A0A077ZID6_TRITR Loading...

TraX domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZID6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 205 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
1M90.9Very high94.2Very high41 Ų4150.5 Ų50.520%0.20225%0.253CS..  0-70.70-168.5-137.7-80.300110.7L3 D4 H5 A24 F28 F189 Y193 H196M1-L3 PolarHBondContact O-N 3.35Å; M1-D4 WeakPolarHBondContact O-CB 3.49Å; M1-D4 PolarHBondContact O-N 2.94Å; M1-H5 VanDerWaalsContact CG-CE1 3.49Å; M1-H5 WeakPolarHBondContact CG-CE1 3.48Å; M1-H5 PolarHBondContact O-N 2.83Å; M1-A24 HydrophobicContact CB-CB 4.11Å; M1-F28 HydrophobicContact CB-CE2 4.34Å; M1-F28 HydrophobicContact CE-CD2 4.44Å; M1-F28 HydrophobicContact CE-CE2 3.57Å; M1-F28 HydrophobicContact CE-CZ 3.75Å; M1-F189 HydrophobicContact CE-CD2 4.34Å; M1-F189 HydrophobicContact CE-CE2 3.49Å; M1-F189 VanDerWaalsContact CE-CE2 3.49Å; M1-F189 HydrophobicContact CE-CZ 4.22Å; M1-Y193 HydrophobicContact CE-CD2 3.91Å; M1-Y193 HydrophobicContact SD-CD2 4.05Å; M1-H196 PolarHBondContact SD-CE1 3.24Å
2V94.4Very high94.2Very high50 Ų5052.8 Ų52.830%0.30327%0.265SS..Hα-helixtrans-57-46.4-175.8-178.30000113.2D4 H5 I6 F192V2-D4 VanDerWaalsContact C-N 3.26Å; V2-D4 PolarHBondContact O-N 3.23Å; V2-H5 PolarHBondContact O-N 2.96Å; V2-I6 HydrophobicContact CG1-CD1 3.8Å; V2-I6 HydrophobicContact CG1-CG1 4.23Å; V2-I6 VanDerWaalsContact O-CG1 3.32Å; V2-I6 WeakPolarHBondContact O-CG1 3.47Å; V2-I6 PolarHBondContact O-N 3.15Å; V2-F192 HydrophobicContact CG2-CE1 3.66Å; V2-F192 HydrophobicContact CG2-CZ 3.61Å
3L94Very high94Very high84 Ų8462.5 Ų62.544%0.4431%0.305SS..Hα-helixtrans-58-38.8176.6-70.3174000112.9M1 I6 N7 W16 M17M1-L3 PolarHBondContact O-N 3.35Å; L3-I6 PolarHBondContact O-N 3.49Å; L3-N7 WeakPolarHBondContact O-CB 3.42Å; L3-N7 PolarHBondContact O-N 3.26Å; L3-W16 HydrophobicContact CD1-CZ3 4.22Å; L3-M17 HydrophobicContact CB-CE 4.32Å; L3-M17 HydrophobicContact CD2-CE 4.14Å; L3-M17 WeakPolarHBondContact O-CE 3.12Å
4D92.9Very high94.1Very high8 Ų864.4 Ų64.44%0.04331%0.313CS..Hα-helixtrans-69-42.6178.517868.8000111.4M1 V2 N7 L8 F18 R22M1-D4 WeakPolarHBondContact O-CB 3.49Å; M1-D4 PolarHBondContact O-N 2.94Å; V2-D4 VanDerWaalsContact C-N 3.26Å; V2-D4 PolarHBondContact O-N 3.23Å; D4-N7 WeakPolarHBondContact O-CB 3.32Å; D4-N7 PolarHBondContact O-N 2.92Å; D4-L8 WeakPolarHBondContact O-CG 3.28Å; D4-L8 PolarHBondContact O-N 3.44Å; D4-F18 WeakPolarHBondContact OD1-CD2 3.44Å; D4-R22 IonicContact OD1-CZ 3.69Å; D4-R22 IonicContact OD1-NE 2.86Å; D4-R22 IonicContact OD1-NH2 2.62Å; D4-R22 PolarHBondContact OD1-NH2 2.8Å; D4-R22 IonicContact OD2-CZ 2.77Å; D4-R22 IonicContact OD2-NH2 3.89Å; D4-R22 PolarHBondContact OD2-NH2 3.47Å
5H95.4Very high94.1Very high22 Ų2268.7 Ų68.710%0.10233%0.332CS..Hα-helixtrans-66-39.9173.8-64.1171.1000112.5M1 V2 N7 L8 I9 Y193 H196 L200M1-H5 VanDerWaalsContact CG-CE1 3.49Å; M1-H5 WeakPolarHBondContact CG-CE1 3.48Å; M1-H5 PolarHBondContact O-N 2.83Å; V2-H5 PolarHBondContact O-N 2.96Å; H5-N7 VanDerWaalsContact C-N 3.28Å; H5-N7 PolarHBondContact O-N 3.48Å; H5-L8 PolarHBondContact O-N 3.28Å; H5-I9 HydrophobicContact CB-CD1 4.07Å; H5-I9 WeakPolarHBondContact O-CB 3.17Å; H5-I9 WeakPolarHBondContact O-CD1 3.38Å; H5-I9 WeakPolarHBondContact O-CG1 3.39Å; H5-I9 PolarHBondContact O-N 3.02Å; H5-Y193 AromaticContact CE1-CE2 3.99Å; H5-H196 AromaticContact CE1-NE2 3.44Å; H5-H196 PolarHBondContact CE1-NE2 3.26Å; H5-H196 AromaticContact CG-NE2 3.92Å; H5-H196 AromaticContact ND1-CD2 3.7Å; H5-H196 AromaticContact ND1-CE1 3.76Å; H5-H196 AromaticContact ND1-NE2 2.76Å; H5-H196 PolarHBondContact ND1-NE2 3.45Å; H5-L200 HydrophobicContact CB-CD1 3.82Å
6I96.4Very high94.1Very high45 Ų4573.8 Ų73.823%0.23135%0.347CS..Hα-helixtrans-56.6-47.3172.1-72169.3000109.6V2 L3 L8 F10 L12 M17 L200V2-I6 HydrophobicContact CG1-CD1 3.8Å; V2-I6 HydrophobicContact CG1-CG1 4.23Å; V2-I6 VanDerWaalsContact O-CG1 3.32Å; V2-I6 WeakPolarHBondContact O-CG1 3.47Å; V2-I6 PolarHBondContact O-N 3.15Å; L3-I6 PolarHBondContact O-N 3.49Å; I6-L8 PolarHBondContact O-N 3.26Å; I6-F10 HydrophobicContact CB-CD2 4.44Å; I6-F10 HydrophobicContact CG2-CD2 3.92Å; I6-F10 HydrophobicContact CG2-CE2 4.42Å; I6-F10 WeakPolarHBondContact O-CB 3.39Å; I6-F10 WeakPolarHBondContact O-CD2 3.5Å; I6-F10 PolarHBondContact O-N 2.89Å; I6-L12 HydrophobicContact CG2-CD1 3.72Å; I6-M17 HydrophobicContact CB-CE 3.96Å; I6-M17 HydrophobicContact CG2-CE 3.65Å; I6-L200 HydrophobicContact CD1-CD2 4.4Å; I6-L200 HydrophobicContact CG1-CD1 3.97Å; I6-L200 HydrophobicContact CG1-CD2 3.6Å; I6-L200 HydrophobicContact CG1-CG 4.47Å
7N95.4Very high94.1Very high11 Ų1170.2 Ų70.26%0.05933%0.33CS..Hα-helixtrans-61.5-42.7-179.8-173.351000112.8L3 D4 H5 Q11 L12 K13 Q14 M17L3-N7 WeakPolarHBondContact O-CB 3.42Å; L3-N7 PolarHBondContact O-N 3.26Å; D4-N7 WeakPolarHBondContact O-CB 3.32Å; D4-N7 PolarHBondContact O-N 2.92Å; H5-N7 VanDerWaalsContact C-N 3.28Å; H5-N7 PolarHBondContact O-N 3.48Å; N7-Q11 WeakPolarHBondContact O-CA 3.35Å; N7-Q11 PolarHBondContact O-N 2.78Å; N7-L12 PolarHBondContact O-N 3.31Å; N7-K13 PolarHBondContact OD1-N 3.41Å; N7-Q14 PolarHBondContact ND2-O 3.29Å; N7-Q14 VanDerWaalsContact ND2-O 3.15Å; N7-Q14 WeakPolarHBondContact OD1-CB 3.32Å; N7-Q14 PolarHBondContact OD1-N 3.09Å; N7-Q14 PolarHBondContact OD1-O 3.01Å; N7-M17 HydrophobicContact CB-CB 3.74Å; N7-M17 HydrophobicContact CB-CE 4.06Å; N7-M17 HydrophobicContact CB-SD 4.29Å
8L93.2Very high94Very high64 Ų6468.3 Ų68.334%0.33532%0.321SS..Hα-helixtrans-72.6-49179.7-69.5171.9000112.4D4 H5 I6 Q11D4-L8 WeakPolarHBondContact O-CG 3.28Å; D4-L8 PolarHBondContact O-N 3.44Å; H5-L8 PolarHBondContact O-N 3.28Å; I6-L8 PolarHBondContact O-N 3.26Å; L8-Q11 PolarHBondContact O-N 2.93Å; L8-Q11 PolarHBondContact O-NE2 2.86Å
9I95.3Very high94.1Very high21 Ų2166.7 Ų66.711%0.10831%0.314CS..Hα-helixtrans-68.7-45.9-173.7-65.2168.3000110.7H5 Q11 A64 F66 L197 L200 A204H5-I9 HydrophobicContact CB-CD1 4.07Å; H5-I9 WeakPolarHBondContact O-CB 3.17Å; H5-I9 WeakPolarHBondContact O-CD1 3.38Å; H5-I9 WeakPolarHBondContact O-CG1 3.39Å; H5-I9 PolarHBondContact O-N 3.02Å; I9-Q11 VanDerWaalsContact C-N 3.27Å; I9-Q11 PolarHBondContact O-N 2.79Å; I9-A64 HydrophobicContact CD1-CB 3.74Å; I9-A64 HydrophobicContact CG1-CB 4.26Å; I9-F66 HydrophobicContact CD1-CE2 4.21Å; I9-F66 HydrophobicContact CG1-CE2 4.13Å; I9-F66 HydrophobicContact CG1-CZ 4.33Å; I9-L197 HydrophobicContact CD1-CD2 4.29Å; I9-L200 HydrophobicContact CD1-CB 3.56Å; I9-L200 HydrophobicContact CD1-CD1 3.81Å; I9-L200 HydrophobicContact CD1-CG 4.34Å; I9-L200 HydrophobicContact CG2-CB 4.42Å; I9-A204 HydrophobicContact CG2-CB 3.61Å
10F95.7Very high94Very high74 Ų7465.5 Ų65.533%0.32532%0.316SS..THydrogen-bonded Turntrans-85.85.2177.7-65.6-75.8000113.6I6 L12 L200 L203 A204I6-F10 HydrophobicContact CB-CD2 4.44Å; I6-F10 HydrophobicContact CG2-CD2 3.92Å; I6-F10 HydrophobicContact CG2-CE2 4.42Å; I6-F10 WeakPolarHBondContact O-CB 3.39Å; I6-F10 WeakPolarHBondContact O-CD2 3.5Å; I6-F10 PolarHBondContact O-N 2.89Å; F10-L12 HydrophobicContact CB-CD1 4.44Å; F10-L12 HydrophobicContact CB-CD2 3.87Å; F10-L12 HydrophobicContact CB-CG 3.83Å; F10-L12 PolarHBondContact O-N 2.79Å; F10-L12 VanDerWaalsContact O-N 3.14Å; F10-L200 HydrophobicContact CE2-CD2 3.86Å; F10-L203 HydrophobicContact CE1-CB 4.15Å; F10-L203 HydrophobicContact CZ-CB 3.69Å; F10-A204 HydrophobicContact CD1-CB 4.29Å; F10-A204 HydrophobicContact CE1-CB 4.07Å
11Q93Very high93.9Very high136 Ų13662.5 Ų62.564%0.63630%0.302SS*.THydrogen-bonded Turntrans52.837.3178.1-58.6-67.9-28.300113.2N7 L8 I9 K13N7-Q11 WeakPolarHBondContact O-CA 3.35Å; N7-Q11 PolarHBondContact O-N 2.78Å; L8-Q11 PolarHBondContact O-N 2.93Å; L8-Q11 PolarHBondContact O-NE2 2.86Å; I9-Q11 VanDerWaalsContact C-N 3.27Å; I9-Q11 PolarHBondContact O-N 2.79Å; Q11-K13 PolarHBondContact O-N 3.33Å
12L94.2Very high94.1Very high77 Ų7761.4 Ų61.440%0.40330%0.296SS..  trans-70.1-18.6-173.9-57.7177.3000113.1I6 N7 F10 Q14 M17I6-L12 HydrophobicContact CG2-CD1 3.72Å; N7-L12 PolarHBondContact O-N 3.31Å; F10-L12 HydrophobicContact CB-CD1 4.44Å; F10-L12 HydrophobicContact CB-CD2 3.87Å; F10-L12 HydrophobicContact CB-CG 3.83Å; F10-L12 PolarHBondContact O-N 2.79Å; F10-L12 VanDerWaalsContact O-N 3.14Å; L12-Q14 HydrophobicContact CB-CG 3.95Å; L12-Q14 PolarHBondContact O-N 3.03Å; L12-Q14 VanDerWaalsContact O-N 3.13Å; L12-Q14 PolarHBondContact O-NE2 3.37Å; L12-M17 HydrophobicContact CD1-CE 4.1Å; L12-M17 HydrophobicContact CD1-SD 4.19Å
13K91.4Very high94.2Very high179 Ų17959.1 Ų59.178%0.77828%0.282SS*.  trans53.930.4179.2-60.7175.7-175.3179.90113.7N7 Q11 E15N7-K13 PolarHBondContact OD1-N 3.41Å; Q11-K13 PolarHBondContact O-N 3.33Å; K13-E15 PolarHBondContact O-N 3.01Å
14Q95.2Very high94.2Very high89 Ų8956 Ų5642%0.41627%0.268SS..  trans-84.4109.2177-61.9-59.9-38.300110.1N7 L12 W16 M17 F18N7-Q14 PolarHBondContact ND2-O 3.29Å; N7-Q14 VanDerWaalsContact ND2-O 3.15Å; N7-Q14 WeakPolarHBondContact OD1-CB 3.32Å; N7-Q14 PolarHBondContact OD1-N 3.09Å; N7-Q14 PolarHBondContact OD1-O 3.01Å; L12-Q14 HydrophobicContact CB-CG 3.95Å; L12-Q14 PolarHBondContact O-N 3.03Å; L12-Q14 VanDerWaalsContact O-N 3.13Å; L12-Q14 PolarHBondContact O-NE2 3.37Å; Q14-W16 VanDerWaalsContact C-N 3.34Å; Q14-W16 PolarHBondContact O-N 3.1Å; Q14-M17 HydrophobicContact CB-CB 4.19Å; Q14-M17 HydrophobicContact CB-CG 3.86Å; Q14-M17 HydrophobicContact CB-SD 3.69Å; Q14-M17 HydrophobicContact CG-SD 3.94Å; Q14-M17 PolarHBondContact O-N 3.34Å; Q14-F18 PolarHBondContact O-N 3.1Å
15E93.9Very high94.4Very high129 Ų12956 Ų5660%0.60327%0.268SS*.Hα-helixtrans-60.2-42.2-176.3-173177.8-176.400112.4K13 M17 F18 L19K13-E15 PolarHBondContact O-N 3.01Å; E15-M17 VanDerWaalsContact C-N 3.31Å; E15-M17 PolarHBondContact O-N 3.01Å; E15-F18 WeakPolarHBondContact O-CB 3.08Å; E15-F18 PolarHBondContact O-N 3.33Å; E15-L19 HydrophobicContact CG-CD1 3.87Å; E15-L19 HydrophobicContact CG-CG 4.11Å; E15-L19 WeakPolarHBondContact O-CG 3.47Å; E15-L19 PolarHBondContact O-N 3.3Å
16W94.3Very high94.5Very high151 Ų15154.9 Ų54.957%0.57226%0.263SS*.Hα-helixtrans-62.9-35.9-179.170-92.7000112.9L3 Q14 A20L3-W16 HydrophobicContact CD1-CZ3 4.22Å; Q14-W16 VanDerWaalsContact C-N 3.34Å; Q14-W16 PolarHBondContact O-N 3.1Å; W16-A20 VanDerWaalsContact O-CB 3.25Å; W16-A20 WeakPolarHBondContact O-CB 3.3Å; W16-A20 PolarHBondContact O-N 3.49Å
17M93.9Very high94.5Very high12 Ų1254.8 Ų54.86%0.05926%0.263CS..Hα-helixtrans-66.8-42.4176.9-66177.367.900110.5L3 I6 N7 L12 Q14 E15 G21L3-M17 HydrophobicContact CB-CE 4.32Å; L3-M17 HydrophobicContact CD2-CE 4.14Å; L3-M17 WeakPolarHBondContact O-CE 3.12Å; I6-M17 HydrophobicContact CB-CE 3.96Å; I6-M17 HydrophobicContact CG2-CE 3.65Å; N7-M17 HydrophobicContact CB-CB 3.74Å; N7-M17 HydrophobicContact CB-CE 4.06Å; N7-M17 HydrophobicContact CB-SD 4.29Å; L12-M17 HydrophobicContact CD1-CE 4.1Å; L12-M17 HydrophobicContact CD1-SD 4.19Å; Q14-M17 HydrophobicContact CB-CB 4.19Å; Q14-M17 HydrophobicContact CB-CG 3.86Å; Q14-M17 HydrophobicContact CB-SD 3.69Å; Q14-M17 HydrophobicContact CG-SD 3.94Å; Q14-M17 PolarHBondContact O-N 3.34Å; E15-M17 VanDerWaalsContact C-N 3.31Å; E15-M17 PolarHBondContact O-N 3.01Å; M17-G21 PolarHBondContact O-N 3.49Å
18F93.3Very high94.5Very high37 Ų3757.6 Ų57.616%0.16228%0.275CS..Hα-helixtrans-62.2-50.8176.5174.1-106.2000111.6D4 Q14 E15 A20 G21 R22 T154 A158D4-F18 WeakPolarHBondContact OD1-CD2 3.44Å; Q14-F18 PolarHBondContact O-N 3.1Å; E15-F18 WeakPolarHBondContact O-CB 3.08Å; E15-F18 PolarHBondContact O-N 3.33Å; F18-A20 PolarHBondContact O-N 2.82Å; F18-G21 WeakPolarHBondContact O-CA 3.47Å; F18-G21 PolarHBondContact O-N 2.93Å; F18-G21 VanDerWaalsContact O-N 3.09Å; F18-R22 WeakPolarHBondContact O-CG 3.27Å; F18-R22 PolarHBondContact O-NE 2.92Å; F18-T154 HydrophobicContact CE1-CG2 4.03Å; F18-T154 HydrophobicContact CE2-CG2 4.39Å; F18-T154 HydrophobicContact CZ-CG2 3.44Å; F18-T154 VanDerWaalsContact CZ-CG2 3.44Å; F18-A158 HydrophobicContact CE1-CB 3.88Å; F18-A158 HydrophobicContact CZ-CB 4.32Å
19L94.8Very high94.7Very high38 Ų3854.6 Ų54.620%0.19926%0.259CS..Hα-helixtrans-63.4-42.8-179.2-67.5179.3000112.2E15 G21 R22 A157 A158 A161E15-L19 HydrophobicContact CG-CD1 3.87Å; E15-L19 HydrophobicContact CG-CG 4.11Å; E15-L19 WeakPolarHBondContact O-CG 3.47Å; E15-L19 PolarHBondContact O-N 3.3Å; L19-G21 PolarHBondContact O-N 3.47Å; L19-R22 WeakPolarHBondContact O-CB 3.5Å; L19-R22 PolarHBondContact O-N 3.41Å; L19-R22 VanDerWaalsContact O-N 3.15Å; L19-A157 HydrophobicContact CD2-CB 4.19Å; L19-A158 HydrophobicContact CD2-CB 4.24Å; L19-A161 HydrophobicContact CB-CB 3.95Å; L19-A161 HydrophobicContact CD2-CB 3.99Å; L19-A161 HydrophobicContact CG-CB 4.47Å
20A91.9Very high94.7Very high41 Ų4154.2 Ų54.234%0.33926%0.257SS..Hα-helixtrans-60.9-28.1175.200000112.6W16 F18W16-A20 VanDerWaalsContact O-CB 3.25Å; W16-A20 WeakPolarHBondContact O-CB 3.3Å; W16-A20 PolarHBondContact O-N 3.49Å; F18-A20 PolarHBondContact O-N 2.82Å
21G93.5Very high94.6Very high3 Ų354.6 Ų54.63%0.03127%0.265CS..Hα-helixtrans-66.4-30.817600000115.1M17 F18 L19 G23 A24M17-G21 PolarHBondContact O-N 3.49Å; F18-G21 WeakPolarHBondContact O-CA 3.47Å; F18-G21 PolarHBondContact O-N 2.93Å; F18-G21 VanDerWaalsContact O-N 3.09Å; L19-G21 PolarHBondContact O-N 3.47Å; G21-G23 VanDerWaalsContact C-N 3.27Å; G21-G23 PolarHBondContact O-N 2.62Å; G21-A24 WeakPolarHBondContact O-CB 3.34Å; G21-A24 PolarHBondContact O-N 2.87Å
22R95.1Very high94.7Very high19 Ų1949.5 Ų49.57%0.07224%0.24CC..THydrogen-bonded Turntrans-67.8-23.9-165.8-59.6-58.5105.7-170.71.9114.4D4 F18 L19 A24 N151 A158D4-R22 IonicContact OD1-CZ 3.69Å; D4-R22 IonicContact OD1-NE 2.86Å; D4-R22 IonicContact OD1-NH2 2.62Å; D4-R22 PolarHBondContact OD1-NH2 2.8Å; D4-R22 IonicContact OD2-CZ 2.77Å; D4-R22 IonicContact OD2-NH2 3.89Å; D4-R22 PolarHBondContact OD2-NH2 3.47Å; F18-R22 WeakPolarHBondContact O-CG 3.27Å; F18-R22 PolarHBondContact O-NE 2.92Å; L19-R22 WeakPolarHBondContact O-CB 3.5Å; L19-R22 PolarHBondContact O-N 3.41Å; L19-R22 VanDerWaalsContact O-N 3.15Å; R22-A24 VanDerWaalsContact C-N 3.32Å; R22-N151 WeakPolarHBondContact CD-OD1 3.2Å; R22-A158 HydrophobicContact CG-CB 4.05Å
23G94.6Very high94.8Very high2 Ų245.9 Ų45.92%0.02122%0.221CC..THydrogen-bonded Turntrans-78.5-11.2173.500000114.3G21 P26 L27G21-G23 VanDerWaalsContact C-N 3.27Å; G21-G23 PolarHBondContact O-N 2.62Å; G23-P26 WeakPolarHBondContact O-CD 3.23Å; G23-L27 WeakPolarHBondContact O-CD1 3.47Å; G23-L27 WeakPolarHBondContact O-CG 3.19Å; G23-L27 PolarHBondContact O-N 2.91Å
24A95.7Very high94.8Very high17 Ų1740.2 Ų40.214%0.1420%0.199CC..Hα-helixtrans-65.7-51.2-171.300000112.7M1 G21 R22 L27 F28M1-A24 HydrophobicContact CB-CB 4.11Å; G21-A24 WeakPolarHBondContact O-CB 3.34Å; G21-A24 PolarHBondContact O-N 2.87Å; R22-A24 VanDerWaalsContact C-N 3.32Å; A24-L27 PolarHBondContact O-N 2.86Å; A24-F28 HydrophobicContact CB-CD2 4.43Å; A24-F28 HydrophobicContact CB-CE2 4.21Å; A24-F28 WeakPolarHBondContact O-CD2 3.39Å; A24-F28 PolarHBondContact O-N 3.31Å
25F96.3Very high94.7Very high8 Ų838.2 Ų38.24%0.03519%0.191CC..Hα-helixtrans-62.8-46.9-177.6175.4-110.8000113.2L27 F28 A29 I73 F77 Y113 M120 L121 L150F25-L27 VanDerWaalsContact C-N 3.28Å; F25-L27 PolarHBondContact O-N 3.4Å; F25-F28 PolarHBondContact O-N 3.31Å; F25-A29 WeakPolarHBondContact O-CB 3.28Å; F25-A29 PolarHBondContact O-N 2.92Å; F25-I73 HydrophobicContact CD2-CD1 3.68Å; F25-I73 HydrophobicContact CD2-CG1 3.84Å; F25-I73 HydrophobicContact CE2-CD1 3.6Å; F25-I73 HydrophobicContact CE2-CG1 3.95Å; F25-I73 HydrophobicContact CG-CD1 4.45Å; F25-I73 HydrophobicContact CZ-CD1 4.33Å; F25-F77 HydrophobicContact CD2-CE2 4.38Å; F25-F77 HydrophobicContact CD2-CZ 4.34Å; F25-F77 HydrophobicContact CE2-CE2 4.03Å; F25-F77 AromaticContact CE2-CZ 3.98Å; F25-F77 HydrophobicContact CE2-CZ 3.98Å; F25-Y113 HydrophobicContact CB-CD2 4.16Å; F25-Y113 HydrophobicContact CB-CE2 3.52Å; F25-Y113 AromaticContact CD1-CD2 3.62Å; F25-Y113 HydrophobicContact CD1-CD2 3.62Å; F25-Y113 AromaticContact CD1-CE2 3.86Å; F25-Y113 HydrophobicContact CD1-CE2 3.86Å; F25-Y113 HydrophobicContact CD1-CG 4Å; F25-Y113 HydrophobicContact CD2-CD2 4.28Å; F25-Y113 HydrophobicContact CD2-CE2 4.33Å; F25-Y113 HydrophobicContact CE1-CD2 4.07Å; F25-Y113 HydrophobicContact CE1-CG 4.29Å; F25-Y113 AromaticContact CG-CD2 3.74Å; F25-Y113 HydrophobicContact CG-CD2 3.74Å; F25-Y113 AromaticContact CG-CE2 3.63Å; F25-Y113 HydrophobicContact CG-CE2 3.63Å; F25-M120 HydrophobicContact CE1-CB 3.95Å; F25-M120 HydrophobicContact CE1-CG 4.01Å; F25-L121 HydrophobicContact CE2-CD2 4.36Å; F25-L121 HydrophobicContact CE2-CG 4.47Å; F25-L121 HydrophobicContact CZ-CD1 4.18Å; F25-L121 HydrophobicContact CZ-CD2 4.3Å; F25-L121 HydrophobicContact CZ-CG 3.99Å; F25-L150 HydrophobicContact CD1-CD1 3.84Å; F25-L150 HydrophobicContact CD1-CD2 4.01Å; F25-L150 HydrophobicContact CE1-CD1 4.22Å; F25-L150 HydrophobicContact CE1-CD2 3.84Å
