A0A3B3V3A4_9TELE Loading...

Phosphatidylinositol glycan anchor biosynthesis, class F

AlphaFold DB , UniProt , Accession A0A3B3V3A4, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 219 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
1M65Low85Confident142 Ų14273.4 Ų73.470%0.737%0.37SS*.  0-58.10-176.6149.36.700111.3D3 H4 E5 C218M1-D3 PolarHBondContact O-N 3.39Å; M1-H4 WeakPolarHBondContact O-CB 3.36Å; M1-H4 PolarHBondContact O-N 3.29Å; M1-E5 PolarHBondContact O-N 3.28Å; M1-E5 VanDerWaalsContact O-N 3.1Å; M1-C218 HydrophobicContact CE-CB 4.38Å; M1-C218 VanDerWaalsContact CE-SG 3.59Å; M1-C218 HydrophobicContact SD-CB 4.16Å; M1-C218 PolarHBondContact SD-SG 2.97Å
2W72.5Confident85.6Confident52 Ų5267.3 Ų67.320%0.19734%0.339CS..Hα-helixtrans-53.1-44175-84.278.4000115.2H4 E5 I6 V150 I207 R211 L214 Y216W2-H4 PolarHBondContact O-N 3.18Å; W2-E5 PolarHBondContact O-N 3.24Å; W2-I6 HydrophobicContact CE3-CD1 4.17Å; W2-I6 WeakPolarHBondContact O-CB 3.29Å; W2-I6 VanDerWaalsContact O-CG1 3.27Å; W2-I6 WeakPolarHBondContact O-CG1 3.41Å; W2-I6 PolarHBondContact O-N 3.34Å; W2-V150 HydrophobicContact CD2-CG2 4.39Å; W2-V150 HydrophobicContact CE3-CG2 3.87Å; W2-V150 HydrophobicContact CH2-CG2 4.22Å; W2-V150 HydrophobicContact CZ3-CG2 3.79Å; W2-I207 HydrophobicContact CE3-CG2 4.4Å; W2-I207 HydrophobicContact CZ3-CG2 3.75Å; W2-R211 HydrophobicContact CE3-CB 4.1Å; W2-R211 HydrophobicContact CZ3-CB 4.03Å; W2-L214 HydrophobicContact CH2-CB 3.55Å; W2-L214 HydrophobicContact CH2-CD1 4.07Å; W2-L214 HydrophobicContact CH2-CG 4.48Å; W2-L214 HydrophobicContact CZ2-CB 4.34Å; W2-L214 HydrophobicContact CZ3-CB 4.41Å; W2-L214 HydrophobicContact CZ3-CD1 4.16Å; W2-Y216 AromaticContact CH2-CD2 2.93Å; W2-Y216 HydrophobicContact CH2-CD2 2.93Å; W2-Y216 AromaticContact CH2-CE2 3.16Å; W2-Y216 HydrophobicContact CH2-CE2 3.16Å; W2-Y216 AromaticContact CH2-CG 3.87Å; W2-Y216 HydrophobicContact CH2-CG 3.87Å; W2-Y216 AromaticContact CZ2-CD2 3.27Å; W2-Y216 HydrophobicContact CZ2-CD2 3.27Å; W2-Y216 HydrophobicContact CZ2-CE2 4Å; W2-Y216 AromaticContact CZ2-CG 3.88Å; W2-Y216 HydrophobicContact CZ2-CG 3.88Å; W2-Y216 AromaticContact CZ3-CD2 3.71Å; W2-Y216 HydrophobicContact CZ3-CD2 3.71Å; W2-Y216 AromaticContact CZ3-CE2 3.65Å; W2-Y216 HydrophobicContact CZ3-CE2 3.65Å
3D79.9Confident86.4Confident81 Ų8162.6 Ų62.643%0.43332%0.315SS..Hα-helixtrans-63.9-31.8178.4-61-48.3000112.5M1 R7M1-D3 PolarHBondContact O-N 3.39Å; D3-R7 VanDerWaalsContact O-CB 3.26Å; D3-R7 WeakPolarHBondContact O-CB 3.41Å; D3-R7 WeakPolarHBondContact O-CD 3.22Å; D3-R7 WeakPolarHBondContact O-CG 3.37Å; D3-R7 PolarHBondContact O-N 3.29Å
4H84.6Confident87.1Confident140 Ų14062.5 Ų62.565%0.64833%0.329SS*.Hα-helixtrans-70.8-45.4175.5-177.9-86.7000110.9M1 W2 R7 A8M1-H4 WeakPolarHBondContact O-CB 3.36Å; M1-H4 PolarHBondContact O-N 3.29Å; W2-H4 PolarHBondContact O-N 3.18Å; H4-R7 PolarHBondContact O-N 2.91Å; H4-A8 WeakPolarHBondContact O-CB 3.45Å; H4-A8 PolarHBondContact O-N 3.21Å
5E85.8Confident87.7Confident53 Ų5364.1 Ų64.125%0.24834%0.337CS..Hα-helixtrans-63.5-42176.5-68.3-170.8127.100112.4M1 W2 A8 M9M1-E5 PolarHBondContact O-N 3.28Å; M1-E5 VanDerWaalsContact O-N 3.1Å; W2-E5 PolarHBondContact O-N 3.24Å; E5-A8 PolarHBondContact O-N 3.05Å; E5-M9 VanDerWaalsContact O-CB 3.31Å; E5-M9 WeakPolarHBondContact O-CB 3.41Å; E5-M9 PolarHBondContact O-N 2.61Å
6I88.8Confident88.2Confident14 Ų1460.1 Ų60.17%0.07232%0.316CS..Hα-helixtrans-65.5-41.6176.4-66.9167.4000110.6W2 M9 A10 V150 P204 I207 H208W2-I6 HydrophobicContact CE3-CD1 4.17Å; W2-I6 WeakPolarHBondContact O-CB 3.29Å; W2-I6 VanDerWaalsContact O-CG1 3.27Å; W2-I6 WeakPolarHBondContact O-CG1 3.41Å; W2-I6 PolarHBondContact O-N 3.34Å; I6-M9 WeakPolarHBondContact O-CB 3.34Å; I6-M9 PolarHBondContact O-N 2.84Å; I6-A10 WeakPolarHBondContact O-CB 3.26Å; I6-A10 PolarHBondContact O-N 3.45Å; I6-V150 HydrophobicContact CG1-CG1 4.42Å; I6-P204 HydrophobicContact CG2-CB 4.33Å; I6-I207 HydrophobicContact CD1-CG2 4.34Å; I6-I207 HydrophobicContact CG1-CG2 4.38Å; I6-H208 HydrophobicContact CD1-CB 4.25Å
7R89.6Confident88.7Confident185 Ų18557.8 Ų57.870%0.69831%0.307SS*.Hα-helixtrans-65.1-42.1175.3-76.1173.2-172-162.83.3112.1D3 H4 M9 A10 S11D3-R7 VanDerWaalsContact O-CB 3.26Å; D3-R7 WeakPolarHBondContact O-CB 3.41Å; D3-R7 WeakPolarHBondContact O-CD 3.22Å; D3-R7 WeakPolarHBondContact O-CG 3.37Å; D3-R7 PolarHBondContact O-N 3.29Å; H4-R7 PolarHBondContact O-N 2.91Å; R7-M9 VanDerWaalsContact C-N 3.32Å; R7-A10 PolarHBondContact O-N 3.34Å; R7-S11 WeakPolarHBondContact O-CB 3.39Å; R7-S11 PolarHBondContact O-N 2.84Å; R7-S11 PolarHBondContact O-OG 3.1Å
8A89.5Confident89.1Confident29 Ų2957.3 Ų57.324%0.2431%0.313CS..Hα-helixtrans-63.3-40.6175.800000111.3H4 E5 S11 T12H4-A8 WeakPolarHBondContact O-CB 3.45Å; H4-A8 PolarHBondContact O-N 3.21Å; E5-A8 PolarHBondContact O-N 3.05Å; A8-S11 PolarHBondContact O-N 3.42Å; A8-T12 WeakPolarHBondContact O-CB 3.3Å; A8-T12 PolarHBondContact O-N 3Å; A8-T12 PolarHBondContact O-OG1 3.26Å
9M91.9Very high89.4Confident0 Ų055 Ų550%030%0.301CS..Hα-helixtrans-61.7-51.9172.6177.2179.7-67.200112E5 I6 R7 S11 T12 H13 V150 W151 C154 P204 I207E5-M9 VanDerWaalsContact O-CB 3.31Å; E5-M9 WeakPolarHBondContact O-CB 3.41Å; E5-M9 PolarHBondContact O-N 2.61Å; I6-M9 WeakPolarHBondContact O-CB 3.34Å; I6-M9 PolarHBondContact O-N 2.84Å; R7-M9 VanDerWaalsContact C-N 3.32Å; M9-S11 VanDerWaalsContact C-N 3.28Å; M9-S11 PolarHBondContact O-N 3.19Å; M9-T12 WeakPolarHBondContact O-CB 3.36Å; M9-T12 PolarHBondContact O-N 3.15Å; M9-H13 WeakPolarHBondContact O-CB 3.21Å; M9-H13 PolarHBondContact O-CD2 3.34Å; M9-H13 VanDerWaalsContact O-CD2 3.27Å; M9-H13 PolarHBondContact O-N 2.92Å; M9-V150 HydrophobicContact CE-CB 4.23Å; M9-V150 HydrophobicContact CE-CG1 3.33Å; M9-V150 HydrophobicContact SD-CG1 4.18Å; M9-W151 HydrophobicContact CB-CH2 3.84Å; M9-W151 HydrophobicContact CB-CZ2 4.11Å; M9-W151 HydrophobicContact CB-CZ3 4.21Å; M9-W151 HydrophobicContact CE-CD2 3.82Å; M9-W151 HydrophobicContact CE-CE3 3.71Å; M9-W151 HydrophobicContact CE-CG 4.31Å; M9-W151 HydrophobicContact CE-CZ3 4.09Å; M9-W151 HydrophobicContact CG-CH2 4.21Å; M9-W151 HydrophobicContact CG-CZ3 4.08Å; M9-C154 HydrophobicContact CE-CB 3.4Å; M9-C154 VanDerWaalsContact CE-CB 3.4Å; M9-C154 HydrophobicContact SD-CB 3.74Å; M9-P204 HydrophobicContact CG-CB 4.47Å; M9-P204 HydrophobicContact SD-CB 4.24Å; M9-I207 HydrophobicContact CE-CD1 4.32Å; M9-I207 HydrophobicContact SD-CD1 4.09Å
10A94Very high89.7Confident43 Ų4352.6 Ų52.636%0.35529%0.288SS..Hα-helixtrans-59-41178.700000111.7I6 R7 H13 A14 P204I6-A10 WeakPolarHBondContact O-CB 3.26Å; I6-A10 PolarHBondContact O-N 3.45Å; R7-A10 PolarHBondContact O-N 3.34Å; A10-H13 PolarHBondContact O-N 2.77Å; A10-A14 WeakPolarHBondContact O-CB 3.46Å; A10-A14 PolarHBondContact O-N 3.15Å; A10-P204 HydrophobicContact CB-CB 4.45Å
11S93.1Very high89.9Confident68 Ų6855.8 Ų55.848%0.47630%0.299SS..Hα-helixtrans-65.5-44.5176.4-54.10000111.7R7 A8 M9 H13 A14 I15R7-S11 WeakPolarHBondContact O-CB 3.39Å; R7-S11 PolarHBondContact O-N 2.84Å; R7-S11 PolarHBondContact O-OG 3.1Å; A8-S11 PolarHBondContact O-N 3.42Å; M9-S11 VanDerWaalsContact C-N 3.28Å; M9-S11 PolarHBondContact O-N 3.19Å; S11-H13 VanDerWaalsContact C-N 3.29Å; S11-H13 PolarHBondContact O-N 3.45Å; S11-A14 PolarHBondContact O-N 2.91Å; S11-I15 VanDerWaalsContact O-CG1 3.32Å; S11-I15 WeakPolarHBondContact O-CG1 3.17Å; S11-I15 PolarHBondContact O-N 2.94Å
