWaalsContact O-CB 3.26Å; M221-F225 WeakPolarHBondContact O-CB 3.05Å; M221-F225 PolarHBondContact O-N 3.35Å; M221-F251 HydrophobicContact CE-CD1 4.05Å; M221-F251 HydrophobicContact CE-CE1 3.92Å; M221-A254 HydrophobicContact CE-CB 4.39Å; M221-A254 HydrophobicContact SD-CB 4.06Å; M221-L258 HydrophobicContact CG-CD1 3.92Å; M221-L258 HydrophobicContact SD-CD1 3.48Å; M221-L258 WeakPolarHBondContact SD-CD1 3.48Å; M221-L258 HydrophobicContact SD-CG 4.27Å
222A78.2Confident77.4Confident54 Ų5473.1 Ų73.145%0.44642%0.415SS..Hα-helixtrans-63.1-40175.700000112I218 A219 K220 L226I218-A222 WeakPolarHBondContact O-CB 3.19Å; I218-A222 PolarHBondContact O-N 3.45Å; A219-A222 PolarHBondContact O-N 3.44Å; K220-A222 VanDerWaalsContact C-N 3.33Å; K220-A222 PolarHBondContact O-N 3.43Å; A222-L226 VanDerWaalsContact O-CB 3.3Å; A222-L226 WeakPolarHBondContact O-CB 3.2Å; A222-L226 PolarHBondContact O-N 2.8Å
223V80Confident79.3Confident103 Ų10374.1 Ų74.162%0.62440%0.403SS*.Hα-helixtrans-66-46.2176173.40000111.1A219 K220 M221 L226 S227A219-V223 WeakPolarHBondContact O-CG2 3.42Å; A219-V223 PolarHBondContact O-N 3.17Å; A219-V223 VanDerWaalsContact O-N 3.08Å; K220-V223 PolarHBondContact O-N 2.96Å; M221-V223 VanDerWaalsContact C-N 3.34Å; M221-V223 PolarHBondContact O-N 3.47Å; V223-L226 PolarHBondContact O-N 3.31Å; V223-S227 VanDerWaalsContact O-CB 3.26Å; V223-S227 WeakPolarHBondContact O-CB 3.29Å; V223-S227 PolarHBondContact O-N 3.15Å
224F83.3Confident80.9Confident62 Ų6266.3 Ų66.327%0.27236%0.364SS..Hα-helixtrans-62.8-43176.5-81.2-66.9000112.3K220 M221 S227 A228 F250 A254 M257K220-F224 VanDerWaalsContact O-CD2 3.24Å; K220-F224 WeakPolarHBondContact O-CD2 3.5Å; K220-F224 PolarHBondContact O-N 2.88Å; M221-F224 PolarHBondContact O-N 2.9Å; F224-S227 WeakPolarHBondContact O-CB 3.31Å; F224-S227 PolarHBondContact O-N 3.47Å; F224-A228 WeakPolarHBondContact O-CB 3.48Å; F224-A228 PolarHBondContact O-N 3.42Å; F224-F250 HydrophobicContact CD1-CD1 4.16Å; F224-A254 HydrophobicContact CB-CB 4.01Å; F224-A254 HydrophobicContact CD1-CB 4.21Å; F224-A254 HydrophobicContact CD2-CB 3.8Å; F224-A254 HydrophobicContact CE2-CB 4.33Å; F224-A254 HydrophobicContact CG-CB 3.75Å; F224-M257 HydrophobicContact CE1-SD 4.17Å; F224-M257 HydrophobicContact CE2-CE 4.43Å; F224-M257 HydrophobicContact CE2-SD 4.23Å; F224-M257 HydrophobicContact CZ-CE 3.85Å; F224-M257 HydrophobicContact CZ-SD 3.53Å; F224-M257 VanDerWaalsContact CZ-SD 3.53Å
225F82.2Confident82.5Confident103 Ų10363 Ų6345%0.45234%0.341SS..Hα-helixtrans-61.6-49.7176.8173.5-112.7000111.9M221 S227 A228 V229 F247 F251M221-F225 VanDerWaalsContact O-CB 3.26Å; M221-F225 WeakPolarHBondContact O-CB 3.05Å; M221-F225 PolarHBondContact O-N 3.35Å; F225-S227 VanDerWaalsContact C-N 3.29Å; F225-S227 PolarHBondContact O-N 2.87Å; F225-A228 WeakPolarHBondContact O-CB 3.41Å; F225-A228 PolarHBondContact O-N 3.31Å; F225-V229 HydrophobicContact CD2-CG2 4.23Å; F225-V229 HydrophobicContact CE1-CG2 4.33Å; F225-V229 HydrophobicContact CE2-CG2 3.87Å; F225-V229 HydrophobicContact CZ-CG2 3.93Å; F225-V229 WeakPolarHBondContact O-CG2 3.33Å; F225-V229 PolarHBondContact O-N 3.42Å; F225-F247 HydrophobicContact CD2-CE2 4.23Å; F225-F247 HydrophobicContact CD2-CZ 4.22Å; F225-F247 HydrophobicContact CE2-CE2 4.11Å; F225-F247 AromaticContact CE2-CZ 4Å; F225-F247 HydrophobicContact CE2-CZ 4Å; F225-F251 HydrophobicContact CB-CZ 4.23Å; F225-F251 AromaticContact CD2-CE2 3.96Å; F225-F251 HydrophobicContact CD2-CE2 3.96Å; F225-F251 AromaticContact CD2-CZ 3.59Å; F225-F251 HydrophobicContact CD2-CZ 3.59Å; F225-F251 HydrophobicContact CE2-CZ 4.44Å; F225-F251 HydrophobicContact CG-CZ 4.36Å
226L83.4Confident83.5Confident82 Ų8262.4 Ų62.443%0.42933%0.328SS..Hα-helixtrans-61.4-41.4178.5-177.564.7000111W77 A222 V223 V229 V230W77-L226 HydrophobicContact CH2-CD2 3.64Å; W77-L226 HydrophobicContact CZ3-CD2 3.99Å; A222-L226 VanDerWaalsContact O-CB 3.3Å; A222-L226 WeakPolarHBondContact O-CB 3.2Å; A222-L226 PolarHBondContact O-N 2.8Å; V223-L226 PolarHBondContact O-N 3.31Å; L226-V229 PolarHBondContact O-N 3.42Å; L226-V230 VanDerWaalsContact O-CG2 3.31Å; L226-V230 WeakPolarHBondContact O-CG2 3.35Å; L226-V230 PolarHBondContact O-N 2.56Å
227S84.4Confident84.1Confident34 Ų3456.3 Ų56.324%0.23830%0.303CS..Hα-helixtrans-59.4-48.7174.1-172.30000111.3V223 F224 F225 V229 V230 H231 F250V223-S227 VanDerWaalsContact O-CB 3.26Å; V223-S227 WeakPolarHBondContact O-CB 3.29Å; V223-S227 PolarHBondContact O-N 3.15Å; F224-S227 WeakPolarHBondContact O-CB 3.31Å; F224-S227 PolarHBondContact O-N 3.47Å; F225-S227 VanDerWaalsContact C-N 3.29Å; F225-S227 PolarHBondContact O-N 2.87Å; S227-V229 PolarHBondContact O-N 3.43Å; S227-V230 PolarHBondContact O-N 3.11Å; S227-H231 PolarHBondContact O-N 2.67Å; S227-H231 PolarHBondContact O-ND1 2.92Å; S227-H231 PolarHBondContact OG-CE1 3.09Å; S227-H231 PolarHBondContact OG-ND1 3.15Å; S227-F250 VanDerWaalsContact OG-CE1 3.29Å; S227-F250 WeakPolarHBondContact OG-CE1 3.34Å
228A88.1Confident84.5Confident0 Ų052.1 Ų52.10%028%0.281CS..Hα-helixtrans-58.5-45.6179.700000111.9F224 F225 V230 H231 E232 F247 F250F224-A228 WeakPolarHBondContact O-CB 3.48Å; F224-A228 PolarHBondContact O-N 3.42Å; F225-A228 WeakPolarHBondContact O-CB 3.41Å; F225-A228 PolarHBondContact O-N 3.31Å; A228-V230 PolarHBondContact O-N 2.96Å; A228-H231 PolarHBondContact O-N 2.91Å; A228-E232 WeakPolarHBondContact O-CB 3.3Å; A228-E232 PolarHBondContact O-N 2.92Å; A228-F247 HydrophobicContact CB-CD2 3.67Å; A228-F247 HydrophobicContact CB-CE2 4.04Å; A228-F247 HydrophobicContact CB-CG 4.4Å; A228-F250 HydrophobicContact CB-CB 3.62Å; A228-F250 HydrophobicContact CB-CD1 4.37Å; A228-F250 HydrophobicContact CB-CD2 4.1Å; A228-F250 HydrophobicContact CB-CG 3.79Å
229V86.3Confident84.7Confident64 Ų6447.6 Ų47.639%0.38826%0.258SS..Hα-helixtrans-61.3-45.2177.3172.70000111.4F225 L226 S227 Y233 F247F225-V229 HydrophobicContact CD2-CG2 4.23Å; F225-V229 HydrophobicContact CE1-CG2 4.33Å; F225-V229 HydrophobicContact CE2-CG2 3.87Å; F225-V229 HydrophobicContact CZ-CG2 3.93Å; F225-V229 WeakPolarHBondContact O-CG2 3.33Å; F225-V229 PolarHBondContact O-N 3.42Å; L226-V229 PolarHBondContact O-N 3.42Å; S227-V229 PolarHBondContact O-N 3.43Å; V229-Y233 VanDerWaalsContact O-CB 3.24Å; V229-Y233 WeakPolarHBondContact O-CB 2.99Å; V229-Y233 PolarHBondContact O-N 2.84Å; V229-F247 HydrophobicContact CG2-CE2 3.95Å
230V86.5Confident85Confident41 Ų4150.2 Ų50.225%0.24826%0.257CS..Hα-helixtrans-65.8-45.2-179169.30000111.4V73 L226 S227 A228 Y233 I234V73-V230 HydrophobicContact CG1-CG1 3.72Å; L226-V230 VanDerWaalsContact O-CG2 3.31Å; L226-V230 WeakPolarHBondContact O-CG2 3.35Å; L226-V230 PolarHBondContact O-N 2.56Å; S227-V230 PolarHBondContact O-N 3.11Å; A228-V230 PolarHBondContact O-N 2.96Å; V230-Y233 WeakPolarHBondContact O-CB 3.35Å; V230-Y233 PolarHBondContact O-N 2.88Å; V230-I234 HydrophobicContact CG1-CD1 3.9Å; V230-I234 WeakPolarHBondContact O-CD1 3.24Å; V230-I234 VanDerWaalsContact O-CG1 3.28Å; V230-I234 WeakPolarHBondContact O-CG1 3.3Å; V230-I234 PolarHBondContact O-N 3.41Å
231H88Confident85.5Confident62 Ų6245.7 Ų45.729%0.28724%0.237SC..Hα-helixtrans-69-40.8179.7-66.573.1000111.5S227 A228 Y233 I234 L235 L246 F250S227-H231 PolarHBondContact O-N 2.67Å; S227-H231 PolarHBondContact O-ND1 2.92Å; S227-H231 PolarHBondContact OG-CE1 3.09Å; S227-H231 PolarHBondContact OG-ND1 3.15Å; A228-H231 PolarHBondContact O-N 2.91Å; H231-Y233 VanDerWaalsContact C-N 3.29Å; H231-Y233 PolarHBondContact O-N 3.38Å; H231-I234 PolarHBondContact O-N 2.81Å; H231-L235 WeakPolarHBondContact O-CG 3.34Å; H231-L235 PolarHBondContact O-N 3.23Å; H231-L246 HydrophobicContact CB-CD2 3.36Å; H231-L246 HydrophobicContact CB-CG 4.5Å; H231-F250 HydrophobicContact CB-CE2 4.19Å; H231-F250 AromaticContact ND1-CZ 3.86Å
232E90.4Very high85.9Confident7 Ų749.4 Ų49.43%0.03325%0.252CS..Hα-helixtrans-62.4-38.1175.4-169.763.4-138.900111.7A228 L235 T236 F242 Y243 P244 F247A228-E232 WeakPolarHBondContact O-CB 3.3Å; A228-E232 PolarHBondContact O-N 2.92Å; E232-L235 PolarHBondContact O-N 3.29Å; E232-T236 VanDerWaalsContact O-CB 3.25Å; E232-T236 WeakPolarHBondContact O-CB 3.4Å; E232-T236 PolarHBondContact O-N 3.2Å; E232-T236 PolarHBondContact O-OG1 3.21Å; E232-F242 HydrophobicContact CG-CD2 4.35Å; E232-F242 HydrophobicContact CG-CE2 3.8Å; E232-Y243 VanDerWaalsContact OE1-C 3.27Å; E232-Y243 VanDerWaalsContact OE1-O 3.04Å; E232-P244 WeakPolarHBondContact OE1-CA 3.46Å; E232-P244 WeakPolarHBondContact OE2-CA 3.3Å; E232-F247 HydrophobicContact CB-CB 4.42Å; E232-F247 HydrophobicContact CG-CB 4.31Å; E232-F247 PolarHBondContact OE2-N 2.86Å