26P97.2Very high94.6Very high0 Ų033.2 Ų33.20%017%0.168CC..Hα-helixtrans-52-43.9172.2-29.734000114.2G23 A29 L30 M120 I147 L150 T166G23-P26 WeakPolarHBondContact O-CD 3.23Å; P26-A29 PolarHBondContact O-N 3.25Å; P26-L30 WeakPolarHBondContact O-CG 3.44Å; P26-L30 PolarHBondContact O-N 2.92Å; P26-M120 HydrophobicContact CB-CE 3.87Å; P26-M120 WeakPolarHBondContact O-CE 3.44Å; P26-I147 HydrophobicContact CB-CG1 4.22Å; P26-I147 HydrophobicContact CB-CG2 4.49Å; P26-I147 HydrophobicContact CG-CG1 4.45Å; P26-I147 HydrophobicContact CG-CG2 4.09Å; P26-L150 HydrophobicContact CG-CD1 3.69Å; P26-T166 HydrophobicContact CB-CG2 3.72Å; P26-T166 VanDerWaalsContact CB-OG1 3.3Å; P26-T166 WeakPolarHBondContact CB-OG1 3.33Å
27L96.3Very high94.4Very high43 Ų4327.5 Ų27.523%0.22515%0.152CC..Hα-helixtrans-66.3-42.6179.3-69.5170.2000111.9G23 A24 F25 A29 L30 V31 T166 T169 V170G23-L27 WeakPolarHBondContact O-CD1 3.47Å; G23-L27 WeakPolarHBondContact O-CG 3.19Å; G23-L27 PolarHBondContact O-N 2.91Å; A24-L27 PolarHBondContact O-N 2.86Å; F25-L27 VanDerWaalsContact C-N 3.28Å; F25-L27 PolarHBondContact O-N 3.4Å; L27-A29 VanDerWaalsContact C-N 3.34Å; L27-A29 PolarHBondContact O-N 3.34Å; L27-L30 PolarHBondContact O-N 2.91Å; L27-V31 WeakPolarHBondContact O-CG2 3.46Å; L27-V31 PolarHBondContact O-N 3.17Å; L27-T166 HydrophobicContact CD2-CG2 4.05Å; L27-T166 HydrophobicContact CG-CG2 4.36Å; L27-T169 HydrophobicContact CD1-CG2 3.88Å; L27-T169 HydrophobicContact CD2-CG2 3.75Å; L27-T169 HydrophobicContact CG-CG2 4.49Å; L27-V170 HydrophobicContact CD2-CG2 4.08Å
28F95.3Very high94.1Very high70 Ų7034.8 Ų34.831%0.30718%0.178SC..Hα-helixtrans-63.5-40174-73.4-60.6000112M1 A24 F25 V31 W32 F77 F189M1-F28 HydrophobicContact CB-CE2 4.34Å; M1-F28 HydrophobicContact CE-CD2 4.44Å; M1-F28 HydrophobicContact CE-CE2 3.57Å; M1-F28 HydrophobicContact CE-CZ 3.75Å; A24-F28 HydrophobicContact CB-CD2 4.43Å; A24-F28 HydrophobicContact CB-CE2 4.21Å; A24-F28 WeakPolarHBondContact O-CD2 3.39Å; A24-F28 PolarHBondContact O-N 3.31Å; F25-F28 PolarHBondContact O-N 3.31Å; F28-V31 PolarHBondContact O-N 3.12Å; F28-W32 WeakPolarHBondContact O-CB 3.38Å; F28-W32 PolarHBondContact O-N 2.73Å; F28-F77 HydrophobicContact CB-CZ 4Å; F28-F189 AromaticContact CD1-CD2 3.73Å; F28-F189 HydrophobicContact CD1-CD2 3.73Å; F28-F189 AromaticContact CD1-CE2 3.45Å; F28-F189 HydrophobicContact CD1-CE2 3.45Å; F28-F189 VanDerWaalsContact CD1-CE2 3.45Å; F28-F189 HydrophobicContact CD1-CZ 4.09Å; F28-F189 AromaticContact CD2-CE2 3.93Å; F28-F189 HydrophobicContact CD2-CE2 3.93Å; F28-F189 HydrophobicContact CD2-CZ 4.32Å; F28-F189 AromaticContact CE1-CD2 3.42Å; F28-F189 HydrophobicContact CE1-CD2 3.42Å; F28-F189 VanDerWaalsContact CE1-CD2 3.42Å; F28-F189 AromaticContact CE1-CE2 3.33Å; F28-F189 HydrophobicContact CE1-CE2 3.33Å; F28-F189 HydrophobicContact CE1-CZ 4.38Å; F28-F189 AromaticContact CE2-CE2 3.84Å; F28-F189 HydrophobicContact CE2-CE2 3.84Å; F28-F189 HydrophobicContact CG-CD2 4.49Å; F28-F189 AromaticContact CG-CE2 3.77Å; F28-F189 HydrophobicContact CG-CE2 3.77Å; F28-F189 HydrophobicContact CG-CZ 4.09Å; F28-F189 AromaticContact CZ-CD2 3.95Å; F28-F189 HydrophobicContact CZ-CD2 3.95Å; F28-F189 AromaticContact CZ-CE2 3.55Å; F28-F189 HydrophobicContact CZ-CE2 3.55Å
29A97.3Very high93.9Very high0 Ų036.6 Ų36.60%019%0.187CC..Hα-helixtrans-62.4-42.4176.800000112.2F25 P26 L27 W32 G33 M120 L121 S124F25-A29 WeakPolarHBondContact O-CB 3.28Å; F25-A29 PolarHBondContact O-N 2.92Å; P26-A29 PolarHBondContact O-N 3.25Å; L27-A29 VanDerWaalsContact C-N 3.34Å; L27-A29 PolarHBondContact O-N 3.34Å; A29-W32 PolarHBondContact O-N 3.18Å; A29-G33 PolarHBondContact O-N 3.26Å; A29-M120 HydrophobicContact CB-CE 3.97Å; A29-M120 HydrophobicContact CB-CG 3.72Å; A29-L121 HydrophobicContact CB-CD2 3.69Å; A29-L121 HydrophobicContact CB-CG 4.46Å; A29-S124 VanDerWaalsContact O-CB 3.27Å; A29-S124 WeakPolarHBondContact O-CB 3.43Å
30L96.7Very high93.5Very high13 Ų1338.2 Ų38.27%0.06821%0.206CC..Hα-helixtrans-62.9-48.9174.8-72.7170.3000111.8P26 L27 W32 G33 L34 M120 L127 Y128 L143 T166 V170P26-L30 WeakPolarHBondContact O-CG 3.44Å; P26-L30 PolarHBondContact O-N 2.92Å; L27-L30 PolarHBondContact O-N 2.91Å; L30-W32 VanDerWaalsContact C-N 3.29Å; L30-W32 PolarHBondContact O-N 3.43Å; L30-G33 PolarHBondContact O-N 3.27Å; L30-L34 WeakPolarHBondContact O-CB 3.21Å; L30-L34 PolarHBondContact O-N 3.05Å; L30-M120 HydrophobicContact CD2-CE 4.42Å; L30-M120 HydrophobicContact CG-CE 4.05Å; L30-L127 HydrophobicContact CD2-CD2 4.42Å; L30-Y128 HydrophobicContact CD2-CE2 4.33Å; L30-Y128 WeakPolarHBondContact O-CE2 3.5Å; L30-L143 HydrophobicContact CD2-CD1 3.87Å; L30-T166 HydrophobicContact CD1-CG2 4.04Å; L30-V170 HydrophobicContact CD1-CG2 3.69Å
31V93.7Very high93.5Very high83 Ų8342.4 Ų42.450%0.50322%0.219SC..Hα-helixtrans-62.1-39.3177.6172.50000111.3L27 F28 L34 N35L27-V31 WeakPolarHBondContact O-CG2 3.46Å; L27-V31 PolarHBondContact O-N 3.17Å; F28-V31 PolarHBondContact O-N 3.12Å; V31-L34 PolarHBondContact O-N 2.79Å; V31-N35 WeakPolarHBondContact O-CB 3.2Å; V31-N35 VanDerWaalsContact O-CG 3.29Å; V31-N35 PolarHBondContact O-N 2.99Å; V31-N35 PolarHBondContact O-ND2 2.94Å
32W94.9Very high93.3Very high29 Ų2942.7 Ų42.711%0.1122%0.219CC..Hα-helixtrans-64.2-46.7175.7176.786.9000111.9F28 A29 L30 L34 N35 L36 F77 A80 A81 L84 L121 N125F28-W32 WeakPolarHBondContact O-CB 3.38Å; F28-W32 PolarHBondContact O-N 2.73Å; A29-W32 PolarHBondContact O-N 3.18Å; L30-W32 VanDerWaalsContact C-N 3.29Å; L30-W32 PolarHBondContact O-N 3.43Å; W32-L34 VanDerWaalsContact C-N 3.34Å; W32-L34 PolarHBondContact O-N 3.39Å; W32-N35 PolarHBondContact O-N 3.45Å; W32-N35 VanDerWaalsContact O-N 3.11Å; W32-L36 HydrophobicContact CD2-CD1 3.93Å; W32-L36 HydrophobicContact CD2-CG 4.27Å; W32-L36 HydrophobicContact CE3-CD1 4Å; W32-L36 HydrophobicContact CH2-CD1 3.4Å; W32-L36 HydrophobicContact CZ2-CD1 3.31Å; W32-L36 HydrophobicContact CZ2-CG 4.27Å; W32-L36 HydrophobicContact CZ3-CD1 3.73Å; W32-L36 PolarHBondContact O-N 3.21Å; W32-F77 HydrophobicContact CB-CD1 4.11Å; W32-F77 HydrophobicContact CB-CE1 3.65Å; W32-F77 AromaticContact CD1-CD1 3.56Å; W32-F77 AromaticContact CD1-CE1 3.98Å; W32-F77 AromaticContact CD2-CD1 3.75Å; W32-F77 HydrophobicContact CD2-CD1 3.75Å; W32-F77 HydrophobicContact CD2-CE1 4.08Å; W32-F77 AromaticContact CE2-CD1 3.81Å; W32-F77 HydrophobicContact CE3-CD1 4.46Å; W32-F77 AromaticContact CG-CD1 3.56Å; W32-F77 HydrophobicContact CG-CD1 3.56Å; W32-F77 AromaticContact CG-CE1 3.64Å; W32-F77 HydrophobicContact CG-CE1 3.64Å; W32-F77 AromaticContact NE1-CD1 3.72Å; W32-A80 HydrophobicContact CH2-CB 4.08Å; W32-A81 HydrophobicContact CZ2-CB 3.87Å; W32-L84 HydrophobicContact CH2-CD1 3.93Å; W32-L84 HydrophobicContact CZ3-CD1 4.34Å; W32-L121 HydrophobicContact CD2-CD2 4.24Å; W32-L121 HydrophobicContact CE3-CB 4.41Å; W32-L121 HydrophobicContact CE3-CD2 3.78Å; W32-L121 HydrophobicContact CH2-CB 4.37Å; W32-L121 HydrophobicContact CZ3-CB 3.85Å; W32-L121 HydrophobicContact CZ3-CD2 4.03Å; W32-N125 HydrophobicContact CZ3-CB 4.15Å
33G95.1Very high93.2Very high0 Ų047.9 Ų47.90%024%0.239CC..Hα-helixtrans-58.4-43.8175.500000112.4A29 L30 N35 L36 S37 Y128A29-G33 PolarHBondContact O-N 3.26Å; L30-G33 PolarHBondContact O-N 3.27Å; G33-N35 VanDerWaalsContact C-N 3.33Å; G33-N35 PolarHBondContact O-N 3.42Å; G33-L36 PolarHBondContact O-N 3.4Å; G33-S37 PolarHBondContact O-N 3.37Å; G33-Y128 VanDerWaalsContact C-CD2 3.48Å
34L93Very high93.2Very high61 Ų6151 Ų5132%0.31925%0.253SS..Hα-helixtrans-63.3-37.5175.1178.462.6000112.2L30 V31 W32 S37 R38 Y128L30-L34 WeakPolarHBondContact O-CB 3.21Å; L30-L34 PolarHBondContact O-N 3.05Å; V31-L34 PolarHBondContact O-N 2.79Å; W32-L34 VanDerWaalsContact C-N 3.34Å; W32-L34 PolarHBondContact O-N 3.39Å; L34-S37 PolarHBondContact O-OG 3.11Å; L34-R38 WeakPolarHBondContact O-CG 3.27Å; L34-Y128 HydrophobicContact CB-CD1 4.32Å; L34-Y128 HydrophobicContact CB-CD2 3.92Å; L34-Y128 HydrophobicContact CB-CE1 4.18Å; L34-Y128 HydrophobicContact CB-CE2 3.79Å; L34-Y128 HydrophobicContact CB-CG 4.19Å; L34-Y128 HydrophobicContact CD1-CD1 3.77Å; L34-Y128 HydrophobicContact CD1-CE1 4.01Å; L34-Y128 HydrophobicContact CD1-CG 4.15Å
35N91.6Very high93.1Very high47 Ų4754.3 Ų54.325%0.25127%0.273SS..Hα-helixtrans-71-35.4177.9-77.2-39.4000112.3V31 W32 G33 H39V31-N35 WeakPolarHBondContact O-CB 3.2Å; V31-N35 VanDerWaalsContact O-CG 3.29Å; V31-N35 PolarHBondContact O-N 2.99Å; V31-N35 PolarHBondContact O-ND2 2.94Å; W32-N35 PolarHBondContact O-N 3.45Å; W32-N35 VanDerWaalsContact O-N 3.11Å; G33-N35 VanDerWaalsContact C-N 3.33Å; G33-N35 PolarHBondContact O-N 3.42Å; N35-H39 PolarHBondContact O-ND1 3.31Å
36L92.1Very high93Very high23 Ų2354.7 Ų54.712%0.1228%0.278CS..Hα-helixtrans-68-43.5174.2-72.2-170.4000111.8W32 G33 R38 H39 I42W32-L36 HydrophobicContact CD2-CD1 3.93Å; W32-L36 HydrophobicContact CD2-CG 4.27Å; W32-L36 HydrophobicContact CE3-CD1 4Å; W32-L36 HydrophobicContact CH2-CD1 3.4Å; W32-L36 HydrophobicContact CZ2-CD1 3.31Å; W32-L36 HydrophobicContact CZ2-CG 4.27Å; W32-L36 HydrophobicContact CZ3-CD1 3.73Å; W32-L36 PolarHBondContact O-N 3.21Å; G33-L36 PolarHBondContact O-N 3.4Å; L36-R38 PolarHBondContact O-N 2.84Å; L36-R38 VanDerWaalsContact O-N 3.1Å; L36-H39 PolarHBondContact O-N 3.49Å; L36-I42 HydrophobicContact CD1-CD1 4.03Å; L36-I42 HydrophobicContact CD1-CG1 4.26Å; L36-I42 HydrophobicContact CD2-CG1 4.47Å; L36-I42 HydrophobicContact CD2-CG2 4.15Å
37S90.5Very high92.9Very high32 Ų3254.8 Ų54.822%0.22428%0.278CS..Hα-helixtrans-63.4-18.5-177.673.30000114.3G33 L34 H39 Y128G33-S37 PolarHBondContact O-N 3.37Å; L34-S37 PolarHBondContact O-OG 3.11Å; S37-H39 PolarHBondContact O-N 2.97Å; S37-Y128 WeakPolarHBondContact OG-CB 3.28Å
38R88Confident92.9Very high164 Ų16457 Ų5762%0.61929%0.29SS*.THydrogen-bonded Turntrans-68.7-11.7173.7-69.8171.7-173.7-168-0.6114L34 L36L34-R38 WeakPolarHBondContact O-CG 3.27Å; L36-R38 PolarHBondContact O-N 2.84Å; L36-R38 VanDerWaalsContact O-N 3.1Å
39H89.3Confident92.9Very high75 Ų7558.4 Ų58.435%0.34729%0.294SS..SBendtrans-115.4142.6178.2-54.781.2000109.3N35 L36 S37 H41 R43N35-H39 PolarHBondContact O-ND1 3.31Å; L36-H39 PolarHBondContact O-N 3.49Å; S37-H39 PolarHBondContact O-N 2.97Å; H39-H41 WeakPolarHBondContact CB-O 3.33Å; H39-H41 PolarHBondContact O-N 2.91Å; H39-R43 PolarHBondContact CD2-NE 3.42Å; H39-R43 PolarHBondContact NE2-NE 3.4Å; H39-R43 PolarHBondContact NE2-NH2 2.97Å; H39-R43 VanDerWaalsContact NE2-NH2 3.18Å
40A86.3Confident92.8Very high73 Ų7359.8 Ų59.860%0.60330%0.301SS*.SBendtrans-58.9-36.2178.100000112.7R129A40-R129 PolarHBondContact O-NH2 2.91Å
41H90.1Very high92.9Very high128 Ų12862.4 Ų62.459%0.59331%0.31SS*.SBendtrans-132.2149178-56.1-68000110.4H39 R43 E88H39-H41 WeakPolarHBondContact CB-O 3.33Å; H39-H41 PolarHBondContact O-N 2.91Å; H41-R43 PolarHBondContact O-N 2.77Å; H41-E88 IonicContact ND1-OE2 3.54Å
42I91.2Very high93.1Very high10 Ų1060 Ų605%0.05130%0.301CS..  trans-68.2119.9170.8-57175.1000108L36 Q44 I47 A81 L84 T85L36-I42 HydrophobicContact CD1-CD1 4.03Å; L36-I42 HydrophobicContact CD1-CG1 4.26Å; L36-I42 HydrophobicContact CD2-CG1 4.47Å; L36-I42 HydrophobicContact CD2-CG2 4.15Å; I42-Q44 PolarHBondContact O-N 3.5Å; I42-I47 HydrophobicContact CG2-CD1 3.8Å; I42-I47 HydrophobicContact CG2-CG1 3.93Å; I42-A81 HydrophobicContact CG2-CB 4.47Å; I42-L84 HydrophobicContact CD1-CB 3.6Å; I42-L84 HydrophobicContact CD1-CD1 4.24Å; I42-T85 WeakPolarHBondContact CB-OG1 3.2Å; I42-T85 WeakPolarHBondContact CG2-OG1 3.14Å
43R92Very high93.2Very high128 Ų12861.2 Ų61.248%0.48331%0.306SS..  trans-80.5119.2-174.5-65.2-172-69.6131.4-8111H39 H41 P45 A46 I47H39-R43 PolarHBondContact CD2-NE 3.42Å; H39-R43 PolarHBondContact NE2-NE 3.4Å; H39-R43 PolarHBondContact NE2-NH2 2.97Å; H39-R43 VanDerWaalsContact NE2-NH2 3.18Å; H41-R43 PolarHBondContact O-N 2.77Å; R43-P45 VanDerWaalsContact C-CD 3.47Å; R43-P45 VanDerWaalsContact C-N 3.32Å; R43-A46 HydrophobicContact CB-CB 4.42Å; R43-A46 WeakPolarHBondContact O-CA 3.47Å; R43-A46 VanDerWaalsContact O-CB 3.31Å; R43-A46 WeakPolarHBondContact O-CB 3.42Å; R43-A46 PolarHBondContact O-N 3.26Å; R43-I47 PolarHBondContact O-N 3.04Å
44Q94.8Very high93.3Very high67 Ų6761.2 Ų61.231%0.31331%0.306SS..Hα-helixtrans-52.3-39.2177.3-169.765.84700114I42 A46 I47 N48I42-Q44 PolarHBondContact O-N 3.5Å; Q44-A46 PolarHBondContact O-N 2.85Å; Q44-I47 WeakPolarHBondContact O-CB 3.34Å; Q44-I47 PolarHBondContact O-N 2.93Å; Q44-N48 PolarHBondContact NE2-OD1 2.7Å; Q44-N48 VanDerWaalsContact O-CG 3.32Å; Q44-N48 PolarHBondContact O-N 2.97Å; Q44-N48 PolarHBondContact O-OD1 3.44Å
45P94.3Very high93.5Very high86 Ų8663 Ų6356%0.55832%0.315SS*.Hα-helixtrans-59.3-30.2173.3-2735.9000114.5R43 R49R43-P45 VanDerWaalsContact C-CD 3.47Å; R43-P45 VanDerWaalsContact C-N 3.32Å; P45-R49 WeakPolarHBondContact O-CB 3.45Å; P45-R49 PolarHBondContact O-N 3.5Å; P45-R49 VanDerWaalsContact O-N 3.14Å
46A92.6Very high93.7Very high17 Ų1765.2 Ų65.214%0.1433%0.326CS..Hα-helixtrans-72.4-37.1174.300000111.9R43 Q44 R49 L50R43-A46 HydrophobicContact CB-CB 4.42Å; R43-A46 WeakPolarHBondContact O-CA 3.47Å; R43-A46 VanDerWaalsContact O-CB 3.31Å; R43-A46 WeakPolarHBondContact O-CB 3.42Å; R43-A46 PolarHBondContact O-N 3.26Å; Q44-A46 PolarHBondContact O-N 2.85Å; A46-R49 PolarHBondContact O-N 3.14Å; A46-L50 PolarHBondContact O-N 3.26Å; A46-L50 VanDerWaalsContact O-N 3.1Å
47I95.4Very high94Very high1 Ų164.1 Ų64.11%0.00532%0.32CS..Hα-helixtrans-65.5-47.1174.5-50177.2000110.3I42 R43 Q44 R49 L50 W51 A81 Q82 T85I42-I47 HydrophobicContact CG2-CD1 3.8Å; I42-I47 HydrophobicContact CG2-CG1 3.93Å; R43-I47 PolarHBondContact O-N 3.04Å; Q44-I47 WeakPolarHBondContact O-CB 3.34Å; Q44-I47 PolarHBondContact O-N 2.93Å; I47-R49 PolarHBondContact O-N 3.25Å; I47-L50 WeakPolarHBondContact O-CA 3.42Å; I47-L50 WeakPolarHBondContact O-CB 3.46Å; I47-L50 PolarHBondContact O-N 2.93Å; I47-W51 VanDerWaalsContact O-CD1 3.26Å; I47-W51 PolarHBondContact O-N 3.45Å; I47-A81 HydrophobicContact CB-CB 4.47Å; I47-A81 HydrophobicContact CD1-CB 4.17Å; I47-A81 HydrophobicContact CG1-CB 3.82Å; I47-A81 HydrophobicContact CG2-CB 4.13Å; I47-Q82 HydrophobicContact CG2-CB 4.14Å; I47-T85 HydrophobicContact CD1-CG2 4.28Å; I47-T85 WeakPolarHBondContact CD1-OG1 3.34Å
48N96.8Very high94.3Very high90 Ų9064.2 Ų64.248%0.48132%0.317SS..Hα-helixtrans-58.5-37177.3-67.2-0.3000111.6Q44 W51 G52Q44-N48 PolarHBondContact NE2-OD1 2.7Å; Q44-N48 VanDerWaalsContact O-CG 3.32Å; Q44-N48 PolarHBondContact O-N 2.97Å; Q44-N48 PolarHBondContact O-OD1 3.44Å; N48-W51 PolarHBondContact O-N 3.36Å; N48-G52 PolarHBondContact O-N 2.88Å
49R95.3Very high94.7Very high100 Ų10063.8 Ų63.838%0.37732%0.32SS..Hα-helixtrans-67.2-37.8174.8-168.117071.8-96.5-2.3112.4P45 A46 I47 G52 W53 D187P45-R49 WeakPolarHBondContact O-CB 3.45Å; P45-R49 PolarHBondContact O-N 3.5Å; P45-R49 VanDerWaalsContact O-N 3.14Å; A46-R49 PolarHBondContact O-N 3.14Å; I47-R49 PolarHBondContact O-N 3.25Å; R49-G52 PolarHBondContact O-N 3.33Å; R49-W53 WeakPolarHBondContact O-CB 3.38Å; R49-W53 VanDerWaalsContact O-CD1 3.25Å; R49-W53 PolarHBondContact O-N 2.85Å; R49-D187 WeakPolarHBondContact CD-OD1 3.45Å; R49-D187 IonicContact CZ-OD1 2.68Å; R49-D187 IonicContact NE-OD1 2.78Å; R49-D187 PolarHBondContact NE-OD1 2.78Å; R49-D187 IonicContact NE-OD2 3.63Å; R49-D187 IonicContact NH2-OD1 3.81Å
50L96Very high95.1Very high29 Ų2960.7 Ų60.715%0.15231%0.307CS..Hα-helixtrans-63.8-42.6172.5-71.9170.1000111.6A46 I47 W53 G54 F77 A78 A81A46-L50 PolarHBondContact O-N 3.26Å; A46-L50 VanDerWaalsContact O-N 3.1Å; I47-L50 WeakPolarHBondContact O-CA 3.42Å; I47-L50 WeakPolarHBondContact O-CB 3.46Å; I47-L50 PolarHBondContact O-N 2.93Å; L50-W53 PolarHBondContact O-N 3.42Å; L50-G54 PolarHBondContact O-N 2.98Å; L50-F77 HydrophobicContact CD1-CB 4.21Å; L50-F77 HydrophobicContact CD2-CB 4.4Å; L50-A78 HydrophobicContact CB-CB 3.89Å; L50-A81 HydrophobicContact CD1-CB 4.48Å
51W97.8Very high95.6Very high68 Ų6857.6 Ų57.626%0.25828%0.28SS..Hα-helixtrans-59.5-48173.1-75.5113.8000111.9I47 N48 W53 G54 I55 F75 A78 V79 L101I47-W51 VanDerWaalsContact O-CD1 3.26Å; I47-W51 PolarHBondContact O-N 3.45Å; N48-W51 PolarHBondContact O-N 3.36Å; W51-W53 PolarHBondContact O-N 2.85Å; W51-G54 PolarHBondContact O-N 3.46Å; W51-I55 WeakPolarHBondContact O-CG1 3.3Å; W51-I55 PolarHBondContact O-N 3Å; W51-F75 AromaticContact CE3-CD1 3.55Å; W51-F75 HydrophobicContact CE3-CD1 3.55Å; W51-F75 AromaticContact CE3-CE1 3.76Å; W51-F75 HydrophobicContact CE3-CE1 3.76Å; W51-F75 AromaticContact CZ3-CD1 3.47Å; W51-F75 HydrophobicContact CZ3-CD1 3.47Å; W51-F75 VanDerWaalsContact CZ3-CD1 3.47Å; W51-F75 AromaticContact CZ3-CE1 3.94Å; W51-F75 HydrophobicContact CZ3-CE1 3.94Å; W51-A78 HydrophobicContact CD2-CB 3.62Å; W51-A78 HydrophobicContact CE3-CB 4.07Å; W51-A78 HydrophobicContact CG-CB 3.94Å; W51-A78 HydrophobicContact CH2-CB 4.39Å; W51-A78 HydrophobicContact CZ2-CB 3.99Å; W51-A78 HydrophobicContact CZ3-CB 4.43Å; W51-V79 HydrophobicContact CH2-CG2 3.66Å; W51-V79 HydrophobicContact CZ2-CG2 4.12Å; W51-L101 HydrophobicContact CH2-CD1 4.2Å; W51-L101 HydrophobicContact CZ2-CD1 4.36Å; W51-L101 HydrophobicContact CZ2-CD2 4.39Å