12T93.1Very high91.3Very high1 Ų154 Ų541%0.00629%0.291CS..Hα-helixtrans-58.2-43.2174.2-62.60000111.3A8 M9 I15 I16 V58 F59 L62 W151A8-T12 WeakPolarHBondContact O-CB 3.3Å; A8-T12 PolarHBondContact O-N 3Å; A8-T12 PolarHBondContact O-OG1 3.26Å; M9-T12 WeakPolarHBondContact O-CB 3.36Å; M9-T12 PolarHBondContact O-N 3.15Å; T12-I15 PolarHBondContact O-N 3.36Å; T12-I16 HydrophobicContact CG2-CD1 3.83Å; T12-I16 WeakPolarHBondContact O-CG1 3.43Å; T12-I16 PolarHBondContact O-N 2.72Å; T12-V58 HydrophobicContact CG2-CG1 3.57Å; T12-F59 HydrophobicContact CG2-CZ 4.3Å; T12-L62 WeakPolarHBondContact OG1-CD1 3.48Å; T12-W151 HydrophobicContact CG2-CH2 4.38Å
13H95.5Very high92.4Very high6 Ų651.8 Ų51.83%0.02828%0.283CS..Hα-helixtrans-67.6-40.8179.2-72.7-167.9000112M9 A10 S11 I15 I16 A17 R126 C154 L200M9-H13 WeakPolarHBondContact O-CB 3.21Å; M9-H13 PolarHBondContact O-CD2 3.34Å; M9-H13 VanDerWaalsContact O-CD2 3.27Å; M9-H13 PolarHBondContact O-N 2.92Å; A10-H13 PolarHBondContact O-N 2.77Å; S11-H13 VanDerWaalsContact C-N 3.29Å; S11-H13 PolarHBondContact O-N 3.45Å; H13-I15 VanDerWaalsContact C-N 3.35Å; H13-I15 PolarHBondContact O-N 2.96Å; H13-I16 PolarHBondContact O-N 3.18Å; H13-A17 VanDerWaalsContact O-CB 3.28Å; H13-A17 WeakPolarHBondContact O-CB 3.2Å; H13-A17 PolarHBondContact O-N 2.91Å; H13-R126 PolarHBondContact NE2-NH2 2.87Å; H13-C154 PolarHBondContact CE1-SG 3.11Å; H13-C154 PolarHBondContact NE2-SG 3Å; H13-L200 HydrophobicContact CB-CB 4.08Å; H13-L200 HydrophobicContact CB-CD2 4.22Å; H13-L200 PolarHBondContact ND1-O 3.48Å
14A96.3Very high92.9Very high61 Ų6149.8 Ų49.850%0.50427%0.274SS..Hα-helixtrans-61.3-43.3174.700000111.6A10 S11 I16 A17 A18A10-A14 WeakPolarHBondContact O-CB 3.46Å; A10-A14 PolarHBondContact O-N 3.15Å; S11-A14 PolarHBondContact O-N 2.91Å; A14-I16 PolarHBondContact O-N 3.42Å; A14-A17 PolarHBondContact O-N 3.38Å; A14-A18 VanDerWaalsContact O-CB 3.31Å; A14-A18 WeakPolarHBondContact O-CB 3.28Å; A14-A18 PolarHBondContact O-N 3.49Å
15I96.1Very high93.4Very high87 Ų8747.5 Ų47.545%0.44627%0.266SS..Hα-helixtrans-62-43.9176.9-67.3165.5000111.2S11 T12 H13 A18 S19 V54 V58S11-I15 VanDerWaalsContact O-CG1 3.32Å; S11-I15 WeakPolarHBondContact O-CG1 3.17Å; S11-I15 PolarHBondContact O-N 2.94Å; T12-I15 PolarHBondContact O-N 3.36Å; H13-I15 VanDerWaalsContact C-N 3.35Å; H13-I15 PolarHBondContact O-N 2.96Å; I15-A18 PolarHBondContact O-N 2.88Å; I15-S19 PolarHBondContact O-N 3.43Å; I15-V54 HydrophobicContact CG2-CG1 3.64Å; I15-V58 HydrophobicContact CG2-CG2 3.87Å
16I95.4Very high93.8Very high0 Ų049.3 Ų49.30%028%0.277CS..Hα-helixtrans-71.7-39.1179.6-66.3165.5000111.6T12 H13 A14 A18 S19 V20 V51 V54 Y196 L200T12-I16 HydrophobicContact CG2-CD1 3.83Å; T12-I16 WeakPolarHBondContact O-CG1 3.43Å; T12-I16 PolarHBondContact O-N 2.72Å; H13-I16 PolarHBondContact O-N 3.18Å; A14-I16 PolarHBondContact O-N 3.42Å; I16-A18 VanDerWaalsContact C-N 3.32Å; I16-A18 PolarHBondContact O-N 3.46Å; I16-S19 PolarHBondContact O-N 3.43Å; I16-S19 PolarHBondContact O-OG 3.42Å; I16-V20 PolarHBondContact O-N 2.92Å; I16-V20 VanDerWaalsContact O-N 3.13Å; I16-V51 HydrophobicContact CG2-CG1 4.47Å; I16-V54 HydrophobicContact CG1-CG1 3.95Å; I16-Y196 HydrophobicContact CG2-CE1 3.94Å; I16-Y196 VanDerWaalsContact CG2-OH 3.3Å; I16-Y196 WeakPolarHBondContact CG2-OH 3.27Å; I16-L200 HydrophobicContact CB-CD1 4.45Å; I16-L200 HydrophobicContact CG2-CD1 4.17Å
17A96.4Very high94Very high20 Ų2049.1 Ų49.117%0.16528%0.276CS..Hα-helixtrans-61.8-43.2173.900000110.7H13 A14 S19 V20 F21 L197 L200H13-A17 VanDerWaalsContact O-CB 3.28Å; H13-A17 WeakPolarHBondContact O-CB 3.2Å; H13-A17 PolarHBondContact O-N 2.91Å; A14-A17 PolarHBondContact O-N 3.38Å; A17-S19 VanDerWaalsContact C-N 3.29Å; A17-S19 PolarHBondContact O-N 3.09Å; A17-V20 WeakPolarHBondContact O-CB 3.3Å; A17-V20 PolarHBondContact O-N 2.69Å; A17-F21 WeakPolarHBondContact O-CD2 3.43Å; A17-F21 PolarHBondContact O-N 2.88Å; A17-F21 VanDerWaalsContact O-N 3.16Å; A17-L197 HydrophobicContact CB-CD2 3.83Å; A17-L200 HydrophobicContact CB-CD1 4.22Å
18A96.6Very high94.2Very high50 Ų5043 Ų4341%0.41327%0.265SS..Hα-helixtrans-59.4-39.3174.200000112A14 I15 I16 V20 F21 M22A14-A18 VanDerWaalsContact O-CB 3.31Å; A14-A18 WeakPolarHBondContact O-CB 3.28Å; A14-A18 PolarHBondContact O-N 3.49Å; I15-A18 PolarHBondContact O-N 2.88Å; I16-A18 VanDerWaalsContact C-N 3.32Å; I16-A18 PolarHBondContact O-N 3.46Å; A18-V20 VanDerWaalsContact C-N 3.33Å; A18-V20 PolarHBondContact O-N 3.31Å; A18-F21 PolarHBondContact O-N 3.21Å; A18-M22 WeakPolarHBondContact O-CB 3.38Å; A18-M22 WeakPolarHBondContact O-CG 3.22Å; A18-M22 PolarHBondContact O-N 2.86Å
19S95.4Very high94.5Very high13 Ų1346.9 Ų46.99%0.09129%0.286CS..Hα-helixtrans-66-34.5177.781.80000113I15 I16 A17 M22 A23I15-S19 PolarHBondContact O-N 3.43Å; I16-S19 PolarHBondContact O-N 3.43Å; I16-S19 PolarHBondContact O-OG 3.42Å; A17-S19 VanDerWaalsContact C-N 3.29Å; A17-S19 PolarHBondContact O-N 3.09Å; S19-M22 PolarHBondContact O-N 2.98Å; S19-A23 VanDerWaalsContact O-CB 3.27Å; S19-A23 WeakPolarHBondContact O-CB 3.2Å; S19-A23 PolarHBondContact O-N 2.87Å
20V94.8Very high94.6Very high7 Ų752.5 Ų52.54%0.04232%0.315CS..Hα-helixtrans-61.3-47.9171.9165.90000111.5I16 A17 A18 A23 T24 V51 M193 Y196 L197I16-V20 PolarHBondContact O-N 2.92Å; I16-V20 VanDerWaalsContact O-N 3.13Å; A17-V20 WeakPolarHBondContact O-CB 3.3Å; A17-V20 PolarHBondContact O-N 2.69Å; A18-V20 VanDerWaalsContact C-N 3.33Å; A18-V20 PolarHBondContact O-N 3.31Å; V20-A23 PolarHBondContact O-N 3.4Å; V20-T24 PolarHBondContact O-N 3.39Å; V20-T24 PolarHBondContact O-OG1 3.48Å; V20-V51 HydrophobicContact CG2-CG2 3.45Å; V20-V51 VanDerWaalsContact CG2-CG2 3.45Å; V20-M193 HydrophobicContact CB-CE 4.03Å; V20-M193 HydrophobicContact CG1-CE 3.12Å; V20-M193 HydrophobicContact CG2-CE 3.68Å; V20-Y196 HydrophobicContact CG2-CE1 4.49Å; V20-L197 HydrophobicContact CB-CD2 4.27Å; V20-L197 HydrophobicContact CG1-CD1 4.25Å; V20-L197 HydrophobicContact CG1-CD2 4.23Å; V20-L197 HydrophobicContact CG2-CD2 4.39Å
21F94.6Very high94.7Very high120 Ų12053.2 Ų53.253%0.52632%0.315SS..Hα-helixtrans-62.3-45.3177.8-69.5-67.6000110.9A17 A18 A23 T24 I25 L197A17-F21 WeakPolarHBondContact O-CD2 3.43Å; A17-F21 PolarHBondContact O-N 2.88Å; A17-F21 VanDerWaalsContact O-N 3.16Å; A18-F21 PolarHBondContact O-N 3.21Å; F21-A23 VanDerWaalsContact C-N 3.31Å; F21-A23 PolarHBondContact O-N 3.14Å; F21-T24 PolarHBondContact O-N 2.87Å; F21-I25 WeakPolarHBondContact O-CG1 3.21Å; F21-I25 PolarHBondContact O-N 3.46Å; F21-L197 HydrophobicContact CZ-CD1 4.2Å
22M94.7Very high94.9Very high105 Ų10556.1 Ų56.152%0.51733%0.332SS..Hα-helixtrans-63.3-35.5177.3-71-54.7-59.800112.8A18 S19 T24 I25 L26A18-M22 WeakPolarHBondContact O-CB 3.38Å; A18-M22 WeakPolarHBondContact O-CG 3.22Å; A18-M22 PolarHBondContact O-N 2.86Å; S19-M22 PolarHBondContact O-N 2.98Å; M22-T24 PolarHBondContact O-N 3.29Å; M22-I25 PolarHBondContact O-N 2.94Å; M22-L26 WeakPolarHBondContact O-CB 3.25Å; M22-L26 PolarHBondContact O-N 3.38Å
23A94.5Very high94.9Very high5 Ų559.5 Ų59.54%0.04137%0.367CS..Hα-helixtrans-67.5-15.8175.100000113.6S19 V20 F21 P27 S46 V47 A50S19-A23 VanDerWaalsContact O-CB 3.27Å; S19-A23 WeakPolarHBondContact O-CB 3.2Å; S19-A23 PolarHBondContact O-N 2.87Å; V20-A23 PolarHBondContact O-N 3.4Å; F21-A23 VanDerWaalsContact C-N 3.31Å; F21-A23 PolarHBondContact O-N 3.14Å; A23-P27 WeakPolarHBondContact O-CD 3.4Å; A23-P27 VanDerWaalsContact O-CG 3.26Å; A23-P27 WeakPolarHBondContact O-CG 3.36Å; A23-S46 PolarHBondContact O-OG 3.46Å; A23-S46 VanDerWaalsContact O-OG 3.05Å; A23-V47 HydrophobicContact CB-CB 4.38Å; A23-V47 HydrophobicContact CB-CG2 3.93Å; A23-A50 HydrophobicContact CB-CB 3.55Å