233Y88.5Confident86.4Confident71 Ų7149.6 Ų49.628%0.27824%0.242SC..Hα-helixtrans-61.9-47.8173.3171.1-102.8000111.7I52 V69 Q72 V73 V229 V230 H231 L235 T236 I237I52-Y233 WeakPolarHBondContact CD1-OH 2.89Å; V69-Y233 HydrophobicContact CG1-CD1 3.92Å; V69-Y233 HydrophobicContact CG1-CE1 3.48Å; V69-Y233 VanDerWaalsContact CG1-CE1 3.48Å; Q72-Y233 PolarHBondContact OE1-OH 3.39Å; V73-Y233 HydrophobicContact CG2-CD1 3.91Å; V73-Y233 HydrophobicContact CG2-CE1 3.82Å; V229-Y233 VanDerWaalsContact O-CB 3.24Å; V229-Y233 WeakPolarHBondContact O-CB 2.99Å; V229-Y233 PolarHBondContact O-N 2.84Å; V230-Y233 WeakPolarHBondContact O-CB 3.35Å; V230-Y233 PolarHBondContact O-N 2.88Å; H231-Y233 VanDerWaalsContact C-N 3.29Å; H231-Y233 PolarHBondContact O-N 3.38Å; Y233-L235 VanDerWaalsContact C-N 3.33Å; Y233-L235 PolarHBondContact O-N 3.34Å; Y233-T236 PolarHBondContact O-N 3.39Å; Y233-I237 HydrophobicContact CD2-CG1 4.15Å; Y233-I237 HydrophobicContact CE2-CD1 4.16Å; Y233-I237 HydrophobicContact CE2-CG1 3.76Å; Y233-I237 WeakPolarHBondContact O-CG1 3.15Å; Y233-I237 PolarHBondContact O-N 2.96Å
234I88.3Confident87Confident21 Ų2146.9 Ų46.911%0.10823%0.226CC..Hα-helixtrans-58.3-47.8177.1-67.6161.3000110.1V69 V73 V230 H231 S238V69-I234 HydrophobicContact CG1-CB 4.36Å; V69-I234 HydrophobicContact CG1-CG1 3.94Å; V73-I234 HydrophobicContact CG2-CG1 4.29Å; V230-I234 HydrophobicContact CG1-CD1 3.9Å; V230-I234 WeakPolarHBondContact O-CD1 3.24Å; V230-I234 VanDerWaalsContact O-CG1 3.28Å; V230-I234 WeakPolarHBondContact O-CG1 3.3Å; V230-I234 PolarHBondContact O-N 3.41Å; H231-I234 PolarHBondContact O-N 2.81Å; I234-S238 VanDerWaalsContact O-CB 3.23Å; I234-S238 WeakPolarHBondContact O-CB 2.99Å; I234-S238 PolarHBondContact O-N 3.09Å; I234-S238 PolarHBondContact O-OG 3.15Å
235L87.9Confident87.3Confident6 Ų645.7 Ų45.73%0.03122%0.222CC..Hα-helixtrans-61.5-46.6177.8-73.6-170.8000112.2H231 E232 Y233 I237 S238 L239 L246 Y287 L318 C322H231-L235 WeakPolarHBondContact O-CG 3.34Å; H231-L235 PolarHBondContact O-N 3.23Å; E232-L235 PolarHBondContact O-N 3.29Å; Y233-L235 VanDerWaalsContact C-N 3.33Å; Y233-L235 PolarHBondContact O-N 3.34Å; L235-I237 PolarHBondContact O-N 3.09Å; L235-S238 PolarHBondContact O-N 3.49Å; L235-L239 VanDerWaalsContact O-CB 3.26Å; L235-L239 WeakPolarHBondContact O-CB 3.07Å; L235-L239 WeakPolarHBondContact O-CG 3.23Å; L235-L239 PolarHBondContact O-N 3.12Å; L235-L246 HydrophobicContact CD1-CB 3.9Å; L235-L246 HydrophobicContact CD1-CD2 3.51Å; L235-L246 HydrophobicContact CD1-CG 4.3Å; L235-L246 HydrophobicContact CG-CD2 4.24Å; L235-Y287 HydrophobicContact CD1-CE1 4.11Å; L235-Y287 HydrophobicContact CD1-CE2 3.76Å; L235-Y287 VanDerWaalsContact CD1-CZ 3.45Å; L235-Y287 VanDerWaalsContact CD1-OH 3.25Å; L235-Y287 WeakPolarHBondContact CD1-OH 3.4Å; L235-L318 HydrophobicContact CD2-CD1 3.71Å; L235-L318 HydrophobicContact CD2-CD2 3.8Å; L235-L318 HydrophobicContact CD2-CG 3.92Å; L235-C322 WeakPolarHBondContact CD2-SG 3.44Å
236T89.2Confident87.7Confident31 Ų3141.8 Ų41.819%0.1921%0.206CC..Hα-helixtrans-60.3-44.1-177.2-64.20000111.8E232 Y233 R240 F241 F242E232-T236 VanDerWaalsContact O-CB 3.25Å; E232-T236 WeakPolarHBondContact O-CB 3.4Å; E232-T236 PolarHBondContact O-N 3.2Å; E232-T236 PolarHBondContact O-OG1 3.21Å; Y233-T236 PolarHBondContact O-N 3.39Å; T236-R240 WeakPolarHBondContact O-CA 3.41Å; T236-R240 PolarHBondContact O-N 3.36Å; T236-F241 WeakPolarHBondContact CA-O 3.33Å; T236-F241 PolarHBondContact O-N 3.42Å; T236-F242 HydrophobicContact CG2-CB 4.14Å; T236-F242 HydrophobicContact CG2-CD2 4.41Å
237I87.6Confident88Confident29 Ų2940.7 Ų40.715%0.14920%0.198CC..Hα-helixtrans-73.9-36.5178.7-56.8-60.2000111.2I52 I55 V69 Y233 L235I52-I237 HydrophobicContact CD1-CD1 4.49Å; I52-I237 HydrophobicContact CG2-CD1 4.5Å; I55-I237 HydrophobicContact CD1-CG2 3.92Å; V69-I237 HydrophobicContact CG1-CB 4.48Å; V69-I237 HydrophobicContact CG2-CB 3.77Å; V69-I237 HydrophobicContact CG2-CG2 3.38Å; Y233-I237 HydrophobicContact CD2-CG1 4.15Å; Y233-I237 HydrophobicContact CE2-CD1 4.16Å; Y233-I237 HydrophobicContact CE2-CG1 3.76Å; Y233-I237 WeakPolarHBondContact O-CG1 3.15Å; Y233-I237 PolarHBondContact O-N 2.96Å; L235-I237 PolarHBondContact O-N 3.09Å
238S86.2Confident88.4Confident1 Ų143.3 Ų43.31%0.00721%0.212CC..Hα-helixtrans-67.8-41.6179.8-570000112.8A66 I234 L235A66-S238 WeakPolarHBondContact CA-OG 3.34Å; A66-S238 WeakPolarHBondContact CB-OG 3.39Å; A66-S238 PolarHBondContact N-OG 2.9Å; I234-S238 VanDerWaalsContact O-CB 3.23Å; I234-S238 WeakPolarHBondContact O-CB 2.99Å; I234-S238 PolarHBondContact O-N 3.09Å; I234-S238 PolarHBondContact O-OG 3.15Å; L235-S238 PolarHBondContact O-N 3.49Å
239L83.8Confident88.5Confident11 Ų1145.1 Ų45.16%0.05822%0.221CC..Hα-helixtrans-89.6-20.6-179.6-66.4179.5000113.3I62 L235 F241 Y287 L318I62-L239 HydrophobicContact CD1-CD2 3.86Å; I62-L239 HydrophobicContact CG2-CD2 4.1Å; L235-L239 VanDerWaalsContact O-CB 3.26Å; L235-L239 WeakPolarHBondContact O-CB 3.07Å; L235-L239 WeakPolarHBondContact O-CG 3.23Å; L235-L239 PolarHBondContact O-N 3.12Å; L239-F241 VanDerWaalsContact C-N 3.27Å; L239-F241 HydrophobicContact CB-CD1 3.94Å; L239-F241 HydrophobicContact CB-CE1 3.7Å; L239-F241 HydrophobicContact CB-CE2 4.47Å; L239-F241 HydrophobicContact CB-CG 4.46Å; L239-F241 HydrophobicContact CB-CZ 3.98Å; L239-F241 HydrophobicContact CD1-CE1 4.33Å; L239-F241 HydrophobicContact CD1-CE2 4.13Å; L239-F241 HydrophobicContact CD1-CZ 3.78Å; L239-F241 HydrophobicContact CG-CE1 4.44Å; L239-F241 HydrophobicContact CG-CZ 4.36Å; L239-F241 WeakPolarHBondContact O-CD1 3.37Å; L239-F241 PolarHBondContact O-N 3.47Å; L239-Y287 HydrophobicContact CD1-CD1 3.26Å; L239-Y287 HydrophobicContact CD1-CE1 3.66Å; L239-Y287 HydrophobicContact CD1-CG 4.14Å; L239-L318 HydrophobicContact CD1-CD2 4.13Å; L239-L318 HydrophobicContact CD2-CD2 3.86Å; L239-L318 HydrophobicContact CG-CD2 4.16Å
240R85.3Confident88.5Confident104 Ų10444.1 Ų44.139%0.39221%0.211SC..SBendtrans66.422.6-176.8-47.5-175-169.8160.69.9115.2D59 L60 T236D59-R240 VanDerWaalsContact CA-NH2 3.26Å; D59-R240 PolarHBondContact O-NH2 2.79Å; D59-R240 IonicContact OD1-CZ 3.06Å; D59-R240 IonicContact OD1-NH1 2.6Å; D59-R240 PolarHBondContact OD1-NH1 2.95Å; D59-R240 IonicContact OD1-NH2 2.67Å; D59-R240 PolarHBondContact OD1-NH2 2.87Å; L60-R240 PolarHBondContact O-NH2 2.7Å; T236-R240 WeakPolarHBondContact O-CA 3.41Å; T236-R240 PolarHBondContact O-N 3.36Å
241F86.2Confident88.5Confident19 Ų1945.7 Ų45.78%0.08322%0.215CC..SBendtrans-144.4150.2168.960.9-99.2000109.2T236 L239 Y243 Y287 E290 W291T236-F241 WeakPolarHBondContact CA-O 3.33Å; T236-F241 PolarHBondContact O-N 3.42Å; L239-F241 VanDerWaalsContact C-N 3.27Å; L239-F241 HydrophobicContact CB-CD1 3.94Å; L239-F241 HydrophobicContact CB-CE1 3.7Å; L239-F241 HydrophobicContact CB-CE2 4.47Å; L239-F241 HydrophobicContact CB-CG 4.46Å; L239-F241 HydrophobicContact CB-CZ 3.98Å; L239-F241 HydrophobicContact CD1-CE1 4.33Å; L239-F241 HydrophobicContact CD1-CE2 4.13Å; L239-F241 HydrophobicContact CD1-CZ 3.78Å; L239-F241 HydrophobicContact CG-CE1 4.44Å; L239-F241 HydrophobicContact CG-CZ 4.36Å; L239-F241 WeakPolarHBondContact O-CD1 3.37Å; L239-F241 PolarHBondContact O-N 3.47Å; F241-Y243 HydrophobicContact CE2-CG 4.28Å; F241-Y287 HydrophobicContact CE2-CD1 4.16Å; F241-Y287 HydrophobicContact CE2-CE1 4.49Å; F241-Y287 HydrophobicContact CZ-CD1 4.37Å; F241-E290 HydrophobicContact CD2-CG 4.34Å; F241-E290 HydrophobicContact CE2-CB 4.41Å; F241-E290 HydrophobicContact CE2-CG 3.79Å; F241-E290 HydrophobicContact CZ-CB 4.47Å; F241-E290 HydrophobicContact CZ-CG 4.17Å; F241-W291 HydrophobicContact CE1-CB 4.14Å; F241-W291 AromaticContact CE1-CD1 3.82Å; F241-W291 HydrophobicContact CE1-CG 4.34Å; F241-W291 HydrophobicContact CZ-CB 4.26Å
242F89.9Confident88.5Confident133 Ų13348 Ų4858%0.58323%0.229SC*.  trans-88.6120.7176.1179.5-108.3000109.3E232 T236 P244E232-F242 HydrophobicContact CG-CD2 4.35Å; E232-F242 HydrophobicContact CG-CE2 3.8Å; T236-F242 HydrophobicContact CG2-CB 4.14Å; T236-F242 HydrophobicContact CG2-CD2 4.41Å; F242-P244 HydrophobicContact CD1-CG 4.43Å; F242-P244 HydrophobicContact CE1-CB 4.02Å; F242-P244 HydrophobicContact CE1-CG 3.7Å; F242-P244 HydrophobicContact CE2-CB 4.22Å; F242-P244 HydrophobicContact CZ-CB 3.65Å; F242-P244 HydrophobicContact CZ-CG 3.89Å
243Y89Confident88.2Confident57 Ų5748.8 Ų48.822%0.22424%0.239CC..  trans-144.890.7178.6-174.6-124.2000110E232 F241 I245 A286 Y287 E290E232-Y243 VanDerWaalsContact OE1-C 3.27Å; E232-Y243 VanDerWaalsContact OE1-O 3.04Å; F241-Y243 HydrophobicContact CE2-CG 4.28Å; Y243-I245 HydrophobicContact CD1-CB 4.4Å; Y243-I245 HydrophobicContact CD1-CD1 4.14Å; Y243-I245 HydrophobicContact CD1-CG1 3.95Å; Y243-I245 HydrophobicContact CE1-CB 4.27Å; Y243-I245 HydrophobicContact CE1-CD1 3.24Å; Y243-I245 HydrophobicContact CE1-CG1 3.54Å; Y243-I245 HydrophobicContact CE2-CD1 4.08Å; Y243-I245 HydrophobicContact CE2-CG1 4.15Å; Y243-I245 HydrophobicContact CG-CG1 4.45Å; Y243-I245 PolarHBondContact O-N 3.13Å; Y243-I245 WeakPolarHBondContact OH-CD1 3.46Å; Y243-A286 HydrophobicContact CE1-CB 3.89Å; Y243-Y287 AromaticContact CD1-CD1 3.69Å; Y243-Y287 HydrophobicContact CD1-CD1 3.69Å; Y243-Y287 AromaticContact CD1-CE1 3.64Å; Y243-Y287 HydrophobicContact CD1-CE1 3.64Å; Y243-Y287 HydrophobicContact CD1-CG 4.23Å; Y243-Y287 HydrophobicContact CG-CE1 4.26Å; Y243-Y287 WeakPolarHBondContact O-CE1 3.46Å; Y243-Y287 PolarHBondContact O-OH 3.07Å; Y243-E290 HydrophobicContact CD1-CB 4.33Å; Y243-E290 HydrophobicContact CD1-CG 4.33Å; Y243-E290 HydrophobicContact CD2-CG 4.09Å; Y243-E290 HydrophobicContact CE1-CB 4.09Å; Y243-E290 HydrophobicContact CE1-CG 4.41Å; Y243-E290 HydrophobicContact CE2-CG 4.22Å; Y243-E290 HydrophobicContact CG-CG 4.14Å