52G97.6Very high95.9Very high31 Ų3158.4 Ų58.432%0.3228%0.279SS..Hα-helixtrans-59.4-47177.900000112.6N48 R49 G54 I55 I56N48-G52 PolarHBondContact O-N 2.88Å; R49-G52 PolarHBondContact O-N 3.33Å; G52-G54 VanDerWaalsContact C-N 3.34Å; G52-G54 PolarHBondContact O-N 3.48Å; G52-I55 PolarHBondContact O-N 3.39Å; G52-I56 WeakPolarHBondContact O-CG1 3.09Å; G52-I56 PolarHBondContact O-N 2.87Å
53W97.4Very high96.2Very high56 Ų5661.2 Ų61.221%0.21229%0.293CS..Hα-helixtrans-66.8-33.2174.7-80.9118.5000113.3R49 L50 W51 I55 I56 A57 L74 P190 T191R49-W53 WeakPolarHBondContact O-CB 3.38Å; R49-W53 VanDerWaalsContact O-CD1 3.25Å; R49-W53 PolarHBondContact O-N 2.85Å; L50-W53 PolarHBondContact O-N 3.42Å; W51-W53 PolarHBondContact O-N 2.85Å; W53-I55 VanDerWaalsContact C-N 3.34Å; W53-I56 HydrophobicContact CE3-CB 4.33Å; W53-I56 HydrophobicContact CE3-CD1 4.2Å; W53-I56 HydrophobicContact CE3-CG2 4.23Å; W53-I56 HydrophobicContact CZ3-CD1 4.44Å; W53-I56 HydrophobicContact CZ3-CG2 4.22Å; W53-I56 PolarHBondContact O-N 2.86Å; W53-A57 WeakPolarHBondContact O-CB 3.17Å; W53-A57 PolarHBondContact O-N 3.46Å; W53-L74 HydrophobicContact CB-CD1 3.92Å; W53-P190 HydrophobicContact CB-CB 3.67Å; W53-P190 HydrophobicContact CD2-CB 3.75Å; W53-P190 HydrophobicContact CD2-CG 4.2Å; W53-P190 HydrophobicContact CE3-CB 4.3Å; W53-P190 HydrophobicContact CG-CB 3.45Å; W53-P190 VanDerWaalsContact CG-CB 3.45Å; W53-P190 HydrophobicContact CG-CG 3.94Å; W53-T191 HydrophobicContact CH2-CG2 4.2Å; W53-T191 WeakPolarHBondContact CH2-OG1 2.99Å; W53-T191 WeakPolarHBondContact CZ2-OG1 3.43Å
54G97.3Very high96.4Very high0 Ų055.5 Ų55.50%027%0.274CS..Hα-helixtrans-59.8-44.2173.100000111.7L50 W51 G52 A57 Q58 N72 F75L50-G54 PolarHBondContact O-N 2.98Å; W51-G54 PolarHBondContact O-N 3.46Å; G52-G54 VanDerWaalsContact C-N 3.34Å; G52-G54 PolarHBondContact O-N 3.48Å; G54-A57 PolarHBondContact O-N 2.87Å; G54-Q58 PolarHBondContact O-N 3.19Å; G54-N72 PolarHBondContact O-ND2 3.29Å; G54-F75 WeakPolarHBondContact O-CE2 3.42Å; G54-F75 WeakPolarHBondContact O-CZ 3.44Å
55I97.3Very high96.4Very high97 Ų9755.6 Ų55.650%0.49729%0.293SS..Hα-helixtrans-63.5-49.1175.6-65.7166.8000110.9W51 G52 W53 A57 Q58 F59 F75W51-I55 WeakPolarHBondContact O-CG1 3.3Å; W51-I55 PolarHBondContact O-N 3Å; G52-I55 PolarHBondContact O-N 3.39Å; W53-I55 VanDerWaalsContact C-N 3.34Å; I55-A57 VanDerWaalsContact C-N 3.32Å; I55-A57 PolarHBondContact O-N 3.29Å; I55-Q58 WeakPolarHBondContact O-CB 3.38Å; I55-Q58 PolarHBondContact O-N 3.18Å; I55-Q58 VanDerWaalsContact O-N 3.15Å; I55-F59 HydrophobicContact CG2-CE2 4.34Å; I55-F59 WeakPolarHBondContact O-CD2 3.46Å; I55-F75 HydrophobicContact CG1-CE1 4.17Å; I55-F75 HydrophobicContact CG1-CZ 4.04Å
56I96.7Very high96.4Very high94 Ų9453 Ų5348%0.48227%0.273SS..Hα-helixtrans-59.8-45.2178.9-66.8166.5000110.7G52 W53 Q58 F59G52-I56 WeakPolarHBondContact O-CG1 3.09Å; G52-I56 PolarHBondContact O-N 2.87Å; W53-I56 HydrophobicContact CE3-CB 4.33Å; W53-I56 HydrophobicContact CE3-CD1 4.2Å; W53-I56 HydrophobicContact CE3-CG2 4.23Å; W53-I56 HydrophobicContact CZ3-CD1 4.44Å; W53-I56 HydrophobicContact CZ3-CG2 4.22Å; W53-I56 PolarHBondContact O-N 2.86Å; I56-Q58 PolarHBondContact O-N 3.4Å; I56-F59 PolarHBondContact O-N 3.3Å
57A97.2Very high96.5Very high0 Ų054.1 Ų54.10%028%0.278CS..Hα-helixtrans-68.4-23179.800000112.8W53 G54 I55 F59 A60 Y61 L74 Y193 A194W53-A57 WeakPolarHBondContact O-CB 3.17Å; W53-A57 PolarHBondContact O-N 3.46Å; G54-A57 PolarHBondContact O-N 2.87Å; I55-A57 VanDerWaalsContact C-N 3.32Å; I55-A57 PolarHBondContact O-N 3.29Å; A57-F59 VanDerWaalsContact C-N 3.26Å; A57-F59 PolarHBondContact O-N 2.81Å; A57-A60 PolarHBondContact O-N 3Å; A57-Y61 VanDerWaalsContact O-CB 3.25Å; A57-Y61 WeakPolarHBondContact O-CB 3.28Å; A57-Y61 PolarHBondContact O-N 2.98Å; A57-L74 HydrophobicContact CB-CD1 3.84Å; A57-Y193 HydrophobicContact CB-CD1 3.9Å; A57-Y193 HydrophobicContact CB-CE1 3.96Å; A57-A194 HydrophobicContact CB-CB 4.09Å
58Q97.6Very high96.5Very high35 Ų3562.4 Ų62.416%0.16431%0.31CS..Hα-helixtrans-62.3-35.1178.8-166.164.111.700112.1G54 I55 I56 Y61 Y62 W68 E70 N72 F75G54-Q58 PolarHBondContact O-N 3.19Å; I55-Q58 WeakPolarHBondContact O-CB 3.38Å; I55-Q58 PolarHBondContact O-N 3.18Å; I55-Q58 VanDerWaalsContact O-N 3.15Å; I56-Q58 PolarHBondContact O-N 3.4Å; Q58-Y61 WeakPolarHBondContact O-CB 3.44Å; Q58-Y61 PolarHBondContact O-N 2.68Å; Q58-Y62 WeakPolarHBondContact O-CB 3.36Å; Q58-Y62 PolarHBondContact O-N 3.38Å; Q58-W68 PolarHBondContact NE2-O 3.24Å; Q58-E70 PolarHBondContact NE2-O 3.28Å; Q58-N72 PolarHBondContact N-ND2 3.3Å; Q58-N72 PolarHBondContact OE1-ND2 3.4Å; Q58-F75 HydrophobicContact CB-CE2 4.27Å; Q58-F75 HydrophobicContact CG-CE2 4.47Å
59F96.9Very high96.3Very high155 Ų15564.2 Ų64.268%0.6831%0.311SS*.Hα-helixtrans-63.9-47.4173.9-64.2-82.8000111.5I55 I56 A57 Y61 Y62 L63I55-F59 HydrophobicContact CG2-CE2 4.34Å; I55-F59 WeakPolarHBondContact O-CD2 3.46Å; I56-F59 PolarHBondContact O-N 3.3Å; A57-F59 VanDerWaalsContact C-N 3.26Å; A57-F59 PolarHBondContact O-N 2.81Å; F59-Y61 VanDerWaalsContact C-N 3.29Å; F59-Y61 PolarHBondContact O-N 3.23Å; F59-Y62 PolarHBondContact O-N 3.31Å; F59-L63 WeakPolarHBondContact O-CB 3.38Å; F59-L63 PolarHBondContact O-N 3.36Å
60A96.9Very high96.4Very high10 Ų1060.8 Ų60.88%0.08330%0.299CS..Hα-helixtrans-64.8-35176.200000112.3A57 L63 A64 A194 L197 A198A57-A60 PolarHBondContact O-N 3Å; A60-L63 PolarHBondContact O-N 3.14Å; A60-A64 WeakPolarHBondContact O-CB 3.31Å; A60-A64 PolarHBondContact O-N 3.27Å; A60-A194 VanDerWaalsContact CB-O 3.26Å; A60-A194 WeakPolarHBondContact CB-O 3.24Å; A60-L197 HydrophobicContact CB-CB 3.97Å; A60-A198 HydrophobicContact CB-CB 3.9Å
61Y97Very high96.4Very high7 Ų759.7 Ų59.73%0.02730%0.295CS..Hα-helixtrans-64-47.5176.5-168.1-111000111.5A57 Q58 F59 A64 F66 N72 T111 L197A57-Y61 VanDerWaalsContact O-CB 3.25Å; A57-Y61 WeakPolarHBondContact O-CB 3.28Å; A57-Y61 PolarHBondContact O-N 2.98Å; Q58-Y61 WeakPolarHBondContact O-CB 3.44Å; Q58-Y61 PolarHBondContact O-N 2.68Å; F59-Y61 VanDerWaalsContact C-N 3.29Å; F59-Y61 PolarHBondContact O-N 3.23Å; Y61-A64 PolarHBondContact O-N 3.33Å; Y61-F66 HydrophobicContact CD1-CB 3.62Å; Y61-F66 HydrophobicContact CD1-CG 4.42Å; Y61-F66 HydrophobicContact CD2-CB 4.03Å; Y61-F66 AromaticContact CD2-CD2 3.65Å; Y61-F66 HydrophobicContact CD2-CD2 3.65Å; Y61-F66 HydrophobicContact CD2-CE2 4.34Å; Y61-F66 AromaticContact CD2-CG 3.94Å; Y61-F66 HydrophobicContact CD2-CG 3.94Å; Y61-F66 HydrophobicContact CE1-CB 3.27Å; Y61-F66 HydrophobicContact CE1-CG 4.01Å; Y61-F66 HydrophobicContact CE2-CB 3.7Å; Y61-F66 AromaticContact CE2-CD1 3.96Å; Y61-F66 HydrophobicContact CE2-CD1 3.96Å; Y61-F66 AromaticContact CE2-CD2 3.53Å; Y61-F66 HydrophobicContact CE2-CD2 3.53Å; Y61-F66 HydrophobicContact CE2-CE1 4.48Å; Y61-F66 HydrophobicContact CE2-CE2 4.12Å; Y61-F66 AromaticContact CE2-CG 3.45Å; Y61-F66 HydrophobicContact CE2-CG 3.45Å; Y61-F66 VanDerWaalsContact CE2-CG 3.45Å; Y61-F66 HydrophobicContact CG-CB 3.98Å; Y61-F66 HydrophobicContact CG-CD2 4.25Å; Y61-F66 HydrophobicContact CG-CG 4.38Å; Y61-F66 AromaticContact CZ-CD1 3.85Å; Y61-F66 AromaticContact CZ-CG 3.47Å; Y61-F66 VanDerWaalsContact CZ-CG 3.47Å; Y61-F66 WeakPolarHBondContact O-CB 3.38Å; Y61-F66 WeakPolarHBondContact O-CD2 3.4Å; Y61-F66 PolarHBondContact O-N 2.86Å; Y61-N72 HydrophobicContact CD1-CB 4.16Å; Y61-N72 HydrophobicContact CD2-CB 3.75Å; Y61-N72 HydrophobicContact CE2-CB 4.16Å; Y61-N72 HydrophobicContact CG-CB 3.76Å; Y61-T111 WeakPolarHBondContact OH-CB 3.19Å; Y61-T111 PolarHBondContact OH-OG1 3.45Å; Y61-L197 HydrophobicContact CD2-CD1 3.91Å
62Y96.6Very high96.3Very high146 Ų14656.5 Ų56.557%0.57328%0.283SS*.Hα-helixtrans-64.4-43.5174.5176.4-123.4000112.1Q58 F59 A64 G65 W68Q58-Y62 WeakPolarHBondContact O-CB 3.36Å; Q58-Y62 PolarHBondContact O-N 3.38Å; F59-Y62 PolarHBondContact O-N 3.31Å; Y62-A64 PolarHBondContact O-N 3.41Å; Y62-G65 PolarHBondContact O-N 2.7Å; Y62-W68 HydrophobicContact CD2-CB 3.58Å; Y62-W68 HydrophobicContact CE2-CB 4.02Å; Y62-W68 HydrophobicContact CG-CB 4.11Å
63L96.2Very high96.3Very high68 Ų6855.9 Ų55.936%0.35627%0.272SS..Hα-helixtrans-60-33.5176.9-174.462.7000112.6F59 A60 G65 G201 V202 L205F59-L63 WeakPolarHBondContact O-CB 3.38Å; F59-L63 PolarHBondContact O-N 3.36Å; A60-L63 PolarHBondContact O-N 3.14Å; L63-G65 PolarHBondContact O-N 2.99Å; L63-G201 WeakPolarHBondContact O-CA 3.44Å; L63-V202 HydrophobicContact CD2-CG2 3.82Å; L63-L205 HydrophobicContact CD1-CD1 4.12Å
64A96.1Very high96.3Very high8 Ų853.2 Ų53.27%0.06626%0.262CS..THydrogen-bonded Turntrans-73.11.4174.400000114.2I9 A60 Y61 Y62 F66 L197I9-A64 HydrophobicContact CD1-CB 3.74Å; I9-A64 HydrophobicContact CG1-CB 4.26Å; A60-A64 WeakPolarHBondContact O-CB 3.31Å; A60-A64 PolarHBondContact O-N 3.27Å; Y61-A64 PolarHBondContact O-N 3.33Å; Y62-A64 PolarHBondContact O-N 3.41Å; A64-F66 HydrophobicContact CB-CD2 3.8Å; A64-F66 HydrophobicContact CB-CE2 3.88Å; A64-L197 HydrophobicContact CB-CB 4.39Å; A64-L197 HydrophobicContact CB-CD2 4.19Å
65G95.1Very high96.3Very high69 Ų6954.6 Ų54.671%0.71127%0.268SS*.THydrogen-bonded Turntrans89.17.4176.600000114.8Y62 L63Y62-G65 PolarHBondContact O-N 2.7Å; L63-G65 PolarHBondContact O-N 2.99Å
66F95.1Very high96.3Very high32 Ų3250 Ų5014%0.1424%0.244CC..  trans-78.9154.2174.9-63.3-81.2000111.9I9 Y61 A64 W68 L197I9-F66 HydrophobicContact CD1-CE2 4.21Å; I9-F66 HydrophobicContact CG1-CE2 4.13Å; I9-F66 HydrophobicContact CG1-CZ 4.33Å; Y61-F66 HydrophobicContact CD1-CB 3.62Å; Y61-F66 HydrophobicContact CD1-CG 4.42Å; Y61-F66 HydrophobicContact CD2-CB 4.03Å; Y61-F66 AromaticContact CD2-CD2 3.65Å; Y61-F66 HydrophobicContact CD2-CD2 3.65Å; Y61-F66 HydrophobicContact CD2-CE2 4.34Å; Y61-F66 AromaticContact CD2-CG 3.94Å; Y61-F66 HydrophobicContact CD2-CG 3.94Å; Y61-F66 HydrophobicContact CE1-CB 3.27Å; Y61-F66 HydrophobicContact CE1-CG 4.01Å; Y61-F66 HydrophobicContact CE2-CB 3.7Å; Y61-F66 AromaticContact CE2-CD1 3.96Å; Y61-F66 HydrophobicContact CE2-CD1 3.96Å; Y61-F66 AromaticContact CE2-CD2 3.53Å; Y61-F66 HydrophobicContact CE2-CD2 3.53Å; Y61-F66 HydrophobicContact CE2-CE1 4.48Å; Y61-F66 HydrophobicContact CE2-CE2 4.12Å; Y61-F66 AromaticContact CE2-CG 3.45Å; Y61-F66 HydrophobicContact CE2-CG 3.45Å; Y61-F66 VanDerWaalsContact CE2-CG 3.45Å; Y61-F66 HydrophobicContact CG-CB 3.98Å; Y61-F66 HydrophobicContact CG-CD2 4.25Å; Y61-F66 HydrophobicContact CG-CG 4.38Å; Y61-F66 AromaticContact CZ-CD1 3.85Å; Y61-F66 AromaticContact CZ-CG 3.47Å; Y61-F66 VanDerWaalsContact CZ-CG 3.47Å; Y61-F66 WeakPolarHBondContact O-CB 3.38Å; Y61-F66 WeakPolarHBondContact O-CD2 3.4Å; Y61-F66 PolarHBondContact O-N 2.86Å; A64-F66 HydrophobicContact CB-CD2 3.8Å; A64-F66 HydrophobicContact CB-CE2 3.88Å; F66-W68 PolarHBondContact O-N 3.08Å; F66-L197 HydrophobicContact CE2-CD2 3.99Å
67P95.3Very high96.3Very high40 Ų4045.8 Ų45.826%0.2622%0.223SC..  trans-60.7121.8-179.5-20.631.7000112Y69 E70P67-Y69 HydrophobicContact CB-CD1 4.12Å; P67-Y69 HydrophobicContact CB-CD2 4.49Å; P67-Y69 HydrophobicContact CB-CE1 3.65Å; P67-Y69 HydrophobicContact CB-CE2 4.04Å; P67-Y69 PolarHBondContact O-N 3Å; P67-Y69 VanDerWaalsContact O-N 3.15Å; P67-E70 HydrophobicContact CB-CB 4.44Å; P67-E70 HydrophobicContact CB-CG 4.1Å; P67-E70 PolarHBondContact O-N 3.23Å
68W93.6Very high96.3Very high176 Ų17645.8 Ų45.867%0.66722%0.223SC*.THydrogen-bonded Turntrans-61.6-26.6-175.969.9-91000113.8Q58 Y62 F66 E70Q58-W68 PolarHBondContact NE2-O 3.24Å; Y62-W68 HydrophobicContact CD2-CB 3.58Å; Y62-W68 HydrophobicContact CE2-CB 4.02Å; Y62-W68 HydrophobicContact CG-CB 4.11Å; F66-W68 PolarHBondContact O-N 3.08Å; W68-E70 VanDerWaalsContact C-N 3.3Å
69Y94.1Very high96.3Very high128 Ų12844.2 Ų44.250%0.50222%0.215SC..THydrogen-bonded Turntrans-81.1-9.7179.760.3-100.1000112.8P67 L108P67-Y69 HydrophobicContact CB-CD1 4.12Å; P67-Y69 HydrophobicContact CB-CD2 4.49Å; P67-Y69 HydrophobicContact CB-CE1 3.65Å; P67-Y69 HydrophobicContact CB-CE2 4.04Å; P67-Y69 PolarHBondContact O-N 3Å; P67-Y69 VanDerWaalsContact O-N 3.15Å; Y69-L108 WeakPolarHBondContact O-CD2 3.39Å
70E95.9Very high96.4Very high27 Ų2737.1 Ų37.113%0.12619%0.185CC..SBendtrans-97.2133174.2-62.8-170-164.300110.6Q58 P67 W68 L108 T111Q58-E70 PolarHBondContact NE2-O 3.28Å; P67-E70 HydrophobicContact CB-CB 4.44Å; P67-E70 HydrophobicContact CB-CG 4.1Å; P67-E70 PolarHBondContact O-N 3.23Å; W68-E70 VanDerWaalsContact C-N 3.3Å; E70-L108 CarbonylContact C-O 3.52Å; E70-L108 WeakPolarHBondContact CA-O 3.3Å; E70-T111 WeakPolarHBondContact CB-OG1 3.25Å; E70-T111 WeakPolarHBondContact OE2-CA 3.15Å; E70-T111 WeakPolarHBondContact OE2-CB 3.32Å; E70-T111 WeakPolarHBondContact OE2-CG2 3.49Å; E70-T111 PolarHBondContact OE2-N 3.32Å; E70-T111 PolarHBondContact OE2-OG1 3.25Å
71G96.5Very high96.4Very high7 Ų736.7 Ų36.77%0.07218%0.182CC..PPolyproline II helixtrans-73.9130.6178.800000110.9L108 S112G71-L108 PolarHBondContact N-O 2.87Å; G71-S112 WeakPolarHBondContact O-CB 3.28Å; G71-S112 PolarHBondContact O-OG 2.9Å
72N96.9Very high96.4Very high0 Ų036.9 Ų36.90%018%0.183CC..PPolyproline II helixtrans-61.4166.6171.272.379.4000113.1G54 Q58 Y61 L74 F75 Y193G54-N72 PolarHBondContact O-ND2 3.29Å; Q58-N72 PolarHBondContact N-ND2 3.3Å; Q58-N72 PolarHBondContact OE1-ND2 3.4Å; Y61-N72 HydrophobicContact CD1-CB 4.16Å; Y61-N72 HydrophobicContact CD2-CB 3.75Å; Y61-N72 HydrophobicContact CE2-CB 4.16Å; Y61-N72 HydrophobicContact CG-CB 3.76Å; N72-L74 PolarHBondContact O-N 3.33Å; N72-L74 VanDerWaalsContact OD1-CB 3.27Å; N72-L74 WeakPolarHBondContact OD1-CB 3.43Å; N72-L74 PolarHBondContact OD1-N 2.66Å; N72-F75 WeakPolarHBondContact ND2-CD2 3.16Å; N72-F75 WeakPolarHBondContact ND2-CE2 3.38Å; N72-F75 WeakPolarHBondContact O-CB 3.02Å; N72-F75 PolarHBondContact O-N 3.18Å; N72-Y193 HydrophobicContact CB-CE1 4.08Å
73I96.3Very high96.4Very high19 Ų1930.8 Ų30.810%0.09716%0.161CC..Hα-helixtrans-59.7-26.9-171.2-160.561.4000114.3F25 F75 A76 F77 S112 Y113 Y193F25-I73 HydrophobicContact CD2-CD1 3.68Å; F25-I73 HydrophobicContact CD2-CG1 3.84Å; F25-I73 HydrophobicContact CE2-CD1 3.6Å; F25-I73 HydrophobicContact CE2-CG1 3.95Å; F25-I73 HydrophobicContact CG-CD1 4.45Å; F25-I73 HydrophobicContact CZ-CD1 4.33Å; I73-F75 PolarHBondContact O-N 2.97Å; I73-A76 HydrophobicContact CD1-CB 4.07Å; I73-A76 VanDerWaalsContact O-CB 3.26Å; I73-A76 WeakPolarHBondContact O-CB 3.36Å; I73-A76 PolarHBondContact O-N 2.67Å; I73-F77 HydrophobicContact CG1-CD2 4.37Å; I73-F77 HydrophobicContact CG1-CE2 3.98Å; I73-F77 VanDerWaalsContact O-CD2 3.25Å; I73-F77 WeakPolarHBondContact O-CD2 3.25Å; I73-F77 PolarHBondContact O-N 3.33Å; I73-S112 PolarHBondContact N-OG 3.14Å; I73-Y113 HydrophobicContact CD1-CD2 3.83Å; I73-Y113 HydrophobicContact CD1-CE2 4.28Å; I73-Y193 HydrophobicContact CG2-CD2 4.18Å; I73-Y193 HydrophobicContact CG2-CE1 4.16Å; I73-Y193 HydrophobicContact CG2-CE2 3.58Å
74L97.1Very high96.3Very high0 Ų029.2 Ų29.20%015%0.153CC..Hα-helixtrans-65.7-30.4178.2-59.6-179.9000111.8W53 A57 N72 A76 F77 A78 F189 P190 Y193W53-L74 HydrophobicContact CB-CD1 3.92Å; A57-L74 HydrophobicContact CB-CD1 3.84Å; N72-L74 PolarHBondContact O-N 3.33Å; N72-L74 VanDerWaalsContact OD1-CB 3.27Å; N72-L74 WeakPolarHBondContact OD1-CB 3.43Å; N72-L74 PolarHBondContact OD1-N 2.66Å; L74-A76 VanDerWaalsContact C-N 3.33Å; L74-F77 PolarHBondContact O-N 3.34Å; L74-A78 WeakPolarHBondContact O-CB 3.18Å; L74-A78 PolarHBondContact O-N 3.25Å; L74-F189 HydrophobicContact CD2-CD1 4.06Å; L74-F189 HydrophobicContact CD2-CE1 3.55Å; L74-F189 HydrophobicContact CD2-CZ 4.42Å; L74-P190 HydrophobicContact CD1-CB 3.9Å; L74-P190 HydrophobicContact CD2-CB 4.29Å; L74-Y193 HydrophobicContact CD1-CD1 3.8Å; L74-Y193 HydrophobicContact CD1-CE1 4.4Å; L74-Y193 HydrophobicContact CD2-CD1 4.47Å; L74-Y193 HydrophobicContact CG-CD1 3.86Å; L74-Y193 HydrophobicContact CG-CE1 4.18Å