24T90.8Very high94.9Very high39 Ų3960.6 Ų60.624%0.23937%0.372CS..Hα-helixtrans-93.3-42.1172-53.40000111.1V20 F21 M22 V36 W43V20-T24 PolarHBondContact O-N 3.39Å; V20-T24 PolarHBondContact O-OG1 3.48Å; F21-T24 PolarHBondContact O-N 2.87Å; M22-T24 PolarHBondContact O-N 3.29Å; T24-V36 HydrophobicContact CG2-CG2 3.89Å; T24-W43 PolarHBondContact OG1-NE1 2.9Å
25I94.1Very high94.9Very high92 Ų9260 Ų6047%0.47236%0.364SS..Hα-helixtrans-70.7-43.7-177.7-65.6169.7000111.6F21 M22 A28 V29F21-I25 WeakPolarHBondContact O-CG1 3.21Å; F21-I25 PolarHBondContact O-N 3.46Å; M22-I25 PolarHBondContact O-N 2.94Å; I25-A28 WeakPolarHBondContact O-CB 3.47Å; I25-A28 PolarHBondContact O-N 2.92Å; I25-A28 VanDerWaalsContact O-N 3.12Å; I25-V29 HydrophobicContact CG2-CG2 4.22Å; I25-V29 WeakPolarHBondContact O-CG2 3.15Å; I25-V29 PolarHBondContact O-N 2.91Å
26L94.3Very high94.8Very high91 Ų9157.3 Ų57.348%0.47635%0.352SS..Hα-helixtrans-64.2-47.1-172.3-172.168.6000112.4M22 A28 V29 L30M22-L26 WeakPolarHBondContact O-CB 3.25Å; M22-L26 PolarHBondContact O-N 3.38Å; L26-A28 VanDerWaalsContact C-N 3.28Å; L26-A28 PolarHBondContact O-N 3.36Å; L26-V29 PolarHBondContact O-N 3.4Å; L26-L30 HydrophobicContact CD1-CD1 3.56Å; L26-L30 HydrophobicContact CD1-CG 3.95Å; L26-L30 HydrophobicContact CD2-CD1 4.36Å; L26-L30 HydrophobicContact CG-CD1 3.7Å; L26-L30 HydrophobicContact CG-CG 4.27Å; L26-L30 WeakPolarHBondContact O-CB 3.28Å; L26-L30 WeakPolarHBondContact O-CG 3.41Å; L26-L30 PolarHBondContact O-N 2.71Å
27P93.8Very high94.7Very high10 Ų1062 Ų627%0.06537%0.37CS..Hα-helixtrans-60.7-36.6171.6-24.436.3000113A23 V29 L30 V31 F34 S46A23-P27 WeakPolarHBondContact O-CD 3.4Å; A23-P27 VanDerWaalsContact O-CG 3.26Å; A23-P27 WeakPolarHBondContact O-CG 3.36Å; P27-V29 VanDerWaalsContact C-N 3.26Å; P27-V29 PolarHBondContact O-N 2.94Å; P27-L30 PolarHBondContact O-N 3.32Å; P27-V31 WeakPolarHBondContact O-CB 3.35Å; P27-V31 PolarHBondContact O-N 2.97Å; P27-F34 HydrophobicContact CB-CD1 4.38Å; P27-F34 HydrophobicContact CB-CD2 3.6Å; P27-F34 HydrophobicContact CB-CE1 4.3Å; P27-F34 HydrophobicContact CB-CE2 3.54Å; P27-F34 HydrophobicContact CB-CG 4.02Å; P27-F34 HydrophobicContact CB-CZ 3.9Å; P27-F34 HydrophobicContact CG-CE2 4.37Å; P27-S46 WeakPolarHBondContact CG-OG 3.35Å
28A93.4Very high94.5Very high57 Ų5764 Ų6447%0.47139%0.392SS..Hα-helixtrans-63.2-31.4178.300000113.4I25 L26 F34I25-A28 WeakPolarHBondContact O-CB 3.47Å; I25-A28 PolarHBondContact O-N 2.92Å; I25-A28 VanDerWaalsContact O-N 3.12Å; L26-A28 VanDerWaalsContact C-N 3.28Å; L26-A28 PolarHBondContact O-N 3.36Å; A28-F34 HydrophobicContact CB-CD1 3.54Å; A28-F34 HydrophobicContact CB-CE1 3.85Å
29V95Very high94.4Very high109 Ų10963.7 Ų63.766%0.66139%0.385SS*.Hα-helixtrans-85-39.4177.4175.90000111.8I25 L26 P27I25-V29 HydrophobicContact CG2-CG2 4.22Å; I25-V29 WeakPolarHBondContact O-CG2 3.15Å; I25-V29 PolarHBondContact O-N 2.91Å; L26-V29 PolarHBondContact O-N 3.4Å; P27-V29 VanDerWaalsContact C-N 3.26Å; P27-V29 PolarHBondContact O-N 2.94Å
30L95.8Very high94.4Very high118 Ų11864.5 Ų64.562%0.61839%0.387SS*.Hα-helixtrans-93.3-23.9-169.1-63.3-174.9000114.7L26 P27L26-L30 HydrophobicContact CD1-CD1 3.56Å; L26-L30 HydrophobicContact CD1-CG 3.95Å; L26-L30 HydrophobicContact CD2-CD1 4.36Å; L26-L30 HydrophobicContact CG-CD1 3.7Å; L26-L30 HydrophobicContact CG-CG 4.27Å; L26-L30 WeakPolarHBondContact O-CB 3.28Å; L26-L30 WeakPolarHBondContact O-CG 3.41Å; L26-L30 PolarHBondContact O-N 2.71Å; P27-L30 PolarHBondContact O-N 3.32Å
31V96.1Very high94.5Very high59 Ų5966 Ų6636%0.35840%0.395SS..SBendtrans-111.4109-173.1-177.10000109.5P27 G33 F34 L42P27-V31 WeakPolarHBondContact O-CB 3.35Å; P27-V31 PolarHBondContact O-N 2.97Å; V31-G33 PolarHBondContact O-N 3.5Å; V31-F34 HydrophobicContact CB-CB 4.18Å; V31-F34 VanDerWaalsContact O-CB 3.29Å; V31-F34 WeakPolarHBondContact O-CB 3.21Å; V31-F34 PolarHBondContact O-N 2.92Å; V31-F34 VanDerWaalsContact O-N 3.1Å; V31-L42 HydrophobicContact CB-CD2 4.44Å; V31-L42 HydrophobicContact CG1-CD2 4Å; V31-L42 HydrophobicContact CG2-CD2 4.3Å
32P96Very high94.7Very high128 Ų12863.9 Ų63.983%0.83139%0.389SS*.THydrogen-bonded Turntrans-56132176.1-25.334.5000111.6F34P32-F34 VanDerWaalsContact C-N 3.28Å; P32-F34 PolarHBondContact O-N 3.3Å
33G93.3Very high94.8Very high72 Ų7259.4 Ų59.474%0.74237%0.366SS*.THydrogen-bonded Turntrans77.67-179.500000115V31 S35V31-G33 PolarHBondContact O-N 3.5Å; G33-S35 PolarHBondContact O-N 3.37Å
34F96.1Very high94.9Very high29 Ų2959.2 Ų59.213%0.12736%0.364CS..  trans-58.3132.4172.7175.1-93.7000111.2P27 A28 V31 P32 V36 T39 L42 W43P27-F34 HydrophobicContact CB-CD1 4.38Å; P27-F34 HydrophobicContact CB-CD2 3.6Å; P27-F34 HydrophobicContact CB-CE1 4.3Å; P27-F34 HydrophobicContact CB-CE2 3.54Å; P27-F34 HydrophobicContact CB-CG 4.02Å; P27-F34 HydrophobicContact CB-CZ 3.9Å; P27-F34 HydrophobicContact CG-CE2 4.37Å; A28-F34 HydrophobicContact CB-CD1 3.54Å; A28-F34 HydrophobicContact CB-CE1 3.85Å; V31-F34 HydrophobicContact CB-CB 4.18Å; V31-F34 VanDerWaalsContact O-CB 3.29Å; V31-F34 WeakPolarHBondContact O-CB 3.21Å; V31-F34 PolarHBondContact O-N 2.92Å; V31-F34 VanDerWaalsContact O-N 3.1Å; P32-F34 VanDerWaalsContact C-N 3.28Å; P32-F34 PolarHBondContact O-N 3.3Å; F34-V36 HydrophobicContact CE1-CG2 4.24Å; F34-V36 HydrophobicContact CZ-CG2 4.35Å; F34-T39 VanDerWaalsContact CD2-OG1 3.27Å; F34-T39 WeakPolarHBondContact CD2-OG1 3.32Å; F34-L42 HydrophobicContact CD2-CD2 3.97Å; F34-L42 HydrophobicContact CD2-CG 4.39Å; F34-L42 HydrophobicContact CE2-CD2 4.49Å; F34-L42 HydrophobicContact CE2-CG 4.42Å; F34-W43 HydrophobicContact CE2-CB 3.9Å; F34-W43 HydrophobicContact CZ-CB 3.9Å; F34-W43 AromaticContact CZ-CD1 4Å; F34-W43 HydrophobicContact CZ-CG 4.26Å
35S95.2Very high95.3Very high48 Ų4861.7 Ų61.734%0.33637%0.37SS..  trans-144.7144.616561.70000109.8G33 Y37 G38 T39G33-S35 PolarHBondContact O-N 3.37Å; S35-Y37 PolarHBondContact O-N 3Å; S35-G38 WeakPolarHBondContact OG-CA 3.44Å; S35-G38 PolarHBondContact OG-N 3.22Å; S35-T39 PolarHBondContact N-OG1 3.15Å; S35-T39 CarbonylContact O-C 3.52Å; S35-T39 WeakPolarHBondContact O-CA 3.48Å; S35-T39 PolarHBondContact O-N 3.04Å; S35-T39 PolarHBondContact O-OG1 3.22Å
36V93.8Very high95.4Very high32 Ų3258.8 Ų58.819%0.19436%0.358CS..THydrogen-bonded Turntrans-56.7-34.7178.6173.60000111.4T24 F34 H40 W43 L190T24-V36 HydrophobicContact CG2-CG2 3.89Å; F34-V36 HydrophobicContact CE1-CG2 4.24Å; F34-V36 HydrophobicContact CZ-CG2 4.35Å; V36-H40 WeakPolarHBondContact O-CA 3.28Å; V36-H40 VanDerWaalsContact O-CB 3.22Å; V36-H40 WeakPolarHBondContact O-CB 3.31Å; V36-W43 HydrophobicContact CG1-CD2 3.77Å; V36-W43 HydrophobicContact CG1-CE3 3.87Å; V36-W43 HydrophobicContact CG1-CG 4.27Å; V36-W43 HydrophobicContact CG1-CH2 4.33Å; V36-W43 HydrophobicContact CG1-CZ2 4.22Å; V36-W43 HydrophobicContact CG1-CZ3 4.15Å; V36-W43 HydrophobicContact CG2-CG 4.44Å; V36-L190 HydrophobicContact CG1-CD2 4.29Å
37Y94.2Very high95.5Very high99 Ų9954.5 Ų54.539%0.38834%0.336SS..THydrogen-bonded Turntrans-91.8-48.5-177-44.4-38.7000112.4S35 H40 P180 W181 V186 L190S35-Y37 PolarHBondContact O-N 3Å; Y37-H40 PolarHBondContact O-ND1 3.46Å; Y37-H40 VanDerWaalsContact O-ND1 3.09Å; Y37-P180 HydrophobicContact CD2-CB 4.28Å; Y37-P180 HydrophobicContact CD2-CG 4.04Å; Y37-P180 HydrophobicContact CG-CB 4.4Å; Y37-W181 HydrophobicContact CD1-CB 4.16Å; Y37-W181 HydrophobicContact CE1-CB 3.84Å; Y37-W181 HydrophobicContact CE2-CB 4.37Å; Y37-V186 HydrophobicContact CD1-CG1 3.68Å; Y37-V186 HydrophobicContact CE1-CG1 4.31Å; Y37-L190 HydrophobicContact CE1-CD1 4Å