244P92.1Very high87.9Confident46 Ų4645.5 Ų45.530%0.29923%0.226SC..THydrogen-bonded Turntrans-79.338.5-161.933.5-38.2000115.2E232 F242 F247 V248E232-P244 WeakPolarHBondContact OE1-CA 3.46Å; E232-P244 WeakPolarHBondContact OE2-CA 3.3Å; F242-P244 HydrophobicContact CD1-CG 4.43Å; F242-P244 HydrophobicContact CE1-CB 4.02Å; F242-P244 HydrophobicContact CE1-CG 3.7Å; F242-P244 HydrophobicContact CE2-CB 4.22Å; F242-P244 HydrophobicContact CZ-CB 3.65Å; F242-P244 HydrophobicContact CZ-CG 3.89Å; P244-F247 HydrophobicContact CB-CB 4.14Å; P244-V248 WeakPolarHBondContact O-CG2 3.02Å; P244-V248 PolarHBondContact O-N 3Å; P244-V248 VanDerWaalsContact O-N 3.12Å
245I90.7Very high87.6Confident38 Ų3845.9 Ų45.920%0.19524%0.235CC..Hα-helixtrans-69.6-44.4176.2-67.9-160.8000110.7Y243 F247 V248 E249 L283 A286Y243-I245 HydrophobicContact CD1-CB 4.4Å; Y243-I245 HydrophobicContact CD1-CD1 4.14Å; Y243-I245 HydrophobicContact CD1-CG1 3.95Å; Y243-I245 HydrophobicContact CE1-CB 4.27Å; Y243-I245 HydrophobicContact CE1-CD1 3.24Å; Y243-I245 HydrophobicContact CE1-CG1 3.54Å; Y243-I245 HydrophobicContact CE2-CD1 4.08Å; Y243-I245 HydrophobicContact CE2-CG1 4.15Å; Y243-I245 HydrophobicContact CG-CG1 4.45Å; Y243-I245 PolarHBondContact O-N 3.13Å; Y243-I245 WeakPolarHBondContact OH-CD1 3.46Å; I245-F247 VanDerWaalsContact C-N 3.29Å; I245-F247 PolarHBondContact O-N 3.37Å; I245-V248 PolarHBondContact O-N 3.31Å; I245-V248 VanDerWaalsContact O-N 3.15Å; I245-E249 HydrophobicContact CG2-CG 4.32Å; I245-E249 WeakPolarHBondContact O-CG 3.25Å; I245-E249 PolarHBondContact O-N 2.94Å; I245-L283 HydrophobicContact CB-CD2 4.49Å; I245-L283 HydrophobicContact CG2-CD2 3.84Å; I245-A286 HydrophobicContact CD1-CB 3.5Å; I245-A286 VanDerWaalsContact CD1-CB 3.5Å
246L90.2Very high87.3Confident20 Ų2047.8 Ų47.811%0.10525%0.245CC..Hα-helixtrans-59.1-45.8176.9-175.667.9000110.8H231 L235 V248 E249 F250 L283 Y287H231-L246 HydrophobicContact CB-CD2 3.36Å; H231-L246 HydrophobicContact CB-CG 4.5Å; L235-L246 HydrophobicContact CD1-CB 3.9Å; L235-L246 HydrophobicContact CD1-CD2 3.51Å; L235-L246 HydrophobicContact CD1-CG 4.3Å; L235-L246 HydrophobicContact CG-CD2 4.24Å; L246-V248 VanDerWaalsContact C-N 3.34Å; L246-V248 PolarHBondContact O-N 3.23Å; L246-E249 PolarHBondContact O-N 3.47Å; L246-F250 HydrophobicContact CD1-CD2 4.04Å; L246-F250 HydrophobicContact CD1-CE2 3.8Å; L246-F250 HydrophobicContact CD2-CE2 4.05Å; L246-F250 HydrophobicContact CG-CD2 3.85Å; L246-F250 HydrophobicContact CG-CE2 3.76Å; L246-F250 WeakPolarHBondContact O-CD2 3.32Å; L246-F250 PolarHBondContact O-N 3.44Å; L246-L283 HydrophobicContact CB-CD2 3.79Å; L246-L283 HydrophobicContact CD1-CD1 3.54Å; L246-L283 HydrophobicContact CD1-CD2 3.77Å; L246-L283 HydrophobicContact CD1-CG 4.33Å; L246-L283 HydrophobicContact CG-CD2 4.4Å; L246-Y287 HydrophobicContact CB-CE2 4.43Å; L246-Y287 PolarHBondContact N-OH 3.36Å
247F90.4Very high86.6Confident59 Ų5949.1 Ų49.126%0.25925%0.25SC..Hα-helixtrans-54.3-48.2174.8-174-89.1000112.6F225 A228 V229 E232 P244 I245 E249 F250 F251F225-F247 HydrophobicContact CD2-CE2 4.23Å; F225-F247 HydrophobicContact CD2-CZ 4.22Å; F225-F247 HydrophobicContact CE2-CE2 4.11Å; F225-F247 AromaticContact CE2-CZ 4Å; F225-F247 HydrophobicContact CE2-CZ 4Å; A228-F247 HydrophobicContact CB-CD2 3.67Å; A228-F247 HydrophobicContact CB-CE2 4.04Å; A228-F247 HydrophobicContact CB-CG 4.4Å; V229-F247 HydrophobicContact CG2-CE2 3.95Å; E232-F247 HydrophobicContact CB-CB 4.42Å; E232-F247 HydrophobicContact CG-CB 4.31Å; E232-F247 PolarHBondContact OE2-N 2.86Å; P244-F247 HydrophobicContact CB-CB 4.14Å; I245-F247 VanDerWaalsContact C-N 3.29Å; I245-F247 PolarHBondContact O-N 3.37Å; F247-E249 PolarHBondContact O-N 3.12Å; F247-F250 PolarHBondContact O-N 3Å; F247-F251 HydrophobicContact CD1-CD2 4.09Å; F247-F251 HydrophobicContact CD1-CE2 4.19Å; F247-F251 AromaticContact CE1-CD2 3.76Å; F247-F251 HydrophobicContact CE1-CD2 3.76Å; F247-F251 AromaticContact CE1-CE2 3.5Å; F247-F251 HydrophobicContact CE1-CE2 3.5Å; F247-F251 VanDerWaalsContact CE1-CE2 3.5Å; F247-F251 AromaticContact CE2-CE2 3.87Å; F247-F251 HydrophobicContact CE2-CE2 3.87Å; F247-F251 HydrophobicContact CZ-CD2 4.06Å; F247-F251 AromaticContact CZ-CE2 3.33Å; F247-F251 HydrophobicContact CZ-CE2 3.33Å; F247-F251 HydrophobicContact CZ-CZ 4.18Å; F247-F251 WeakPolarHBondContact O-CD2 2.88Å; F247-F251 PolarHBondContact O-N 3.39Å
248V91.8Very high86Confident90 Ų9050.9 Ų50.955%0.54526%0.259SS..Hα-helixtrans-63.5-40.51781710000111.8P244 I245 L246 F251 L252P244-V248 WeakPolarHBondContact O-CG2 3.02Å; P244-V248 PolarHBondContact O-N 3Å; P244-V248 VanDerWaalsContact O-N 3.12Å; I245-V248 PolarHBondContact O-N 3.31Å; I245-V248 VanDerWaalsContact O-N 3.15Å; L246-V248 VanDerWaalsContact C-N 3.34Å; L246-V248 PolarHBondContact O-N 3.23Å; V248-F251 PolarHBondContact O-N 3.17Å; V248-L252 PolarHBondContact O-N 3.38Å
249E89.7Confident85.5Confident37 Ų3757.9 Ų57.917%0.17330%0.296CS..Hα-helixtrans-64.5-39.1177.9-75.3-172.8-171.100112.9I245 L246 F247 F251 L252 G253 G279 I282 L283I245-E249 HydrophobicContact CG2-CG 4.32Å; I245-E249 WeakPolarHBondContact O-CG 3.25Å; I245-E249 PolarHBondContact O-N 2.94Å; L246-E249 PolarHBondContact O-N 3.47Å; F247-E249 PolarHBondContact O-N 3.12Å; E249-F251 VanDerWaalsContact C-N 3.26Å; E249-F251 PolarHBondContact O-N 2.94Å; E249-L252 PolarHBondContact O-N 3.04Å; E249-G253 PolarHBondContact O-N 2.97Å; E249-G279 VanDerWaalsContact OE2-CA 3.31Å; E249-G279 WeakPolarHBondContact OE2-CA 3.48Å; E249-I282 WeakPolarHBondContact OE1-CB 3.23Å; E249-I282 WeakPolarHBondContact OE1-CG2 3.05Å; E249-L283 VanDerWaalsContact OE2-CD1 3.23Å; E249-L283 WeakPolarHBondContact OE2-CD1 3.35Å; E249-L283 WeakPolarHBondContact OE2-CG 3.14Å
250F86.1Confident84.9Confident43 Ų4359.5 Ų59.519%0.18930%0.304CS..Hα-helixtrans-57.2-41173.3-95.7-85000111.7F224 S227 A228 H231 L246 F247 A254F224-F250 HydrophobicContact CD1-CD1 4.16Å; S227-F250 VanDerWaalsContact OG-CE1 3.29Å; S227-F250 WeakPolarHBondContact OG-CE1 3.34Å; A228-F250 HydrophobicContact CB-CB 3.62Å; A228-F250 HydrophobicContact CB-CD1 4.37Å; A228-F250 HydrophobicContact CB-CD2 4.1Å; A228-F250 HydrophobicContact CB-CG 3.79Å; H231-F250 HydrophobicContact CB-CE2 4.19Å; H231-F250 AromaticContact ND1-CZ 3.86Å; L246-F250 HydrophobicContact CD1-CD2 4.04Å; L246-F250 HydrophobicContact CD1-CE2 3.8Å; L246-F250 HydrophobicContact CD2-CE2 4.05Å; L246-F250 HydrophobicContact CG-CD2 3.85Å; L246-F250 HydrophobicContact CG-CE2 3.76Å; L246-F250 WeakPolarHBondContact O-CD2 3.32Å; L246-F250 PolarHBondContact O-N 3.44Å; F247-F250 PolarHBondContact O-N 3Å; F250-A254 WeakPolarHBondContact O-CB 2.81Å; F250-A254 PolarHBondContact O-N 2.89Å
251F87Confident83.7Confident75 Ų7565.4 Ų65.433%0.32933%0.326SS..Hα-helixtrans-73.9-39.1177.9-86.6-82.4000113.3M221 F225 F247 V248 E249 G253 A254 G255M221-F251 HydrophobicContact CE-CD1 4.05Å; M221-F251 HydrophobicContact CE-CE1 3.92Å; F225-F251 HydrophobicContact CB-CZ 4.23Å; F225-F251 AromaticContact CD2-CE2 3.96Å; F225-F251 HydrophobicContact CD2-CE2 3.96Å; F225-F251 AromaticContact CD2-CZ 3.59Å; F225-F251 HydrophobicContact CD2-CZ 3.59Å; F225-F251 HydrophobicContact CE2-CZ 4.44Å; F225-F251 HydrophobicContact CG-CZ 4.36Å; F247-F251 HydrophobicContact CD1-CD2 4.09Å; F247-F251 HydrophobicContact CD1-CE2 4.19Å; F247-F251 AromaticContact CE1-CD2 3.76Å; F247-F251 HydrophobicContact CE1-CD2 3.76Å; F247-F251 AromaticContact CE1-CE2 3.5Å; F247-F251 HydrophobicContact CE1-CE2 3.5Å; F247-F251 VanDerWaalsContact CE1-CE2 3.5Å; F247-F251 AromaticContact CE2-CE2 3.87Å; F247-F251 HydrophobicContact CE2-CE2 3.87Å; F247-F251 HydrophobicContact CZ-CD2 4.06Å; F247-F251 AromaticContact CZ-CE2 3.33Å; F247-F251 HydrophobicContact CZ-CE2 3.33Å; F247-F251 HydrophobicContact CZ-CZ 4.18Å; F247-F251 WeakPolarHBondContact O-CD2 2.88Å; F247-F251 PolarHBondContact O-N 3.39Å; V248-F251 PolarHBondContact O-N 3.17Å; E249-F251 VanDerWaalsContact C-N 3.26Å; E249-F251 PolarHBondContact O-N 2.94Å; F251-G253 VanDerWaalsContact C-N 3.35Å; F251-A254 PolarHBondContact O-N 3.48Å; F251-G255 PolarHBondContact O-N 3.06Å
252L87.3Confident82.3Confident110 Ų11069.9 Ų69.958%0.57636%0.359SS*.Hα-helixtrans-62.3-46.1174.2-178.460.8000110.5V248 E249 G255 I256V248-L252 PolarHBondContact O-N 3.38Å; E249-L252 PolarHBondContact O-N 3.04Å; L252-G255 PolarHBondContact O-N 3.46Å; L252-I256 HydrophobicContact CD1-CD1 3.98Å; L252-I256 HydrophobicContact CD1-CG1 4.4Å; L252-I256 HydrophobicContact CG-CD1 4.02Å; L252-I256 VanDerWaalsContact O-CG1 3.27Å; L252-I256 WeakPolarHBondContact O-CG1 3.49Å; L252-I256 PolarHBondContact O-N 3.29Å
253G85.1Confident80.7Confident23 Ų2366.1 Ų66.124%0.23735%0.347CS..Hα-helixtrans-57.6-56.3173.200000111.4E249 F251 G255 I256 M257E249-G253 PolarHBondContact O-N 2.97Å; F251-G253 VanDerWaalsContact C-N 3.35Å; G253-G255 VanDerWaalsContact C-N 3.31Å; G253-G255 PolarHBondContact O-N 3.48Å; G253-I256 PolarHBondContact O-N 3Å; G253-M257 VanDerWaalsContact O-CB 3.31Å; G253-M257 WeakPolarHBondContact O-CB 3.43Å; G253-M257 WeakPolarHBondContact O-CG 3.32Å; G253-M257 PolarHBondContact O-N 2.87Å