75F97.5Very high96.2Very high29 Ų2929.7 Ų29.713%0.12716%0.155CC..Hα-helixtrans-65.6-36.2171.4-70.8-59.5000111.8W51 G54 I55 Q58 N72 I73 F77 A78 V79 W105W51-F75 AromaticContact CE3-CD1 3.55Å; W51-F75 HydrophobicContact CE3-CD1 3.55Å; W51-F75 AromaticContact CE3-CE1 3.76Å; W51-F75 HydrophobicContact CE3-CE1 3.76Å; W51-F75 AromaticContact CZ3-CD1 3.47Å; W51-F75 HydrophobicContact CZ3-CD1 3.47Å; W51-F75 VanDerWaalsContact CZ3-CD1 3.47Å; W51-F75 AromaticContact CZ3-CE1 3.94Å; W51-F75 HydrophobicContact CZ3-CE1 3.94Å; G54-F75 WeakPolarHBondContact O-CE2 3.42Å; G54-F75 WeakPolarHBondContact O-CZ 3.44Å; I55-F75 HydrophobicContact CG1-CE1 4.17Å; I55-F75 HydrophobicContact CG1-CZ 4.04Å; Q58-F75 HydrophobicContact CB-CE2 4.27Å; Q58-F75 HydrophobicContact CG-CE2 4.47Å; N72-F75 WeakPolarHBondContact ND2-CD2 3.16Å; N72-F75 WeakPolarHBondContact ND2-CE2 3.38Å; N72-F75 WeakPolarHBondContact O-CB 3.02Å; N72-F75 PolarHBondContact O-N 3.18Å; I73-F75 PolarHBondContact O-N 2.97Å; F75-F77 VanDerWaalsContact C-N 3.33Å; F75-F77 PolarHBondContact O-N 2.89Å; F75-A78 PolarHBondContact O-N 2.91Å; F75-A78 VanDerWaalsContact O-N 3.16Å; F75-V79 WeakPolarHBondContact O-CB 3.37Å; F75-V79 VanDerWaalsContact O-CG2 3.28Å; F75-V79 WeakPolarHBondContact O-CG2 3.25Å; F75-V79 PolarHBondContact O-N 3.22Å; F75-W105 HydrophobicContact CB-CE3 4.35Å; F75-W105 HydrophobicContact CB-CH2 3.82Å; F75-W105 HydrophobicContact CB-CZ3 3.46Å; F75-W105 VanDerWaalsContact CB-CZ3 3.46Å
76A97.5Very high96.2Very high0 Ų029.2 Ų29.20%013%0.132CC..Hα-helixtrans-59.6-44.917400000111.4I73 L74 A80 W105 L121I73-A76 HydrophobicContact CD1-CB 4.07Å; I73-A76 VanDerWaalsContact O-CB 3.26Å; I73-A76 WeakPolarHBondContact O-CB 3.36Å; I73-A76 PolarHBondContact O-N 2.67Å; L74-A76 VanDerWaalsContact C-N 3.33Å; A76-A80 WeakPolarHBondContact O-CB 3.16Å; A76-A80 PolarHBondContact O-N 3.14Å; A76-W105 HydrophobicContact CB-CH2 4.17Å; A76-W105 HydrophobicContact CB-CZ2 3.55Å; A76-L121 HydrophobicContact CB-CD1 4.4Å
77F97.4Very high96Very high5 Ų531.2 Ų31.22%0.02215%0.148CC..Hα-helixtrans-62-42.4173.8-74.7-82.6000112.2F25 F28 W32 L50 I73 L74 F75 A81 L121 F189F25-F77 HydrophobicContact CD2-CE2 4.38Å; F25-F77 HydrophobicContact CD2-CZ 4.34Å; F25-F77 HydrophobicContact CE2-CE2 4.03Å; F25-F77 AromaticContact CE2-CZ 3.98Å; F25-F77 HydrophobicContact CE2-CZ 3.98Å; F28-F77 HydrophobicContact CB-CZ 4Å; W32-F77 HydrophobicContact CB-CD1 4.11Å; W32-F77 HydrophobicContact CB-CE1 3.65Å; W32-F77 AromaticContact CD1-CD1 3.56Å; W32-F77 AromaticContact CD1-CE1 3.98Å; W32-F77 AromaticContact CD2-CD1 3.75Å; W32-F77 HydrophobicContact CD2-CD1 3.75Å; W32-F77 HydrophobicContact CD2-CE1 4.08Å; W32-F77 AromaticContact CE2-CD1 3.81Å; W32-F77 HydrophobicContact CE3-CD1 4.46Å; W32-F77 AromaticContact CG-CD1 3.56Å; W32-F77 HydrophobicContact CG-CD1 3.56Å; W32-F77 AromaticContact CG-CE1 3.64Å; W32-F77 HydrophobicContact CG-CE1 3.64Å; W32-F77 AromaticContact NE1-CD1 3.72Å; L50-F77 HydrophobicContact CD1-CB 4.21Å; L50-F77 HydrophobicContact CD2-CB 4.4Å; I73-F77 HydrophobicContact CG1-CD2 4.37Å; I73-F77 HydrophobicContact CG1-CE2 3.98Å; I73-F77 VanDerWaalsContact O-CD2 3.25Å; I73-F77 WeakPolarHBondContact O-CD2 3.25Å; I73-F77 PolarHBondContact O-N 3.33Å; L74-F77 PolarHBondContact O-N 3.34Å; F75-F77 VanDerWaalsContact C-N 3.33Å; F75-F77 PolarHBondContact O-N 2.89Å; F77-A81 VanDerWaalsContact O-CB 3.32Å; F77-A81 WeakPolarHBondContact O-CB 3.46Å; F77-A81 PolarHBondContact O-N 3.24Å; F77-L121 HydrophobicContact CD1-CD1 4.34Å; F77-L121 HydrophobicContact CD1-CD2 3.43Å; F77-L121 VanDerWaalsContact CD1-CD2 3.43Å; F77-L121 HydrophobicContact CE1-CD2 3.22Å; F77-L121 HydrophobicContact CG-CD2 4.31Å; F77-L121 HydrophobicContact CZ-CD2 3.95Å; F77-F189 HydrophobicContact CE2-CE1 4.2Å; F77-F189 HydrophobicContact CE2-CZ 4.4Å
78A97.5Very high95.6Very high0 Ų032.5 Ų32.50%015%0.151CC..Hα-helixtrans-66.3-45.3-18000000112.1L50 W51 L74 F75 A81 Q82L50-A78 HydrophobicContact CB-CB 3.89Å; W51-A78 HydrophobicContact CD2-CB 3.62Å; W51-A78 HydrophobicContact CE3-CB 4.07Å; W51-A78 HydrophobicContact CG-CB 3.94Å; W51-A78 HydrophobicContact CH2-CB 4.39Å; W51-A78 HydrophobicContact CZ2-CB 3.99Å; W51-A78 HydrophobicContact CZ3-CB 4.43Å; L74-A78 WeakPolarHBondContact O-CB 3.18Å; L74-A78 PolarHBondContact O-N 3.25Å; F75-A78 PolarHBondContact O-N 2.91Å; F75-A78 VanDerWaalsContact O-N 3.16Å; A78-A81 PolarHBondContact O-N 2.89Å; A78-Q82 WeakPolarHBondContact O-CB 3.3Å; A78-Q82 PolarHBondContact O-N 3.41Å
79V97.8Very high95.1Very high2 Ų227.1 Ų27.11%0.01214%0.138CC..Hα-helixtrans-59.2-51.8174.7169.20000110.2W51 F75 A81 Q82 V83 L101 W105 L118W51-V79 HydrophobicContact CH2-CG2 3.66Å; W51-V79 HydrophobicContact CZ2-CG2 4.12Å; F75-V79 WeakPolarHBondContact O-CB 3.37Å; F75-V79 VanDerWaalsContact O-CG2 3.28Å; F75-V79 WeakPolarHBondContact O-CG2 3.25Å; F75-V79 PolarHBondContact O-N 3.22Å; V79-A81 PolarHBondContact O-N 3.49Å; V79-Q82 PolarHBondContact O-N 2.85Å; V79-V83 HydrophobicContact CG1-CG2 4.3Å; V79-V83 WeakPolarHBondContact O-CB 3.5Å; V79-V83 VanDerWaalsContact O-CG2 3.28Å; V79-V83 WeakPolarHBondContact O-CG2 3.29Å; V79-V83 PolarHBondContact O-N 3.1Å; V79-L101 HydrophobicContact CG1-CD2 4.4Å; V79-L101 HydrophobicContact CG1-CG 4.2Å; V79-L101 HydrophobicContact CG2-CD1 4.31Å; V79-L101 HydrophobicContact CG2-CG 4.36Å; V79-W105 HydrophobicContact CB-CG 4.45Å; V79-W105 HydrophobicContact CG1-CB 4.1Å; V79-W105 HydrophobicContact CG1-CG 4.07Å; V79-W105 HydrophobicContact CG2-CB 4.19Å; V79-W105 HydrophobicContact CG2-CD2 4.04Å; V79-W105 HydrophobicContact CG2-CE3 4.05Å; V79-W105 HydrophobicContact CG2-CG 4.11Å; V79-L118 HydrophobicContact CB-CD2 4.27Å; V79-L118 HydrophobicContact CG1-CD1 4.19Å; V79-L118 HydrophobicContact CG1-CD2 3.84Å
80A97.6Very high94.4Very high6 Ų632.1 Ų32.15%0.0516%0.155CC..Hα-helixtrans-59.1-45.6178.900000111.8W32 A76 Q82 L84 L118 L121W32-A80 HydrophobicContact CH2-CB 4.08Å; A76-A80 WeakPolarHBondContact O-CB 3.16Å; A76-A80 PolarHBondContact O-N 3.14Å; A80-Q82 PolarHBondContact O-N 3.45Å; A80-L84 WeakPolarHBondContact O-CB 3.42Å; A80-L84 WeakPolarHBondContact O-CG 3.4Å; A80-L84 PolarHBondContact O-N 2.83Å; A80-L118 HydrophobicContact CB-CD2 4.05Å; A80-L121 HydrophobicContact CB-CB 3.76Å; A80-L121 HydrophobicContact CB-CD1 3.59Å; A80-L121 HydrophobicContact CB-CG 4.29Å
81A96.9Very high94.2Very high1 Ų133.1 Ų33.11%0.00817%0.165CC..Hα-helixtrans-60.2-45.1177.600000112.1W32 I42 I47 L50 F77 A78 V79 T85W32-A81 HydrophobicContact CZ2-CB 3.87Å; I42-A81 HydrophobicContact CG2-CB 4.47Å; I47-A81 HydrophobicContact CB-CB 4.47Å; I47-A81 HydrophobicContact CD1-CB 4.17Å; I47-A81 HydrophobicContact CG1-CB 3.82Å; I47-A81 HydrophobicContact CG2-CB 4.13Å; L50-A81 HydrophobicContact CD1-CB 4.48Å; F77-A81 VanDerWaalsContact O-CB 3.32Å; F77-A81 WeakPolarHBondContact O-CB 3.46Å; F77-A81 PolarHBondContact O-N 3.24Å; A78-A81 PolarHBondContact O-N 2.89Å; V79-A81 PolarHBondContact O-N 3.49Å; A81-T85 WeakPolarHBondContact O-CB 3.22Å; A81-T85 PolarHBondContact O-N 3.33Å; A81-T85 PolarHBondContact O-OG1 3.29Å
82Q97.1Very high93.9Very high12 Ų1235.6 Ų35.66%0.05619%0.191CC..Hα-helixtrans-66.8-44.6-177.5-168.563.669.700111.5I47 A78 V79 A80 T85 W86 L101I47-Q82 HydrophobicContact CG2-CB 4.14Å; A78-Q82 WeakPolarHBondContact O-CB 3.3Å; A78-Q82 PolarHBondContact O-N 3.41Å; V79-Q82 PolarHBondContact O-N 2.85Å; A80-Q82 PolarHBondContact O-N 3.45Å; Q82-T85 PolarHBondContact O-N 3.42Å; Q82-W86 HydrophobicContact CG-CD2 4.01Å; Q82-W86 HydrophobicContact CG-CE3 4.05Å; Q82-W86 HydrophobicContact CG-CH2 3.61Å; Q82-W86 HydrophobicContact CG-CZ2 3.54Å; Q82-W86 HydrophobicContact CG-CZ3 3.86Å; Q82-W86 PolarHBondContact O-N 2.9Å; Q82-L101 HydrophobicContact CB-CD2 3.87Å; Q82-L101 HydrophobicContact CG-CD2 3.88Å
83V96.1Very high93.7Very high18 Ų1845.3 Ų45.311%0.10923%0.228CC..Hα-helixtrans-59.7-51.1175.5168.70000110.4V79 T85 W86 C87 A98 L101 M102V79-V83 HydrophobicContact CG1-CG2 4.3Å; V79-V83 WeakPolarHBondContact O-CB 3.5Å; V79-V83 VanDerWaalsContact O-CG2 3.28Å; V79-V83 WeakPolarHBondContact O-CG2 3.29Å; V79-V83 PolarHBondContact O-N 3.1Å; V83-T85 VanDerWaalsContact C-N 3.3Å; V83-T85 PolarHBondContact O-N 3.28Å; V83-W86 PolarHBondContact O-N 3.35Å; V83-C87 PolarHBondContact O-N 3.2Å; V83-C87 PolarHBondContact O-SG 3.22Å; V83-A98 HydrophobicContact CG1-CB 4.27Å; V83-A98 HydrophobicContact CG2-CB 4.37Å; V83-L101 HydrophobicContact CG2-CD2 4.19Å; V83-M102 HydrophobicContact CG1-SD 4.07Å; V83-M102 HydrophobicContact CG2-CG 3.76Å; V83-M102 HydrophobicContact CG2-SD 4.34Å
84L94.8Very high93.5Very high35 Ų3549.3 Ų49.318%0.18324%0.242CC..Hα-helixtrans-58-42.7178.9-71.6170.2000111.9W32 I42 A80 W86 C87 E88 A122 N125W32-L84 HydrophobicContact CH2-CD1 3.93Å; W32-L84 HydrophobicContact CZ3-CD1 4.34Å; I42-L84 HydrophobicContact CD1-CB 3.6Å; I42-L84 HydrophobicContact CD1-CD1 4.24Å; A80-L84 WeakPolarHBondContact O-CB 3.42Å; A80-L84 WeakPolarHBondContact O-CG 3.4Å; A80-L84 PolarHBondContact O-N 2.83Å; L84-W86 PolarHBondContact O-N 3.44Å; L84-C87 PolarHBondContact O-N 3.15Å; L84-E88 PolarHBondContact O-N 3.14Å; L84-E88 VanDerWaalsContact O-N 3.14Å; L84-A122 HydrophobicContact CD2-CB 4.46Å; L84-N125 HydrophobicContact CD1-CB 4.09Å
85T94.8Very high93.3Very high17 Ų1752.6 Ų52.610%0.10426%0.262CS..Hα-helixtrans-64-41.7178.5-55.40000112I42 I47 A81 Q82 V83 E88I42-T85 WeakPolarHBondContact CB-OG1 3.2Å; I42-T85 WeakPolarHBondContact CG2-OG1 3.14Å; I47-T85 HydrophobicContact CD1-CG2 4.28Å; I47-T85 WeakPolarHBondContact CD1-OG1 3.34Å; A81-T85 WeakPolarHBondContact O-CB 3.22Å; A81-T85 PolarHBondContact O-N 3.33Å; A81-T85 PolarHBondContact O-OG1 3.29Å; Q82-T85 PolarHBondContact O-N 3.42Å; V83-T85 VanDerWaalsContact C-N 3.3Å; V83-T85 PolarHBondContact O-N 3.28Å; T85-E88 PolarHBondContact O-N 2.9Å
86W94.5Very high93.2Very high60 Ų6053.8 Ų53.823%0.22728%0.278CS..Hα-helixtrans-67.6-38.5176.9-74.6-16.5000112.2Q82 V83 L84 E88 T89 R94 A97 A98 L101Q82-W86 HydrophobicContact CG-CD2 4.01Å; Q82-W86 HydrophobicContact CG-CE3 4.05Å; Q82-W86 HydrophobicContact CG-CH2 3.61Å; Q82-W86 HydrophobicContact CG-CZ2 3.54Å; Q82-W86 HydrophobicContact CG-CZ3 3.86Å; Q82-W86 PolarHBondContact O-N 2.9Å; V83-W86 PolarHBondContact O-N 3.35Å; L84-W86 PolarHBondContact O-N 3.44Å; W86-E88 VanDerWaalsContact C-N 3.31Å; W86-E88 PolarHBondContact O-N 2.92Å; W86-T89 PolarHBondContact O-N 3.26Å; W86-T89 PolarHBondContact O-OG1 3.41Å; W86-R94 HydrophobicContact CB-CB 4Å; W86-R94 HydrophobicContact CG-CB 4.22Å; W86-R94 HydrophobicContact CG-CG 4.49Å; W86-A97 HydrophobicContact CD2-CB 4.39Å; W86-A97 HydrophobicContact CE3-CB 3.93Å; W86-A97 HydrophobicContact CH2-CB 4.06Å; W86-A97 VanDerWaalsContact CZ3-C 3.49Å; W86-A97 HydrophobicContact CZ3-CB 3.75Å; W86-A97 WeakPolarHBondContact CZ3-O 3.39Å; W86-A98 HydrophobicContact CB-CB 4.43Å; W86-A98 HydrophobicContact CE3-CB 3.98Å; W86-L101 HydrophobicContact CH2-CD2 4.19Å; W86-L101 HydrophobicContact CZ3-CB 4.04Å; W86-L101 HydrophobicContact CZ3-CD2 3.77Å
87C90.4Very high93.1Very high73 Ų7354.7 Ų54.749%0.49329%0.285SS..Hα-helixtrans-61.2-34.9174.7-700000113.2V83 L84 T89V83-C87 PolarHBondContact O-N 3.2Å; V83-C87 PolarHBondContact O-SG 3.22Å; L84-C87 PolarHBondContact O-N 3.15Å; C87-T89 PolarHBondContact O-N 3.39Å
88E87.5Confident93Very high68 Ų6854.6 Ų54.632%0.31829%0.285SS..Hα-helixtrans-62.2-28.3178.5-74.8-176.2175.700112.8H41 L84 T85 W86 R129H41-E88 IonicContact ND1-OE2 3.54Å; L84-E88 PolarHBondContact O-N 3.14Å; L84-E88 VanDerWaalsContact O-N 3.14Å; T85-E88 PolarHBondContact O-N 2.9Å; W86-E88 VanDerWaalsContact C-N 3.31Å; W86-E88 PolarHBondContact O-N 2.92Å; E88-R129 IonicContact OE1-CZ 3.26Å; E88-R129 IonicContact OE1-NH1 3.58Å; E88-R129 PolarHBondContact OE1-NH1 2.97Å; E88-R129 IonicContact OE1-NH2 2.8Å
89T82.7Confident92.9Very high62 Ų6259.4 Ų59.438%0.3831%0.31SS..THydrogen-bonded Turntrans-98.33.2-168.758.60000115.9W86 C87 S91 R94W86-T89 PolarHBondContact O-N 3.26Å; W86-T89 PolarHBondContact O-OG1 3.41Å; C87-T89 PolarHBondContact O-N 3.39Å; T89-S91 VanDerWaalsContact C-N 3.3Å; T89-S91 PolarHBondContact O-N 2.87Å; T89-S91 VanDerWaalsContact O-N 3.08Å; T89-R94 WeakPolarHBondContact OG1-CD 3.37Å; T89-R94 PolarHBondContact OG1-NH1 3.42Å
90R80.2Confident92.9Very high233 Ų23364.4 Ų64.488%0.87934%0.336SS*.THydrogen-bonded Turntrans42.945.9169.8-60.1-170.7-179.51781.3115.5
91S90.3Very high92.8Very high48 Ų4865.6 Ų65.634%0.33634%0.341SS..  trans-109.2132.9174.4170.70000110.3T89 W93 R94 T95T89-S91 VanDerWaalsContact C-N 3.3Å; T89-S91 PolarHBondContact O-N 2.87Å; T89-S91 VanDerWaalsContact O-N 3.08Å; S91-W93 VanDerWaalsContact C-N 3.27Å; S91-W93 PolarHBondContact O-N 3.32Å; S91-R94 WeakPolarHBondContact O-CA 3.3Å; S91-R94 WeakPolarHBondContact O-CB 3.47Å; S91-R94 PolarHBondContact O-N 2.8Å; S91-T95 PolarHBondContact O-N 2.9Å; S91-T95 PolarHBondContact O-OG1 2.98Å
92G90.2Very high92.8Very high60 Ų6069.2 Ų69.262%0.61936%0.359SS*.Hα-helixtrans-55-40.4-179.700000113.4R94 T95 A96G92-R94 PolarHBondContact O-N 2.82Å; G92-T95 PolarHBondContact O-N 2.95Å; G92-A96 PolarHBondContact O-N 3.01Å
93W93.1Very high92.7Very high204 Ų20471.8 Ų71.877%0.77338%0.382SS*.Hα-helixtrans-61.3-42.6173.6173.4-102.4000112.4S91 A96 A97S91-W93 VanDerWaalsContact C-N 3.27Å; S91-W93 PolarHBondContact O-N 3.32Å; W93-A96 PolarHBondContact O-N 3.06Å; W93-A97 WeakPolarHBondContact O-CB 3.36Å; W93-A97 PolarHBondContact O-N 2.89Å
94R93Very high92.7Very high103 Ų10375.9 Ų75.939%0.38940%0.403SS..Hα-helixtrans-70.2-34.6179.4-68.7-176.4-178.6-170.42.8112W86 T89 S91 G92 A97 A98W86-R94 HydrophobicContact CB-CB 4Å; W86-R94 HydrophobicContact CG-CB 4.22Å; W86-R94 HydrophobicContact CG-CG 4.49Å; T89-R94 WeakPolarHBondContact OG1-CD 3.37Å; T89-R94 PolarHBondContact OG1-NH1 3.42Å; S91-R94 WeakPolarHBondContact O-CA 3.3Å; S91-R94 WeakPolarHBondContact O-CB 3.47Å; S91-R94 PolarHBondContact O-N 2.8Å; G92-R94 PolarHBondContact O-N 2.82Å; R94-A97 PolarHBondContact O-N 3.1Å; R94-A98 WeakPolarHBondContact O-CB 3.27Å; R94-A98 PolarHBondContact O-N 3.31Å
95T92.7Very high92.8Very high69 Ų6974.7 Ų74.742%0.42340%0.396SS..Hα-helixtrans-62.9-47.4170.6-55.90000110.7S91 G92 A97 A98 I99S91-T95 PolarHBondContact O-N 2.9Å; S91-T95 PolarHBondContact O-OG1 2.98Å; G92-T95 PolarHBondContact O-N 2.95Å; T95-A97 VanDerWaalsContact C-N 3.33Å; T95-A97 PolarHBondContact O-N 2.95Å; T95-A98 PolarHBondContact O-N 3.22Å; T95-I99 HydrophobicContact CG2-CD1 4.11Å; T95-I99 WeakPolarHBondContact O-CG1 3.06Å; T95-I99 PolarHBondContact O-N 3.26Å
96A95.2Very high92.7Very high54 Ų5475.3 Ų75.345%0.44641%0.406SS..Hα-helixtrans-60.5-42.6175.700000111.9G92 W93 A98 I99 L100G92-A96 PolarHBondContact O-N 3.01Å; W93-A96 PolarHBondContact O-N 3.06Å; A96-A98 PolarHBondContact O-N 3.39Å; A96-I99 PolarHBondContact O-N 3.41Å; A96-L100 WeakPolarHBondContact O-CB 3.42Å; A96-L100 PolarHBondContact O-N 2.93Å
97A96.3Very high92.7Very high19 Ų1977.4 Ų77.416%0.15743%0.427CS..Hα-helixtrans-63.4-40.1176.200000112.4W86 W93 R94 T95 L100 L101W86-A97 HydrophobicContact CD2-CB 4.39Å; W86-A97 HydrophobicContact CE3-CB 3.93Å; W86-A97 HydrophobicContact CH2-CB 4.06Å; W86-A97 VanDerWaalsContact CZ3-C 3.49Å; W86-A97 HydrophobicContact CZ3-CB 3.75Å; W86-A97 WeakPolarHBondContact CZ3-O 3.39Å; W93-A97 WeakPolarHBondContact O-CB 3.36Å; W93-A97 PolarHBondContact O-N 2.89Å; R94-A97 PolarHBondContact O-N 3.1Å; T95-A97 VanDerWaalsContact C-N 3.33Å; T95-A97 PolarHBondContact O-N 2.95Å; A97-L100 PolarHBondContact O-N 2.78Å; A97-L101 WeakPolarHBondContact O-CB 3.17Å; A97-L101 PolarHBondContact O-N 2.82Å
98A95.5Very high93Very high3 Ų377.6 Ų77.63%0.02542%0.423CS..Hα-helixtrans-63.6-44.9175.700000111.9V83 W86 R94 T95 A96 L101 M102V83-A98 HydrophobicContact CG1-CB 4.27Å; V83-A98 HydrophobicContact CG2-CB 4.37Å; W86-A98 HydrophobicContact CB-CB 4.43Å; W86-A98 HydrophobicContact CE3-CB 3.98Å; R94-A98 WeakPolarHBondContact O-CB 3.27Å; R94-A98 PolarHBondContact O-N 3.31Å; T95-A98 PolarHBondContact O-N 3.22Å; A96-A98 PolarHBondContact O-N 3.39Å; A98-L101 PolarHBondContact O-N 3.43Å; A98-M102 WeakPolarHBondContact O-CG 3.11Å; A98-M102 PolarHBondContact O-N 3.34Å
99I94.7Very high93.4Very high101 Ų10174.6 Ų74.652%0.51841%0.409SS..Hα-helixtrans-60.8-47.8175.8-67.1166.7000110.2T95 A96 L101 M102 A103T95-I99 HydrophobicContact CG2-CD1 4.11Å; T95-I99 WeakPolarHBondContact O-CG1 3.06Å; T95-I99 PolarHBondContact O-N 3.26Å; A96-I99 PolarHBondContact O-N 3.41Å; I99-L101 PolarHBondContact O-N 3.24Å; I99-M102 HydrophobicContact CG1-CE 4.49Å; I99-M102 PolarHBondContact O-N 2.93Å; I99-A103 WeakPolarHBondContact O-CB 3.33Å; I99-A103 PolarHBondContact O-N 3.4Å
100L96.8Very high93.7Very high107 Ų10774.5 Ų74.556%0.5642%0.421SS*.Hα-helixtrans-59.5-45.2178179.362.1000111.6A96 A97 M102 A103 L104A96-L100 WeakPolarHBondContact O-CB 3.42Å; A96-L100 PolarHBondContact O-N 2.93Å; A97-L100 PolarHBondContact O-N 2.78Å; L100-M102 PolarHBondContact O-N 3.16Å; L100-A103 PolarHBondContact O-N 2.92Å; L100-L104 HydrophobicContact CD1-CD1 4.23Å; L100-L104 HydrophobicContact CD1-CG 4.27Å; L100-L104 HydrophobicContact CG-CD1 4.11Å; L100-L104 WeakPolarHBondContact O-CG 3.39Å; L100-L104 PolarHBondContact O-N 2.95Å