38G91.9Very high95.7Very high60 Ų6054.3 Ų54.362%0.61933%0.334SS*.THydrogen-bonded Turntrans-75.7-25.4-176.700000114.1S35S35-G38 WeakPolarHBondContact OG-CA 3.44Å; S35-G38 PolarHBondContact OG-N 3.22Å
39T95.4Very high95.9Very high45 Ų4554.5 Ų54.528%0.27634%0.336SS..THydrogen-bonded Turntrans-120.740.4174.458.70000111.4F34 S35 L41 L42 W43F34-T39 VanDerWaalsContact CD2-OG1 3.27Å; F34-T39 WeakPolarHBondContact CD2-OG1 3.32Å; S35-T39 PolarHBondContact N-OG1 3.15Å; S35-T39 CarbonylContact O-C 3.52Å; S35-T39 WeakPolarHBondContact O-CA 3.48Å; S35-T39 PolarHBondContact O-N 3.04Å; S35-T39 PolarHBondContact O-OG1 3.22Å; T39-L41 VanDerWaalsContact C-N 3.28Å; T39-L41 PolarHBondContact O-N 3.3Å; T39-L42 WeakPolarHBondContact O-CB 3.42Å; T39-L42 PolarHBondContact O-N 3.39Å; T39-W43 PolarHBondContact O-N 3.15Å
40H95.7Very high96Very high29 Ų2950.5 Ų50.513%0.13431%0.314CS..Hα-helixtrans-57.2-35.6-171.461.2-89.6000113.7V36 Y37 L42 W43 L44 V186V36-H40 WeakPolarHBondContact O-CA 3.28Å; V36-H40 VanDerWaalsContact O-CB 3.22Å; V36-H40 WeakPolarHBondContact O-CB 3.31Å; Y37-H40 PolarHBondContact O-ND1 3.46Å; Y37-H40 VanDerWaalsContact O-ND1 3.09Å; H40-L42 PolarHBondContact O-N 2.87Å; H40-W43 WeakPolarHBondContact O-CB 3.3Å; H40-W43 PolarHBondContact O-N 2.96Å; H40-L44 WeakPolarHBondContact O-CB 3.4Å; H40-L44 VanDerWaalsContact O-CG 3.22Å; H40-L44 WeakPolarHBondContact O-CG 3.38Å; H40-L44 PolarHBondContact O-N 3.1Å; H40-V186 HydrophobicContact CB-CG2 3.73Å
41L96.9Very high96Very high40 Ų4044.9 Ų44.921%0.20929%0.285CS..Hα-helixtrans-60.2-43.9175.9-64.6-179.3000112.4T39 W43 L44 Y45 L110 E111 S114T39-L41 VanDerWaalsContact C-N 3.28Å; T39-L41 PolarHBondContact O-N 3.3Å; L41-W43 VanDerWaalsContact C-N 3.33Å; L41-W43 PolarHBondContact O-N 3.3Å; L41-L44 PolarHBondContact O-N 3.44Å; L41-Y45 HydrophobicContact CB-CE2 4.41Å; L41-Y45 WeakPolarHBondContact O-CD2 3.37Å; L41-Y45 PolarHBondContact O-N 3.41Å; L41-L110 HydrophobicContact CD1-CD2 3.79Å; L41-L110 HydrophobicContact CD1-CG 4.24Å; L41-E111 HydrophobicContact CD2-CG 4.31Å; L41-S114 WeakPolarHBondContact CD2-OG 3.17Å
42L96.9Very high95.9Very high74 Ų7443.2 Ų43.239%0.38728%0.277SS..Hα-helixtrans-62.6-42.8176174.759.5000110.9V31 F34 T39 H40 S46V31-L42 HydrophobicContact CB-CD2 4.44Å; V31-L42 HydrophobicContact CG1-CD2 4Å; V31-L42 HydrophobicContact CG2-CD2 4.3Å; F34-L42 HydrophobicContact CD2-CD2 3.97Å; F34-L42 HydrophobicContact CD2-CG 4.39Å; F34-L42 HydrophobicContact CE2-CD2 4.49Å; F34-L42 HydrophobicContact CE2-CG 4.42Å; T39-L42 WeakPolarHBondContact O-CB 3.42Å; T39-L42 PolarHBondContact O-N 3.39Å; H40-L42 PolarHBondContact O-N 2.87Å; L42-S46 VanDerWaalsContact O-CB 3.28Å; L42-S46 WeakPolarHBondContact O-CB 3.48Å; L42-S46 PolarHBondContact O-N 2.8Å
43W97.3Very high95.9Very high11 Ų1139.9 Ų39.94%0.04226%0.261CS..Hα-helixtrans-61.4-47.5175.6174.263.9000111.9T24 F34 V36 T39 H40 L41 Y45 S46 V47 L190 M193T24-W43 PolarHBondContact OG1-NE1 2.9Å; F34-W43 HydrophobicContact CE2-CB 3.9Å; F34-W43 HydrophobicContact CZ-CB 3.9Å; F34-W43 AromaticContact CZ-CD1 4Å; F34-W43 HydrophobicContact CZ-CG 4.26Å; V36-W43 HydrophobicContact CG1-CD2 3.77Å; V36-W43 HydrophobicContact CG1-CE3 3.87Å; V36-W43 HydrophobicContact CG1-CG 4.27Å; V36-W43 HydrophobicContact CG1-CH2 4.33Å; V36-W43 HydrophobicContact CG1-CZ2 4.22Å; V36-W43 HydrophobicContact CG1-CZ3 4.15Å; V36-W43 HydrophobicContact CG2-CG 4.44Å; T39-W43 PolarHBondContact O-N 3.15Å; H40-W43 WeakPolarHBondContact O-CB 3.3Å; H40-W43 PolarHBondContact O-N 2.96Å; L41-W43 VanDerWaalsContact C-N 3.33Å; L41-W43 PolarHBondContact O-N 3.3Å; W43-Y45 PolarHBondContact O-N 3.04Å; W43-S46 PolarHBondContact O-N 3.28Å; W43-V47 WeakPolarHBondContact O-CG2 3.49Å; W43-V47 PolarHBondContact O-N 3.38Å; W43-L190 HydrophobicContact CH2-CD2 3.61Å; W43-L190 HydrophobicContact CH2-CG 4.16Å; W43-L190 HydrophobicContact CZ2-CD2 4.12Å; W43-L190 HydrophobicContact CZ3-CD2 4.3Å; W43-M193 HydrophobicContact CH2-CG 4.09Å; W43-M193 HydrophobicContact CZ2-CG 4.21Å
44L97.5Very high96Very high1 Ų138.1 Ų38.11%0.00524%0.235CC..Hα-helixtrans-58.6-46.4178.5-71176.3000112.5H40 L41 S48 L118 P185 S189H40-L44 WeakPolarHBondContact O-CB 3.4Å; H40-L44 VanDerWaalsContact O-CG 3.22Å; H40-L44 WeakPolarHBondContact O-CG 3.38Å; H40-L44 PolarHBondContact O-N 3.1Å; L41-L44 PolarHBondContact O-N 3.44Å; L44-S48 VanDerWaalsContact O-CB 3.25Å; L44-S48 WeakPolarHBondContact O-CB 3.47Å; L44-S48 PolarHBondContact O-N 2.9Å; L44-S48 PolarHBondContact O-OG 3.48Å; L44-L118 HydrophobicContact CD2-CB 4.35Å; L44-L118 HydrophobicContact CD2-CD1 4.28Å; L44-L118 HydrophobicContact CD2-CD2 3.65Å; L44-L118 HydrophobicContact CD2-CG 4.29Å; L44-P185 HydrophobicContact CD1-CG 4.14Å; L44-S189 WeakPolarHBondContact CD2-OG 3.27Å
45Y97.7Very high95.9Very high92 Ų9236.8 Ų36.836%0.36123%0.229SC..Hα-helixtrans-69.4-37.6177.9-66.7-45.1000112.3L41 W43 S48 A49 S114L41-Y45 HydrophobicContact CB-CE2 4.41Å; L41-Y45 WeakPolarHBondContact O-CD2 3.37Å; L41-Y45 PolarHBondContact O-N 3.41Å; W43-Y45 PolarHBondContact O-N 3.04Å; Y45-S48 PolarHBondContact O-N 3.2Å; Y45-A49 WeakPolarHBondContact O-CB 3.29Å; Y45-A49 PolarHBondContact O-N 3.35Å; Y45-S114 PolarHBondContact OH-OG 3.46Å
46S97.1Very high95.7Very high31 Ų3137.8 Ų37.822%0.21723%0.234CC..Hα-helixtrans-60.4-49.2175.1-170.30000111.2A23 P27 L42 W43 A49 A50A23-S46 PolarHBondContact O-OG 3.46Å; A23-S46 VanDerWaalsContact O-OG 3.05Å; P27-S46 WeakPolarHBondContact CG-OG 3.35Å; L42-S46 VanDerWaalsContact O-CB 3.28Å; L42-S46 WeakPolarHBondContact O-CB 3.48Å; L42-S46 PolarHBondContact O-N 2.8Å; W43-S46 PolarHBondContact O-N 3.28Å; S46-A49 PolarHBondContact O-N 3.33Å; S46-A50 VanDerWaalsContact O-CB 3.29Å; S46-A50 WeakPolarHBondContact O-CB 3.3Å; S46-A50 PolarHBondContact O-N 3.06Å
47V97.4Very high95.6Very high1 Ų139.3 Ų39.31%0.00625%0.245CC..Hα-helixtrans-63.6-47.3178.2173.30000111.4A23 W43 A49 A50 V51 L118 M193A23-V47 HydrophobicContact CB-CB 4.38Å; A23-V47 HydrophobicContact CB-CG2 3.93Å; W43-V47 WeakPolarHBondContact O-CG2 3.49Å; W43-V47 PolarHBondContact O-N 3.38Å; V47-A49 PolarHBondContact O-N 3.27Å; V47-A50 PolarHBondContact O-N 3.2Å; V47-V51 HydrophobicContact CG1-CG2 4.3Å; V47-V51 WeakPolarHBondContact O-CB 3.33Å; V47-V51 WeakPolarHBondContact O-CG2 3.27Å; V47-V51 PolarHBondContact O-N 3.43Å; V47-L118 HydrophobicContact CB-CD1 4.39Å; V47-L118 HydrophobicContact CG1-CD1 3.96Å; V47-M193 HydrophobicContact CG1-CE 3.49Å; V47-M193 VanDerWaalsContact CG1-CE 3.49Å; V47-M193 HydrophobicContact CG1-SD 3.55Å; V47-M193 VanDerWaalsContact CG1-SD 3.55Å
48S97.8Very high95.4Very high6 Ų635.2 Ų35.24%0.04223%0.231CC..Hα-helixtrans-59-46.4178.7-61.20000111.6L44 Y45 A52 L118L44-S48 VanDerWaalsContact O-CB 3.25Å; L44-S48 WeakPolarHBondContact O-CB 3.47Å; L44-S48 PolarHBondContact O-N 2.9Å; L44-S48 PolarHBondContact O-OG 3.48Å; Y45-S48 PolarHBondContact O-N 3.2Å; S48-A52 WeakPolarHBondContact O-CB 3.41Å; S48-A52 PolarHBondContact O-N 2.82Å; S48-L118 WeakPolarHBondContact OG-CA 3.45Å
49A97.1Very high95.1Very high61 Ų6132.4 Ų32.450%0.50420%0.202SC..Hα-helixtrans-65.3-44178.700000112.2Y45 S46 V47 A52 A53Y45-A49 WeakPolarHBondContact O-CB 3.29Å; Y45-A49 PolarHBondContact O-N 3.35Å; S46-A49 PolarHBondContact O-N 3.33Å; V47-A49 PolarHBondContact O-N 3.27Å; A49-A52 PolarHBondContact O-N 3.38Å; A49-A53 WeakPolarHBondContact O-CB 3.24Å; A49-A53 PolarHBondContact O-N 3.17Å