254A81.9Confident79.3Confident2 Ų272.4 Ų72.42%0.01738%0.376CS..Hα-helixtrans-58.5-39.4179.100000113M221 F224 F250 F251 M257 L258M221-A254 HydrophobicContact CE-CB 4.39Å; M221-A254 HydrophobicContact SD-CB 4.06Å; F224-A254 HydrophobicContact CB-CB 4.01Å; F224-A254 HydrophobicContact CD1-CB 4.21Å; F224-A254 HydrophobicContact CD2-CB 3.8Å; F224-A254 HydrophobicContact CE2-CB 4.33Å; F224-A254 HydrophobicContact CG-CB 3.75Å; F250-A254 WeakPolarHBondContact O-CB 2.81Å; F250-A254 PolarHBondContact O-N 2.89Å; F251-A254 PolarHBondContact O-N 3.48Å; A254-M257 WeakPolarHBondContact O-CB 3.28Å; A254-M257 PolarHBondContact O-N 3.42Å; A254-L258 WeakPolarHBondContact O-CG 3.36Å; A254-L258 PolarHBondContact O-N 3.32Å
255G82.5Confident78.3Confident29 Ų2972.3 Ų72.330%0.29938%0.383SS..Hα-helixtrans-63.8-50.9177.500000112.3F251 L252 G253 M257 L258 L259F251-G255 PolarHBondContact O-N 3.06Å; L252-G255 PolarHBondContact O-N 3.46Å; G253-G255 VanDerWaalsContact C-N 3.31Å; G253-G255 PolarHBondContact O-N 3.48Å; G255-M257 PolarHBondContact O-N 2.84Å; G255-L258 PolarHBondContact O-N 3.15Å; G255-L259 WeakPolarHBondContact O-CG 3.4Å; G255-L259 PolarHBondContact O-N 3.36Å; G255-L259 VanDerWaalsContact O-N 3.12Å
256I80.8Confident77.8Confident46 Ų4675.3 Ų75.324%0.23641%0.407CS..Hα-helixtrans-59.4-39.7174-65.9167.8000110L252 G253 L258 L259 M260 M275L252-I256 HydrophobicContact CD1-CD1 3.98Å; L252-I256 HydrophobicContact CD1-CG1 4.4Å; L252-I256 HydrophobicContact CG-CD1 4.02Å; L252-I256 VanDerWaalsContact O-CG1 3.27Å; L252-I256 WeakPolarHBondContact O-CG1 3.49Å; L252-I256 PolarHBondContact O-N 3.29Å; G253-I256 PolarHBondContact O-N 3Å; I256-L258 VanDerWaalsContact C-N 3.34Å; I256-L258 PolarHBondContact O-N 3.17Å; I256-L259 PolarHBondContact O-N 2.9Å; I256-M260 HydrophobicContact CG2-CG 4.28Å; I256-M260 HydrophobicContact CG2-SD 4.04Å; I256-M260 WeakPolarHBondContact O-CG 3.45Å; I256-M260 PolarHBondContact O-N 3.39Å; I256-M275 HydrophobicContact CD1-CE 3.76Å; I256-M275 HydrophobicContact CD1-SD 4.09Å; I256-M275 HydrophobicContact CG2-CE 4.47Å
257M75.5Confident77.3Confident59 Ų5981.6 Ų81.629%0.29143%0.434SS..Hα-helixtrans-63.6-36.2178.9-73.8-177.97600113.4F224 G253 A254 G255 W268 L272F224-M257 HydrophobicContact CE1-SD 4.17Å; F224-M257 HydrophobicContact CE2-CE 4.43Å; F224-M257 HydrophobicContact CE2-SD 4.23Å; F224-M257 HydrophobicContact CZ-CE 3.85Å; F224-M257 HydrophobicContact CZ-SD 3.53Å; F224-M257 VanDerWaalsContact CZ-SD 3.53Å; G253-M257 VanDerWaalsContact O-CB 3.31Å; G253-M257 WeakPolarHBondContact O-CB 3.43Å; G253-M257 WeakPolarHBondContact O-CG 3.32Å; G253-M257 PolarHBondContact O-N 2.87Å; A254-M257 WeakPolarHBondContact O-CB 3.28Å; A254-M257 PolarHBondContact O-N 3.42Å; G255-M257 PolarHBondContact O-N 2.84Å; M257-W268 HydrophobicContact CB-CH2 3.52Å; M257-W268 HydrophobicContact CB-CZ2 4.34Å; M257-W268 HydrophobicContact CB-CZ3 4.38Å; M257-W268 HydrophobicContact CE-CH2 3.83Å; M257-W268 HydrophobicContact CE-CZ2 3.51Å; M257-W268 HydrophobicContact CG-CH2 3.38Å; M257-W268 HydrophobicContact CG-CZ2 4.09Å; M257-W268 HydrophobicContact CG-CZ3 4.13Å; M257-W268 HydrophobicContact SD-CH2 4.44Å; M257-L272 HydrophobicContact CE-CD1 3.9Å; M257-L272 HydrophobicContact SD-CD1 4.35Å
258L75.3Confident76.9Confident67 Ų6781.8 Ų81.835%0.35143%0.433SS..Hα-helixtrans-70.3-35173.7-73178000112.5N217 M221 A254 G255 I256N217-L258 HydrophobicContact CB-CD2 4.34Å; M221-L258 HydrophobicContact CG-CD1 3.92Å; M221-L258 HydrophobicContact SD-CD1 3.48Å; M221-L258 WeakPolarHBondContact SD-CD1 3.48Å; M221-L258 HydrophobicContact SD-CG 4.27Å; A254-L258 WeakPolarHBondContact O-CG 3.36Å; A254-L258 PolarHBondContact O-N 3.32Å; G255-L258 PolarHBondContact O-N 3.15Å; I256-L258 VanDerWaalsContact C-N 3.34Å; I256-L258 PolarHBondContact O-N 3.17Å
259L74.5Confident76.4Confident148 Ų14881.6 Ų81.678%0.77543%0.429SS*.Hα-helixtrans-70.5-34.4177.1-66.4173000112G255 I256 R261G255-L259 WeakPolarHBondContact O-CG 3.4Å; G255-L259 PolarHBondContact O-N 3.36Å; G255-L259 VanDerWaalsContact O-N 3.12Å; I256-L259 PolarHBondContact O-N 2.9Å; L259-R261 PolarHBondContact O-N 3.09Å
260M70.6Confident76.2Confident45 Ų4586.3 Ų86.322%0.22245%0.449CS..  trans-76.253.2174.9-67.8-170.973.300112.1I256 S262 T263 W268 C271I256-M260 HydrophobicContact CG2-CG 4.28Å; I256-M260 HydrophobicContact CG2-SD 4.04Å; I256-M260 WeakPolarHBondContact O-CG 3.45Å; I256-M260 PolarHBondContact O-N 3.39Å; M260-S262 PolarHBondContact O-N 2.93Å; M260-T263 HydrophobicContact CE-CG2 4.05Å; M260-W268 HydrophobicContact CB-CE3 3.87Å; M260-W268 HydrophobicContact CB-CH2 4.26Å; M260-W268 HydrophobicContact CB-CZ3 3.43Å; M260-W268 VanDerWaalsContact CB-CZ3 3.43Å; M260-W268 HydrophobicContact CE-CE3 3.66Å; M260-W268 HydrophobicContact CE-CZ3 4.11Å; M260-W268 HydrophobicContact CG-CE3 4.43Å; M260-W268 HydrophobicContact CG-CZ3 4.01Å; M260-W268 HydrophobicContact SD-CE3 3.72Å; M260-W268 HydrophobicContact SD-CZ3 3.53Å; M260-W268 VanDerWaalsContact SD-CZ3 3.53Å; M260-C271 HydrophobicContact CE-CB 3.64Å; M260-C271 HydrophobicContact SD-CB 3.86Å
261R60.1Low76.2Confident227 Ų22786 Ų8686%0.85745%0.452SS*.THydrogen-bonded Turntrans-62.5-17.4-173.6-172.2170.2174.6162.6-2.6114.7L259L259-R261 PolarHBondContact O-N 3.09Å
262S58.4Low76Confident113 Ų11384.9 Ų84.979%0.7945%0.449SS*.THydrogen-bonded Turntrans-162.459.4-164.7-177.50000113M260M260-S262 PolarHBondContact O-N 2.93Å
263T56.3Low75.9Confident54 Ų5485.6 Ų85.633%0.33144%0.444SS..  trans-105.4135.2165.661.30000110.3M260 G265 W268M260-T263 HydrophobicContact CE-CG2 4.05Å; T263-G265 PolarHBondContact O-N 2.72Å; T263-W268 WeakPolarHBondContact OG1-CA 3.39Å; T263-W268 WeakPolarHBondContact OG1-CB 3.45Å; T263-W268 PolarHBondContact OG1-N 3.33Å
264K60Low76Confident190 Ų19088.2 Ų88.283%0.82645%0.452SS*.  trans-49.9136.2171.5-67.8-176.9178.3-178.80108.5S266 K267K264-S266 PolarHBondContact O-N 3.2Å; K264-K267 PolarHBondContact O-N 3.14Å
265G70.6Confident76.2Confident43 Ų4392 Ų9244%0.44347%0.47SS..Hα-helixtrans-48.8-28.6-161.100000117T263 N269T263-G265 PolarHBondContact O-N 2.72Å; G265-N269 WeakPolarHBondContact O-CB 3.49Å; G265-N269 PolarHBondContact O-N 3.38Å; G265-N269 PolarHBondContact O-ND2 3.41Å; G265-N269 PolarHBondContact O-OD1 3.07Å
266S80.2Confident76.3Confident101 Ų10192.9 Ų92.971%0.70647%0.468SS*.Hα-helixtrans-66.9-47.2176.2171.60000113.6K264 W268 N269 F270K264-S266 PolarHBondContact O-N 3.2Å; S266-W268 VanDerWaalsContact C-N 3.28Å; S266-W268 PolarHBondContact O-N 3.17Å; S266-N269 PolarHBondContact O-N 3.2Å; S266-F270 WeakPolarHBondContact O-CB 3.28Å; S266-F270 PolarHBondContact O-N 2.94Å
267K79.8Confident76.6Confident152 Ų15292.2 Ų92.266%0.66146%0.464SS*.Hα-helixtrans-65.1-38.1179-70.9-172.5179.4-173.80111.1K264 F270 C271K264-K267 PolarHBondContact O-N 3.14Å; K267-F270 PolarHBondContact O-N 3.49Å; K267-C271 PolarHBondContact O-N 2.85Å; K267-C271 PolarHBondContact O-SG 3.12Å; K267-C271 VanDerWaalsContact O-SG 3.38Å
268W80.5Confident77.1Confident64 Ų6491.9 Ų91.924%0.24246%0.464CS..Hα-helixtrans-59.6-52.2175.5176.8-128.6000112.1M257 M260 T263 S266 F270 C271 L272M257-W268 HydrophobicContact CB-CH2 3.52Å; M257-W268 HydrophobicContact CB-CZ2 4.34Å; M257-W268 HydrophobicContact CB-CZ3 4.38Å; M257-W268 HydrophobicContact CE-CH2 3.83Å; M257-W268 HydrophobicContact CE-CZ2 3.51Å; M257-W268 HydrophobicContact CG-CH2 3.38Å; M257-W268 HydrophobicContact CG-CZ2 4.09Å; M257-W268 HydrophobicContact CG-CZ3 4.13Å; M257-W268 HydrophobicContact SD-CH2 4.44Å; M260-W268 HydrophobicContact CB-CE3 3.87Å; M260-W268 HydrophobicContact CB-CH2 4.26Å; M260-W268 HydrophobicContact CB-CZ3 3.43Å; M260-W268 VanDerWaalsContact CB-CZ3 3.43Å; M260-W268 HydrophobicContact CE-CE3 3.66Å; M260-W268 HydrophobicContact CE-CZ3 4.11Å; M260-W268 HydrophobicContact CG-CE3 4.43Å; M260-W268 HydrophobicContact CG-CZ3 4.01Å; M260-W268 HydrophobicContact SD-CE3 3.72Å; M260-W268 HydrophobicContact SD-CZ3 3.53Å; M260-W268 VanDerWaalsContact SD-CZ3 3.53Å; T263-W268 WeakPolarHBondContact OG1-CA 3.39Å; T263-W268 WeakPolarHBondContact OG1-CB 3.45Å; T263-W268 PolarHBondContact OG1-N 3.33Å; S266-W268 VanDerWaalsContact C-N 3.28Å; S266-W268 PolarHBondContact O-N 3.17Å; W268-F270 VanDerWaalsContact C-N 3.31Å; W268-F270 PolarHBondContact O-N 3.33Å; W268-C271 PolarHBondContact O-N 2.96Å; W268-L272 HydrophobicContact CZ2-CD1 4.49Å; W268-L272 WeakPolarHBondContact O-CB 3.41Å; W268-L272 PolarHBondContact O-N 3.32Å
269N83Confident77.8Confident85 Ų8589.2 Ų89.246%0.45545%0.452SS..Hα-helixtrans-60-43.7178.3-70.8-8.9000111G265 S266 L272 W273G265-N269 WeakPolarHBondContact O-CB 3.49Å; G265-N269 PolarHBondContact O-N 3.38Å; G265-N269 PolarHBondContact O-ND2 3.41Å; G265-N269 PolarHBondContact O-OD1 3.07Å; S266-N269 PolarHBondContact O-N 3.2Å; N269-L272 PolarHBondContact O-N 2.98Å; N269-W273 WeakPolarHBondContact O-CB 3.36Å; N269-W273 PolarHBondContact O-N 2.79Å