101L97.1Very high94.2Very high30 Ų3066.2 Ų66.216%0.15740%0.396CS..Hα-helixtrans-63.2-42179.2-178.161.6000112W51 V79 Q82 V83 W86 A97 A98 I99 L104 W105W51-L101 HydrophobicContact CH2-CD1 4.2Å; W51-L101 HydrophobicContact CZ2-CD1 4.36Å; W51-L101 HydrophobicContact CZ2-CD2 4.39Å; V79-L101 HydrophobicContact CG1-CD2 4.4Å; V79-L101 HydrophobicContact CG1-CG 4.2Å; V79-L101 HydrophobicContact CG2-CD1 4.31Å; V79-L101 HydrophobicContact CG2-CG 4.36Å; Q82-L101 HydrophobicContact CB-CD2 3.87Å; Q82-L101 HydrophobicContact CG-CD2 3.88Å; V83-L101 HydrophobicContact CG2-CD2 4.19Å; W86-L101 HydrophobicContact CH2-CD2 4.19Å; W86-L101 HydrophobicContact CZ3-CB 4.04Å; W86-L101 HydrophobicContact CZ3-CD2 3.77Å; A97-L101 WeakPolarHBondContact O-CB 3.17Å; A97-L101 PolarHBondContact O-N 2.82Å; A98-L101 PolarHBondContact O-N 3.43Å; I99-L101 PolarHBondContact O-N 3.24Å; L101-L104 PolarHBondContact O-N 2.99Å; L101-W105 WeakPolarHBondContact O-CB 3.48Å; L101-W105 PolarHBondContact O-N 3.45Å
102M95.8Very high94.4Very high78 Ų7864 Ų6438%0.38438%0.381SS..Hα-helixtrans-65.3-40.2175-69.8-174.4-6400112V83 A98 I99 L100 W105 G106 L118V83-M102 HydrophobicContact CG1-SD 4.07Å; V83-M102 HydrophobicContact CG2-CG 3.76Å; V83-M102 HydrophobicContact CG2-SD 4.34Å; A98-M102 WeakPolarHBondContact O-CG 3.11Å; A98-M102 PolarHBondContact O-N 3.34Å; I99-M102 HydrophobicContact CG1-CE 4.49Å; I99-M102 PolarHBondContact O-N 2.93Å; L100-M102 PolarHBondContact O-N 3.16Å; M102-W105 PolarHBondContact O-N 3.4Å; M102-G106 PolarHBondContact O-N 3.18Å; M102-L118 HydrophobicContact CG-CD1 4.21Å
103A95.9Very high94.5Very high66 Ų6663.6 Ų63.655%0.54536%0.361SS..Hα-helixtrans-63.6-40.1176.600000112.1I99 L100 P107I99-A103 WeakPolarHBondContact O-CB 3.33Å; I99-A103 PolarHBondContact O-N 3.4Å; L100-A103 PolarHBondContact O-N 2.92Å; A103-P107 WeakPolarHBondContact O-CD 3.44Å
104L95.8Very high94.6Very high103 Ų10354.4 Ų54.454%0.53933%0.33SS..Hα-helixtrans-70.7-34.6174.6-69173.2000112.5L100 L101 L108L100-L104 HydrophobicContact CD1-CD1 4.23Å; L100-L104 HydrophobicContact CD1-CG 4.27Å; L100-L104 HydrophobicContact CG-CD1 4.11Å; L100-L104 WeakPolarHBondContact O-CG 3.39Å; L100-L104 PolarHBondContact O-N 2.95Å; L101-L104 PolarHBondContact O-N 2.99Å; L104-L108 WeakPolarHBondContact O-CD1 3.48Å; L104-L108 WeakPolarHBondContact O-CG 3.22Å
105W96.2Very high94.5Very high11 Ų1155.4 Ų55.44%0.04234%0.341CS..Hα-helixtrans-67.2-37.7176.7175.8-112000112.4F75 A76 V79 L101 M102 L108 S109F75-W105 HydrophobicContact CB-CE3 4.35Å; F75-W105 HydrophobicContact CB-CH2 3.82Å; F75-W105 HydrophobicContact CB-CZ3 3.46Å; F75-W105 VanDerWaalsContact CB-CZ3 3.46Å; A76-W105 HydrophobicContact CB-CH2 4.17Å; A76-W105 HydrophobicContact CB-CZ2 3.55Å; V79-W105 HydrophobicContact CB-CG 4.45Å; V79-W105 HydrophobicContact CG1-CB 4.1Å; V79-W105 HydrophobicContact CG1-CG 4.07Å; V79-W105 HydrophobicContact CG2-CB 4.19Å; V79-W105 HydrophobicContact CG2-CD2 4.04Å; V79-W105 HydrophobicContact CG2-CE3 4.05Å; V79-W105 HydrophobicContact CG2-CG 4.11Å; L101-W105 WeakPolarHBondContact O-CB 3.48Å; L101-W105 PolarHBondContact O-N 3.45Å; M102-W105 PolarHBondContact O-N 3.4Å; W105-L108 HydrophobicContact CE3-CB 4.32Å; W105-L108 HydrophobicContact CZ3-CB 4.48Å; W105-L108 CarbonylContact O-C 3.57Å; W105-L108 WeakPolarHBondContact O-CA 3.45Å; W105-L108 PolarHBondContact O-N 2.9Å; W105-S109 VanDerWaalsContact NE1-CB 3.32Å; W105-S109 VanDerWaalsContact O-CB 3.24Å; W105-S109 WeakPolarHBondContact O-CB 3.48Å; W105-S109 PolarHBondContact O-N 3.31Å; W105-S109 VanDerWaalsContact O-N 3.16Å; W105-S109 PolarHBondContact O-OG 3.5Å
106G94Very high94.7Very high30 Ų3053.4 Ų53.431%0.30933%0.332SS..Hα-helixtrans-45.6-59.4-175.700000113.9M102 L108 S109M102-G106 PolarHBondContact O-N 3.18Å; G106-L108 PolarHBondContact O-N 3.03Å; G106-S109 PolarHBondContact O-N 2.98Å; G106-S109 PolarHBondContact O-OG 2.95Å
107P94.5Very high94.7Very high103 Ų10350.8 Ų50.867%0.66931%0.31SS*.Hα-helixtrans-63.7-25.6178.9-23.734.1000114.8A103 S109A103-P107 WeakPolarHBondContact O-CD 3.44Å; P107-S109 VanDerWaalsContact C-N 3.33Å
108L95.5Very high94.8Very high78 Ų7850.9 Ų50.941%0.40831%0.308SS..Hα-helixtrans-88.6-1.6-176.6-55.6175.2000112.8Y69 E70 G71 L104 W105 G106Y69-L108 WeakPolarHBondContact O-CD2 3.39Å; E70-L108 CarbonylContact C-O 3.52Å; E70-L108 WeakPolarHBondContact CA-O 3.3Å; G71-L108 PolarHBondContact N-O 2.87Å; L104-L108 WeakPolarHBondContact O-CD1 3.48Å; L104-L108 WeakPolarHBondContact O-CG 3.22Å; W105-L108 HydrophobicContact CE3-CB 4.32Å; W105-L108 HydrophobicContact CZ3-CB 4.48Å; W105-L108 CarbonylContact O-C 3.57Å; W105-L108 WeakPolarHBondContact O-CA 3.45Å; W105-L108 PolarHBondContact O-N 2.9Å; G106-L108 PolarHBondContact O-N 3.03Å
109S95.5Very high94.8Very high5 Ų555 Ų554%0.03533%0.329CS..  trans-1079.6-162.667.20000115.3W105 G106 P107 T111 S112 Y113 G114W105-S109 VanDerWaalsContact NE1-CB 3.32Å; W105-S109 VanDerWaalsContact O-CB 3.24Å; W105-S109 WeakPolarHBondContact O-CB 3.48Å; W105-S109 PolarHBondContact O-N 3.31Å; W105-S109 VanDerWaalsContact O-N 3.16Å; W105-S109 PolarHBondContact O-OG 3.5Å; G106-S109 PolarHBondContact O-N 2.98Å; G106-S109 PolarHBondContact O-OG 2.95Å; P107-S109 VanDerWaalsContact C-N 3.33Å; S109-T111 VanDerWaalsContact C-N 3.34Å; S109-T111 PolarHBondContact O-N 2.97Å; S109-S112 CarbonylContact O-C 3.33Å; S109-S112 WeakPolarHBondContact O-CA 3.32Å; S109-S112 PolarHBondContact O-N 2.93Å; S109-Y113 PolarHBondContact O-N 3.25Å; S109-G114 PolarHBondContact O-N 3.5Å; S109-G114 VanDerWaalsContact O-N 3.12Å; S109-G114 WeakPolarHBondContact OG-CA 3.33Å
110G90.2Very high95Very high60 Ų6050.1 Ų50.162%0.61930%0.304SS*.THydrogen-bonded Turntrans-51.9-47.2-172.900000113.8
111T90.8Very high95Very high59 Ų5945 Ų4536%0.36228%0.278SS..THydrogen-bonded Turntrans-90-2178.144.60000113.9Y61 E70 S109Y61-T111 WeakPolarHBondContact OH-CB 3.19Å; Y61-T111 PolarHBondContact OH-OG1 3.45Å; E70-T111 WeakPolarHBondContact CB-OG1 3.25Å; E70-T111 WeakPolarHBondContact OE2-CA 3.15Å; E70-T111 WeakPolarHBondContact OE2-CB 3.32Å; E70-T111 WeakPolarHBondContact OE2-CG2 3.49Å; E70-T111 PolarHBondContact OE2-N 3.32Å; E70-T111 PolarHBondContact OE2-OG1 3.25Å; S109-T111 VanDerWaalsContact C-N 3.34Å; S109-T111 PolarHBondContact O-N 2.97Å
112S93.4Very high95Very high2 Ų245.2 Ų45.21%0.01428%0.283CS..THydrogen-bonded Turntrans-118.836.5-178.1-72.20000112.7G71 I73 S109 G114G71-S112 WeakPolarHBondContact O-CB 3.28Å; G71-S112 PolarHBondContact O-OG 2.9Å; I73-S112 PolarHBondContact N-OG 3.14Å; S109-S112 CarbonylContact O-C 3.33Å; S109-S112 WeakPolarHBondContact O-CA 3.32Å; S109-S112 PolarHBondContact O-N 2.93Å; S112-G114 PolarHBondContact O-N 3.25Å; S112-G114 VanDerWaalsContact O-N 3.08Å
113Y93.5Very high95.1Very high50 Ų5042.2 Ų42.220%0.19627%0.269CS..THydrogen-bonded Turntrans646.3172.5-59.9-79.4000116.9F25 I73 S109 A116 G117 L150F25-Y113 HydrophobicContact CB-CD2 4.16Å; F25-Y113 HydrophobicContact CB-CE2 3.52Å; F25-Y113 AromaticContact CD1-CD2 3.62Å; F25-Y113 HydrophobicContact CD1-CD2 3.62Å; F25-Y113 AromaticContact CD1-CE2 3.86Å; F25-Y113 HydrophobicContact CD1-CE2 3.86Å; F25-Y113 HydrophobicContact CD1-CG 4Å; F25-Y113 HydrophobicContact CD2-CD2 4.28Å; F25-Y113 HydrophobicContact CD2-CE2 4.33Å; F25-Y113 HydrophobicContact CE1-CD2 4.07Å; F25-Y113 HydrophobicContact CE1-CG 4.29Å; F25-Y113 AromaticContact CG-CD2 3.74Å; F25-Y113 HydrophobicContact CG-CD2 3.74Å; F25-Y113 AromaticContact CG-CE2 3.63Å; F25-Y113 HydrophobicContact CG-CE2 3.63Å; I73-Y113 HydrophobicContact CD1-CD2 3.83Å; I73-Y113 HydrophobicContact CD1-CE2 4.28Å; S109-Y113 PolarHBondContact O-N 3.25Å; Y113-A116 PolarHBondContact O-N 2.98Å; Y113-G117 PolarHBondContact O-N 3.17Å; Y113-L150 HydrophobicContact CD1-CB 3.92Å; Y113-L150 HydrophobicContact CD1-CD2 3.9Å; Y113-L150 HydrophobicContact CD1-CG 4.47Å; Y113-L150 WeakPolarHBondContact CD1-O 3.43Å; Y113-L150 HydrophobicContact CE1-CB 4.22Å; Y113-L150 HydrophobicContact CG-CD2 3.99Å
114G93.7Very high95.1Very high12 Ų1239 Ų3912%0.12424%0.243CC..Hα-helixtrans48.6-139.5175.800000116.4S109 S112 A116 G117 L118S109-G114 PolarHBondContact O-N 3.5Å; S109-G114 VanDerWaalsContact O-N 3.12Å; S109-G114 WeakPolarHBondContact OG-CA 3.33Å; S112-G114 PolarHBondContact O-N 3.25Å; S112-G114 VanDerWaalsContact O-N 3.08Å; G114-A116 VanDerWaalsContact C-N 3.31Å; G114-A116 PolarHBondContact O-N 2.88Å; G114-G117 WeakPolarHBondContact O-CA 3.49Å; G114-G117 PolarHBondContact O-N 3.23Å; G114-G117 VanDerWaalsContact O-N 3.15Å; G114-L118 PolarHBondContact O-N 3.33Å
115I92.5Very high95.1Very high123 Ų12334.6 Ų34.663%0.63122%0.22SC*.Hα-helixtrans-64.8-37.7-178.9-63.6171.8000110.8G117 L118 L119I115-G117 PolarHBondContact O-N 3.28Å; I115-L118 PolarHBondContact O-N 3.24Å; I115-L118 VanDerWaalsContact O-N 3.13Å; I115-L119 HydrophobicContact CG2-CD1 4.2Å; I115-L119 HydrophobicContact CG2-CG 4.32Å; I115-L119 WeakPolarHBondContact O-CG 2.91Å; I115-L119 PolarHBondContact O-N 3.15Å
116A95.2Very high95.1Very high27 Ų2738.7 Ų38.722%0.22324%0.235CC..Hα-helixtrans-58.7-37.7174.900000111.1Y113 G114 L119 M120 L150Y113-A116 PolarHBondContact O-N 2.98Å; G114-A116 VanDerWaalsContact C-N 3.31Å; G114-A116 PolarHBondContact O-N 2.88Å; A116-L119 PolarHBondContact O-N 3.27Å; A116-M120 WeakPolarHBondContact O-CB 3.37Å; A116-M120 PolarHBondContact O-N 3.22Å; A116-L150 HydrophobicContact CB-CD2 3.88Å
117G96.8Very high95.3Very high0 Ų038.5 Ų38.50%023%0.227CC..Hα-helixtrans-60.1-48.117300000113.2Y113 G114 I115 M120 L121Y113-G117 PolarHBondContact O-N 3.17Å; G114-G117 WeakPolarHBondContact O-CA 3.49Å; G114-G117 PolarHBondContact O-N 3.23Å; G114-G117 VanDerWaalsContact O-N 3.15Å; I115-G117 PolarHBondContact O-N 3.28Å; G117-M120 PolarHBondContact O-N 3.09Å; G117-L121 WeakPolarHBondContact O-CG 3.09Å; G117-L121 PolarHBondContact O-N 3.34Å; G117-L121 VanDerWaalsContact O-N 3.14Å
118L96.7Very high95.3Very high21 Ų2137.7 Ų37.711%0.1121%0.211CC..Hα-helixtrans-63.8-40.9176.3-65.2-174.2000112.3V79 A80 M102 G114 I115 L121 A122V79-L118 HydrophobicContact CB-CD2 4.27Å; V79-L118 HydrophobicContact CG1-CD1 4.19Å; V79-L118 HydrophobicContact CG1-CD2 3.84Å; A80-L118 HydrophobicContact CB-CD2 4.05Å; M102-L118 HydrophobicContact CG-CD1 4.21Å; G114-L118 PolarHBondContact O-N 3.33Å; I115-L118 PolarHBondContact O-N 3.24Å; I115-L118 VanDerWaalsContact O-N 3.13Å; L118-L121 PolarHBondContact O-N 2.9Å; L118-A122 WeakPolarHBondContact O-CB 3.49Å; L118-A122 PolarHBondContact O-N 3.15Å
119L96.4Very high95.2Very high88 Ų8837.6 Ų37.646%0.46121%0.206SC..Hα-helixtrans-62.3-44.4175.5-71.4174.4000111.2I115 A116 L121 A122 V123 V146I115-L119 HydrophobicContact CG2-CD1 4.2Å; I115-L119 HydrophobicContact CG2-CG 4.32Å; I115-L119 WeakPolarHBondContact O-CG 2.91Å; I115-L119 PolarHBondContact O-N 3.15Å; A116-L119 PolarHBondContact O-N 3.27Å; L119-L121 VanDerWaalsContact C-N 3.28Å; L119-L121 PolarHBondContact O-N 3.2Å; L119-A122 PolarHBondContact O-N 2.85Å; L119-V123 WeakPolarHBondContact O-CB 3.49Å; L119-V123 VanDerWaalsContact O-CG2 3.22Å; L119-V123 WeakPolarHBondContact O-CG2 3.37Å; L119-V123 PolarHBondContact O-N 3.31Å; L119-V146 HydrophobicContact CB-CG1 4.37Å; L119-V146 HydrophobicContact CB-CG2 4.4Å
120M97.9Very high95.2Very high0 Ų037.4 Ų37.40%020%0.204CC..Hα-helixtrans-56.7-44.4177-178.460.2-157.500111.2F25 P26 A29 L30 A116 G117 S124 L143 V146 I147 L150F25-M120 HydrophobicContact CE1-CB 3.95Å; F25-M120 HydrophobicContact CE1-CG 4.01Å; P26-M120 HydrophobicContact CB-CE 3.87Å; P26-M120 WeakPolarHBondContact O-CE 3.44Å; A29-M120 HydrophobicContact CB-CE 3.97Å; A29-M120 HydrophobicContact CB-CG 3.72Å; L30-M120 HydrophobicContact CD2-CE 4.42Å; L30-M120 HydrophobicContact CG-CE 4.05Å; A116-M120 WeakPolarHBondContact O-CB 3.37Å; A116-M120 PolarHBondContact O-N 3.22Å; G117-M120 PolarHBondContact O-N 3.09Å; M120-S124 VanDerWaalsContact CE-OG 3.29Å; M120-S124 WeakPolarHBondContact CE-OG 3.32Å; M120-S124 WeakPolarHBondContact O-CB 3.49Å; M120-S124 PolarHBondContact O-N 3.39Å; M120-S124 PolarHBondContact O-OG 2.89Å; M120-L143 HydrophobicContact CE-CD2 3.7Å; M120-L143 HydrophobicContact SD-CD2 3.67Å; M120-V146 HydrophobicContact CB-CG1 3.76Å; M120-V146 HydrophobicContact SD-CG1 4.17Å; M120-I147 HydrophobicContact CE-CG1 4.3Å; M120-I147 HydrophobicContact SD-CG1 4.01Å; M120-L150 HydrophobicContact CB-CD1 4.28Å; M120-L150 HydrophobicContact CB-CD2 4.29Å; M120-L150 HydrophobicContact CG-CD1 4.07Å; M120-L150 HydrophobicContact SD-CD1 4.48Å
121L97.9Very high95.3Very high0 Ų043 Ų430%021%0.214CC..Hα-helixtrans-66.9-46178-67.9167.8000112.1F25 A29 W32 A76 F77 A80 G117 L118 L119 S124 N125F25-L121 HydrophobicContact CE2-CD2 4.36Å; F25-L121 HydrophobicContact CE2-CG 4.47Å; F25-L121 HydrophobicContact CZ-CD1 4.18Å; F25-L121 HydrophobicContact CZ-CD2 4.3Å; F25-L121 HydrophobicContact CZ-CG 3.99Å; A29-L121 HydrophobicContact CB-CD2 3.69Å; A29-L121 HydrophobicContact CB-CG 4.46Å; W32-L121 HydrophobicContact CD2-CD2 4.24Å; W32-L121 HydrophobicContact CE3-CB 4.41Å; W32-L121 HydrophobicContact CE3-CD2 3.78Å; W32-L121 HydrophobicContact CH2-CB 4.37Å; W32-L121 HydrophobicContact CZ3-CB 3.85Å; W32-L121 HydrophobicContact CZ3-CD2 4.03Å; A76-L121 HydrophobicContact CB-CD1 4.4Å; F77-L121 HydrophobicContact CD1-CD1 4.34Å; F77-L121 HydrophobicContact CD1-CD2 3.43Å; F77-L121 VanDerWaalsContact CD1-CD2 3.43Å; F77-L121 HydrophobicContact CE1-CD2 3.22Å; F77-L121 HydrophobicContact CG-CD2 4.31Å; F77-L121 HydrophobicContact CZ-CD2 3.95Å; A80-L121 HydrophobicContact CB-CB 3.76Å; A80-L121 HydrophobicContact CB-CD1 3.59Å; A80-L121 HydrophobicContact CB-CG 4.29Å; G117-L121 WeakPolarHBondContact O-CG 3.09Å; G117-L121 PolarHBondContact O-N 3.34Å; G117-L121 VanDerWaalsContact O-N 3.14Å; L118-L121 PolarHBondContact O-N 2.9Å; L119-L121 VanDerWaalsContact C-N 3.28Å; L119-L121 PolarHBondContact O-N 3.2Å; L121-S124 PolarHBondContact O-N 3.13Å; L121-N125 PolarHBondContact O-N 3.27Å
122A96.9Very high95.5Very high34 Ų3444.6 Ų44.628%0.28122%0.221SC..Hα-helixtrans-62-48.2179.900000112L84 L118 L119 N125 R126L84-A122 HydrophobicContact CD2-CB 4.46Å; L118-A122 WeakPolarHBondContact O-CB 3.49Å; L118-A122 PolarHBondContact O-N 3.15Å; L119-A122 PolarHBondContact O-N 2.85Å; A122-N125 PolarHBondContact O-N 2.9Å; A122-R126 WeakPolarHBondContact O-CB 3.42Å; A122-R126 PolarHBondContact O-N 3.11Å
123V97.3Very high95.7Very high14 Ų1454.3 Ų54.39%0.08526%0.257CS..Hα-helixtrans-64.7-42.5178.4178.70000110.4L119 N125 R126 L127 L139 C142 L143L119-V123 WeakPolarHBondContact O-CB 3.49Å; L119-V123 VanDerWaalsContact O-CG2 3.22Å; L119-V123 WeakPolarHBondContact O-CG2 3.37Å; L119-V123 PolarHBondContact O-N 3.31Å; V123-N125 PolarHBondContact O-N 3.42Å; V123-R126 PolarHBondContact O-N 3.12Å; V123-L127 WeakPolarHBondContact O-CB 3.33Å; V123-L127 PolarHBondContact O-N 3.02Å; V123-L139 HydrophobicContact CG1-CB 4.36Å; V123-L139 HydrophobicContact CG1-CD2 4Å; V123-C142 HydrophobicContact CG1-CB 4.15Å; V123-C142 HydrophobicContact CG2-CB 4.47Å; V123-C142 VanDerWaalsContact CG2-SG 3.58Å; V123-L143 HydrophobicContact CB-CD2 4.01Å; V123-L143 HydrophobicContact CG1-CD2 3.53Å; V123-L143 HydrophobicContact CG1-CG 3.59Å
124S97.5Very high95.8Very high0 Ų055 Ų550%027%0.274CS..Hα-helixtrans-59.1-45.6176.2-63.80000112A29 M120 L121 Y128A29-S124 VanDerWaalsContact O-CB 3.27Å; A29-S124 WeakPolarHBondContact O-CB 3.43Å; M120-S124 VanDerWaalsContact CE-OG 3.29Å; M120-S124 WeakPolarHBondContact CE-OG 3.32Å; M120-S124 WeakPolarHBondContact O-CB 3.49Å; M120-S124 PolarHBondContact O-N 3.39Å; M120-S124 PolarHBondContact O-OG 2.89Å; L121-S124 PolarHBondContact O-N 3.13Å; S124-Y128 WeakPolarHBondContact O-CD2 3.28Å
125N95.7Very high96Very high9 Ų957.3 Ų57.35%0.04828%0.281CS..Hα-helixtrans-64.1-45.5175.5171.369000112W32 L84 L121 A122 V123 L127W32-N125 HydrophobicContact CZ3-CB 4.15Å; L84-N125 HydrophobicContact CD1-CB 4.09Å; L121-N125 PolarHBondContact O-N 3.27Å; A122-N125 PolarHBondContact O-N 2.9Å; V123-N125 PolarHBondContact O-N 3.42Å; N125-L127 VanDerWaalsContact C-N 3.34Å; N125-L127 PolarHBondContact O-N 3.05Å
126R95.9Very high96.2Very high97 Ų9757.4 Ų57.437%0.36627%0.273SS..Hα-helixtrans-65.7-37.3-177.9-173.666.9-172.9113-12.6111.9A122 V123 Y128 R129 A130 E135 L139A122-R126 WeakPolarHBondContact O-CB 3.42Å; A122-R126 PolarHBondContact O-N 3.11Å; V123-R126 PolarHBondContact O-N 3.12Å; R126-Y128 VanDerWaalsContact C-N 3.32Å; R126-Y128 PolarHBondContact O-N 3.49Å; R126-R129 PolarHBondContact NH1-O 3.23Å; R126-R129 CarbonylContact O-C 3.48Å; R126-R129 PolarHBondContact O-N 3.4Å; R126-A130 PolarHBondContact O-N 3.41Å; R126-E135 IonicContact CZ-OE1 3.85Å; R126-E135 IonicContact CZ-OE2 3.8Å; R126-E135 VanDerWaalsContact CZ-OE2 3.26Å; R126-E135 IonicContact NE-OE1 3.87Å; R126-E135 PolarHBondContact NE-OE1 3.32Å; R126-E135 IonicContact NH1-OE1 3.72Å; R126-E135 IonicContact NH1-OE2 3.66Å; R126-E135 IonicContact NH2-OE1 2.77Å; R126-E135 PolarHBondContact NH2-OE1 3.49Å; R126-E135 IonicContact NH2-OE2 2.87Å; R126-E135 PolarHBondContact NH2-OE2 3.06Å; R126-L139 HydrophobicContact CB-CD1 4.17Å; R126-L139 HydrophobicContact CB-CD2 4.04Å; R126-L139 HydrophobicContact CG-CD1 3.64Å; R126-L139 HydrophobicContact CG-CD2 3.87Å; R126-L139 HydrophobicContact CG-CG 4.42Å