50A96.8Very high94.4Very high25 Ų2537.6 Ų37.621%0.20722%0.216CC..Hα-helixtrans-66-46.4179.600000112.3A23 S46 V47 A52 V54A23-A50 HydrophobicContact CB-CB 3.55Å; S46-A50 VanDerWaalsContact O-CB 3.29Å; S46-A50 WeakPolarHBondContact O-CB 3.3Å; S46-A50 PolarHBondContact O-N 3.06Å; V47-A50 PolarHBondContact O-N 3.2Å; A50-A52 PolarHBondContact O-N 3.29Å; A50-V54 WeakPolarHBondContact O-CB 3.4Å; A50-V54 WeakPolarHBondContact O-CG2 3.29Å; A50-V54 PolarHBondContact O-N 2.92Å
51V95.4Very high93.7Very high0 Ų043 Ų430%025%0.246CC..Hα-helixtrans-60.6-40.3174.7171.70000110.1I16 V20 V47 S55 L122I16-V51 HydrophobicContact CG2-CG1 4.47Å; V20-V51 HydrophobicContact CG2-CG2 3.45Å; V20-V51 VanDerWaalsContact CG2-CG2 3.45Å; V47-V51 HydrophobicContact CG1-CG2 4.3Å; V47-V51 WeakPolarHBondContact O-CB 3.33Å; V47-V51 WeakPolarHBondContact O-CG2 3.27Å; V47-V51 PolarHBondContact O-N 3.43Å; V51-S55 WeakPolarHBondContact O-CB 3.5Å; V51-S55 PolarHBondContact O-N 3.11Å; V51-S55 PolarHBondContact O-OG 3Å; V51-L122 HydrophobicContact CG1-CD2 4.26Å; V51-L122 HydrophobicContact CG2-CD2 4.16Å
52A95.4Very high92.6Very high24 Ų2445.5 Ų45.520%0.19826%0.258CS..Hα-helixtrans-67.4-51.1-179.500000113.2S48 A49 A50 V54 S55 V56 L125S48-A52 WeakPolarHBondContact O-CB 3.41Å; S48-A52 PolarHBondContact O-N 2.82Å; A49-A52 PolarHBondContact O-N 3.38Å; A50-A52 PolarHBondContact O-N 3.29Å; A52-V54 VanDerWaalsContact C-N 3.34Å; A52-V54 PolarHBondContact O-N 2.93Å; A52-S55 PolarHBondContact O-N 2.82Å; A52-V56 WeakPolarHBondContact O-CB 3.29Å; A52-V56 VanDerWaalsContact O-CG2 3.26Å; A52-V56 WeakPolarHBondContact O-CG2 3.48Å; A52-V56 PolarHBondContact O-N 2.96Å; A52-L125 HydrophobicContact CB-CD2 3.38Å
53A95.4Very high91.3Very high58 Ų5844.6 Ų44.648%0.47927%0.267SS..Hα-helixtrans-58.9-46.4178.800000111.4A49 S57A49-A53 WeakPolarHBondContact O-CB 3.24Å; A49-A53 PolarHBondContact O-N 3.17Å; A53-S57 VanDerWaalsContact O-CB 3.27Å; A53-S57 WeakPolarHBondContact O-CB 3.41Å; A53-S57 PolarHBondContact O-N 3.5Å; A53-S57 PolarHBondContact O-OG 3.47Å
54V95.1Very high90Very high35 Ų3545.7 Ų45.721%0.21227%0.273CS..Hα-helixtrans-71.2-42.7-178.7174.20000111.6I15 I16 A50 A52 S57 V58I15-V54 HydrophobicContact CG2-CG1 3.64Å; I16-V54 HydrophobicContact CG1-CG1 3.95Å; A50-V54 WeakPolarHBondContact O-CB 3.4Å; A50-V54 WeakPolarHBondContact O-CG2 3.29Å; A50-V54 PolarHBondContact O-N 2.92Å; A52-V54 VanDerWaalsContact C-N 3.34Å; A52-V54 PolarHBondContact O-N 2.93Å; V54-S57 PolarHBondContact O-N 3.32Å; V54-V58 HydrophobicContact CG1-CG2 4.03Å; V54-V58 WeakPolarHBondContact O-CB 3.23Å; V54-V58 VanDerWaalsContact O-CG2 3.25Å; V54-V58 WeakPolarHBondContact O-CG2 3.43Å; V54-V58 PolarHBondContact O-N 2.83Å
55S92.9Very high88.5Confident0 Ų046.7 Ų46.70%028%0.28CS..Hα-helixtrans-60.4-50.2176.8-65.10000111V51 A52 S57 V58 F59V51-S55 WeakPolarHBondContact O-CB 3.5Å; V51-S55 PolarHBondContact O-N 3.11Å; V51-S55 PolarHBondContact O-OG 3Å; A52-S55 PolarHBondContact O-N 2.82Å; S55-S57 VanDerWaalsContact C-N 3.32Å; S55-S57 PolarHBondContact O-N 3.34Å; S55-V58 PolarHBondContact O-N 3.39Å; S55-F59 WeakPolarHBondContact O-CB 3.22Å; S55-F59 WeakPolarHBondContact O-CD2 3.36Å; S55-F59 PolarHBondContact O-N 3.43Å
56V92.4Very high86.9Confident70 Ų7044.8 Ų44.842%0.42428%0.28SS..Hα-helixtrans-58.8-46178.5171.60000110.5A52 W60 L125A52-V56 WeakPolarHBondContact O-CB 3.29Å; A52-V56 VanDerWaalsContact O-CG2 3.26Å; A52-V56 WeakPolarHBondContact O-CG2 3.48Å; A52-V56 PolarHBondContact O-N 2.96Å; V56-W60 WeakPolarHBondContact O-CB 3.36Å; V56-W60 PolarHBondContact O-N 3Å; V56-L125 HydrophobicContact CG2-CD1 4.28Å
57S91Very high85.3Confident63 Ų6349.2 Ų49.244%0.44131%0.307SS..Hα-helixtrans-62.3-48.9-179.9-59.10000112.1A53 V54 S55 W60 L61A53-S57 VanDerWaalsContact O-CB 3.27Å; A53-S57 WeakPolarHBondContact O-CB 3.41Å; A53-S57 PolarHBondContact O-N 3.5Å; A53-S57 PolarHBondContact O-OG 3.47Å; V54-S57 PolarHBondContact O-N 3.32Å; S55-S57 VanDerWaalsContact C-N 3.32Å; S55-S57 PolarHBondContact O-N 3.34Å; S57-W60 PolarHBondContact O-N 3.47Å; S57-L61 VanDerWaalsContact O-CB 3.31Å; S57-L61 WeakPolarHBondContact O-CB 3.12Å; S57-L61 WeakPolarHBondContact O-CG 3.3Å; S57-L61 PolarHBondContact O-N 3.33Å
58V89.6Confident83.6Confident14 Ų1450.5 Ų50.59%0.08532%0.315CS..Hα-helixtrans-66.8-46.5-177.11740000111.2T12 I15 V54 S55 W60 L61 L62T12-V58 HydrophobicContact CG2-CG1 3.57Å; I15-V58 HydrophobicContact CG2-CG2 3.87Å; V54-V58 HydrophobicContact CG1-CG2 4.03Å; V54-V58 WeakPolarHBondContact O-CB 3.23Å; V54-V58 VanDerWaalsContact O-CG2 3.25Å; V54-V58 WeakPolarHBondContact O-CG2 3.43Å; V54-V58 PolarHBondContact O-N 2.83Å; S55-V58 PolarHBondContact O-N 3.39Å; V58-W60 VanDerWaalsContact C-N 3.3Å; V58-W60 PolarHBondContact O-N 3.32Å; V58-L61 PolarHBondContact O-N 2.94Å; V58-L62 HydrophobicContact CG1-CD1 3.47Å; V58-L62 VanDerWaalsContact CG1-CD1 3.47Å; V58-L62 HydrophobicContact CG1-CG 4.07Å; V58-L62 VanDerWaalsContact O-CB 3.28Å; V58-L62 WeakPolarHBondContact O-CB 3.42Å; V58-L62 VanDerWaalsContact O-CG 3.28Å; V58-L62 WeakPolarHBondContact O-CG 3.42Å; V58-L62 PolarHBondContact O-N 3.26Å
59F85.6Confident81.8Confident1 Ų160 Ų600%0.00436%0.356CS..Hα-helixtrans-68.5-31179.8-76.2-66.5000113T12 S55 G63 I64 R126 C129 V130 W151T12-F59 HydrophobicContact CG2-CZ 4.3Å; S55-F59 WeakPolarHBondContact O-CB 3.22Å; S55-F59 WeakPolarHBondContact O-CD2 3.36Å; S55-F59 PolarHBondContact O-N 3.43Å; F59-G63 PolarHBondContact O-N 3.43Å; F59-I64 HydrophobicContact CD1-CB 3.86Å; F59-I64 HydrophobicContact CD1-CD1 3.67Å; F59-I64 HydrophobicContact CD1-CG1 4.38Å; F59-I64 HydrophobicContact CD1-CG2 3.85Å; F59-I64 HydrophobicContact CE1-CB 4.44Å; F59-I64 HydrophobicContact CE1-CD1 3.84Å; F59-I64 HydrophobicContact CE1-CG2 4.04Å; F59-I64 PolarHBondContact O-N 3.2Å; F59-R126 VanDerWaalsContact CZ-CZ 3.48Å; F59-C129 HydrophobicContact CB-CB 3.7Å; F59-C129 HydrophobicContact CD1-CB 4.47Å; F59-C129 HydrophobicContact CD2-CB 3.32Å; F59-C129 HydrophobicContact CE2-CB 4.07Å; F59-C129 HydrophobicContact CG-CB 3.58Å; F59-V130 HydrophobicContact CD1-CG2 3.89Å; F59-V130 HydrophobicContact CE1-CG2 3.37Å; F59-V130 HydrophobicContact CE2-CG2 4.34Å; F59-V130 HydrophobicContact CZ-CG2 3.62Å; F59-W151 HydrophobicContact CE1-CE3 4.13Å; F59-W151 HydrophobicContact CE1-CH2 4.29Å; F59-W151 AromaticContact CE1-CZ3 3.8Å; F59-W151 HydrophobicContact CE1-CZ3 3.8Å; F59-W151 HydrophobicContact CZ-CZ3 4.15Å
60W82.2Confident80.2Confident153 Ų15363.9 Ų63.958%0.5836%0.361SS*.Hα-helixtrans-67.6-50.2171.8-173.9-81.1000111.7V56 S57 V58 G63V56-W60 WeakPolarHBondContact O-CB 3.36Å; V56-W60 PolarHBondContact O-N 3Å; S57-W60 PolarHBondContact O-N 3.47Å; V58-W60 VanDerWaalsContact C-N 3.3Å; V58-W60 PolarHBondContact O-N 3.32Å; W60-G63 PolarHBondContact O-N 3.05Å
61L81.1Confident78.9Confident144 Ų14469.7 Ų69.775%0.75438%0.384SS*.Hα-helixtrans-66.6-38.8-177.9-72171.1000112.8S57 V58 G63S57-L61 VanDerWaalsContact O-CB 3.31Å; S57-L61 WeakPolarHBondContact O-CB 3.12Å; S57-L61 WeakPolarHBondContact O-CG 3.3Å; S57-L61 PolarHBondContact O-N 3.33Å; V58-L61 PolarHBondContact O-N 2.94Å; L61-G63 PolarHBondContact O-N 2.69Å
62L72.8Confident78.4Confident91 Ų9173.9 Ų73.948%0.47641%0.41SS..THydrogen-bonded Turntrans-79.2-4.4-179.8-66-179.7000113.6T12 V58 I64T12-L62 WeakPolarHBondContact OG1-CD1 3.48Å; V58-L62 HydrophobicContact CG1-CD1 3.47Å; V58-L62 VanDerWaalsContact CG1-CD1 3.47Å; V58-L62 HydrophobicContact CG1-CG 4.07Å; V58-L62 VanDerWaalsContact O-CB 3.28Å; V58-L62 WeakPolarHBondContact O-CB 3.42Å; V58-L62 VanDerWaalsContact O-CG 3.28Å; V58-L62 WeakPolarHBondContact O-CG 3.42Å; V58-L62 PolarHBondContact O-N 3.26Å; L62-I64 HydrophobicContact CB-CD1 3.61Å; L62-I64 HydrophobicContact CB-CG1 3.79Å; L62-I64 HydrophobicContact CD1-CD1 3.69Å; L62-I64 HydrophobicContact CG-CD1 4.32Å; L62-I64 PolarHBondContact O-N 3.46Å; L62-I64 VanDerWaalsContact O-N 3.08Å