270F85.2Confident78.3Confident136 Ų13683.4 Ų83.460%0.59642%0.422SS*.Hα-helixtrans-58.7-49.3177.3178-98.1000112.2S266 K267 W268 L272 W273 L274S266-F270 WeakPolarHBondContact O-CB 3.28Å; S266-F270 PolarHBondContact O-N 2.94Å; K267-F270 PolarHBondContact O-N 3.49Å; W268-F270 VanDerWaalsContact C-N 3.31Å; W268-F270 PolarHBondContact O-N 3.33Å; F270-L272 PolarHBondContact O-N 3.48Å; F270-W273 PolarHBondContact O-N 3.3Å; F270-L274 HydrophobicContact CE1-CD2 4.3Å; F270-L274 WeakPolarHBondContact O-CB 3.11Å; F270-L274 PolarHBondContact O-N 3.49Å
271C85.1Confident78.9Confident38 Ų3881.2 Ų81.226%0.25741%0.411SS..Hα-helixtrans-64-40.5178-70.10000112.5M260 K267 W268 L274 M275M260-C271 HydrophobicContact CE-CB 3.64Å; M260-C271 HydrophobicContact SD-CB 3.86Å; K267-C271 PolarHBondContact O-N 2.85Å; K267-C271 PolarHBondContact O-SG 3.12Å; K267-C271 VanDerWaalsContact O-SG 3.38Å; W268-C271 PolarHBondContact O-N 2.96Å; C271-L274 PolarHBondContact O-N 3.34Å; C271-M275 WeakPolarHBondContact O-CB 3.31Å; C271-M275 VanDerWaalsContact O-CG 3.23Å; C271-M275 WeakPolarHBondContact O-CG 3.44Å; C271-M275 PolarHBondContact O-N 2.85Å
272L84.4Confident80.1Confident51 Ų5173.7 Ų73.727%0.26739%0.387SS..Hα-helixtrans-60.4-49.5176.4-179.4122.5000111.1M257 W268 N269 F270 L274 M275 I276M257-L272 HydrophobicContact CE-CD1 3.9Å; M257-L272 HydrophobicContact SD-CD1 4.35Å; W268-L272 HydrophobicContact CZ2-CD1 4.49Å; W268-L272 WeakPolarHBondContact O-CB 3.41Å; W268-L272 PolarHBondContact O-N 3.32Å; N269-L272 PolarHBondContact O-N 2.98Å; F270-L272 PolarHBondContact O-N 3.48Å; L272-L274 PolarHBondContact O-N 3.32Å; L272-M275 PolarHBondContact O-N 2.92Å; L272-I276 HydrophobicContact CD2-CD1 3.7Å; L272-I276 HydrophobicContact CG-CD1 3.98Å; L272-I276 VanDerWaalsContact O-CG1 3.29Å; L272-I276 WeakPolarHBondContact O-CG1 3.29Å; L272-I276 PolarHBondContact O-N 3.01Å
273W85.1Confident81.5Confident125 Ų12569.4 Ų69.447%0.47336%0.355SS..Hα-helixtrans-62.7-43.1177.1-77.4114.8000112L165 N269 F270 M275 I276 M277L165-W273 HydrophobicContact CD2-CZ3 4.24Å; N269-W273 WeakPolarHBondContact O-CB 3.36Å; N269-W273 PolarHBondContact O-N 2.79Å; F270-W273 PolarHBondContact O-N 3.3Å; W273-M275 VanDerWaalsContact C-N 3.34Å; W273-M275 PolarHBondContact O-N 3.26Å; W273-I276 PolarHBondContact O-N 2.89Å; W273-M277 HydrophobicContact CE3-CE 3.84Å; W273-M277 HydrophobicContact CZ3-CE 4.09Å; W273-M277 VanDerWaalsContact O-CG 3.26Å; W273-M277 WeakPolarHBondContact O-CG 3.38Å; W273-M277 PolarHBondContact O-N 3.26Å
274L86.1Confident82.7Confident77 Ų7767.9 Ų67.940%0.40334%0.343SS..Hα-helixtrans-58.6-45.2176.5-178.364.5000111.7F270 C271 L272 M277 L278F270-L274 HydrophobicContact CE1-CD2 4.3Å; F270-L274 WeakPolarHBondContact O-CB 3.11Å; F270-L274 PolarHBondContact O-N 3.49Å; C271-L274 PolarHBondContact O-N 3.34Å; L272-L274 PolarHBondContact O-N 3.32Å; L274-M277 PolarHBondContact O-N 3.39Å; L274-L278 HydrophobicContact CD1-CD1 4.18Å; L274-L278 HydrophobicContact CD1-CG 4.31Å; L274-L278 HydrophobicContact CG-CD1 4.02Å; L274-L278 WeakPolarHBondContact O-CB 3.49Å; L274-L278 WeakPolarHBondContact O-CG 3.45Å; L274-L278 PolarHBondContact O-N 2.87Å
275M86.7Confident83.6Confident81 Ų8159 Ų5940%0.39931%0.305SS..Hα-helixtrans-65.8-41.1178.4-70.2-65.8173.600112.2I256 C271 L272 W273 M277 L278 G279I256-M275 HydrophobicContact CD1-CE 3.76Å; I256-M275 HydrophobicContact CD1-SD 4.09Å; I256-M275 HydrophobicContact CG2-CE 4.47Å; C271-M275 WeakPolarHBondContact O-CB 3.31Å; C271-M275 VanDerWaalsContact O-CG 3.23Å; C271-M275 WeakPolarHBondContact O-CG 3.44Å; C271-M275 PolarHBondContact O-N 2.85Å; L272-M275 PolarHBondContact O-N 2.92Å; W273-M275 VanDerWaalsContact C-N 3.34Å; W273-M275 PolarHBondContact O-N 3.26Å; M275-M277 VanDerWaalsContact C-N 3.33Å; M275-M277 PolarHBondContact O-N 2.89Å; M275-L278 PolarHBondContact O-N 2.9Å; M275-G279 PolarHBondContact O-N 3.32Å
276I84.9Confident84.3Confident49 Ų4957 Ų5725%0.25128%0.284SS..Hα-helixtrans-60.7-44.2174.4-69.8167.2000110.3Y164 L272 W273 N280Y164-I276 HydrophobicContact CE1-CG2 3.93Å; L272-I276 HydrophobicContact CD2-CD1 3.7Å; L272-I276 HydrophobicContact CG-CD1 3.98Å; L272-I276 VanDerWaalsContact O-CG1 3.29Å; L272-I276 WeakPolarHBondContact O-CG1 3.29Å; L272-I276 PolarHBondContact O-N 3.01Å; W273-I276 PolarHBondContact O-N 2.89Å; I276-N280 WeakPolarHBondContact CG2-ND2 3.39Å; I276-N280 WeakPolarHBondContact O-CB 3.2Å; I276-N280 PolarHBondContact O-N 2.97Å; I276-N280 PolarHBondContact O-ND2 3.47Å
277M86.3Confident84.5Confident32 Ų3252.8 Ų52.816%0.15825%0.253CS..Hα-helixtrans-68.8-42.9-179.4-62.6-33.6-175.100112.4V157 S161 L165 W273 L274 M275 N280 G281V157-M277 HydrophobicContact CG1-CB 4.1Å; S161-M277 WeakPolarHBondContact CB-SD 3.18Å; L165-M277 HydrophobicContact CD1-CE 4.08Å; L165-M277 HydrophobicContact CD2-CE 4.3Å; L165-M277 HydrophobicContact CG-CE 4.19Å; W273-M277 HydrophobicContact CE3-CE 3.84Å; W273-M277 HydrophobicContact CZ3-CE 4.09Å; W273-M277 VanDerWaalsContact O-CG 3.26Å; W273-M277 WeakPolarHBondContact O-CG 3.38Å; W273-M277 PolarHBondContact O-N 3.26Å; L274-M277 PolarHBondContact O-N 3.39Å; M275-M277 VanDerWaalsContact C-N 3.33Å; M275-M277 PolarHBondContact O-N 2.89Å; M277-N280 PolarHBondContact O-N 3.49Å; M277-G281 PolarHBondContact O-N 3.08Å; M277-G281 VanDerWaalsContact O-N 3.15Å
278L87.2Confident84.4Confident52 Ų5245.9 Ų45.927%0.27222%0.224SC..Hα-helixtrans-63.7-45.4176.2-71.9175000111.7F154 V157 L274 M275 G281 I282F154-L278 HydrophobicContact CD1-CD2 4.29Å; F154-L278 HydrophobicContact CE1-CD2 3.99Å; V157-L278 HydrophobicContact CG2-CD2 3.94Å; L274-L278 HydrophobicContact CD1-CD1 4.18Å; L274-L278 HydrophobicContact CD1-CG 4.31Å; L274-L278 HydrophobicContact CG-CD1 4.02Å; L274-L278 WeakPolarHBondContact O-CB 3.49Å; L274-L278 WeakPolarHBondContact O-CG 3.45Å; L274-L278 PolarHBondContact O-N 2.87Å; M275-L278 PolarHBondContact O-N 2.9Å; L278-G281 PolarHBondContact O-N 3.22Å; L278-I282 WeakPolarHBondContact O-CG1 3.49Å; L278-I282 PolarHBondContact O-N 3.48Å
279G88.6Confident84.3Confident10 Ų1045.8 Ų45.810%0.10322%0.224CC..Hα-helixtrans-57.8-49.117600000111.6E249 M275 G281 I282 L283E249-G279 VanDerWaalsContact OE2-CA 3.31Å; E249-G279 WeakPolarHBondContact OE2-CA 3.48Å; M275-G279 PolarHBondContact O-N 3.32Å; G279-G281 VanDerWaalsContact C-N 3.28Å; G279-G281 PolarHBondContact O-N 3.04Å; G279-I282 PolarHBondContact O-N 3.21Å; G279-I282 VanDerWaalsContact O-N 3.08Å; G279-L283 WeakPolarHBondContact O-CB 3.25Å; G279-L283 VanDerWaalsContact O-CG 3.25Å; G279-L283 WeakPolarHBondContact O-CG 3.43Å; G279-L283 PolarHBondContact O-N 3.49Å
280N84.4Confident84.2Confident26 Ų2643.9 Ų43.914%0.13921%0.212CC..Hα-helixtrans-56-40.1176.1-84-69.1000113.4A160 Y164 I276 M277 Y284A160-N280 HydrophobicContact CB-CB 4.25Å; Y164-N280 WeakPolarHBondContact CD2-OD1 3.44Å; I276-N280 WeakPolarHBondContact CG2-ND2 3.39Å; I276-N280 WeakPolarHBondContact O-CB 3.2Å; I276-N280 PolarHBondContact O-N 2.97Å; I276-N280 PolarHBondContact O-ND2 3.47Å; M277-N280 PolarHBondContact O-N 3.49Å; N280-Y284 VanDerWaalsContact O-CB 3.23Å; N280-Y284 WeakPolarHBondContact O-CB 3.31Å; N280-Y284 PolarHBondContact O-N 2.8Å
281G83.9Confident83.7Confident0 Ų039.4 Ų39.40%019%0.191CC..Hα-helixtrans-64.5-43.6175.600000113.1M277 L278 G279 C285M277-G281 PolarHBondContact O-N 3.08Å; M277-G281 VanDerWaalsContact O-N 3.15Å; L278-G281 PolarHBondContact O-N 3.22Å; G279-G281 VanDerWaalsContact C-N 3.28Å; G279-G281 PolarHBondContact O-N 3.04Å; G281-C285 WeakPolarHBondContact O-CB 3.13Å; G281-C285 PolarHBondContact O-N 3.05Å; G281-C285 VanDerWaalsContact O-N 3.07Å
282I86.1Confident83Confident68 Ų6841.1 Ų41.135%0.34919%0.193SC..Hα-helixtrans-67.1-50.3178.3-65.9167.9000110.5A153 E249 L278 G279 Y284 C285 A286A153-I282 HydrophobicContact CB-CG1 4.46Å; E249-I282 WeakPolarHBondContact OE1-CB 3.23Å; E249-I282 WeakPolarHBondContact OE1-CG2 3.05Å; L278-I282 WeakPolarHBondContact O-CG1 3.49Å; L278-I282 PolarHBondContact O-N 3.48Å; G279-I282 PolarHBondContact O-N 3.21Å; G279-I282 VanDerWaalsContact O-N 3.08Å; I282-Y284 VanDerWaalsContact C-N 3.31Å; I282-Y284 PolarHBondContact O-N 3.24Å; I282-C285 PolarHBondContact O-N 3.28Å; I282-A286 VanDerWaalsContact O-CB 3.24Å; I282-A286 WeakPolarHBondContact O-CB 3.47Å; I282-A286 PolarHBondContact O-N 3.15Å
283L86.7Confident82.4Confident24 Ų2441 Ų4113%0.12620%0.199CC..Hα-helixtrans-52.6-51.8175.9-69.9166.9000110.7I245 L246 E249 G279 C285 A286 Y287I245-L283 HydrophobicContact CB-CD2 4.49Å; I245-L283 HydrophobicContact CG2-CD2 3.84Å; L246-L283 HydrophobicContact CB-CD2 3.79Å; L246-L283 HydrophobicContact CD1-CD1 3.54Å; L246-L283 HydrophobicContact CD1-CD2 3.77Å; L246-L283 HydrophobicContact CD1-CG 4.33Å; L246-L283 HydrophobicContact CG-CD2 4.4Å; E249-L283 VanDerWaalsContact OE2-CD1 3.23Å; E249-L283 WeakPolarHBondContact OE2-CD1 3.35Å; E249-L283 WeakPolarHBondContact OE2-CG 3.14Å; G279-L283 WeakPolarHBondContact O-CB 3.25Å; G279-L283 VanDerWaalsContact O-CG 3.25Å; G279-L283 WeakPolarHBondContact O-CG 3.43Å; G279-L283 PolarHBondContact O-N 3.49Å; L283-C285 PolarHBondContact O-N 3.21Å; L283-A286 PolarHBondContact O-N 2.98Å; L283-Y287 HydrophobicContact CB-CD2 4.32Å; L283-Y287 HydrophobicContact CD2-CD2 4.25Å; L283-Y287 HydrophobicContact CD2-CE2 3.67Å; L283-Y287 WeakPolarHBondContact O-CB 3.4Å; L283-Y287 VanDerWaalsContact O-CD2 3.25Å; L283-Y287 WeakPolarHBondContact O-CD2 3.44Å; L283-Y287 PolarHBondContact O-N 2.89Å