127L96.9Very high96.3Very high27 Ų2762 Ų6214%0.14129%0.294CS..Hα-helixtrans-53.4-48.2-179.7177.467.9000111.7L30 V123 N125 R129 A130 L139 V140 L143L30-L127 HydrophobicContact CD2-CD2 4.42Å; V123-L127 WeakPolarHBondContact O-CB 3.33Å; V123-L127 PolarHBondContact O-N 3.02Å; N125-L127 VanDerWaalsContact C-N 3.34Å; N125-L127 PolarHBondContact O-N 3.05Å; L127-R129 VanDerWaalsContact C-N 3.25Å; L127-R129 PolarHBondContact O-N 2.92Å; L127-A130 PolarHBondContact O-N 3.17Å; L127-L139 HydrophobicContact CB-CB 4.38Å; L127-L139 HydrophobicContact CD1-CB 3.86Å; L127-V140 HydrophobicContact CD1-CG2 3.83Å; L127-L143 HydrophobicContact CD2-CD1 3.63Å
128Y94.7Very high96.3Very high86 Ų8665 Ų6534%0.33732%0.318SS..Hα-helixtrans-77.2-9.8-178.6-62.4-69.8000114L30 G33 L34 S37 S124 R126L30-Y128 HydrophobicContact CD2-CE2 4.33Å; L30-Y128 WeakPolarHBondContact O-CE2 3.5Å; G33-Y128 VanDerWaalsContact C-CD2 3.48Å; L34-Y128 HydrophobicContact CB-CD1 4.32Å; L34-Y128 HydrophobicContact CB-CD2 3.92Å; L34-Y128 HydrophobicContact CB-CE1 4.18Å; L34-Y128 HydrophobicContact CB-CE2 3.79Å; L34-Y128 HydrophobicContact CB-CG 4.19Å; L34-Y128 HydrophobicContact CD1-CD1 3.77Å; L34-Y128 HydrophobicContact CD1-CE1 4.01Å; L34-Y128 HydrophobicContact CD1-CG 4.15Å; S37-Y128 WeakPolarHBondContact OG-CB 3.28Å; S124-Y128 WeakPolarHBondContact O-CD2 3.28Å; R126-Y128 VanDerWaalsContact C-N 3.32Å; R126-Y128 PolarHBondContact O-N 3.49Å
129R93.8Very high96.4Very high75 Ų7565 Ų6528%0.28332%0.319SS..Hα-helixtrans-104.5-5175.3-62.8-175.274.7158.73.1113A40 E88 R126 L127 E131A40-R129 PolarHBondContact O-NH2 2.91Å; E88-R129 IonicContact OE1-CZ 3.26Å; E88-R129 IonicContact OE1-NH1 3.58Å; E88-R129 PolarHBondContact OE1-NH1 2.97Å; E88-R129 IonicContact OE1-NH2 2.8Å; R126-R129 PolarHBondContact NH1-O 3.23Å; R126-R129 CarbonylContact O-C 3.48Å; R126-R129 PolarHBondContact O-N 3.4Å; L127-R129 VanDerWaalsContact C-N 3.25Å; L127-R129 PolarHBondContact O-N 2.92Å; R129-E131 PolarHBondContact O-N 3Å
130A94.9Very high96.4Very high1 Ų164 Ų641%0.00832%0.315CS..  trans-69.3130.1178.200000109.5R126 L127 E135 R136 L139R126-A130 PolarHBondContact O-N 3.41Å; L127-A130 PolarHBondContact O-N 3.17Å; A130-E135 WeakPolarHBondContact CA-OE2 3.5Å; A130-E135 HydrophobicContact CB-CB 4.34Å; A130-E135 HydrophobicContact CB-CG 3.77Å; A130-E135 WeakPolarHBondContact CB-OE2 3.45Å; A130-R136 HydrophobicContact CB-CG 3.51Å; A130-R136 PolarHBondContact O-NE 3.38Å; A130-R136 PolarHBondContact O-NH2 3.42Å; A130-L139 HydrophobicContact CB-CD1 3.79Å
131E94.1Very high96.4Very high178 Ų17866.8 Ų66.883%0.83234%0.339SS*.  trans-94.7-40.6-179.5-65.7-178.6178.900110.8R129R129-E131 PolarHBondContact O-N 3Å
132D95.1Very high96.4Very high93 Ų9369.2 Ų69.250%0.49736%0.355SS..SBendtrans-83.5147.5-179.2-18060.8000113A134 E135 R136D132-A134 WeakPolarHBondContact OD2-CA 3.45Å; D132-A134 WeakPolarHBondContact OD2-CB 3.43Å; D132-A134 PolarHBondContact OD2-N 3.45Å; D132-E135 HydrophobicContact CB-CB 4.43Å; D132-E135 PolarHBondContact OD2-N 3.42Å; D132-R136 WeakPolarHBondContact O-CG 3.31Å; D132-R136 PolarHBondContact O-N 3.48Å; D132-R136 VanDerWaalsContact O-N 3.09Å
133R95.8Very high96.4Very high205 Ų20568.2 Ų68.277%0.77435%0.345SS*.Hα-helixtrans-68.7-39.7-179.3-70-176.5-179171.20.9112.4E135 R136 L137R133-E135 VanDerWaalsContact C-N 3.33Å; R133-R136 PolarHBondContact O-N 3.26Å; R133-L137 VanDerWaalsContact O-CG 3.32Å; R133-L137 WeakPolarHBondContact O-CG 3.43Å; R133-L137 PolarHBondContact O-N 3.46Å
134A97Very high96.3Very high66 Ų6671.6 Ų71.655%0.54536%0.362SS..Hα-helixtrans-65.8-41.2-179.700000110.5D132 L137 A138D132-A134 WeakPolarHBondContact OD2-CA 3.45Å; D132-A134 WeakPolarHBondContact OD2-CB 3.43Å; D132-A134 PolarHBondContact OD2-N 3.45Å; A134-L137 PolarHBondContact O-N 2.91Å; A134-A138 WeakPolarHBondContact O-CB 3.38Å; A134-A138 PolarHBondContact O-N 3.03Å
135E97.3Very high96.3Very high60 Ų6074.6 Ų74.628%0.2839%0.387SS..Hα-helixtrans-60.5-47.1172.8178.4172.5-13900111.9R126 A130 D132 R133 L137 A138 L139R126-E135 IonicContact CZ-OE1 3.85Å; R126-E135 IonicContact CZ-OE2 3.8Å; R126-E135 VanDerWaalsContact CZ-OE2 3.26Å; R126-E135 IonicContact NE-OE1 3.87Å; R126-E135 PolarHBondContact NE-OE1 3.32Å; R126-E135 IonicContact NH1-OE1 3.72Å; R126-E135 IonicContact NH1-OE2 3.66Å; R126-E135 IonicContact NH2-OE1 2.77Å; R126-E135 PolarHBondContact NH2-OE1 3.49Å; R126-E135 IonicContact NH2-OE2 2.87Å; R126-E135 PolarHBondContact NH2-OE2 3.06Å; A130-E135 WeakPolarHBondContact CA-OE2 3.5Å; A130-E135 HydrophobicContact CB-CB 4.34Å; A130-E135 HydrophobicContact CB-CG 3.77Å; A130-E135 WeakPolarHBondContact CB-OE2 3.45Å; D132-E135 HydrophobicContact CB-CB 4.43Å; D132-E135 PolarHBondContact OD2-N 3.42Å; R133-E135 VanDerWaalsContact C-N 3.33Å; E135-L137 VanDerWaalsContact C-N 3.33Å; E135-L137 PolarHBondContact O-N 3.49Å; E135-A138 PolarHBondContact O-N 3.49Å; E135-L139 HydrophobicContact CG-CD1 3.71Å; E135-L139 HydrophobicContact CG-CG 4.35Å; E135-L139 VanDerWaalsContact O-CG 3.28Å; E135-L139 WeakPolarHBondContact O-CG 3.49Å; E135-L139 PolarHBondContact O-N 3.46Å
136R96.7Very high96.4Very high124 Ų12474.8 Ų74.847%0.46839%0.388SS..Hα-helixtrans-57.9-45176.6-75.9178.3-175174.76.6112A130 D132 R133 L139 V140A130-R136 HydrophobicContact CB-CG 3.51Å; A130-R136 PolarHBondContact O-NE 3.38Å; A130-R136 PolarHBondContact O-NH2 3.42Å; D132-R136 WeakPolarHBondContact O-CG 3.31Å; D132-R136 PolarHBondContact O-N 3.48Å; D132-R136 VanDerWaalsContact O-N 3.09Å; R133-R136 PolarHBondContact O-N 3.26Å; R136-L139 PolarHBondContact O-N 2.91Å; R136-V140 WeakPolarHBondContact O-CG2 3.41Å; R136-V140 PolarHBondContact O-N 3.47Å
137L97.1Very high96.5Very high125 Ų12570.5 Ų70.565%0.65437%0.373SS*.Hα-helixtrans-63.9-42178.3-71173000111.8R133 A134 E135 L139 V140 A141R133-L137 VanDerWaalsContact O-CG 3.32Å; R133-L137 WeakPolarHBondContact O-CG 3.43Å; R133-L137 PolarHBondContact O-N 3.46Å; A134-L137 PolarHBondContact O-N 2.91Å; E135-L137 VanDerWaalsContact C-N 3.33Å; E135-L137 PolarHBondContact O-N 3.49Å; L137-L139 VanDerWaalsContact C-N 3.33Å; L137-L139 PolarHBondContact O-N 3.01Å; L137-V140 PolarHBondContact O-N 3.17Å; L137-A141 PolarHBondContact O-N 3.36Å
138A97.6Very high96.5Very high62 Ų6270.4 Ų70.451%0.51237%0.374SS..Hα-helixtrans-61.8-40.8175.200000111.9A134 E135 A141 C142A134-A138 WeakPolarHBondContact O-CB 3.38Å; A134-A138 PolarHBondContact O-N 3.03Å; E135-A138 PolarHBondContact O-N 3.49Å; A138-A141 PolarHBondContact O-N 3Å; A138-C142 WeakPolarHBondContact O-CB 3.26Å; A138-C142 PolarHBondContact O-N 2.76Å
139L97.6Very high96.6Very high22 Ų2268.4 Ų68.412%0.11538%0.375CS..Hα-helixtrans-68.7-37.5176.7-68.6163.7000112.2V123 R126 L127 A130 E135 R136 L137 C142 L143V123-L139 HydrophobicContact CG1-CB 4.36Å; V123-L139 HydrophobicContact CG1-CD2 4Å; R126-L139 HydrophobicContact CB-CD1 4.17Å; R126-L139 HydrophobicContact CB-CD2 4.04Å; R126-L139 HydrophobicContact CG-CD1 3.64Å; R126-L139 HydrophobicContact CG-CD2 3.87Å; R126-L139 HydrophobicContact CG-CG 4.42Å; L127-L139 HydrophobicContact CB-CB 4.38Å; L127-L139 HydrophobicContact CD1-CB 3.86Å; A130-L139 HydrophobicContact CB-CD1 3.79Å; E135-L139 HydrophobicContact CG-CD1 3.71Å; E135-L139 HydrophobicContact CG-CG 4.35Å; E135-L139 VanDerWaalsContact O-CG 3.28Å; E135-L139 WeakPolarHBondContact O-CG 3.49Å; E135-L139 PolarHBondContact O-N 3.46Å; R136-L139 PolarHBondContact O-N 2.91Å; L137-L139 VanDerWaalsContact C-N 3.33Å; L137-L139 PolarHBondContact O-N 3.01Å; L139-C142 WeakPolarHBondContact O-CB 3.18Å; L139-C142 PolarHBondContact O-N 2.81Å; L139-L143 WeakPolarHBondContact O-CG 3.16Å; L139-L143 PolarHBondContact O-N 3.04Å
140V97Very high96.7Very high65 Ų6565.5 Ų65.539%0.39437%0.365SS..Hα-helixtrans-63-45.4172170.70000110.7L127 R136 L137 C142 L143 L144L127-V140 HydrophobicContact CD1-CG2 3.83Å; R136-V140 WeakPolarHBondContact O-CG2 3.41Å; R136-V140 PolarHBondContact O-N 3.47Å; L137-V140 PolarHBondContact O-N 3.17Å; V140-C142 VanDerWaalsContact C-N 3.28Å; V140-C142 PolarHBondContact O-N 2.8Å; V140-L143 WeakPolarHBondContact O-CB 3.27Å; V140-L143 PolarHBondContact O-N 3.05Å; V140-L144 HydrophobicContact CG1-CD1 4.42Å; V140-L144 WeakPolarHBondContact O-CG 3.39Å; V140-L144 PolarHBondContact O-N 3.05Å
141A97.3Very high96.7Very high59 Ų5965.4 Ų65.449%0.48836%0.364SS..Hα-helixtrans-60.3-40.4174.700000111.6L137 A138 L144 A145L137-A141 PolarHBondContact O-N 3.36Å; A138-A141 PolarHBondContact O-N 3Å; A141-L144 PolarHBondContact O-N 2.81Å; A141-A145 PolarHBondContact O-N 3.48Å
142C97.4Very high96.7Very high51 Ų5161.5 Ų61.535%0.34535%0.348SS..Hα-helixtrans-62.4-43174.6-169.30000111.8V123 A138 L139 V140 L144 A145 V146V123-C142 HydrophobicContact CG1-CB 4.15Å; V123-C142 HydrophobicContact CG2-CB 4.47Å; V123-C142 VanDerWaalsContact CG2-SG 3.58Å; A138-C142 WeakPolarHBondContact O-CB 3.26Å; A138-C142 PolarHBondContact O-N 2.76Å; L139-C142 WeakPolarHBondContact O-CB 3.18Å; L139-C142 PolarHBondContact O-N 2.81Å; V140-C142 VanDerWaalsContact C-N 3.28Å; V140-C142 PolarHBondContact O-N 2.8Å; C142-L144 PolarHBondContact O-N 3.36Å; C142-A145 PolarHBondContact O-N 3.44Å; C142-A145 VanDerWaalsContact O-N 3.15Å; C142-V146 WeakPolarHBondContact O-CB 3.41Å; C142-V146 VanDerWaalsContact O-CG2 3.3Å; C142-V146 WeakPolarHBondContact O-CG2 3.49Å; C142-V146 PolarHBondContact O-N 2.95Å
143L97.2Very high96.5Very high13 Ų1362.1 Ų62.17%0.06837%0.367CS..Hα-helixtrans-59.8-44.4173.9-74.4179000112.1L30 M120 V123 L127 L139 V140 A145 V146 I147L30-L143 HydrophobicContact CD2-CD1 3.87Å; M120-L143 HydrophobicContact CE-CD2 3.7Å; M120-L143 HydrophobicContact SD-CD2 3.67Å; V123-L143 HydrophobicContact CB-CD2 4.01Å; V123-L143 HydrophobicContact CG1-CD2 3.53Å; V123-L143 HydrophobicContact CG1-CG 3.59Å; L127-L143 HydrophobicContact CD2-CD1 3.63Å; L139-L143 WeakPolarHBondContact O-CG 3.16Å; L139-L143 PolarHBondContact O-N 3.04Å; V140-L143 WeakPolarHBondContact O-CB 3.27Å; V140-L143 PolarHBondContact O-N 3.05Å; L143-A145 PolarHBondContact O-N 3.22Å; L143-V146 PolarHBondContact O-N 2.97Å; L143-I147 HydrophobicContact CB-CD1 4.31Å; L143-I147 WeakPolarHBondContact O-CB 3.26Å; L143-I147 WeakPolarHBondContact O-CD1 3.4Å; L143-I147 WeakPolarHBondContact O-CG1 3.38Å; L143-I147 PolarHBondContact O-N 2.84Å
144L96.9Very high96.3Very high86 Ų8656.3 Ų56.345%0.4535%0.354SS..Hα-helixtrans-62-24.4178.3-67.8175.6000112.8V140 A141 C142 P148 L163 V167V140-L144 HydrophobicContact CG1-CD1 4.42Å; V140-L144 WeakPolarHBondContact O-CG 3.39Å; V140-L144 PolarHBondContact O-N 3.05Å; A141-L144 PolarHBondContact O-N 2.81Å; C142-L144 PolarHBondContact O-N 3.36Å; L144-P148 WeakPolarHBondContact O-CD 3.42Å; L144-P148 VanDerWaalsContact O-CG 3.27Å; L144-P148 WeakPolarHBondContact O-CG 3.47Å; L144-L163 HydrophobicContact CD2-CD1 3.84Å; L144-V167 HydrophobicContact CD2-CG2 4.14Å
145A96.8Very high96.2Very high63 Ų6355.2 Ų55.252%0.52134%0.342SS..Hα-helixtrans-87-41.4172.400000113.1A141 C142 L143 P148 A149A141-A145 PolarHBondContact O-N 3.48Å; C142-A145 PolarHBondContact O-N 3.44Å; C142-A145 VanDerWaalsContact O-N 3.15Å; L143-A145 PolarHBondContact O-N 3.22Å; A145-P148 WeakPolarHBondContact O-CD 3.45Å; A145-P148 WeakPolarHBondContact O-CG 3.09Å; A145-A149 WeakPolarHBondContact O-CB 3.4Å; A145-A149 PolarHBondContact O-N 3.48Å
146V97.1Very high96.2Very high13 Ų1358.2 Ų58.28%0.07936%0.36CS..Hα-helixtrans-71.3-37.8-176.7172.20000111.6L119 M120 C142 L143 A149 L150L119-V146 HydrophobicContact CB-CG1 4.37Å; L119-V146 HydrophobicContact CB-CG2 4.4Å; M120-V146 HydrophobicContact CB-CG1 3.76Å; M120-V146 HydrophobicContact SD-CG1 4.17Å; C142-V146 WeakPolarHBondContact O-CB 3.41Å; C142-V146 VanDerWaalsContact O-CG2 3.3Å; C142-V146 WeakPolarHBondContact O-CG2 3.49Å; C142-V146 PolarHBondContact O-N 2.95Å; L143-V146 PolarHBondContact O-N 2.97Å; V146-A149 WeakPolarHBondContact O-CB 3.28Å; V146-A149 PolarHBondContact O-N 3.33Å; V146-A149 VanDerWaalsContact O-N 3.12Å; V146-L150 WeakPolarHBondContact O-CG 3.38Å; V146-L150 PolarHBondContact O-N 2.98Å
147I97.6Very high96.2Very high7 Ų754.4 Ų54.44%0.03636%0.356CS..Hα-helixtrans-57-52.5-179.3-67.4163.2000112.6P26 M120 L143 A149 L150 L163 T166P26-I147 HydrophobicContact CB-CG1 4.22Å; P26-I147 HydrophobicContact CB-CG2 4.49Å; P26-I147 HydrophobicContact CG-CG1 4.45Å; P26-I147 HydrophobicContact CG-CG2 4.09Å; M120-I147 HydrophobicContact CE-CG1 4.3Å; M120-I147 HydrophobicContact SD-CG1 4.01Å; L143-I147 HydrophobicContact CB-CD1 4.31Å; L143-I147 WeakPolarHBondContact O-CB 3.26Å; L143-I147 WeakPolarHBondContact O-CD1 3.4Å; L143-I147 WeakPolarHBondContact O-CG1 3.38Å; L143-I147 PolarHBondContact O-N 2.84Å; I147-A149 VanDerWaalsContact C-N 3.33Å; I147-L150 WeakPolarHBondContact O-CB 3.35Å; I147-L150 PolarHBondContact O-N 3.25Å; I147-L163 HydrophobicContact CB-CD1 4.22Å; I147-L163 HydrophobicContact CD1-CD1 4.37Å; I147-L163 HydrophobicContact CG2-CB 4.15Å; I147-L163 HydrophobicContact CG2-CD1 4.15Å; I147-T166 HydrophobicContact CD1-CG2 3.87Å
148P97.2Very high96.1Very high25 Ų2548.5 Ų48.516%0.16232%0.324CS..Hα-helixtrans-64.8-37.8174.122.5-30.9000111.6L144 A145 L150 N151 L152 A159L144-P148 WeakPolarHBondContact O-CD 3.42Å; L144-P148 VanDerWaalsContact O-CG 3.27Å; L144-P148 WeakPolarHBondContact O-CG 3.47Å; A145-P148 WeakPolarHBondContact O-CD 3.45Å; A145-P148 WeakPolarHBondContact O-CG 3.09Å; P148-L150 PolarHBondContact O-N 3.06Å; P148-L150 VanDerWaalsContact O-N 3.11Å; P148-N151 PolarHBondContact O-N 3.45Å; P148-L152 WeakPolarHBondContact O-CG 3.48Å; P148-L152 PolarHBondContact O-N 3.41Å; P148-A159 HydrophobicContact CB-CB 3.87Å; P148-A159 WeakPolarHBondContact O-CB 3.41Å
149A96.3Very high96.1Very high44 Ų4445.7 Ų45.736%0.36430%0.302SS..Hα-helixtrans-58.5-25.9179.200000114.3A145 V146 I147 N151 L152A145-A149 WeakPolarHBondContact O-CB 3.4Å; A145-A149 PolarHBondContact O-N 3.48Å; V146-A149 WeakPolarHBondContact O-CB 3.28Å; V146-A149 PolarHBondContact O-N 3.33Å; V146-A149 VanDerWaalsContact O-N 3.12Å; I147-A149 VanDerWaalsContact C-N 3.33Å; A149-N151 PolarHBondContact O-N 2.8Å; A149-L152 HydrophobicContact CB-CD1 4.47Å
150L96.1Very high96.1Very high13 Ų1349 Ų497%0.06832%0.322CS..THydrogen-bonded Turntrans-60.7-26.5172.3-68.6167.8000113.5F25 P26 Y113 A116 M120 V146 I147 P148F25-L150 HydrophobicContact CD1-CD1 3.84Å; F25-L150 HydrophobicContact CD1-CD2 4.01Å; F25-L150 HydrophobicContact CE1-CD1 4.22Å; F25-L150 HydrophobicContact CE1-CD2 3.84Å; P26-L150 HydrophobicContact CG-CD1 3.69Å; Y113-L150 HydrophobicContact CD1-CB 3.92Å; Y113-L150 HydrophobicContact CD1-CD2 3.9Å; Y113-L150 HydrophobicContact CD1-CG 4.47Å; Y113-L150 WeakPolarHBondContact CD1-O 3.43Å; Y113-L150 HydrophobicContact CE1-CB 4.22Å; Y113-L150 HydrophobicContact CG-CD2 3.99Å; A116-L150 HydrophobicContact CB-CD2 3.88Å; M120-L150 HydrophobicContact CB-CD1 4.28Å; M120-L150 HydrophobicContact CB-CD2 4.29Å; M120-L150 HydrophobicContact CG-CD1 4.07Å; M120-L150 HydrophobicContact SD-CD1 4.48Å; V146-L150 WeakPolarHBondContact O-CG 3.38Å; V146-L150 PolarHBondContact O-N 2.98Å; I147-L150 WeakPolarHBondContact O-CB 3.35Å; I147-L150 PolarHBondContact O-N 3.25Å; P148-L150 PolarHBondContact O-N 3.06Å; P148-L150 VanDerWaalsContact O-N 3.11Å
151N95.4Very high96.1Very high0 Ų046.8 Ų46.80%031%0.311CS..THydrogen-bonded Turntrans-125.7-3.5-171.8-59.5-72.3000113.8R22 P148 A149 A153 T154 S155 A158R22-N151 WeakPolarHBondContact CD-OD1 3.2Å; P148-N151 PolarHBondContact O-N 3.45Å; A149-N151 PolarHBondContact O-N 2.8Å; N151-A153 PolarHBondContact O-N 3.31Å; N151-T154 WeakPolarHBondContact O-CA 3.37Å; N151-T154 WeakPolarHBondContact O-CB 3.34Å; N151-T154 PolarHBondContact O-N 2.78Å; N151-S155 PolarHBondContact O-N 2.95Å; N151-A158 HydrophobicContact CB-CB 3.88Å
152L93.6Very high96.1Very high95 Ų9544 Ų4450%0.49729%0.288SS..THydrogen-bonded Turntrans-57.4-37177.7-84.2177.4000112.6P148 A149 T154 A159P148-L152 WeakPolarHBondContact O-CG 3.48Å; P148-L152 PolarHBondContact O-N 3.41Å; A149-L152 HydrophobicContact CB-CD1 4.47Å; L152-T154 PolarHBondContact O-N 2.61Å; L152-A159 HydrophobicContact CD2-CB 3.74Å; L152-A159 HydrophobicContact CG-CB 4.03Å
153A91.2Very high96.1Very high106 Ų10643.8 Ų43.888%0.87628%0.283SS*.THydrogen-bonded Turntrans-66-17.2176.400000113N151N151-A153 PolarHBondContact O-N 3.31Å
154T91.9Very high96.1Very high83 Ų8346.4 Ų46.451%0.50930%0.299SS..THydrogen-bonded Turntrans-95.5-53.6178-46.50000112.2F18 N151 L152F18-T154 HydrophobicContact CE1-CG2 4.03Å; F18-T154 HydrophobicContact CE2-CG2 4.39Å; F18-T154 HydrophobicContact CZ-CG2 3.44Å; F18-T154 VanDerWaalsContact CZ-CG2 3.44Å; N151-T154 WeakPolarHBondContact O-CA 3.37Å; N151-T154 WeakPolarHBondContact O-CB 3.34Å; N151-T154 PolarHBondContact O-N 2.78Å; L152-T154 PolarHBondContact O-N 2.61Å