63G69.3Low77.9Confident56 Ų5679.8 Ų79.858%0.57744%0.437SS*.THydrogen-bonded Turntrans60.620.6179.200000114.1F59 W60 L61 S65F59-G63 PolarHBondContact O-N 3.43Å; W60-G63 PolarHBondContact O-N 3.05Å; L61-G63 PolarHBondContact O-N 2.69Å; G63-S65 PolarHBondContact O-N 2.87Å
64I69.8Low77.5Confident33 Ų3379.5 Ų79.517%0.16944%0.439CS..  trans-69.1-28.2-179.9-65.1161.2000110.3F59 L62 V130 W151F59-I64 HydrophobicContact CD1-CB 3.86Å; F59-I64 HydrophobicContact CD1-CD1 3.67Å; F59-I64 HydrophobicContact CD1-CG1 4.38Å; F59-I64 HydrophobicContact CD1-CG2 3.85Å; F59-I64 HydrophobicContact CE1-CB 4.44Å; F59-I64 HydrophobicContact CE1-CD1 3.84Å; F59-I64 HydrophobicContact CE1-CG2 4.04Å; F59-I64 PolarHBondContact O-N 3.2Å; L62-I64 HydrophobicContact CB-CD1 3.61Å; L62-I64 HydrophobicContact CB-CG1 3.79Å; L62-I64 HydrophobicContact CD1-CD1 3.69Å; L62-I64 HydrophobicContact CG-CD1 4.32Å; L62-I64 PolarHBondContact O-N 3.46Å; L62-I64 VanDerWaalsContact O-N 3.08Å; I64-V130 HydrophobicContact CG2-CG1 4.5Å; I64-V130 HydrophobicContact CG2-CG2 4.47Å; I64-W151 HydrophobicContact CD1-CH2 3.58Å; I64-W151 HydrophobicContact CD1-CZ2 3.39Å; I64-W151 HydrophobicContact CD1-CZ3 4.35Å; I64-W151 HydrophobicContact CG1-CZ2 4.08Å; I64-W151 HydrophobicContact CG2-CD2 4.13Å; I64-W151 HydrophobicContact CG2-CG 4.28Å
65S67.3Low77Confident22 Ų2282.4 Ų82.415%0.15445%0.447CS..SBendtrans-58.4144171.7-58.90000110.6G63 C129G63-S65 PolarHBondContact O-N 2.87Å; S65-C129 PolarHBondContact OG-O 3.42Å
66P64.3Low76.7Confident53 Ų5386.8 Ų86.834%0.34447%0.466SS..PPolyproline II helixtrans-55.6135.5-177.7-20.430.3000110.9T68 V130P66-T68 PolarHBondContact O-N 2.9Å; P66-V130 WeakPolarHBondContact CD-O 3.38Å
67P62.3Low76.5Confident123 Ų12388.8 Ų88.880%0.79947%0.474SS*.PPolyproline II helixtrans-57.7127.7179.921.3-31.2000109.7K69P67-K69 PolarHBondContact O-N 3.48Å
68T62.4Low76.5Confident28 Ų2888.4 Ų88.417%0.17247%0.471CS..  trans-75.5112.6-17852.60000109.4P66 K70 Y75 R79P66-T68 PolarHBondContact O-N 2.9Å; T68-K70 PolarHBondContact O-N 2.98Å; T68-Y75 HydrophobicContact CG2-CD1 4.43Å; T68-Y75 HydrophobicContact CG2-CE1 3.71Å; T68-R79 VanDerWaalsContact CG2-NH1 3.27Å
69K59.4Low76.5Confident207 Ų20790.1 Ų90.190%0.948%0.476SS*.SBendtrans-60.5-15.5177.5-67.5-172.8177.7-174.80114.2P67P67-K69 PolarHBondContact O-N 3.48Å
70K64.2Low76.8Confident141 Ų14195 Ų9561%0.61350%0.502SS*.  trans-133.1121.2179.3-63.5-174.3179.1-175.20109T68 T72 Y75T68-K70 PolarHBondContact O-N 2.98Å; K70-T72 VanDerWaalsContact C-N 3.31Å; K70-T72 PolarHBondContact O-N 3.33Å; K70-Y75 HydrophobicContact CB-CG 4.34Å; K70-Y75 VanDerWaalsContact O-CD1 3.31Å; K70-Y75 WeakPolarHBondContact O-CD1 3.26Å
71H68.5Low77.4Confident148 Ų14894.4 Ų94.469%0.68550%0.504SS*.  trans-88.27-178.5-74.8-91.5000113.9
72T85.1Confident78.1Confident87 Ų8793.8 Ų93.853%0.53449%0.491SS..  trans-66.8142.4-176.859.40000111.7K70 G74 Y75 K76K70-T72 VanDerWaalsContact C-N 3.31Å; K70-T72 PolarHBondContact O-N 3.33Å; T72-G74 VanDerWaalsContact C-N 3.26Å; T72-G74 PolarHBondContact O-N 3.18Å; T72-Y75 PolarHBondContact O-N 2.79Å; T72-Y75 VanDerWaalsContact O-N 3.09Å; T72-K76 PolarHBondContact O-N 2.67Å
73L85.1Confident79.1Confident149 Ų14990.6 Ų90.678%0.7848%0.477SS*.Hα-helixtrans-54.9-42.5178.8-176.766.4000111.9Y75 K76 L77L73-Y75 VanDerWaalsContact C-N 3.31Å; L73-Y75 PolarHBondContact O-N 3.43Å; L73-K76 PolarHBondContact O-N 2.91Å; L73-L77 PolarHBondContact O-N 3.31Å
74G86.9Confident80.4Confident51 Ų5191.4 Ų91.453%0.52647%0.473SS..Hα-helixtrans-61.2-35.4178.200000113.8T72 S78T72-G74 VanDerWaalsContact C-N 3.26Å; T72-G74 PolarHBondContact O-N 3.18Å; G74-S78 WeakPolarHBondContact O-CB 3.35Å; G74-S78 PolarHBondContact O-N 3.4Å
75Y85.3Confident81.8Confident97 Ų9793.4 Ų93.438%0.3848%0.483SS..Hα-helixtrans-68.2-43175.2177.2-97.3000111.6T68 K70 T72 L73 S78 R79T68-Y75 HydrophobicContact CG2-CD1 4.43Å; T68-Y75 HydrophobicContact CG2-CE1 3.71Å; K70-Y75 HydrophobicContact CB-CG 4.34Å; K70-Y75 VanDerWaalsContact O-CD1 3.31Å; K70-Y75 WeakPolarHBondContact O-CD1 3.26Å; T72-Y75 PolarHBondContact O-N 2.79Å; T72-Y75 VanDerWaalsContact O-N 3.09Å; L73-Y75 VanDerWaalsContact C-N 3.31Å; L73-Y75 PolarHBondContact O-N 3.43Å; Y75-S78 PolarHBondContact O-N 3.09Å; Y75-R79 WeakPolarHBondContact O-CB 3.37Å; Y75-R79 PolarHBondContact O-N 3.11Å
76K85.6Confident83.2Confident91 Ų9195.4 Ų95.440%0.39649%0.488SS..Hα-helixtrans-60.9-45.2176.1-67.4-176.2179.6-178.50111.4T72 L73 R79 L80T72-K76 PolarHBondContact O-N 2.67Å; L73-K76 PolarHBondContact O-N 2.91Å; K76-R79 PolarHBondContact O-N 3.28Å; K76-L80 PolarHBondContact O-N 2.9Å
77L89.9Confident84.8Confident113 Ų11395.1 Ų95.159%0.59248%0.481SS*.Hα-helixtrans-64.6-43.8178.1-17560.8000111.8L73 R79 L80 F81L73-L77 PolarHBondContact O-N 3.31Å; L77-R79 VanDerWaalsContact C-N 3.32Å; L77-R79 PolarHBondContact O-N 2.88Å; L77-L80 PolarHBondContact O-N 3.48Å; L77-F81 WeakPolarHBondContact O-CB 3.44Å; L77-F81 PolarHBondContact O-N 2.94Å
78S90.8Very high86.6Confident54 Ų5494.4 Ų94.438%0.37847%0.466SS..Hα-helixtrans-60.8-41.4175.3-173.30000112G74 Y75 F81 R82G74-S78 WeakPolarHBondContact O-CB 3.35Å; G74-S78 PolarHBondContact O-N 3.4Å; Y75-S78 PolarHBondContact O-N 3.09Å; S78-F81 PolarHBondContact O-N 3.45Å; S78-R82 WeakPolarHBondContact O-CB 3.49Å; S78-R82 VanDerWaalsContact O-CG 3.32Å; S78-R82 WeakPolarHBondContact O-CG 3.32Å; S78-R82 PolarHBondContact O-N 3.32Å
79R89.6Confident88.3Confident50 Ų5097.2 Ų97.219%0.18948%0.48CS..Hα-helixtrans-63.5-43.5175.9-167.717986.9169.55.2111.6T68 Y75 K76 L77 S83 P133T68-R79 VanDerWaalsContact CG2-NH1 3.27Å; Y75-R79 WeakPolarHBondContact O-CB 3.37Å; Y75-R79 PolarHBondContact O-N 3.11Å; K76-R79 PolarHBondContact O-N 3.28Å; L77-R79 VanDerWaalsContact C-N 3.32Å; L77-R79 PolarHBondContact O-N 2.88Å; R79-S83 WeakPolarHBondContact O-CB 3.35Å; R79-S83 PolarHBondContact O-N 3.32Å; R79-S83 PolarHBondContact O-OG 3.33Å; R79-P133 HydrophobicContact CG-CG 3.98Å
80L90.6Very high90.1Very high104 Ų10488 Ų8855%0.54544%0.441SS..Hα-helixtrans-61.4-50.8176.5178.261.8000110.8K76 L77 R82 S83 C84K76-L80 PolarHBondContact O-N 2.9Å; L77-L80 PolarHBondContact O-N 3.48Å; L80-R82 PolarHBondContact O-N 3.32Å; L80-S83 WeakPolarHBondContact O-CA 3.35Å; L80-S83 WeakPolarHBondContact O-CB 3.3Å; L80-S83 PolarHBondContact O-N 2.92Å; L80-C84 PolarHBondContact O-N 3.39Å; L80-C84 PolarHBondContact O-SG 3.12Å; L80-C84 VanDerWaalsContact O-SG 3.37Å
81F95.1Very high91.8Very high141 Ų14181.5 Ų81.562%0.61841%0.413SS*.Hα-helixtrans-55.6-48.4178.4178-97.6000112.2L77 S78 S83 C84 L85L77-F81 WeakPolarHBondContact O-CB 3.44Å; L77-F81 PolarHBondContact O-N 2.94Å; S78-F81 PolarHBondContact O-N 3.45Å; F81-S83 VanDerWaalsContact C-N 3.27Å; F81-S83 PolarHBondContact O-N 3.25Å; F81-C84 PolarHBondContact O-N 2.96Å; F81-L85 WeakPolarHBondContact O-CB 3.43Å; F81-L85 PolarHBondContact O-N 2.89Å
82R95.4Very high93.2Very high130 Ų13077.8 Ų77.849%0.49140%0.398SS..Hα-helixtrans-60.7-36.8175.6-71.3177.3-176.5-146.6-1.2112.4S78 L80 L85 Y86 P133S78-R82 WeakPolarHBondContact O-CB 3.49Å; S78-R82 VanDerWaalsContact O-CG 3.32Å; S78-R82 WeakPolarHBondContact O-CG 3.32Å; S78-R82 PolarHBondContact O-N 3.32Å; L80-R82 PolarHBondContact O-N 3.32Å; R82-L85 PolarHBondContact O-N 3.39Å; R82-Y86 WeakPolarHBondContact O-CB 3.35Å; R82-Y86 PolarHBondContact O-N 2.89Å; R82-P133 HydrophobicContact CB-CB 3.91Å; R82-P133 HydrophobicContact CB-CG 3.95Å