284Y81.2Confident82Confident22 Ų2239.9 Ų39.99%0.08620%0.195CC..Hα-helixtrans-56.7-55.9-179.5179.3-102.2000110.7F136 C156 A160 N280 I282 A286 C288 V315 V319F136-Y284 AromaticContact CD1-CE2 3.87Å; F136-Y284 HydrophobicContact CD1-CE2 3.87Å; F136-Y284 AromaticContact CD1-CZ 3.99Å; F136-Y284 WeakPolarHBondContact CD1-OH 3.24Å; F136-Y284 HydrophobicContact CE1-CD2 4.15Å; F136-Y284 AromaticContact CE1-CE2 3.4Å; F136-Y284 HydrophobicContact CE1-CE2 3.4Å; F136-Y284 VanDerWaalsContact CE1-CE2 3.4Å; F136-Y284 AromaticContact CE1-CZ 3.94Å; C156-Y284 HydrophobicContact CB-CD1 3.83Å; A160-Y284 HydrophobicContact CB-CG 4.38Å; N280-Y284 VanDerWaalsContact O-CB 3.23Å; N280-Y284 WeakPolarHBondContact O-CB 3.31Å; N280-Y284 PolarHBondContact O-N 2.8Å; I282-Y284 VanDerWaalsContact C-N 3.31Å; I282-Y284 PolarHBondContact O-N 3.24Å; Y284-A286 VanDerWaalsContact C-N 3.33Å; Y284-A286 PolarHBondContact O-N 3.37Å; Y284-C288 WeakPolarHBondContact CE2-SG 3Å; Y284-C288 VanDerWaalsContact CZ-SG 3.56Å; Y284-C288 WeakPolarHBondContact O-CB 3.48Å; Y284-C288 PolarHBondContact O-N 3.27Å; Y284-C288 PolarHBondContact O-SG 3.08Å; Y284-V315 HydrophobicContact CD2-CG1 4.01Å; Y284-V315 HydrophobicContact CE2-CG1 3.7Å; Y284-V319 HydrophobicContact CD2-CG2 4.17Å
285C80.6Confident81.3Confident3 Ų337.1 Ų37.12%0.0218%0.184CC..Hα-helixtrans-58.7-43.4-178.6-175.20000112.3F149 S152 A153 G281 I282 L283 C288 R289F149-C285 HydrophobicContact CE2-CB 4.28Å; S152-C285 PolarHBondContact OG-SG 3.42Å; A153-C285 HydrophobicContact CB-CB 4.25Å; G281-C285 WeakPolarHBondContact O-CB 3.13Å; G281-C285 PolarHBondContact O-N 3.05Å; G281-C285 VanDerWaalsContact O-N 3.07Å; I282-C285 PolarHBondContact O-N 3.28Å; L283-C285 PolarHBondContact O-N 3.21Å; C285-C288 WeakPolarHBondContact O-CB 3.39Å; C285-R289 WeakPolarHBondContact O-CB 3.48Å; C285-R289 VanDerWaalsContact O-CG 3.29Å; C285-R289 WeakPolarHBondContact O-CG 3.49Å; C285-R289 PolarHBondContact O-N 3.02Å; C285-R289 PolarHBondContact SG-NE 3.21Å
286A84.9Confident80.3Confident1 Ų135 Ų351%0.00818%0.176CC..Hα-helixtrans-74.4-48.8-173.500000112.8F149 Y243 I245 I282 L283 Y284 C288 R289 E290F149-A286 HydrophobicContact CE2-CB 4.28Å; F149-A286 HydrophobicContact CZ-CB 4.42Å; Y243-A286 HydrophobicContact CE1-CB 3.89Å; I245-A286 HydrophobicContact CD1-CB 3.5Å; I245-A286 VanDerWaalsContact CD1-CB 3.5Å; I282-A286 VanDerWaalsContact O-CB 3.24Å; I282-A286 WeakPolarHBondContact O-CB 3.47Å; I282-A286 PolarHBondContact O-N 3.15Å; L283-A286 PolarHBondContact O-N 2.98Å; Y284-A286 VanDerWaalsContact C-N 3.33Å; Y284-A286 PolarHBondContact O-N 3.37Å; A286-C288 VanDerWaalsContact C-N 3.25Å; A286-C288 PolarHBondContact O-N 3.05Å; A286-R289 PolarHBondContact O-N 3.25Å; A286-E290 WeakPolarHBondContact O-CB 3.29Å; A286-E290 PolarHBondContact O-N 3.29Å
287Y84.4Confident79.4Confident12 Ų1238.4 Ų38.45%0.04720%0.199CC..Hα-helixtrans-62.8-36.2175.5-79.7-73.8000111.8L235 L239 F241 Y243 L246 L283 W291L235-Y287 HydrophobicContact CD1-CE1 4.11Å; L235-Y287 HydrophobicContact CD1-CE2 3.76Å; L235-Y287 VanDerWaalsContact CD1-CZ 3.45Å; L235-Y287 VanDerWaalsContact CD1-OH 3.25Å; L235-Y287 WeakPolarHBondContact CD1-OH 3.4Å; L239-Y287 HydrophobicContact CD1-CD1 3.26Å; L239-Y287 HydrophobicContact CD1-CE1 3.66Å; L239-Y287 HydrophobicContact CD1-CG 4.14Å; F241-Y287 HydrophobicContact CE2-CD1 4.16Å; F241-Y287 HydrophobicContact CE2-CE1 4.49Å; F241-Y287 HydrophobicContact CZ-CD1 4.37Å; Y243-Y287 AromaticContact CD1-CD1 3.69Å; Y243-Y287 HydrophobicContact CD1-CD1 3.69Å; Y243-Y287 AromaticContact CD1-CE1 3.64Å; Y243-Y287 HydrophobicContact CD1-CE1 3.64Å; Y243-Y287 HydrophobicContact CD1-CG 4.23Å; Y243-Y287 HydrophobicContact CG-CE1 4.26Å; Y243-Y287 WeakPolarHBondContact O-CE1 3.46Å; Y243-Y287 PolarHBondContact O-OH 3.07Å; L246-Y287 HydrophobicContact CB-CE2 4.43Å; L246-Y287 PolarHBondContact N-OH 3.36Å; L283-Y287 HydrophobicContact CB-CD2 4.32Å; L283-Y287 HydrophobicContact CD2-CD2 4.25Å; L283-Y287 HydrophobicContact CD2-CE2 3.67Å; L283-Y287 WeakPolarHBondContact O-CB 3.4Å; L283-Y287 VanDerWaalsContact O-CD2 3.25Å; L283-Y287 WeakPolarHBondContact O-CD2 3.44Å; L283-Y287 PolarHBondContact O-N 2.89Å; Y287-W291 WeakPolarHBondContact O-CB 3.46Å; Y287-W291 PolarHBondContact O-N 3.28Å
288C77.6Confident78.2Confident8 Ų845.2 Ų45.25%0.05423%0.228CC..Hα-helixtrans-56.7-56.7173.5-85.70000112.2Y284 C285 A286 E290 W291 Y292 Y311Y284-C288 WeakPolarHBondContact CE2-SG 3Å; Y284-C288 VanDerWaalsContact CZ-SG 3.56Å; Y284-C288 WeakPolarHBondContact O-CB 3.48Å; Y284-C288 PolarHBondContact O-N 3.27Å; Y284-C288 PolarHBondContact O-SG 3.08Å; C285-C288 WeakPolarHBondContact O-CB 3.39Å; A286-C288 VanDerWaalsContact C-N 3.25Å; A286-C288 PolarHBondContact O-N 3.05Å; C288-E290 PolarHBondContact O-N 3.4Å; C288-W291 PolarHBondContact O-N 3.02Å; C288-Y292 WeakPolarHBondContact O-CB 3.36Å; C288-Y292 PolarHBondContact O-N 3.41Å; C288-Y311 WeakPolarHBondContact CA-OH 3.41Å; C288-Y311 WeakPolarHBondContact CB-OH 3.44Å; C288-Y311 PolarHBondContact O-OH 3.15Å; C288-Y311 PolarHBondContact SG-OH 2.84Å
289R77.1Confident76.8Confident61 Ų6144.4 Ų44.423%0.2323%0.227CC..Hα-helixtrans-63.6-42.4-178.2-74175.4-174.8-92.5-3111.9H143 S152 C285 A286 Y292 A293H143-R289 PolarHBondContact O-NH1 3.05Å; S152-R289 PolarHBondContact OG-NH2 2.71Å; C285-R289 WeakPolarHBondContact O-CB 3.48Å; C285-R289 VanDerWaalsContact O-CG 3.29Å; C285-R289 WeakPolarHBondContact O-CG 3.49Å; C285-R289 PolarHBondContact O-N 3.02Å; C285-R289 PolarHBondContact SG-NE 3.21Å; A286-R289 PolarHBondContact O-N 3.25Å; R289-Y292 PolarHBondContact O-N 3.38Å; R289-A293 WeakPolarHBondContact O-CB 3.36Å; R289-A293 PolarHBondContact O-N 2.84Å
290E81.8Confident75.1Confident45 Ų4549.3 Ų49.321%0.2126%0.259CS..Hα-helixtrans-63.3-43.9179.7-174.861.2-16000111.5F241 Y243 A286 C288 A293 R294F241-E290 HydrophobicContact CD2-CG 4.34Å; F241-E290 HydrophobicContact CE2-CB 4.41Å; F241-E290 HydrophobicContact CE2-CG 3.79Å; F241-E290 HydrophobicContact CZ-CB 4.47Å; F241-E290 HydrophobicContact CZ-CG 4.17Å; Y243-E290 HydrophobicContact CD1-CB 4.33Å; Y243-E290 HydrophobicContact CD1-CG 4.33Å; Y243-E290 HydrophobicContact CD2-CG 4.09Å; Y243-E290 HydrophobicContact CE1-CB 4.09Å; Y243-E290 HydrophobicContact CE1-CG 4.41Å; Y243-E290 HydrophobicContact CE2-CG 4.22Å; Y243-E290 HydrophobicContact CG-CG 4.14Å; A286-E290 WeakPolarHBondContact O-CB 3.29Å; A286-E290 PolarHBondContact O-N 3.29Å; C288-E290 PolarHBondContact O-N 3.4Å; E290-A293 PolarHBondContact O-N 2.99Å; E290-R294 VanDerWaalsContact O-CG 3.32Å; E290-R294 WeakPolarHBondContact O-CG 3.46Å; E290-R294 PolarHBondContact O-N 2.85Å; E290-R294 IonicContact OE1-CZ 3.13Å; E290-R294 IonicContact OE1-NE 2.75Å; E290-R294 PolarHBondContact OE1-NE 2.98Å; E290-R294 IonicContact OE1-NH2 2.71Å; E290-R294 PolarHBondContact OE1-NH2 2.94Å
291W74.2Confident73.6Confident43 Ų4355.8 Ų55.816%0.16329%0.286CS..Hα-helixtrans-62.7-44.6175.3-171.1103.1000111.3F241 Y287 C288 R294 A295 L303 Y311F241-W291 HydrophobicContact CE1-CB 4.14Å; F241-W291 AromaticContact CE1-CD1 3.82Å; F241-W291 HydrophobicContact CE1-CG 4.34Å; F241-W291 HydrophobicContact CZ-CB 4.26Å; Y287-W291 WeakPolarHBondContact O-CB 3.46Å; Y287-W291 PolarHBondContact O-N 3.28Å; C288-W291 PolarHBondContact O-N 3.02Å; W291-R294 PolarHBondContact O-N 3.41Å; W291-A295 HydrophobicContact CE3-CB 3.92Å; W291-A295 HydrophobicContact CH2-CB 4.08Å; W291-A295 HydrophobicContact CZ3-CB 3.66Å; W291-A295 WeakPolarHBondContact O-CB 3.47Å; W291-A295 PolarHBondContact O-N 3.38Å; W291-L303 HydrophobicContact CZ3-CD1 4.33Å; W291-Y311 HydrophobicContact CB-CE2 4.25Å; W291-Y311 AromaticContact CD2-CD2 3.75Å; W291-Y311 HydrophobicContact CD2-CD2 3.75Å; W291-Y311 HydrophobicContact CD2-CE2 4.01Å; W291-Y311 AromaticContact CE3-CD2 3.09Å; W291-Y311 HydrophobicContact CE3-CD2 3.09Å; W291-Y311 AromaticContact CE3-CE2 3.5Å; W291-Y311 HydrophobicContact CE3-CE2 3.5Å; W291-Y311 VanDerWaalsContact CE3-CE2 3.5Å; W291-Y311 HydrophobicContact CE3-CG 4.07Å; W291-Y311 HydrophobicContact CG-CD2 4.49Å; W291-Y311 HydrophobicContact CG-CE2 4.34Å; W291-Y311 HydrophobicContact CH2-CD2 4.12Å; W291-Y311 AromaticContact CZ3-CD2 3.31Å; W291-Y311 HydrophobicContact CZ3-CD2 3.31Å; W291-Y311 HydrophobicContact CZ3-CE2 4.16Å; W291-Y311 AromaticContact CZ3-CG 3.87Å; W291-Y311 HydrophobicContact CZ3-CG 3.87Å
292Y70.1Confident72.2Confident73 Ų7360.5 Ų60.529%0.28632%0.317SS..Hα-helixtrans-62.5-45.4178.6-176.4-91.6000111.9C288 R289 R294 A295 C296 L303C288-Y292 WeakPolarHBondContact O-CB 3.36Å; C288-Y292 PolarHBondContact O-N 3.41Å; R289-Y292 PolarHBondContact O-N 3.38Å; Y292-R294 VanDerWaalsContact C-N 3.3Å; Y292-R294 PolarHBondContact O-N 3.41Å; Y292-A295 PolarHBondContact O-N 2.92Å; Y292-C296 WeakPolarHBondContact CE1-SG 3.49Å; Y292-C296 WeakPolarHBondContact O-CB 3.45Å; Y292-C296 PolarHBondContact O-N 3.3Å; Y292-L303 HydrophobicContact CD2-CD1 4.25Å; Y292-L303 HydrophobicContact CE2-CD1 4.14Å