155S94.7Very high96Very high43 Ų4345.8 Ų45.830%0.30130%0.295SS..  trans-172.4158.5171.267.20000112.2N151 A157 A158 A159N151-S155 PolarHBondContact O-N 2.95Å; S155-A157 VanDerWaalsContact C-N 3.28Å; S155-A157 PolarHBondContact O-N 3.38Å; S155-A158 WeakPolarHBondContact O-CB 3.34Å; S155-A158 PolarHBondContact O-N 3.36Å; S155-A158 VanDerWaalsContact O-N 3.17Å; S155-A158 VanDerWaalsContact OG-CB 3.28Å; S155-A158 WeakPolarHBondContact OG-CB 3.47Å; S155-A158 PolarHBondContact OG-N 3.25Å; S155-A159 PolarHBondContact O-N 3.49Å
156D96.7Very high96Very high123 Ų12342.9 Ų42.966%0.65827%0.271SS*.Hα-helixtrans-58.9-41.1172-65.2-19.1000111.6A158 A159 V160D156-A158 VanDerWaalsContact C-N 3.32Å; D156-A158 PolarHBondContact O-N 2.89Å; D156-A159 WeakPolarHBondContact O-CB 3.38Å; D156-A159 PolarHBondContact O-N 3.08Å; D156-V160 WeakPolarHBondContact O-CG2 3.49Å; D156-V160 PolarHBondContact O-N 3.01Å
157A96.6Very high96Very high45 Ų4545.7 Ų45.737%0.37229%0.288SS..Hα-helixtrans-60.5-41.2176.200000111.8L19 S155 V160 A161L19-A157 HydrophobicContact CD2-CB 4.19Å; S155-A157 VanDerWaalsContact C-N 3.28Å; S155-A157 PolarHBondContact O-N 3.38Å; A157-V160 PolarHBondContact O-N 2.99Å; A157-A161 WeakPolarHBondContact O-CB 3.41Å; A157-A161 PolarHBondContact O-N 3.43Å
158A96.2Very high96Very high0 Ų050.1 Ų50.10%031%0.311CS..Hα-helixtrans-67.8-38.217700000112.3F18 L19 R22 N151 S155 D156 G162F18-A158 HydrophobicContact CE1-CB 3.88Å; F18-A158 HydrophobicContact CZ-CB 4.32Å; L19-A158 HydrophobicContact CD2-CB 4.24Å; R22-A158 HydrophobicContact CG-CB 4.05Å; N151-A158 HydrophobicContact CB-CB 3.88Å; S155-A158 WeakPolarHBondContact O-CB 3.34Å; S155-A158 PolarHBondContact O-N 3.36Å; S155-A158 VanDerWaalsContact O-N 3.17Å; S155-A158 VanDerWaalsContact OG-CB 3.28Å; S155-A158 WeakPolarHBondContact OG-CB 3.47Å; S155-A158 PolarHBondContact OG-N 3.25Å; D156-A158 VanDerWaalsContact C-N 3.32Å; D156-A158 PolarHBondContact O-N 2.89Å; A158-G162 PolarHBondContact O-N 3.44Å
159A97.2Very high95.9Very high4 Ų451.4 Ų51.43%0.03332%0.318CS..Hα-helixtrans-62.5-48.1174.400000111.7P148 L152 S155 D156 G162 L163P148-A159 HydrophobicContact CB-CB 3.87Å; P148-A159 WeakPolarHBondContact O-CB 3.41Å; L152-A159 HydrophobicContact CD2-CB 3.74Å; L152-A159 HydrophobicContact CG-CB 4.03Å; S155-A159 PolarHBondContact O-N 3.49Å; D156-A159 WeakPolarHBondContact O-CB 3.38Å; D156-A159 PolarHBondContact O-N 3.08Å; A159-G162 PolarHBondContact O-N 3.43Å; A159-L163 PolarHBondContact O-N 3.36Å; A159-L163 VanDerWaalsContact O-N 3.1Å
160V97.4Very high95.7Very high90 Ų9051.7 Ų51.755%0.54532%0.316SS..Hα-helixtrans-63.8-46.7176.3174.60000110.9D156 A157 G162 L163 V164D156-V160 WeakPolarHBondContact O-CG2 3.49Å; D156-V160 PolarHBondContact O-N 3.01Å; A157-V160 PolarHBondContact O-N 2.99Å; V160-G162 PolarHBondContact O-N 2.94Å; V160-L163 PolarHBondContact O-N 3.35Å; V160-V164 HydrophobicContact CG1-CG2 4.06Å; V160-V164 WeakPolarHBondContact O-CB 3.19Å; V160-V164 VanDerWaalsContact O-CG2 3.3Å; V160-V164 WeakPolarHBondContact O-CG2 3.46Å; V160-V164 PolarHBondContact O-N 3.13Å
161A97Very high95.6Very high19 Ų1952.5 Ų52.516%0.15733%0.327CS..Hα-helixtrans-60.2-45.4178.800000111.8L19 A157 L163 V164 M165L19-A161 HydrophobicContact CB-CB 3.95Å; L19-A161 HydrophobicContact CD2-CB 3.99Å; L19-A161 HydrophobicContact CG-CB 4.47Å; A157-A161 WeakPolarHBondContact O-CB 3.41Å; A157-A161 PolarHBondContact O-N 3.43Å; A161-L163 VanDerWaalsContact C-N 3.33Å; A161-L163 PolarHBondContact O-N 2.89Å; A161-V164 PolarHBondContact O-N 2.79Å; A161-M165 VanDerWaalsContact O-CB 3.25Å; A161-M165 WeakPolarHBondContact O-CB 3.48Å; A161-M165 WeakPolarHBondContact O-CG 3.48Å; A161-M165 PolarHBondContact O-N 3.15Å
162G97Very high95.6Very high0 Ų058.5 Ų58.50%036%0.358CS..Hα-helixtrans-58.1-44.6176.100000112.4A158 A159 V160 T166A158-G162 PolarHBondContact O-N 3.44Å; A159-G162 PolarHBondContact O-N 3.43Å; V160-G162 PolarHBondContact O-N 2.94Å; G162-T166 WeakPolarHBondContact O-CB 3.32Å; G162-T166 PolarHBondContact O-N 3.21Å; G162-T166 VanDerWaalsContact O-N 3.14Å; G162-T166 PolarHBondContact O-OG1 3.12Å
163L97.5Very high95.4Very high48 Ų4858.7 Ų58.725%0.25136%0.364SS..Hα-helixtrans-64.2-53176.8-17863.3000112.1L144 I147 A159 V160 A161 M165 T166 V167L144-L163 HydrophobicContact CD2-CD1 3.84Å; I147-L163 HydrophobicContact CB-CD1 4.22Å; I147-L163 HydrophobicContact CD1-CD1 4.37Å; I147-L163 HydrophobicContact CG2-CB 4.15Å; I147-L163 HydrophobicContact CG2-CD1 4.15Å; A159-L163 PolarHBondContact O-N 3.36Å; A159-L163 VanDerWaalsContact O-N 3.1Å; V160-L163 PolarHBondContact O-N 3.35Å; A161-L163 VanDerWaalsContact C-N 3.33Å; A161-L163 PolarHBondContact O-N 2.89Å; L163-M165 PolarHBondContact O-N 3.38Å; L163-T166 PolarHBondContact O-N 2.77Å; L163-V167 HydrophobicContact CD1-CG2 3.88Å; L163-V167 HydrophobicContact CG-CG2 4.36Å; L163-V167 WeakPolarHBondContact O-CB 3.44Å; L163-V167 WeakPolarHBondContact O-CG2 3.25Å; L163-V167 PolarHBondContact O-N 3.35Å
164V97.3Very high95.3Very high67 Ų6759.9 Ų59.941%0.40636%0.355SS..Hα-helixtrans-59.4-49.8-178.5169.80000110.7V160 A161 T166 V167 L168V160-V164 HydrophobicContact CG1-CG2 4.06Å; V160-V164 WeakPolarHBondContact O-CB 3.19Å; V160-V164 VanDerWaalsContact O-CG2 3.3Å; V160-V164 WeakPolarHBondContact O-CG2 3.46Å; V160-V164 PolarHBondContact O-N 3.13Å; A161-V164 PolarHBondContact O-N 2.79Å; V164-T166 VanDerWaalsContact C-N 3.29Å; V164-T166 PolarHBondContact O-N 3.37Å; V164-V167 PolarHBondContact O-N 3.48Å; V164-L168 HydrophobicContact CG1-CD1 3.48Å; V164-L168 VanDerWaalsContact CG1-CD1 3.48Å; V164-L168 HydrophobicContact CG1-CG 4.06Å; V164-L168 VanDerWaalsContact O-CB 3.23Å; V164-L168 WeakPolarHBondContact O-CB 3.46Å; V164-L168 WeakPolarHBondContact O-CG 3.39Å; V164-L168 PolarHBondContact O-N 3.45Å
165M96.1Very high95.2Very high74 Ų7461.4 Ų61.437%0.36537%0.367SS..Hα-helixtrans-59.9-40.3179.5-70.1-59.6-66.700111.9A161 L163 T169A161-M165 VanDerWaalsContact O-CB 3.25Å; A161-M165 WeakPolarHBondContact O-CB 3.48Å; A161-M165 WeakPolarHBondContact O-CG 3.48Å; A161-M165 PolarHBondContact O-N 3.15Å; L163-M165 PolarHBondContact O-N 3.38Å; M165-T169 VanDerWaalsContact O-CB 3.28Å; M165-T169 WeakPolarHBondContact O-CB 3.29Å; M165-T169 PolarHBondContact O-N 3.3Å; M165-T169 VanDerWaalsContact O-N 3.1Å; M165-T169 PolarHBondContact O-OG1 3.37Å
166T96.9Very high94.9Very high2 Ų262.5 Ų62.51%0.01238%0.379CS..Hα-helixtrans-68.7-51.5179-53.80000111.2P26 L27 L30 I147 G162 L163 V164 L168 T169 V170P26-T166 HydrophobicContact CB-CG2 3.72Å; P26-T166 VanDerWaalsContact CB-OG1 3.3Å; P26-T166 WeakPolarHBondContact CB-OG1 3.33Å; L27-T166 HydrophobicContact CD2-CG2 4.05Å; L27-T166 HydrophobicContact CG-CG2 4.36Å; L30-T166 HydrophobicContact CD1-CG2 4.04Å; I147-T166 HydrophobicContact CD1-CG2 3.87Å; G162-T166 WeakPolarHBondContact O-CB 3.32Å; G162-T166 PolarHBondContact O-N 3.21Å; G162-T166 VanDerWaalsContact O-N 3.14Å; G162-T166 PolarHBondContact O-OG1 3.12Å; L163-T166 PolarHBondContact O-N 2.77Å; V164-T166 VanDerWaalsContact C-N 3.29Å; V164-T166 PolarHBondContact O-N 3.37Å; T166-L168 PolarHBondContact O-N 3.48Å; T166-T169 PolarHBondContact O-N 3.21Å; T166-V170 HydrophobicContact CG2-CG2 4.45Å; T166-V170 WeakPolarHBondContact O-CB 3.43Å; T166-V170 VanDerWaalsContact O-CG2 3.3Å; T166-V170 WeakPolarHBondContact O-CG2 3.32Å; T166-V170 PolarHBondContact O-N 2.91Å
167V96.4Very high93.8Very high72 Ų7259.9 Ų59.944%0.43638%0.381SS..Hα-helixtrans-62.8-44.8-178.2171.40000111.1L144 L163 V164 V170 G171L144-V167 HydrophobicContact CD2-CG2 4.14Å; L163-V167 HydrophobicContact CD1-CG2 3.88Å; L163-V167 HydrophobicContact CG-CG2 4.36Å; L163-V167 WeakPolarHBondContact O-CB 3.44Å; L163-V167 WeakPolarHBondContact O-CG2 3.25Å; L163-V167 PolarHBondContact O-N 3.35Å; V164-V167 PolarHBondContact O-N 3.48Å; V167-V170 PolarHBondContact O-N 3.43Å; V167-G171 PolarHBondContact O-N 3.35Å
168L96.6Very high92.5Very high100 Ų10065.9 Ų65.952%0.52440%0.399SS..Hα-helixtrans-61.2-47.6177-72.4176.7000111.2V164 T166 V170 G171 L172V164-L168 HydrophobicContact CG1-CD1 3.48Å; V164-L168 VanDerWaalsContact CG1-CD1 3.48Å; V164-L168 HydrophobicContact CG1-CG 4.06Å; V164-L168 VanDerWaalsContact O-CB 3.23Å; V164-L168 WeakPolarHBondContact O-CB 3.46Å; V164-L168 WeakPolarHBondContact O-CG 3.39Å; V164-L168 PolarHBondContact O-N 3.45Å; T166-L168 PolarHBondContact O-N 3.48Å; L168-V170 PolarHBondContact O-N 3.07Å; L168-G171 PolarHBondContact O-N 2.91Å; L168-L172 WeakPolarHBondContact O-CB 3.48Å; L168-L172 VanDerWaalsContact O-CG 3.27Å; L168-L172 WeakPolarHBondContact O-CG 3.39Å; L168-L172 PolarHBondContact O-N 3.39Å
169T94.9Very high91.2Very high51 Ų5171.8 Ų71.831%0.31344%0.44SS..Hα-helixtrans-62.9-45.8-179.6-57.20000111.3L27 M165 T166 L172 V173L27-T169 HydrophobicContact CD1-CG2 3.88Å; L27-T169 HydrophobicContact CD2-CG2 3.75Å; L27-T169 HydrophobicContact CG-CG2 4.49Å; M165-T169 VanDerWaalsContact O-CB 3.28Å; M165-T169 WeakPolarHBondContact O-CB 3.29Å; M165-T169 PolarHBondContact O-N 3.3Å; M165-T169 VanDerWaalsContact O-N 3.1Å; M165-T169 PolarHBondContact O-OG1 3.37Å; T166-T169 PolarHBondContact O-N 3.21Å; T169-L172 PolarHBondContact O-N 3.15Å; T169-V173 VanDerWaalsContact O-CG2 3.32Å; T169-V173 WeakPolarHBondContact O-CG2 3.49Å; T169-V173 PolarHBondContact O-N 3.13Å
170V93.8Very high89.9Confident51 Ų5178.5 Ų78.531%0.30947%0.474SS..Hα-helixtrans-62.6-44.5176.6172.60000110.7L27 L30 T166 V167 L168 L172 V173 L174L27-V170 HydrophobicContact CD2-CG2 4.08Å; L30-V170 HydrophobicContact CD1-CG2 3.69Å; T166-V170 HydrophobicContact CG2-CG2 4.45Å; T166-V170 WeakPolarHBondContact O-CB 3.43Å; T166-V170 VanDerWaalsContact O-CG2 3.3Å; T166-V170 WeakPolarHBondContact O-CG2 3.32Å; T166-V170 PolarHBondContact O-N 2.91Å; V167-V170 PolarHBondContact O-N 3.43Å; L168-V170 PolarHBondContact O-N 3.07Å; V170-L172 PolarHBondContact O-N 3.42Å; V170-V173 PolarHBondContact O-N 3.38Å; V170-L174 HydrophobicContact CG1-CD1 3.97Å; V170-L174 HydrophobicContact CG1-CG 4.36Å; V170-L174 VanDerWaalsContact O-CG 3.28Å; V170-L174 WeakPolarHBondContact O-CG 3.44Å; V170-L174 PolarHBondContact O-N 3.39Å
171G94.1Very high88.8Confident30 Ų3079.6 Ų79.631%0.30948%0.484SS..Hα-helixtrans-59-45.7176.700000112.8V167 L168 V173 L174 C175V167-G171 PolarHBondContact O-N 3.35Å; L168-G171 PolarHBondContact O-N 2.91Å; G171-V173 PolarHBondContact O-N 3.01Å; G171-L174 PolarHBondContact O-N 3.4Å; G171-C175 WeakPolarHBondContact O-CB 3.25Å; G171-C175 PolarHBondContact O-N 3.47Å; G171-C175 PolarHBondContact O-SG 2.84Å
172L93.6Very high87.8Confident125 Ų12585.6 Ų85.665%0.65450%0.502SS*.Hα-helixtrans-61.9-42.8176.1-72.1171.9000112.2L168 T169 V170 L174 C175 A176L168-L172 WeakPolarHBondContact O-CB 3.48Å; L168-L172 VanDerWaalsContact O-CG 3.27Å; L168-L172 WeakPolarHBondContact O-CG 3.39Å; L168-L172 PolarHBondContact O-N 3.39Å; T169-L172 PolarHBondContact O-N 3.15Å; V170-L172 PolarHBondContact O-N 3.42Å; L172-L174 VanDerWaalsContact C-N 3.34Å; L172-C175 PolarHBondContact O-N 3.1Å; L172-A176 WeakPolarHBondContact O-CB 3.44Å; L172-A176 PolarHBondContact O-N 3.39Å
173V90.2Very high87Confident100 Ų10093.7 Ų93.761%0.60654%0.538SS*.Hα-helixtrans-63.5-40.8176.3170.50000111.2T169 V170 G171 A176T169-V173 VanDerWaalsContact O-CG2 3.32Å; T169-V173 WeakPolarHBondContact O-CG2 3.49Å; T169-V173 PolarHBondContact O-N 3.13Å; V170-V173 PolarHBondContact O-N 3.38Å; G171-V173 PolarHBondContact O-N 3.01Å; V173-A176 PolarHBondContact O-N 3.45Å
174L89.1Confident86.3Confident131 Ų13197.7 Ų97.769%0.68655%0.55SS*.Hα-helixtrans-64.5-43.8175.6-70.1172.2000111.6V170 G171 L172 A176 G177V170-L174 HydrophobicContact CG1-CD1 3.97Å; V170-L174 HydrophobicContact CG1-CG 4.36Å; V170-L174 VanDerWaalsContact O-CG 3.28Å; V170-L174 WeakPolarHBondContact O-CG 3.44Å; V170-L174 PolarHBondContact O-N 3.39Å; G171-L174 PolarHBondContact O-N 3.4Å; L172-L174 VanDerWaalsContact C-N 3.34Å; L174-A176 VanDerWaalsContact C-N 3.34Å; L174-A176 PolarHBondContact O-N 3.38Å; L174-G177 PolarHBondContact O-N 2.78Å
175C90.7Very high85.7Confident114 Ų11498.6 Ų98.677%0.7756%0.557SS**Hα-helixtrans-65.6-33.7177.3-700000113G171 L172 G177G171-C175 WeakPolarHBondContact O-CB 3.25Å; G171-C175 PolarHBondContact O-N 3.47Å; G171-C175 PolarHBondContact O-SG 2.84Å; L172-C175 PolarHBondContact O-N 3.1Å; C175-G177 PolarHBondContact O-N 3.46Å
176A88Confident85Confident67 Ų6797.1 Ų97.155%0.55456%0.56SS**Hα-helixtrans-63.9-23.1177.300000112.6L172 V173 L174 K178L172-A176 WeakPolarHBondContact O-CB 3.44Å; L172-A176 PolarHBondContact O-N 3.39Å; V173-A176 PolarHBondContact O-N 3.45Å; L174-A176 VanDerWaalsContact C-N 3.34Å; L174-A176 PolarHBondContact O-N 3.38Å; A176-K178 WeakPolarHBondContact O-CG 3.38Å; A176-K178 PolarHBondContact O-N 2.96Å
177G74.4Confident84.5Confident68 Ų6899.9 Ų99.970%0.70158%0.575SS**  trans62.6-1.2168.300000116.6L174 C175L174-G177 PolarHBondContact O-N 2.78Å; C175-G177 PolarHBondContact O-N 3.46Å
178K67.4Low84.2Confident171 Ų17199.5 Ų99.574%0.74357%0.568SS**  trans-104.7121.2-174.9-69179.6-175.3-178.40110.3A176 L180A176-K178 WeakPolarHBondContact O-CG 3.38Å; A176-K178 PolarHBondContact O-N 2.96Å; K178-L180 HydrophobicContact CB-CD2 4.48Å; K178-L180 PolarHBondContact O-N 3.19Å; K178-L180 VanDerWaalsContact O-N 3.15Å
179S70.3Confident84Confident124 Ų12496.9 Ų96.987%0.86755%0.552SS**  trans-71.6102.7160.551.40000108.2
180L69.9Low83.9Confident144 Ų14494.9 Ų94.975%0.75454%0.54SS*.  trans-79.7142.6171-64.3175.5000109.2K178K178-L180 HydrophobicContact CB-CD2 4.48Å; K178-L180 PolarHBondContact O-N 3.19Å; K178-L180 VanDerWaalsContact O-N 3.15Å
181P73Confident84Confident114 Ų11494.9 Ų94.974%0.7454%0.54SS*.  trans-56.7151.4169.126.5-33.7000109.3F183P181-F183 PolarHBondContact O-N 3.43Å
182R76.6Confident84Confident145 Ų14597.4 Ų97.455%0.54754%0.543SS..  trans-58.7111.3177.7179.5178.8179.41428.7108.9W184 P185 G186R182-W184 WeakPolarHBondContact CD-O 3.41Å; R182-W184 WeakPolarHBondContact CG-O 3.41Å; R182-W184 PolarHBondContact NE-O 2.84Å; R182-P185 VanDerWaalsContact NH2-C 3.32Å; R182-P185 PolarHBondContact NH2-O 2.87Å; R182-G186 VanDerWaalsContact NH2-C 3.29Å; R182-G186 PolarHBondContact NH2-O 2.99Å
183F79.6Confident84.2Confident169 Ų16991.8 Ų91.874%0.74151%0.513SS*.  trans-73.9-38.9-177.8-177.2-107.1000112.7P181P181-F183 PolarHBondContact O-N 3.43Å
184W83.2Confident84.5Confident133 Ų13387.4 Ų87.450%0.50449%0.487SS..SBendtrans-102.9146.9-174.9-66.1117.8000113.2R182 F188R182-W184 WeakPolarHBondContact CD-O 3.41Å; R182-W184 WeakPolarHBondContact CG-O 3.41Å; R182-W184 PolarHBondContact NE-O 2.84Å; W184-F188 HydrophobicContact CB-CB 3.73Å; W184-F188 HydrophobicContact CB-CD1 3.94Å; W184-F188 HydrophobicContact CB-CD2 4.33Å; W184-F188 HydrophobicContact CB-CG 3.73Å; W184-F188 HydrophobicContact CD2-CD1 4.06Å; W184-F188 AromaticContact CD2-CD2 3.77Å; W184-F188 HydrophobicContact CD2-CD2 3.77Å; W184-F188 HydrophobicContact CD2-CE1 4.02Å; W184-F188 AromaticContact CD2-CE2 3.73Å; W184-F188 HydrophobicContact CD2-CE2 3.73Å; W184-F188 AromaticContact CD2-CG 3.94Å; W184-F188 HydrophobicContact CD2-CG 3.94Å; W184-F188 AromaticContact CD2-CZ 3.86Å; W184-F188 HydrophobicContact CD2-CZ 3.86Å; W184-F188 AromaticContact CE2-CZ 3.79Å; W184-F188 AromaticContact CE3-CD2 3.48Å; W184-F188 HydrophobicContact CE3-CD2 3.48Å; W184-F188 VanDerWaalsContact CE3-CD2 3.48Å; W184-F188 AromaticContact CE3-CE2 3.49Å; W184-F188 HydrophobicContact CE3-CE2 3.49Å; W184-F188 VanDerWaalsContact CE3-CE2 3.49Å; W184-F188 HydrophobicContact CE3-CG 4.07Å; W184-F188 HydrophobicContact CE3-CZ 4.09Å; W184-F188 HydrophobicContact CG-CB 4.38Å; W184-F188 AromaticContact CG-CD1 3.77Å; W184-F188 HydrophobicContact CG-CD1 3.77Å; W184-F188 HydrophobicContact CG-CD2 4.18Å; W184-F188 HydrophobicContact CG-CE1 4.06Å; W184-F188 HydrophobicContact CG-CE2 4.43Å; W184-F188 AromaticContact CG-CG 3.83Å; W184-F188 HydrophobicContact CG-CG 3.83Å; W184-F188 HydrophobicContact CG-CZ 4.38Å; W184-F188 AromaticContact CH2-CE2 3.99Å; W184-F188 HydrophobicContact CH2-CE2 3.99Å; W184-F188 HydrophobicContact CH2-CZ 4.23Å; W184-F188 HydrophobicContact CZ2-CE2 4.19Å; W184-F188 AromaticContact CZ2-CZ 3.99Å; W184-F188 HydrophobicContact CZ2-CZ 3.99Å; W184-F188 HydrophobicContact CZ3-CD2 4.04Å; W184-F188 AromaticContact CZ3-CE2 3.63Å; W184-F188 HydrophobicContact CZ3-CE2 3.63Å; W184-F188 HydrophobicContact CZ3-CZ 4.27Å
185P85.9Confident84.8Confident85 Ų8584.5 Ų84.555%0.55248%0.477SS*.  trans-61.2164.817824.8-33.2000113.1R182 D187 F188R182-P185 VanDerWaalsContact NH2-C 3.32Å; R182-P185 PolarHBondContact NH2-O 2.87Å; P185-D187 PolarHBondContact O-N 3.35Å; P185-D187 VanDerWaalsContact O-N 3.12Å; P185-F188 HydrophobicContact CG-CB 4.05Å; P185-F188 WeakPolarHBondContact O-CB 3.21Å; P185-F188 PolarHBondContact O-N 2.93Å