83S95.1Very high93.8Very high24 Ų2479.6 Ų79.617%0.16840%0.399CS..Hα-helixtrans-68.3-43.8178.5-55.40000111.5R79 L80 F81 L85 Y86 F87 L128R79-S83 WeakPolarHBondContact O-CB 3.35Å; R79-S83 PolarHBondContact O-N 3.32Å; R79-S83 PolarHBondContact O-OG 3.33Å; L80-S83 WeakPolarHBondContact O-CA 3.35Å; L80-S83 WeakPolarHBondContact O-CB 3.3Å; L80-S83 PolarHBondContact O-N 2.92Å; F81-S83 VanDerWaalsContact C-N 3.27Å; F81-S83 PolarHBondContact O-N 3.25Å; S83-L85 VanDerWaalsContact C-N 3.34Å; S83-Y86 PolarHBondContact O-N 3.03Å; S83-F87 WeakPolarHBondContact O-CB 3.39Å; S83-F87 PolarHBondContact O-N 3.46Å; S83-L128 WeakPolarHBondContact O-CD1 3.38Å
84C96.4Very high94.4Very high74 Ų7473.4 Ų73.450%0.537%0.366SS..Hα-helixtrans-61.9-42.4173.9-62.90000111.6L80 F81 F87 F88L80-C84 PolarHBondContact O-N 3.39Å; L80-C84 PolarHBondContact O-SG 3.12Å; L80-C84 VanDerWaalsContact O-SG 3.37Å; F81-C84 PolarHBondContact O-N 2.96Å; C84-F87 PolarHBondContact O-N 3.48Å; C84-F88 WeakPolarHBondContact O-CB 3.27Å; C84-F88 PolarHBondContact O-N 2.91Å
85L97.9Very high94.9Very high74 Ų7472.6 Ų72.639%0.38735%0.348SS..Hα-helixtrans-60.1-47.5175.717962.6000111.4F81 R82 S83 F87 F88 L89F81-L85 WeakPolarHBondContact O-CB 3.43Å; F81-L85 PolarHBondContact O-N 2.89Å; R82-L85 PolarHBondContact O-N 3.39Å; S83-L85 VanDerWaalsContact C-N 3.34Å; L85-F87 PolarHBondContact O-N 3.27Å; L85-F88 PolarHBondContact O-N 3.37Å; L85-L89 HydrophobicContact CD1-CD1 4.21Å; L85-L89 HydrophobicContact CD1-CG 4.21Å; L85-L89 HydrophobicContact CG-CD1 4.05Å; L85-L89 HydrophobicContact CG-CG 4.44Å; L85-L89 WeakPolarHBondContact O-CB 3.34Å; L85-L89 VanDerWaalsContact O-CG 3.29Å; L85-L89 WeakPolarHBondContact O-CG 3.49Å; L85-L89 PolarHBondContact O-N 3.2Å
86Y98Very high95.5Very high64 Ų6471.7 Ų71.725%0.25135%0.353SS..Hα-helixtrans-68.2-34.3179.5-71.2-1.4000112.9R82 S83 L89 S90 L128 P133 W138R82-Y86 WeakPolarHBondContact O-CB 3.35Å; R82-Y86 PolarHBondContact O-N 2.89Å; S83-Y86 PolarHBondContact O-N 3.03Å; Y86-L89 HydrophobicContact CD1-CD1 4.39Å; Y86-S90 VanDerWaalsContact O-CB 3.29Å; Y86-S90 WeakPolarHBondContact O-CB 3.38Å; Y86-S90 PolarHBondContact O-N 3.33Å; Y86-L128 HydrophobicContact CD2-CD2 4.31Å; Y86-P133 HydrophobicContact CD2-CB 3.5Å; Y86-P133 VanDerWaalsContact CD2-CB 3.5Å; Y86-P133 HydrophobicContact CE2-CB 3.49Å; Y86-P133 VanDerWaalsContact CE2-CB 3.49Å; Y86-P133 HydrophobicContact CG-CB 4.48Å; Y86-W138 HydrophobicContact CD2-CH2 4.04Å; Y86-W138 HydrophobicContact CD2-CZ2 4.33Å
87F98Very high96.1Very high47 Ų4769.4 Ų69.421%0.20635%0.346CS..Hα-helixtrans-61.1-50.4171-174-82.2000110.5S83 C84 L85 L89 S90 C91 T120 L125 L128S83-F87 WeakPolarHBondContact O-CB 3.39Å; S83-F87 PolarHBondContact O-N 3.46Å; C84-F87 PolarHBondContact O-N 3.48Å; L85-F87 PolarHBondContact O-N 3.27Å; F87-L89 PolarHBondContact O-N 3.16Å; F87-S90 WeakPolarHBondContact O-CB 3.01Å; F87-S90 PolarHBondContact O-N 3.44Å; F87-S90 VanDerWaalsContact O-N 3.14Å; F87-C91 PolarHBondContact O-N 3.25Å; F87-C91 PolarHBondContact O-SG 3.31Å; F87-T120 HydrophobicContact CD1-CG2 4.07Å; F87-T120 HydrophobicContact CD2-CG2 3.61Å; F87-T120 HydrophobicContact CE1-CG2 4.04Å; F87-T120 HydrophobicContact CE2-CG2 3.6Å; F87-T120 HydrophobicContact CG-CG2 3.86Å; F87-T120 HydrophobicContact CZ-CG2 3.81Å; F87-T120 WeakPolarHBondContact O-CG2 3.22Å; F87-L125 HydrophobicContact CD2-CB 4.24Å; F87-L125 HydrophobicContact CD2-CD1 4.08Å; F87-L125 HydrophobicContact CE2-CB 4.05Å; F87-L125 HydrophobicContact CE2-CD1 4.28Å; F87-L125 HydrophobicContact CE2-CD2 4.4Å; F87-L125 HydrophobicContact CE2-CG 4.48Å; F87-L128 HydrophobicContact CB-CD1 3.95Å; F87-L128 HydrophobicContact CD2-CD1 4.39Å
88F98.3Very high96.4Very high109 Ų10965 Ų6548%0.47832%0.324SS..Hα-helixtrans-61.4-46.2178.8179.1-105.5000112.7C84 L85 S90 C91 L92C84-F88 WeakPolarHBondContact O-CB 3.27Å; C84-F88 PolarHBondContact O-N 2.91Å; L85-F88 PolarHBondContact O-N 3.37Å; F88-S90 PolarHBondContact O-N 2.97Å; F88-C91 WeakPolarHBondContact O-CB 3.19Å; F88-C91 PolarHBondContact O-N 3.04Å; F88-C91 VanDerWaalsContact O-N 3.09Å; F88-L92 HydrophobicContact CD1-CD1 4.15Å; F88-L92 HydrophobicContact CE1-CD1 3.56Å; F88-L92 HydrophobicContact CE1-CG 4.12Å; F88-L92 HydrophobicContact CZ-CD1 3.95Å; F88-L92 HydrophobicContact CZ-CD2 4.15Å; F88-L92 HydrophobicContact CZ-CG 4.15Å; F88-L92 PolarHBondContact O-N 3.39Å
89L98.4Very high96.7Very high87 Ų8764.2 Ų64.246%0.45532%0.315SS..Hα-helixtrans-60.2-34.6175.4-70.6175.6000112L85 Y86 F87 L92 F93L85-L89 HydrophobicContact CD1-CD1 4.21Å; L85-L89 HydrophobicContact CD1-CG 4.21Å; L85-L89 HydrophobicContact CG-CD1 4.05Å; L85-L89 HydrophobicContact CG-CG 4.44Å; L85-L89 WeakPolarHBondContact O-CB 3.34Å; L85-L89 VanDerWaalsContact O-CG 3.29Å; L85-L89 WeakPolarHBondContact O-CG 3.49Å; L85-L89 PolarHBondContact O-N 3.2Å; Y86-L89 HydrophobicContact CD1-CD1 4.39Å; F87-L89 PolarHBondContact O-N 3.16Å; L89-L92 PolarHBondContact O-N 3.31Å; L89-F93 WeakPolarHBondContact O-CB 3.27Å; L89-F93 PolarHBondContact O-N 3.45Å
90S98.4Very high97Very high13 Ų1368.4 Ų68.49%0.09134%0.341CS..Hα-helixtrans-68.7-37.9173.9179.40000112.6Y86 F87 F88 L92 F93 F94 T120 T124Y86-S90 VanDerWaalsContact O-CB 3.29Å; Y86-S90 WeakPolarHBondContact O-CB 3.38Å; Y86-S90 PolarHBondContact O-N 3.33Å; F87-S90 WeakPolarHBondContact O-CB 3.01Å; F87-S90 PolarHBondContact O-N 3.44Å; F87-S90 VanDerWaalsContact O-N 3.14Å; F88-S90 PolarHBondContact O-N 2.97Å; S90-L92 VanDerWaalsContact C-N 3.32Å; S90-L92 PolarHBondContact O-N 2.86Å; S90-F93 PolarHBondContact O-N 3.05Å; S90-F94 WeakPolarHBondContact O-CD2 3.15Å; S90-F94 PolarHBondContact O-N 3.39Å; S90-T120 PolarHBondContact O-OG1 3.27Å; S90-T120 PolarHBondContact OG-OG1 3.49Å; S90-T124 WeakPolarHBondContact OG-CB 3.38Å; S90-T124 PolarHBondContact OG-OG1 3.31Å
91C98.4Very high97.2Very high4 Ų472 Ų723%0.02735%0.348CS..Hα-helixtrans-59.6-45.8172.4-64.80000110.7F87 F88 F93 F94 H95 F113 A116 T120F87-C91 PolarHBondContact O-N 3.25Å; F87-C91 PolarHBondContact O-SG 3.31Å; F88-C91 WeakPolarHBondContact O-CB 3.19Å; F88-C91 PolarHBondContact O-N 3.04Å; F88-C91 VanDerWaalsContact O-N 3.09Å; C91-F93 PolarHBondContact O-N 2.97Å; C91-F94 PolarHBondContact O-N 2.88Å; C91-H95 VanDerWaalsContact O-CB 3.27Å; C91-H95 WeakPolarHBondContact O-CB 3.35Å; C91-H95 PolarHBondContact O-N 3.31Å; C91-F113 HydrophobicContact CB-CE2 4.11Å; C91-F113 HydrophobicContact CB-CZ 4.2Å; C91-A116 WeakPolarHBondContact O-CB 3.31Å; C91-T120 WeakPolarHBondContact CA-OG1 3.25Å; C91-T120 PolarHBondContact N-OG1 3.36Å
92L98.4Very high97Very high70 Ų7068.5 Ų68.537%0.36635%0.352SS..Hα-helixtrans-61.6-44.7176.4-63.6-178.4000111.6F88 L89 S90 H95 T96 F113F88-L92 HydrophobicContact CD1-CD1 4.15Å; F88-L92 HydrophobicContact CE1-CD1 3.56Å; F88-L92 HydrophobicContact CE1-CG 4.12Å; F88-L92 HydrophobicContact CZ-CD1 3.95Å; F88-L92 HydrophobicContact CZ-CD2 4.15Å; F88-L92 HydrophobicContact CZ-CG 4.15Å; F88-L92 PolarHBondContact O-N 3.39Å; L89-L92 PolarHBondContact O-N 3.31Å; S90-L92 VanDerWaalsContact C-N 3.32Å; S90-L92 PolarHBondContact O-N 2.86Å; L92-H95 PolarHBondContact O-N 3.01Å; L92-T96 PolarHBondContact O-N 3.49Å; L92-T96 PolarHBondContact O-OG1 2.84Å; L92-T96 VanDerWaalsContact O-OG1 3.11Å; L92-F113 HydrophobicContact CD2-CE2 4.26Å