293A73.3Confident70.6Confident49 Ų4958.3 Ų58.341%0.40531%0.306SS..Hα-helixtrans-57.9-44.6176.700000111.1R289 E290 V297R289-A293 WeakPolarHBondContact O-CB 3.36Å; R289-A293 PolarHBondContact O-N 2.84Å; E290-A293 PolarHBondContact O-N 2.99Å; A293-V297 VanDerWaalsContact O-CG2 3.28Å; A293-V297 WeakPolarHBondContact O-CG2 3.23Å; A293-V297 PolarHBondContact O-N 2.95Å; A293-V297 VanDerWaalsContact O-N 3.09Å
294R76Confident69.1Low101 Ų10162.7 Ų62.738%0.38133%0.33SS..Hα-helixtrans-65.5-44.8176.6-70.3173-176.8-86.8-7.7112.1E290 W291 Y292 C296 V297 F298E290-R294 VanDerWaalsContact O-CG 3.32Å; E290-R294 WeakPolarHBondContact O-CG 3.46Å; E290-R294 PolarHBondContact O-N 2.85Å; E290-R294 IonicContact OE1-CZ 3.13Å; E290-R294 IonicContact OE1-NE 2.75Å; E290-R294 PolarHBondContact OE1-NE 2.98Å; E290-R294 IonicContact OE1-NH2 2.71Å; E290-R294 PolarHBondContact OE1-NH2 2.94Å; W291-R294 PolarHBondContact O-N 3.41Å; Y292-R294 VanDerWaalsContact C-N 3.3Å; Y292-R294 PolarHBondContact O-N 3.41Å; R294-C296 VanDerWaalsContact C-N 3.34Å; R294-C296 PolarHBondContact O-N 3.35Å; R294-V297 PolarHBondContact O-N 3.42Å; R294-F298 WeakPolarHBondContact O-CD2 3.33Å; R294-F298 PolarHBondContact O-N 3.38Å; R294-F298 VanDerWaalsContact O-N 3.16Å
295A70.7Confident67.8Low20 Ų2067.9 Ų67.917%0.16536%0.355CS..Hα-helixtrans-60.3-44.417900000111.6W291 Y292 V297 F298 S299 L303W291-A295 HydrophobicContact CE3-CB 3.92Å; W291-A295 HydrophobicContact CH2-CB 4.08Å; W291-A295 HydrophobicContact CZ3-CB 3.66Å; W291-A295 WeakPolarHBondContact O-CB 3.47Å; W291-A295 PolarHBondContact O-N 3.38Å; Y292-A295 PolarHBondContact O-N 2.92Å; A295-V297 VanDerWaalsContact C-N 3.32Å; A295-V297 PolarHBondContact O-N 3.49Å; A295-F298 PolarHBondContact O-N 3.35Å; A295-S299 PolarHBondContact O-N 2.93Å; A295-S299 PolarHBondContact O-OG 3.39Å; A295-L303 HydrophobicContact CB-CD1 3.88Å
296C65.8Low66.4Low37 Ų3771.9 Ų71.925%0.2538%0.381CS..Hα-helixtrans-68.4-24.2176.1-73.10000114.5Y292 R294 S299Y292-C296 WeakPolarHBondContact CE1-SG 3.49Å; Y292-C296 WeakPolarHBondContact O-CB 3.45Å; Y292-C296 PolarHBondContact O-N 3.3Å; R294-C296 VanDerWaalsContact C-N 3.34Å; R294-C296 PolarHBondContact O-N 3.35Å; C296-S299 CarbonylContact C-O 3.57Å
297V66.4Low64.9Low119 Ų11976.1 Ų76.172%0.72140%0.403SS*.Hα-helixtrans-73.4-35.7172.4169.70000110.7A293 R294 A295A293-V297 VanDerWaalsContact O-CG2 3.28Å; A293-V297 WeakPolarHBondContact O-CG2 3.23Å; A293-V297 PolarHBondContact O-N 2.95Å; A293-V297 VanDerWaalsContact O-N 3.09Å; R294-V297 PolarHBondContact O-N 3.42Å; A295-V297 VanDerWaalsContact C-N 3.32Å; A295-V297 PolarHBondContact O-N 3.49Å
298F60.9Low63.4Low175 Ų17579.3 Ų79.377%0.76842%0.415SS*.Hα-helixtrans-82.1-30178.2-68.7-65.6000113.7R294 A295R294-F298 WeakPolarHBondContact O-CD2 3.33Å; R294-F298 PolarHBondContact O-N 3.38Å; R294-F298 VanDerWaalsContact O-N 3.16Å; A295-F298 PolarHBondContact O-N 3.35Å
299S57.4Low62.3Low36 Ų3682.8 Ų82.825%0.25243%0.433SS..SBendtrans-96.5110.1170.363.90000109A295 C296 F301A295-S299 PolarHBondContact O-N 2.93Å; A295-S299 PolarHBondContact O-OG 3.39Å; C296-S299 CarbonylContact C-O 3.57Å; S299-F301 PolarHBondContact O-N 2.89Å; S299-F301 VanDerWaalsContact O-O 3.13Å; S299-F301 PolarHBondContact OG-O 3.41Å; S299-F301 VanDerWaalsContact OG-O 3.14Å
300S54Low61.3Low112 Ų11282.5 Ų82.578%0.78344%0.44SS*.SBendtrans-58.75.2179.1-29.60000115.5
301F53.4Low60.1Low162 Ų16281.3 Ų81.371%0.71143%0.434SS*.SBendtrans-131.7147.7-179.7-69-84.8000110.6S299 L303S299-F301 PolarHBondContact O-N 2.89Å; S299-F301 VanDerWaalsContact O-O 3.13Å; S299-F301 PolarHBondContact OG-O 3.41Å; S299-F301 VanDerWaalsContact OG-O 3.14Å; F301-L303 PolarHBondContact O-N 2.93Å
302P53.9Low59.2Low100 Ų10079.6 Ų79.665%0.64943%0.428SS*.PPolyproline II helixtrans-51.5131.7166.9-19.529.6000109.7D304P302-D304 PolarHBondContact O-N 3.42Å
303L51.5Low58.6Low22 Ų2277.3 Ų77.312%0.11542%0.42CS..PPolyproline II helixtrans-61.2121.4177.9-64.9171.7000109.6W291 Y292 A295 F301 L307W291-L303 HydrophobicContact CZ3-CD1 4.33Å; Y292-L303 HydrophobicContact CD2-CD1 4.25Å; Y292-L303 HydrophobicContact CE2-CD1 4.14Å; A295-L303 HydrophobicContact CB-CD1 3.88Å; F301-L303 PolarHBondContact O-N 2.93Å; L303-L307 HydrophobicContact CB-CB 3.96Å; L303-L307 HydrophobicContact CD2-CB 4.11Å; L303-L307 HydrophobicContact CD2-CD1 3.77Å; L303-L307 HydrophobicContact CD2-CG 4.47Å; L303-L307 HydrophobicContact CG-CB 4.5Å
304D55Low58Low116 Ų11680 Ų8062%0.6242%0.42SS*.PPolyproline II helixtrans-55153.2172.1-63.1-41.2000111.2P302 P306 L307 R308P302-D304 PolarHBondContact O-N 3.42Å; D304-P306 VanDerWaalsContact C-CD 3.41Å; D304-P306 VanDerWaalsContact C-N 3.32Å; D304-P306 HydrophobicContact CB-CG 4.13Å; D304-P306 VanDerWaalsContact O-N 3.11Å; D304-L307 WeakPolarHBondContact O-CB 3.32Å; D304-L307 PolarHBondContact O-N 2.92Å; D304-R308 PolarHBondContact O-N 2.82Å
305E54.4Low57.1Low130 Ų13075.5 Ų75.561%0.60740%0.404SS*.Hα-helixtrans-42.5-43.8177.6-81.6-141.5161.600116L307 R308 N309E305-L307 VanDerWaalsContact C-N 3.31Å; E305-L307 PolarHBondContact O-N 2.75Å; E305-R308 WeakPolarHBondContact O-CB 3.27Å; E305-R308 PolarHBondContact O-N 3.46Å; E305-R308 VanDerWaalsContact O-N 3.15Å; E305-N309 PolarHBondContact O-N 3.23Å
306P51.6Low56.4Low87 Ų8774.8 Ų74.857%0.56540%0.397SS*.Hα-helixtrans-62.5-32.6177.219.2-31.9000114.2D304 S310D304-P306 VanDerWaalsContact C-CD 3.41Å; D304-P306 VanDerWaalsContact C-N 3.32Å; D304-P306 HydrophobicContact CB-CG 4.13Å; D304-P306 VanDerWaalsContact O-N 3.11Å; P306-S310 WeakPolarHBondContact O-CB 3.44Å; P306-S310 PolarHBondContact O-N 3.21Å; P306-S310 PolarHBondContact O-OG 3.16Å
307L54.3Low55.9Low90 Ų9073.9 Ų73.947%0.47139%0.39SS..Hα-helixtrans-73-36174.1-72.9166.1000110.8L303 D304 E305 S310 Y311L303-L307 HydrophobicContact CB-CB 3.96Å; L303-L307 HydrophobicContact CD2-CB 4.11Å; L303-L307 HydrophobicContact CD2-CD1 3.77Å; L303-L307 HydrophobicContact CD2-CG 4.47Å; L303-L307 HydrophobicContact CG-CB 4.5Å; D304-L307 WeakPolarHBondContact O-CB 3.32Å; D304-L307 PolarHBondContact O-N 2.92Å; E305-L307 VanDerWaalsContact C-N 3.31Å; E305-L307 PolarHBondContact O-N 2.75Å; L307-S310 WeakPolarHBondContact O-CB 3.26Å; L307-S310 PolarHBondContact O-N 3.4Å; L307-Y311 WeakPolarHBondContact O-CB 3.16Å; L307-Y311 PolarHBondContact O-N 3.29Å
308R51.6Low55.4Low79 Ų7968.6 Ų68.630%0.29836%0.357SS..Hα-helixtrans-63-43.6172.3-173.1-173.8-64.6-115.3-4.7112.3S140 D304 E305 Y311 N312S140-R308 PolarHBondContact O-NH1 3.47Å; D304-R308 PolarHBondContact O-N 2.82Å; E305-R308 WeakPolarHBondContact O-CB 3.27Å; E305-R308 PolarHBondContact O-N 3.46Å; E305-R308 VanDerWaalsContact O-N 3.15Å; R308-Y311 VanDerWaalsContact O-CB 3.28Å; R308-Y311 WeakPolarHBondContact O-CB 3.44Å; R308-Y311 WeakPolarHBondContact O-CD1 3.32Å; R308-Y311 PolarHBondContact O-N 2.74Å; R308-Y311 VanDerWaalsContact O-N 3.17Å; R308-N312 PolarHBondContact O-N 3.43Å; R308-N312 PolarHBondContact O-ND2 3.04Å
309N55.1Low55.1Low82 Ų8261.3 Ų61.344%0.43933%0.327SS..Hα-helixtrans-66.3-39175.8-73.8-26.2000112.1E305 Y311 N312 L313E305-N309 PolarHBondContact O-N 3.23Å; N309-Y311 PolarHBondContact O-N 3.23Å; N309-N312 PolarHBondContact O-N 3.29Å; N309-L313 WeakPolarHBondContact O-CB 3.48Å; N309-L313 PolarHBondContact O-N 3.05Å; N309-L313 VanDerWaalsContact O-N 3.13Å
310S56.4Low54.9Low55 Ų5560.3 Ų60.339%0.38532%0.319SS..Hα-helixtrans-61.7-34.1172.1-60.70000112P306 L307 R314P306-S310 WeakPolarHBondContact O-CB 3.44Å; P306-S310 PolarHBondContact O-N 3.21Å; P306-S310 PolarHBondContact O-OG 3.16Å; L307-S310 WeakPolarHBondContact O-CB 3.26Å; L307-S310 PolarHBondContact O-N 3.4Å; S310-R314 VanDerWaalsContact O-CG 3.24Å; S310-R314 WeakPolarHBondContact O-CG 3.27Å; S310-R314 PolarHBondContact O-N 3.5Å
311Y56.6Low54.7Low19 Ų1958.9 Ų58.98%0.07530%0.297CS..Hα-helixtrans-68.7-49175.5151.9-94.7000113C288 W291 L307 R308 N309 L313 R314 V315C288-Y311 WeakPolarHBondContact CA-OH 3.41Å; C288-Y311 WeakPolarHBondContact CB-OH 3.44Å; C288-Y311 PolarHBondContact O-OH 3.15Å; C288-Y311 PolarHBondContact SG-OH 2.84Å; W291-Y311 HydrophobicContact CB-CE2 4.25Å; W291-Y311 AromaticContact CD2-CD2 3.75Å; W291-Y311 HydrophobicContact CD2-CD2 3.75Å; W291-Y311 HydrophobicContact CD2-CE2 4.01Å; W291-Y311 AromaticContact CE3-CD2 3.09Å; W291-Y311 HydrophobicContact CE3-CD2 3.09Å; W291-Y311 AromaticContact CE3-CE2 3.5Å; W291-Y311 HydrophobicContact CE3-CE2 3.5Å; W291-Y311 VanDerWaalsContact CE3-CE2 3.5Å; W291-Y311 HydrophobicContact CE3-CG 4.07Å; W291-Y311 HydrophobicContact CG-CD2 4.49Å; W291-Y311 HydrophobicContact CG-CE2 4.34Å; W291-Y311 HydrophobicContact CH2-CD2 4.12Å; W291-Y311 AromaticContact CZ3-CD2 3.31Å; W291-Y311 HydrophobicContact CZ3-CD2 3.31Å; W291-Y311 HydrophobicContact CZ3-CE2 4.16Å; W291-Y311 AromaticContact CZ3-CG 3.87Å; W291-Y311 HydrophobicContact CZ3-CG 3.87Å; L307-Y311 WeakPolarHBondContact O-CB 3.16Å; L307-Y311 PolarHBondContact O-N 3.29Å; R308-Y311 VanDerWaalsContact O-CB 3.28Å; R308-Y311 WeakPolarHBondContact O-CB 3.44Å; R308-Y311 WeakPolarHBondContact O-CD1 3.32Å; R308-Y311 PolarHBondContact O-N 2.74Å; R308-Y311 VanDerWaalsContact O-N 3.17Å; N309-Y311 PolarHBondContact O-N 3.23Å; Y311-L313 PolarHBondContact O-N 3.29Å; Y311-R314 WeakPolarHBondContact O-CA 3.25Å; Y311-R314 WeakPolarHBondContact O-CB 3.37Å; Y311-R314 PolarHBondContact O-N 3.32Å; Y311-V315 HydrophobicContact CD2-CG2 3.95Å; Y311-V315 HydrophobicContact CE2-CG2 3.51Å; Y311-V315 PolarHBondContact O-N 3.42Å