186G81.4Confident85.1Confident43 Ų4379.8 Ų79.844%0.44344%0.444SS..THydrogen-bonded Turntrans-39.4-48.8177.300000114.1R182R182-G186 VanDerWaalsContact NH2-C 3.29Å; R182-G186 PolarHBondContact NH2-O 2.99Å
187D84.6Confident85.6Confident60 Ų6076.6 Ų76.632%0.32142%0.418SS..THydrogen-bonded Turntrans-104.49.3-168.1-59.9-41.9000113.7R49 P185 F189 P190 T191R49-D187 WeakPolarHBondContact CD-OD1 3.45Å; R49-D187 IonicContact CZ-OD1 2.68Å; R49-D187 IonicContact NE-OD1 2.78Å; R49-D187 PolarHBondContact NE-OD1 2.78Å; R49-D187 IonicContact NE-OD2 3.63Å; R49-D187 IonicContact NH2-OD1 3.81Å; P185-D187 PolarHBondContact O-N 3.35Å; P185-D187 VanDerWaalsContact O-N 3.12Å; D187-F189 VanDerWaalsContact C-N 3.3Å; D187-F189 PolarHBondContact O-N 3.42Å; D187-P190 HydrophobicContact CB-CG 4.37Å; D187-P190 WeakPolarHBondContact O-CD 3.15Å; D187-P190 VanDerWaalsContact O-CG 3.28Å; D187-P190 WeakPolarHBondContact O-CG 3.48Å; D187-T191 WeakPolarHBondContact O-CB 3.42Å; D187-T191 PolarHBondContact O-N 3.27Å; D187-T191 VanDerWaalsContact O-N 3.14Å; D187-T191 PolarHBondContact O-OG1 2.79Å
188F91Very high86.7Confident65 Ų6574.9 Ų74.929%0.28540%0.396SS..Hα-helixtrans-53.5-47.5179.8174.9-99.3000112.6W184 P185 F192W184-F188 HydrophobicContact CB-CB 3.73Å; W184-F188 HydrophobicContact CB-CD1 3.94Å; W184-F188 HydrophobicContact CB-CD2 4.33Å; W184-F188 HydrophobicContact CB-CG 3.73Å; W184-F188 HydrophobicContact CD2-CD1 4.06Å; W184-F188 AromaticContact CD2-CD2 3.77Å; W184-F188 HydrophobicContact CD2-CD2 3.77Å; W184-F188 HydrophobicContact CD2-CE1 4.02Å; W184-F188 AromaticContact CD2-CE2 3.73Å; W184-F188 HydrophobicContact CD2-CE2 3.73Å; W184-F188 AromaticContact CD2-CG 3.94Å; W184-F188 HydrophobicContact CD2-CG 3.94Å; W184-F188 AromaticContact CD2-CZ 3.86Å; W184-F188 HydrophobicContact CD2-CZ 3.86Å; W184-F188 AromaticContact CE2-CZ 3.79Å; W184-F188 AromaticContact CE3-CD2 3.48Å; W184-F188 HydrophobicContact CE3-CD2 3.48Å; W184-F188 VanDerWaalsContact CE3-CD2 3.48Å; W184-F188 AromaticContact CE3-CE2 3.49Å; W184-F188 HydrophobicContact CE3-CE2 3.49Å; W184-F188 VanDerWaalsContact CE3-CE2 3.49Å; W184-F188 HydrophobicContact CE3-CG 4.07Å; W184-F188 HydrophobicContact CE3-CZ 4.09Å; W184-F188 HydrophobicContact CG-CB 4.38Å; W184-F188 AromaticContact CG-CD1 3.77Å; W184-F188 HydrophobicContact CG-CD1 3.77Å; W184-F188 HydrophobicContact CG-CD2 4.18Å; W184-F188 HydrophobicContact CG-CE1 4.06Å; W184-F188 HydrophobicContact CG-CE2 4.43Å; W184-F188 AromaticContact CG-CG 3.83Å; W184-F188 HydrophobicContact CG-CG 3.83Å; W184-F188 HydrophobicContact CG-CZ 4.38Å; W184-F188 AromaticContact CH2-CE2 3.99Å; W184-F188 HydrophobicContact CH2-CE2 3.99Å; W184-F188 HydrophobicContact CH2-CZ 4.23Å; W184-F188 HydrophobicContact CZ2-CE2 4.19Å; W184-F188 AromaticContact CZ2-CZ 3.99Å; W184-F188 HydrophobicContact CZ2-CZ 3.99Å; W184-F188 HydrophobicContact CZ3-CD2 4.04Å; W184-F188 AromaticContact CZ3-CE2 3.63Å; W184-F188 HydrophobicContact CZ3-CE2 3.63Å; W184-F188 HydrophobicContact CZ3-CZ 4.27Å; P185-F188 HydrophobicContact CG-CB 4.05Å; P185-F188 WeakPolarHBondContact O-CB 3.21Å; P185-F188 PolarHBondContact O-N 2.93Å; F188-F192 HydrophobicContact CE1-CB 4.29Å; F188-F192 HydrophobicContact CE1-CG 4.41Å; F188-F192 HydrophobicContact CE2-CB 4.46Å; F188-F192 HydrophobicContact CE2-CD2 4.42Å; F188-F192 HydrophobicContact CZ-CB 4.22Å; F188-F192 AromaticContact CZ-CD2 3.98Å; F188-F192 HydrophobicContact CZ-CD2 3.98Å; F188-F192 HydrophobicContact CZ-CG 4.18Å; F188-F192 WeakPolarHBondContact O-CB 3.45Å; F188-F192 PolarHBondContact O-N 3.14Å
189F91.7Very high88.1Confident45 Ų4570.8 Ų70.820%0.19739%0.385CS..Hα-helixtrans-60.6-56.3-176.8174.8-108.1000113.4M1 F28 L74 F77 D187 T191 F192 Y193M1-F189 HydrophobicContact CE-CD2 4.34Å; M1-F189 HydrophobicContact CE-CE2 3.49Å; M1-F189 VanDerWaalsContact CE-CE2 3.49Å; M1-F189 HydrophobicContact CE-CZ 4.22Å; F28-F189 AromaticContact CD1-CD2 3.73Å; F28-F189 HydrophobicContact CD1-CD2 3.73Å; F28-F189 AromaticContact CD1-CE2 3.45Å; F28-F189 HydrophobicContact CD1-CE2 3.45Å; F28-F189 VanDerWaalsContact CD1-CE2 3.45Å; F28-F189 HydrophobicContact CD1-CZ 4.09Å; F28-F189 AromaticContact CD2-CE2 3.93Å; F28-F189 HydrophobicContact CD2-CE2 3.93Å; F28-F189 HydrophobicContact CD2-CZ 4.32Å; F28-F189 AromaticContact CE1-CD2 3.42Å; F28-F189 HydrophobicContact CE1-CD2 3.42Å; F28-F189 VanDerWaalsContact CE1-CD2 3.42Å; F28-F189 AromaticContact CE1-CE2 3.33Å; F28-F189 HydrophobicContact CE1-CE2 3.33Å; F28-F189 HydrophobicContact CE1-CZ 4.38Å; F28-F189 AromaticContact CE2-CE2 3.84Å; F28-F189 HydrophobicContact CE2-CE2 3.84Å; F28-F189 HydrophobicContact CG-CD2 4.49Å; F28-F189 AromaticContact CG-CE2 3.77Å; F28-F189 HydrophobicContact CG-CE2 3.77Å; F28-F189 HydrophobicContact CG-CZ 4.09Å; F28-F189 AromaticContact CZ-CD2 3.95Å; F28-F189 HydrophobicContact CZ-CD2 3.95Å; F28-F189 AromaticContact CZ-CE2 3.55Å; F28-F189 HydrophobicContact CZ-CE2 3.55Å; L74-F189 HydrophobicContact CD2-CD1 4.06Å; L74-F189 HydrophobicContact CD2-CE1 3.55Å; L74-F189 HydrophobicContact CD2-CZ 4.42Å; F77-F189 HydrophobicContact CE2-CE1 4.2Å; F77-F189 HydrophobicContact CE2-CZ 4.4Å; D187-F189 VanDerWaalsContact C-N 3.3Å; D187-F189 PolarHBondContact O-N 3.42Å; F189-T191 VanDerWaalsContact C-N 3.34Å; F189-T191 PolarHBondContact O-N 3.31Å; F189-F192 PolarHBondContact O-N 2.56Å; F189-Y193 VanDerWaalsContact O-CB 3.22Å; F189-Y193 WeakPolarHBondContact O-CB 3.48Å; F189-Y193 PolarHBondContact O-N 3.16Å
190P93.8Very high89.4Confident8 Ų865.5 Ų65.55%0.05235%0.348CS..Hα-helixtrans-64.4-3718024-34.2000112.9W53 L74 D187 Y193 A194W53-P190 HydrophobicContact CB-CB 3.67Å; W53-P190 HydrophobicContact CD2-CB 3.75Å; W53-P190 HydrophobicContact CD2-CG 4.2Å; W53-P190 HydrophobicContact CE3-CB 4.3Å; W53-P190 HydrophobicContact CG-CB 3.45Å; W53-P190 VanDerWaalsContact CG-CB 3.45Å; W53-P190 HydrophobicContact CG-CG 3.94Å; L74-P190 HydrophobicContact CD1-CB 3.9Å; L74-P190 HydrophobicContact CD2-CB 4.29Å; D187-P190 HydrophobicContact CB-CG 4.37Å; D187-P190 WeakPolarHBondContact O-CD 3.15Å; D187-P190 VanDerWaalsContact O-CG 3.28Å; D187-P190 WeakPolarHBondContact O-CG 3.48Å; P190-Y193 PolarHBondContact O-N 2.94Å; P190-A194 PolarHBondContact O-N 3.03Å
191T95.2Very high90.6Very high52 Ų5258.7 Ų58.732%0.31931%0.312SS..Hα-helixtrans-64.3-50.8175.5-550000111.2W53 D187 F189 Y193 A194 C195W53-T191 HydrophobicContact CH2-CG2 4.2Å; W53-T191 WeakPolarHBondContact CH2-OG1 2.99Å; W53-T191 WeakPolarHBondContact CZ2-OG1 3.43Å; D187-T191 WeakPolarHBondContact O-CB 3.42Å; D187-T191 PolarHBondContact O-N 3.27Å; D187-T191 VanDerWaalsContact O-N 3.14Å; D187-T191 PolarHBondContact O-OG1 2.79Å; F189-T191 VanDerWaalsContact C-N 3.34Å; F189-T191 PolarHBondContact O-N 3.31Å; T191-Y193 VanDerWaalsContact C-N 3.27Å; T191-Y193 PolarHBondContact O-N 3.25Å; T191-A194 PolarHBondContact O-N 3.02Å; T191-C195 WeakPolarHBondContact O-CB 3.02Å; T191-C195 PolarHBondContact O-N 2.66Å; T191-C195 PolarHBondContact O-SG 2.93Å
192F95.6Very high91.8Very high83 Ų8357.3 Ų57.336%0.36430%0.302SS..Hα-helixtrans-58.3-42.2176.5-179.9-92.2000111.1V2 F188 F189 C195 H196V2-F192 HydrophobicContact CG2-CE1 3.66Å; V2-F192 HydrophobicContact CG2-CZ 3.61Å; F188-F192 HydrophobicContact CE1-CB 4.29Å; F188-F192 HydrophobicContact CE1-CG 4.41Å; F188-F192 HydrophobicContact CE2-CB 4.46Å; F188-F192 HydrophobicContact CE2-CD2 4.42Å; F188-F192 HydrophobicContact CZ-CB 4.22Å; F188-F192 AromaticContact CZ-CD2 3.98Å; F188-F192 HydrophobicContact CZ-CD2 3.98Å; F188-F192 HydrophobicContact CZ-CG 4.18Å; F188-F192 WeakPolarHBondContact O-CB 3.45Å; F188-F192 PolarHBondContact O-N 3.14Å; F189-F192 PolarHBondContact O-N 2.56Å; F192-C195 PolarHBondContact O-N 2.9Å; F192-H196 PolarHBondContact O-N 3.29Å; F192-H196 PolarHBondContact O-ND1 3.48Å
193Y96Very high92.7Very high6 Ų655.7 Ų55.72%0.02430%0.303CS..Hα-helixtrans-58.5-51.6177.6-179.3-100000111.8M1 H5 A57 N72 I73 L74 F189 P190 T191 H196 L197M1-Y193 HydrophobicContact CE-CD2 3.91Å; M1-Y193 HydrophobicContact SD-CD2 4.05Å; H5-Y193 AromaticContact CE1-CE2 3.99Å; A57-Y193 HydrophobicContact CB-CD1 3.9Å; A57-Y193 HydrophobicContact CB-CE1 3.96Å; N72-Y193 HydrophobicContact CB-CE1 4.08Å; I73-Y193 HydrophobicContact CG2-CD2 4.18Å; I73-Y193 HydrophobicContact CG2-CE1 4.16Å; I73-Y193 HydrophobicContact CG2-CE2 3.58Å; L74-Y193 HydrophobicContact CD1-CD1 3.8Å; L74-Y193 HydrophobicContact CD1-CE1 4.4Å; L74-Y193 HydrophobicContact CD2-CD1 4.47Å; L74-Y193 HydrophobicContact CG-CD1 3.86Å; L74-Y193 HydrophobicContact CG-CE1 4.18Å; F189-Y193 VanDerWaalsContact O-CB 3.22Å; F189-Y193 WeakPolarHBondContact O-CB 3.48Å; F189-Y193 PolarHBondContact O-N 3.16Å; P190-Y193 PolarHBondContact O-N 2.94Å; T191-Y193 VanDerWaalsContact C-N 3.27Å; T191-Y193 PolarHBondContact O-N 3.25Å; Y193-H196 VanDerWaalsContact CA-CE1 3.48Å; Y193-H196 WeakPolarHBondContact CA-CE1 3.13Å; Y193-H196 VanDerWaalsContact CA-ND1 3.3Å; Y193-H196 WeakPolarHBondContact CA-ND1 3.38Å; Y193-H196 AromaticContact CD2-CE1 3.69Å; Y193-H196 PolarHBondContact O-CE1 3.35Å; Y193-H196 PolarHBondContact O-ND1 3.32Å; Y193-L197 HydrophobicContact CD1-CD1 4.18Å; Y193-L197 HydrophobicContact CD2-CD1 4.48Å; Y193-L197 HydrophobicContact CE1-CD1 3.56Å; Y193-L197 HydrophobicContact CE2-CD1 3.92Å; Y193-L197 VanDerWaalsContact CZ-CD1 3.4Å; Y193-L197 WeakPolarHBondContact O-CG 3.5Å; Y193-L197 PolarHBondContact O-N 2.92Å
194A96.6Very high93.4Very high8 Ų849.9 Ų49.97%0.06629%0.287CS..Hα-helixtrans-64.1-46.617800000112.1A57 A60 P190 T191 L197 A198A57-A194 HydrophobicContact CB-CB 4.09Å; A60-A194 VanDerWaalsContact CB-O 3.26Å; A60-A194 WeakPolarHBondContact CB-O 3.24Å; P190-A194 PolarHBondContact O-N 3.03Å; T191-A194 PolarHBondContact O-N 3.02Å; A194-L197 PolarHBondContact O-N 2.91Å; A194-A198 WeakPolarHBondContact O-CB 3.36Å; A194-A198 PolarHBondContact O-N 3.29Å
195C96.9Very high93.7Very high70 Ų7052.2 Ų52.247%0.47331%0.308SS..Hα-helixtrans-64.8-46.4-176.2-69.30000112.8T191 F192 L197 A198 V199T191-C195 WeakPolarHBondContact O-CB 3.02Å; T191-C195 PolarHBondContact O-N 2.66Å; T191-C195 PolarHBondContact O-SG 2.93Å; F192-C195 PolarHBondContact O-N 2.9Å; C195-L197 VanDerWaalsContact C-N 3.34Å; C195-L197 PolarHBondContact O-N 3.43Å; C195-A198 PolarHBondContact O-N 2.91Å; C195-V199 VanDerWaalsContact O-CG2 3.31Å; C195-V199 WeakPolarHBondContact O-CG2 3.33Å; C195-V199 PolarHBondContact O-N 2.63Å
196H97Very high94.1Very high16 Ų1650.6 Ų50.67%0.07430%0.296CS..Hα-helixtrans-68.4-35.8-177.884.1-78.8000111.5M1 H5 F192 Y193 V199 L200M1-H196 PolarHBondContact SD-CE1 3.24Å; H5-H196 AromaticContact CE1-NE2 3.44Å; H5-H196 PolarHBondContact CE1-NE2 3.26Å; H5-H196 AromaticContact CG-NE2 3.92Å; H5-H196 AromaticContact ND1-CD2 3.7Å; H5-H196 AromaticContact ND1-CE1 3.76Å; H5-H196 AromaticContact ND1-NE2 2.76Å; H5-H196 PolarHBondContact ND1-NE2 3.45Å; F192-H196 PolarHBondContact O-N 3.29Å; F192-H196 PolarHBondContact O-ND1 3.48Å; Y193-H196 VanDerWaalsContact CA-CE1 3.48Å; Y193-H196 WeakPolarHBondContact CA-CE1 3.13Å; Y193-H196 VanDerWaalsContact CA-ND1 3.3Å; Y193-H196 WeakPolarHBondContact CA-ND1 3.38Å; Y193-H196 AromaticContact CD2-CE1 3.69Å; Y193-H196 PolarHBondContact O-CE1 3.35Å; Y193-H196 PolarHBondContact O-ND1 3.32Å; H196-V199 PolarHBondContact O-N 3.02Å; H196-L200 WeakPolarHBondContact O-CB 3.42Å; H196-L200 WeakPolarHBondContact O-CG 3.36Å; H196-L200 PolarHBondContact O-N 3.33Å
197L97.2Very high94.8Very high0 Ų051 Ų510%029%0.288CS..Hα-helixtrans-62-44.7172.6-74.1-179.8000111.4I9 A60 Y61 A64 F66 Y193 A194 C195 V199 L200 G201I9-L197 HydrophobicContact CD1-CD2 4.29Å; A60-L197 HydrophobicContact CB-CB 3.97Å; Y61-L197 HydrophobicContact CD2-CD1 3.91Å; A64-L197 HydrophobicContact CB-CB 4.39Å; A64-L197 HydrophobicContact CB-CD2 4.19Å; F66-L197 HydrophobicContact CE2-CD2 3.99Å; Y193-L197 HydrophobicContact CD1-CD1 4.18Å; Y193-L197 HydrophobicContact CD2-CD1 4.48Å; Y193-L197 HydrophobicContact CE1-CD1 3.56Å; Y193-L197 HydrophobicContact CE2-CD1 3.92Å; Y193-L197 VanDerWaalsContact CZ-CD1 3.4Å; Y193-L197 WeakPolarHBondContact O-CG 3.5Å; Y193-L197 PolarHBondContact O-N 2.92Å; A194-L197 PolarHBondContact O-N 2.91Å; C195-L197 VanDerWaalsContact C-N 3.34Å; C195-L197 PolarHBondContact O-N 3.43Å; L197-V199 PolarHBondContact O-N 3.44Å; L197-L200 PolarHBondContact O-N 3.29Å; L197-G201 PolarHBondContact O-N 3.25Å
198A97.3Very high95.4Very high31 Ų3150.5 Ų50.526%0.25629%0.286SS..Hα-helixtrans-61.1-46.3177.400000111.5A60 A194 C195 G201 V202A60-A198 HydrophobicContact CB-CB 3.9Å; A194-A198 WeakPolarHBondContact O-CB 3.36Å; A194-A198 PolarHBondContact O-N 3.29Å; C195-A198 PolarHBondContact O-N 2.91Å; A198-G201 PolarHBondContact O-N 3.25Å; A198-V202 VanDerWaalsContact O-CG2 3.29Å; A198-V202 WeakPolarHBondContact O-CG2 3.16Å; A198-V202 PolarHBondContact O-N 3.28Å
199V97.5Very high95.6Very high85 Ų8549.6 Ų49.652%0.51529%0.286SS..Hα-helixtrans-61.4-48.7178.2170.50000111.1C195 H196 L197 G201 V202 L203C195-V199 VanDerWaalsContact O-CG2 3.31Å; C195-V199 WeakPolarHBondContact O-CG2 3.33Å; C195-V199 PolarHBondContact O-N 2.63Å; H196-V199 PolarHBondContact O-N 3.02Å; L197-V199 PolarHBondContact O-N 3.44Å; V199-G201 VanDerWaalsContact C-N 3.33Å; V199-G201 PolarHBondContact O-N 3.33Å; V199-V202 PolarHBondContact O-N 2.94Å; V199-L203 HydrophobicContact CG1-CD1 3.91Å; V199-L203 HydrophobicContact CG1-CG 4.48Å; V199-L203 WeakPolarHBondContact O-CB 3.45Å; V199-L203 VanDerWaalsContact O-CG 3.25Å; V199-L203 WeakPolarHBondContact O-CG 3.15Å; V199-L203 PolarHBondContact O-N 2.94Å
200L97.3Very high95.9Very high14 Ų1449.9 Ų49.97%0.07329%0.292CS..Hα-helixtrans-63.9-39.6179-65.7178.7000111.8H5 I6 I9 F10 H196 L197 L203 A204H5-L200 HydrophobicContact CB-CD1 3.82Å; I6-L200 HydrophobicContact CD1-CD2 4.4Å; I6-L200 HydrophobicContact CG1-CD1 3.97Å; I6-L200 HydrophobicContact CG1-CD2 3.6Å; I6-L200 HydrophobicContact CG1-CG 4.47Å; I9-L200 HydrophobicContact CD1-CB 3.56Å; I9-L200 HydrophobicContact CD1-CD1 3.81Å; I9-L200 HydrophobicContact CD1-CG 4.34Å; I9-L200 HydrophobicContact CG2-CB 4.42Å; F10-L200 HydrophobicContact CE2-CD2 3.86Å; H196-L200 WeakPolarHBondContact O-CB 3.42Å; H196-L200 WeakPolarHBondContact O-CG 3.36Å; H196-L200 PolarHBondContact O-N 3.33Å; L197-L200 PolarHBondContact O-N 3.29Å; L200-L203 PolarHBondContact O-N 3.41Å; L200-A204 WeakPolarHBondContact O-CB 3.39Å; L200-A204 PolarHBondContact O-N 3.15Å; L200-A204 VanDerWaalsContact O-N 3.1Å
201G96.4Very high96Very high1 Ų152.7 Ų52.71%0.0131%0.308CS..Hα-helixtrans-62.6-47.6175.600000112.6L63 L197 A198 V199 L203 A204 L205L63-G201 WeakPolarHBondContact O-CA 3.44Å; L197-G201 PolarHBondContact O-N 3.25Å; A198-G201 PolarHBondContact O-N 3.25Å; V199-G201 VanDerWaalsContact C-N 3.33Å; V199-G201 PolarHBondContact O-N 3.33Å; G201-L203 VanDerWaalsContact C-N 3.3Å; G201-L203 PolarHBondContact O-N 3.2Å; G201-A204 PolarHBondContact O-N 2.89Å; G201-A204 VanDerWaalsContact O-N 3.13Å; G201-L205 PolarHBondContact O-N 2.7Å
202V96.8Very high96.1Very high85 Ų8552.8 Ų52.852%0.51531%0.307SS..Hα-helixtrans-60.6-40.2175.9172.40000111.8L63 A198 V199 A204 L205L63-V202 HydrophobicContact CD2-CG2 3.82Å; A198-V202 VanDerWaalsContact O-CG2 3.29Å; A198-V202 WeakPolarHBondContact O-CG2 3.16Å; A198-V202 PolarHBondContact O-N 3.28Å; V199-V202 PolarHBondContact O-N 2.94Å; V202-A204 PolarHBondContact O-N 3.03Å; V202-L205 PolarHBondContact O-N 3.26Å
203L96.7Very high96.1Very high110 Ų11050.5 Ų50.558%0.57630%0.302SS*.Hα-helixtrans-71-18.6179-71.1173.8000113.6F10 V199 L200 G201F10-L203 HydrophobicContact CE1-CB 4.15Å; F10-L203 HydrophobicContact CZ-CB 3.69Å; V199-L203 HydrophobicContact CG1-CD1 3.91Å; V199-L203 HydrophobicContact CG1-CG 4.48Å; V199-L203 WeakPolarHBondContact O-CB 3.45Å; V199-L203 VanDerWaalsContact O-CG 3.25Å; V199-L203 WeakPolarHBondContact O-CG 3.15Å; V199-L203 PolarHBondContact O-N 2.94Å; L200-L203 PolarHBondContact O-N 3.41Å; G201-L203 VanDerWaalsContact C-N 3.3Å; G201-L203 PolarHBondContact O-N 3.2Å
204A93.8Very high96.1Very high48 Ų4854.2 Ų54.240%0.39733%0.326SS..Hα-helixtrans-93.3-7.9179.500000113.6I9 F10 L200 G201 V202I9-A204 HydrophobicContact CG2-CB 3.61Å; F10-A204 HydrophobicContact CD1-CB 4.29Å; F10-A204 HydrophobicContact CE1-CB 4.07Å; L200-A204 WeakPolarHBondContact O-CB 3.39Å; L200-A204 PolarHBondContact O-N 3.15Å; L200-A204 VanDerWaalsContact O-N 3.1Å; G201-A204 PolarHBondContact O-N 2.89Å; G201-A204 VanDerWaalsContact O-N 3.13Å; V202-A204 PolarHBondContact O-N 3.03Å
205L90Very high96.1Very high182 Ų18258.4 Ų58.495%0.95335%0.349SS*.  trans-74.10169.2-65.4175.8000111L63 G201 V202L63-L205 HydrophobicContact CD1-CD1 4.12Å; G201-L205 PolarHBondContact O-N 2.7Å; V202-L205 PolarHBondContact O-N 3.26Å

Retrieved 205 of 205 residues in 213.5 ms (Link to these results)

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