312N56Low54.1Low7 Ų754 Ų544%0.03728%0.282CS..Hα-helixtrans-58-38176.6-69.2-34.3000110.5S140 R308 N309 R314 F316S140-N312 WeakPolarHBondContact CB-ND2 3.33Å; S140-N312 PolarHBondContact OG-ND2 2.93Å; R308-N312 PolarHBondContact O-N 3.43Å; R308-N312 PolarHBondContact O-ND2 3.04Å; N309-N312 PolarHBondContact O-N 3.29Å; N312-R314 VanDerWaalsContact C-N 3.35Å; N312-F316 WeakPolarHBondContact O-CB 3.41Å; N312-F316 PolarHBondContact O-N 3.04Å
313L56.8Low54.2Low25 Ų2551.7 Ų51.713%0.13126%0.264CS..Hα-helixtrans-65.6-34.9174.1-164.876.5000112.7H133 N309 Y311 F316 N317H133-L313 VanDerWaalsContact CE1-CD1 3.49Å; H133-L313 WeakPolarHBondContact CE1-CD1 3.38Å; H133-L313 WeakPolarHBondContact ND1-CD1 3.35Å; N309-L313 WeakPolarHBondContact O-CB 3.48Å; N309-L313 PolarHBondContact O-N 3.05Å; N309-L313 VanDerWaalsContact O-N 3.13Å; Y311-L313 PolarHBondContact O-N 3.29Å; L313-F316 HydrophobicContact CD1-CD1 4.05Å; L313-F316 WeakPolarHBondContact O-CB 3.31Å; L313-N317 PolarHBondContact O-N 3.31Å; L313-N317 VanDerWaalsContact O-N 3.07Å; L313-N317 PolarHBondContact O-ND2 3.43Å; L313-N317 VanDerWaalsContact O-ND2 3.07Å
314R59.7Low54.3Low107 Ų10753.3 Ų53.340%0.40427%0.272SS..Hα-helixtrans-73.6-41.9178.3-77.8174.6-174.3-150.33112.8I62 S310 Y311 N312 N317 L318I62-R314 HydrophobicContact CD1-CB 3.74Å; I62-R314 HydrophobicContact CD1-CG 4.49Å; I62-R314 HydrophobicContact CG1-CB 4.21Å; S310-R314 VanDerWaalsContact O-CG 3.24Å; S310-R314 WeakPolarHBondContact O-CG 3.27Å; S310-R314 PolarHBondContact O-N 3.5Å; Y311-R314 WeakPolarHBondContact O-CA 3.25Å; Y311-R314 WeakPolarHBondContact O-CB 3.37Å; Y311-R314 PolarHBondContact O-N 3.32Å; N312-R314 VanDerWaalsContact C-N 3.35Å; R314-N317 PolarHBondContact O-N 2.88Å; R314-L318 PolarHBondContact O-N 3.07Å
315V57.5Low54.3Low6 Ų649.8 Ų49.84%0.03625%0.252CS..Hα-helixtrans-70.9-38.3173.7-178.60000110.8Y284 Y311 N317 L318 V319Y284-V315 HydrophobicContact CD2-CG1 4.01Å; Y284-V315 HydrophobicContact CE2-CG1 3.7Å; Y311-V315 HydrophobicContact CD2-CG2 3.95Å; Y311-V315 HydrophobicContact CE2-CG2 3.51Å; Y311-V315 PolarHBondContact O-N 3.42Å; V315-N317 VanDerWaalsContact C-N 3.29Å; V315-N317 PolarHBondContact O-N 2.93Å; V315-L318 WeakPolarHBondContact O-CA 3.39Å; V315-L318 VanDerWaalsContact O-CB 3.26Å; V315-L318 WeakPolarHBondContact O-CB 3.11Å; V315-L318 PolarHBondContact O-N 2.88Å; V315-V319 HydrophobicContact CG1-CG2 4.45Å; V315-V319 PolarHBondContact O-N 2.99Å
316F55.7Low54.2Low5 Ų545.1 Ų45.12%0.02223%0.231CC..Hα-helixtrans-51.3-49.9169.9165.9-134.5000111.7V129 S132 H133 F136 N312 L313 L318 V319 L320V129-F316 HydrophobicContact CG1-CZ 4.39Å; V129-F316 WeakPolarHBondContact O-CZ 2.97Å; S132-F316 WeakPolarHBondContact OG-CE2 3.34Å; S132-F316 WeakPolarHBondContact OG-CZ 3.48Å; H133-F316 HydrophobicContact CB-CD1 4.44Å; H133-F316 HydrophobicContact CB-CE1 3.84Å; H133-F316 HydrophobicContact CB-CZ 4.14Å; F136-F316 HydrophobicContact CB-CB 4.45Å; F136-F316 HydrophobicContact CD1-CB 4.14Å; F136-F316 HydrophobicContact CD2-CB 3.53Å; F136-F316 HydrophobicContact CD2-CD1 4.48Å; F136-F316 AromaticContact CD2-CD2 3.14Å; F136-F316 HydrophobicContact CD2-CD2 3.14Å; F136-F316 AromaticContact CD2-CE2 3.88Å; F136-F316 HydrophobicContact CD2-CE2 3.88Å; F136-F316 AromaticContact CD2-CG 3.45Å; F136-F316 HydrophobicContact CD2-CG 3.45Å; F136-F316 VanDerWaalsContact CD2-CG 3.45Å; F136-F316 HydrophobicContact CE1-CB 4.31Å; F136-F316 HydrophobicContact CE2-CB 3.82Å; F136-F316 AromaticContact CE2-CD2 2.95Å; F136-F316 HydrophobicContact CE2-CD2 2.95Å; F136-F316 AromaticContact CE2-CE2 3.68Å; F136-F316 HydrophobicContact CE2-CE2 3.68Å; F136-F316 AromaticContact CE2-CG 3.7Å; F136-F316 HydrophobicContact CE2-CG 3.7Å; F136-F316 HydrophobicContact CG-CB 3.77Å; F136-F316 HydrophobicContact CG-CD2 4.21Å; F136-F316 HydrophobicContact CG-CG 4.17Å; F136-F316 HydrophobicContact CZ-CB 4.18Å; F136-F316 AromaticContact CZ-CD2 3.83Å; F136-F316 HydrophobicContact CZ-CD2 3.83Å; F136-F316 HydrophobicContact CZ-CG 4.47Å; N312-F316 WeakPolarHBondContact O-CB 3.41Å; N312-F316 PolarHBondContact O-N 3.04Å; L313-F316 HydrophobicContact CD1-CD1 4.05Å; L313-F316 WeakPolarHBondContact O-CB 3.31Å; F316-L318 PolarHBondContact O-N 3.3Å; F316-V319 PolarHBondContact O-N 3.47Å; F316-L320 HydrophobicContact CD2-CD1 4Å; F316-L320 HydrophobicContact CD2-CG 3.91Å; F316-L320 HydrophobicContact CE1-CD1 3.98Å; F316-L320 HydrophobicContact CE2-CD1 3.32Å; F316-L320 HydrophobicContact CE2-CD2 3.9Å; F316-L320 HydrophobicContact CE2-CG 3.4Å; F316-L320 VanDerWaalsContact CE2-CG 3.4Å; F316-L320 HydrophobicContact CZ-CD1 3.34Å; F316-L320 HydrophobicContact CZ-CD2 4.45Å; F316-L320 HydrophobicContact CZ-CG 3.99Å; F316-L320 PolarHBondContact O-N 3.14Å
317N55.8Low54.4Low18 Ų1842.4 Ų42.410%0.09621%0.21CC..Hα-helixtrans-57.3-36.6176.2-72.2-33.9000111.5L313 R314 V315 Y321L313-N317 PolarHBondContact O-N 3.31Å; L313-N317 VanDerWaalsContact O-N 3.07Å; L313-N317 PolarHBondContact O-ND2 3.43Å; L313-N317 VanDerWaalsContact O-ND2 3.07Å; R314-N317 PolarHBondContact O-N 2.88Å; V315-N317 VanDerWaalsContact C-N 3.29Å; V315-N317 PolarHBondContact O-N 2.93Å; N317-Y321 HydrophobicContact CB-CE2 4.49Å; N317-Y321 WeakPolarHBondContact O-CD2 3.37Å; N317-Y321 VanDerWaalsContact O-CE2 3.29Å; N317-Y321 WeakPolarHBondContact O-CE2 3.32Å
318L56.7Low54.4Low8 Ų839.3 Ų39.34%0.04219%0.193CC..Hα-helixtrans-67.2-46.1177.4-171.176.6000113.1I62 L235 L239 R314 V315 F316 L320 Y321 C322I62-L318 HydrophobicContact CG2-CB 3.99Å; I62-L318 HydrophobicContact CG2-CD1 3.7Å; I62-L318 HydrophobicContact CG2-CG 4.38Å; L235-L318 HydrophobicContact CD2-CD1 3.71Å; L235-L318 HydrophobicContact CD2-CD2 3.8Å; L235-L318 HydrophobicContact CD2-CG 3.92Å; L239-L318 HydrophobicContact CD1-CD2 4.13Å; L239-L318 HydrophobicContact CD2-CD2 3.86Å; L239-L318 HydrophobicContact CG-CD2 4.16Å; R314-L318 PolarHBondContact O-N 3.07Å; V315-L318 WeakPolarHBondContact O-CA 3.39Å; V315-L318 VanDerWaalsContact O-CB 3.26Å; V315-L318 WeakPolarHBondContact O-CB 3.11Å; V315-L318 PolarHBondContact O-N 2.88Å; F316-L318 PolarHBondContact O-N 3.3Å; L318-L320 PolarHBondContact O-N 3.47Å; L318-Y321 PolarHBondContact O-N 2.8Å; L318-C322 PolarHBondContact O-N 3.05Å; L318-C322 VanDerWaalsContact O-N 3.1Å; L318-C322 PolarHBondContact O-SG 3.12Å; L318-C322 VanDerWaalsContact O-SG 3.4Å
319V53.7Low54.6Low22 Ų2236.4 Ų36.413%0.13319%0.186CC..Hα-helixtrans-64-31.3178.6177.10000111F136 C163 T167 Y284 V315 F316 Y321F136-V319 HydrophobicContact CE1-CG2 4.45Å; F136-V319 HydrophobicContact CZ-CB 4.03Å; F136-V319 HydrophobicContact CZ-CG1 4.23Å; F136-V319 HydrophobicContact CZ-CG2 4.21Å; C163-V319 HydrophobicContact CB-CG1 3.76Å; T167-V319 WeakPolarHBondContact CG2-O 3.12Å; T167-V319 PolarHBondContact OG1-O 3.39Å; Y284-V319 HydrophobicContact CD2-CG2 4.17Å; V315-V319 HydrophobicContact CG1-CG2 4.45Å; V315-V319 PolarHBondContact O-N 2.99Å; F316-V319 PolarHBondContact O-N 3.47Å; V319-Y321 PolarHBondContact O-N 2.72Å
320L52.7Low54.6Low15 Ų1532.9 Ų32.98%0.07917%0.166CC..THydrogen-bonded Turntrans-65.1-11.4170.3-79179.6000114.8T167 F316 L318T167-L320 WeakPolarHBondContact CG2-O 3.29Å; T167-L320 WeakPolarHBondContact OG1-CA 3.41Å; F316-L320 HydrophobicContact CD2-CD1 4Å; F316-L320 HydrophobicContact CD2-CG 3.91Å; F316-L320 HydrophobicContact CE1-CD1 3.98Å; F316-L320 HydrophobicContact CE2-CD1 3.32Å; F316-L320 HydrophobicContact CE2-CD2 3.9Å; F316-L320 HydrophobicContact CE2-CG 3.4Å; F316-L320 VanDerWaalsContact CE2-CG 3.4Å; F316-L320 HydrophobicContact CZ-CD1 3.34Å; F316-L320 HydrophobicContact CZ-CD2 4.45Å; F316-L320 HydrophobicContact CZ-CG 3.99Å; F316-L320 PolarHBondContact O-N 3.14Å; L318-L320 PolarHBondContact O-N 3.47Å
321Y51.5Low54.4Low82 Ų8231.1 Ų31.132%0.32215%0.148SC..THydrogen-bonded Turntrans-125.1-7.1-174.7-63.4-58.2000114.7A66 N317 L318 V319A66-Y321 HydrophobicContact CB-CD2 4.25Å; N317-Y321 HydrophobicContact CB-CE2 4.49Å; N317-Y321 WeakPolarHBondContact O-CD2 3.37Å; N317-Y321 VanDerWaalsContact O-CE2 3.29Å; N317-Y321 WeakPolarHBondContact O-CE2 3.32Å; L318-Y321 PolarHBondContact O-N 2.8Å; V319-Y321 PolarHBondContact O-N 2.72Å
322C40.6Very low54.2Low59 Ų5932.2 Ų32.240%0.39916%0.155SC..  trans-95.60171.1-59.20000110.1L235 L318L235-C322 WeakPolarHBondContact CD2-SG 3.44Å; L318-C322 PolarHBondContact O-N 3.05Å; L318-C322 VanDerWaalsContact O-N 3.1Å; L318-C322 PolarHBondContact O-SG 3.12Å; L318-C322 VanDerWaalsContact O-SG 3.4Å

Retrieved 322 of 322 residues in 360.6 ms (Link to these results)

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