93F98.1Very high96.9Very high125 Ų12562.9 Ų62.955%0.54833%0.334SS..Hα-helixtrans-58.2-51.4177173.3-99.1000112.1L89 S90 C91 H95 T96 V97L89-F93 WeakPolarHBondContact O-CB 3.27Å; L89-F93 PolarHBondContact O-N 3.45Å; S90-F93 PolarHBondContact O-N 3.05Å; C91-F93 PolarHBondContact O-N 2.97Å; F93-H95 VanDerWaalsContact C-N 3.33Å; F93-H95 PolarHBondContact O-N 2.91Å; F93-T96 PolarHBondContact O-N 3.4Å; F93-V97 HydrophobicContact CD1-CG2 4.35Å; F93-V97 HydrophobicContact CD2-CG2 4.34Å; F93-V97 HydrophobicContact CE1-CG2 3.92Å; F93-V97 HydrophobicContact CE2-CG2 3.9Å; F93-V97 HydrophobicContact CZ-CG2 3.67Å; F93-V97 WeakPolarHBondContact O-CG2 3.36Å; F93-V97 PolarHBondContact O-N 3.48Å
94F98.4Very high96.5Very high20 Ų2064.1 Ų64.19%0.08834%0.341CS..Hα-helixtrans-63.6-39.5178.3-83-61.9000112.2S90 C91 T96 V97 V98 A116 L119 T120 T123 L163S90-F94 WeakPolarHBondContact O-CD2 3.15Å; S90-F94 PolarHBondContact O-N 3.39Å; C91-F94 PolarHBondContact O-N 2.88Å; F94-T96 PolarHBondContact O-N 3.33Å; F94-V97 PolarHBondContact O-N 3.36Å; F94-V98 WeakPolarHBondContact O-CB 3.23Å; F94-V98 WeakPolarHBondContact O-CG2 3.33Å; F94-V98 PolarHBondContact O-N 2.72Å; F94-A116 HydrophobicContact CB-CB 3.77Å; F94-L119 HydrophobicContact CD1-CB 4.17Å; F94-L119 HydrophobicContact CD1-CD1 3.95Å; F94-L119 HydrophobicContact CD2-CB 4.11Å; F94-L119 HydrophobicContact CE1-CB 4.39Å; F94-L119 HydrophobicContact CE1-CD1 4.5Å; F94-L119 HydrophobicContact CE2-CB 4.3Å; F94-L119 HydrophobicContact CG-CB 4.04Å; F94-L119 HydrophobicContact CG-CD1 4.33Å; F94-L119 HydrophobicContact CZ-CB 4.44Å; F94-T120 WeakPolarHBondContact CD2-OG1 3.26Å; F94-T123 WeakPolarHBondContact CE2-OG1 3.35Å; F94-T123 WeakPolarHBondContact CZ-OG1 3.41Å; F94-L163 HydrophobicContact CE1-CD2 3.55Å; F94-L163 HydrophobicContact CZ-CD2 3.91Å
95H97.7Very high95.9Very high34 Ų3465.8 Ų65.816%0.15735%0.345CS..Hα-helixtrans-58.7-48.4176.1-178.182.5000111.1C91 L92 F93 V98 I99 F113 A116C91-H95 VanDerWaalsContact O-CB 3.27Å; C91-H95 WeakPolarHBondContact O-CB 3.35Å; C91-H95 PolarHBondContact O-N 3.31Å; L92-H95 PolarHBondContact O-N 3.01Å; F93-H95 VanDerWaalsContact C-N 3.33Å; F93-H95 PolarHBondContact O-N 2.91Å; H95-V98 PolarHBondContact O-N 3.13Å; H95-I99 VanDerWaalsContact NE2-CD1 3.3Å; H95-I99 WeakPolarHBondContact NE2-CD1 3.39Å; H95-I99 WeakPolarHBondContact O-CG1 3.11Å; H95-I99 PolarHBondContact O-N 3.24Å; H95-F113 HydrophobicContact CB-CD2 4.23Å; H95-F113 VanDerWaalsContact ND1-CA 3.35Å; H95-F113 WeakPolarHBondContact ND1-CA 3.44Å; H95-F113 AromaticContact ND1-CD2 3.93Å; H95-F113 PolarHBondContact ND1-N 3.44Å; H95-A116 HydrophobicContact CB-CB 3.81Å
96T97.8Very high95.3Very high77 Ų7769 Ų6947%0.47236%0.361SS..Hα-helixtrans-61.4-46.8175.5-58.90000112L92 F93 F94 V98 I99 L100L92-T96 PolarHBondContact O-N 3.49Å; L92-T96 PolarHBondContact O-OG1 2.84Å; L92-T96 VanDerWaalsContact O-OG1 3.11Å; F93-T96 PolarHBondContact O-N 3.4Å; F94-T96 PolarHBondContact O-N 3.33Å; T96-V98 VanDerWaalsContact C-N 3.32Å; T96-V98 PolarHBondContact O-N 2.91Å; T96-I99 PolarHBondContact O-N 2.91Å; T96-L100 HydrophobicContact CG2-CD1 4.11Å; T96-L100 HydrophobicContact CG2-CG 4.42Å; T96-L100 VanDerWaalsContact O-CG 3.3Å; T96-L100 WeakPolarHBondContact O-CG 3.4Å; T96-L100 PolarHBondContact O-N 2.95Å
97V97.6Very high94.7Very high44 Ų4474.8 Ų74.827%0.26739%0.39SS..Hα-helixtrans-59.1-45.5178.4168.70000111F93 F94 I99 L100 Y101F93-V97 HydrophobicContact CD1-CG2 4.35Å; F93-V97 HydrophobicContact CD2-CG2 4.34Å; F93-V97 HydrophobicContact CE1-CG2 3.92Å; F93-V97 HydrophobicContact CE2-CG2 3.9Å; F93-V97 HydrophobicContact CZ-CG2 3.67Å; F93-V97 WeakPolarHBondContact O-CG2 3.36Å; F93-V97 PolarHBondContact O-N 3.48Å; F94-V97 PolarHBondContact O-N 3.36Å; V97-I99 VanDerWaalsContact C-N 3.35Å; V97-I99 PolarHBondContact O-N 3.43Å; V97-L100 WeakPolarHBondContact O-CB 3.34Å; V97-L100 PolarHBondContact O-N 3.06Å; V97-L100 VanDerWaalsContact O-N 3.15Å; V97-Y101 HydrophobicContact CG1-CD2 4.03Å; V97-Y101 HydrophobicContact CG1-CE2 4.15Å; V97-Y101 VanDerWaalsContact O-CD2 3.31Å; V97-Y101 WeakPolarHBondContact O-CD2 3.43Å; V97-Y101 PolarHBondContact O-N 3.43Å
98V96.8Very high94.5Very high19 Ų1973.9 Ų73.912%0.11539%0.39CS..Hα-helixtrans-64.9-39-178.9169.70000111.6F94 H95 T96 Y101 G102 A103 T112 L115 L119 W184F94-V98 WeakPolarHBondContact O-CB 3.23Å; F94-V98 WeakPolarHBondContact O-CG2 3.33Å; F94-V98 PolarHBondContact O-N 2.72Å; H95-V98 PolarHBondContact O-N 3.13Å; T96-V98 VanDerWaalsContact C-N 3.32Å; T96-V98 PolarHBondContact O-N 2.91Å; V98-Y101 CarbonylContact O-C 3.31Å; V98-Y101 PolarHBondContact O-N 2.96Å; V98-G102 PolarHBondContact O-N 3.34Å; V98-A103 HydrophobicContact CG1-CB 3.45Å; V98-A103 VanDerWaalsContact CG1-CB 3.45Å; V98-A103 VanDerWaalsContact O-CB 3.28Å; V98-A103 WeakPolarHBondContact O-CB 3.28Å; V98-A103 PolarHBondContact O-N 3.46Å; V98-A103 VanDerWaalsContact O-N 3.15Å; V98-T112 HydrophobicContact CB-CG2 4.38Å; V98-T112 HydrophobicContact CG1-CG2 3.87Å; V98-L115 HydrophobicContact CG1-CD2 4.24Å; V98-L115 HydrophobicContact CG2-CD2 4.48Å; V98-L119 HydrophobicContact CG2-CD1 4.26Å; V98-W184 HydrophobicContact CG1-CH2 3.38Å; V98-W184 HydrophobicContact CG1-CZ2 3.49Å; V98-W184 VanDerWaalsContact CG1-CZ2 3.49Å
99I96.6Very high94.3Very high39 Ų3970.5 Ų70.520%0.238%0.381CS..Hα-helixtrans-60.5-45.9171-72.1163.4000111.1H95 T96 V97 Y101 G102 L105 T112H95-I99 VanDerWaalsContact NE2-CD1 3.3Å; H95-I99 WeakPolarHBondContact NE2-CD1 3.39Å; H95-I99 WeakPolarHBondContact O-CG1 3.11Å; H95-I99 PolarHBondContact O-N 3.24Å; T96-I99 PolarHBondContact O-N 2.91Å; V97-I99 VanDerWaalsContact C-N 3.35Å; V97-I99 PolarHBondContact O-N 3.43Å; I99-Y101 PolarHBondContact O-N 3.44Å; I99-G102 PolarHBondContact O-N 3.01Å; I99-L105 HydrophobicContact CD1-CD1 3.6Å; I99-L105 HydrophobicContact CG1-CD1 4.27Å; I99-L105 HydrophobicContact CG2-CD1 4Å; I99-T112 HydrophobicContact CG1-CG2 4.04Å
100L96.3Very high94.2Very high138 Ų13870.7 Ų70.772%0.72338%0.382SS*.Hα-helixtrans-63-24.8178.4-68.4173.9000112.7T96 V97 G102T96-L100 HydrophobicContact CG2-CD1 4.11Å; T96-L100 HydrophobicContact CG2-CG 4.42Å; T96-L100 VanDerWaalsContact O-CG 3.3Å; T96-L100 WeakPolarHBondContact O-CG 3.4Å; T96-L100 PolarHBondContact O-N 2.95Å; V97-L100 WeakPolarHBondContact O-CB 3.34Å; V97-L100 PolarHBondContact O-N 3.06Å; V97-L100 VanDerWaalsContact O-N 3.15Å; L100-G102 VanDerWaalsContact C-N 3.28Å
101Y93.3Very high94.1Very high178 Ų17872.1 Ų72.170%0.69839%0.388SS*.THydrogen-bonded Turntrans-85.77.3173.1-88.3-105.5000113.8V97 V98 I99V97-Y101 HydrophobicContact CG1-CD2 4.03Å; V97-Y101 HydrophobicContact CG1-CE2 4.15Å; V97-Y101 VanDerWaalsContact O-CD2 3.31Å; V97-Y101 WeakPolarHBondContact O-CD2 3.43Å; V97-Y101 PolarHBondContact O-N 3.43Å; V98-Y101 CarbonylContact O-C 3.31Å; V98-Y101 PolarHBondContact O-N 2.96Å; I99-Y101 PolarHBondContact O-N 3.44Å
102G92.7Very high94.1Very high69 Ų6971.9 Ų71.971%0.71139%0.386SS*.THydrogen-bonded Turntrans103.411.4170.900000115.6V98 I99 L100V98-G102 PolarHBondContact O-N 3.34Å; I99-G102 PolarHBondContact O-N 3.01Å; L100-G102 VanDerWaalsContact C-N 3.28Å
103A92.7Very high94Very high12 Ų1271.5 Ų71.510%0.09938%0.382CS..  trans-69.6151.7174.500000112.7V98 L105 T112 W184V98-A103 HydrophobicContact CG1-CB 3.45Å; V98-A103 VanDerWaalsContact CG1-CB 3.45Å; V98-A103 VanDerWaalsContact O-CB 3.28Å; V98-A103 WeakPolarHBondContact O-CB 3.28Å; V98-A103 PolarHBondContact O-N 3.46Å; V98-A103 VanDerWaalsContact O-N 3.15Å; A103-L105 PolarHBondContact O-N 2.79Å; A103-T112 HydrophobicContact CB-CG2 4.07Å; A103-W184 HydrophobicContact CB-CH2 3.67Å; A103-W184 HydrophobicContact CB-CZ2 3.36Å; A103-W184 HydrophobicContact CB-CZ3 4.44Å
104P86.7Confident94Very high49 Ų4965.5 Ų65.532%0.31836%0.356SS..  trans-60.1130.3177.9-21.632.3000112.4T112P104-T112 PolarHBondContact O-OG1 3.41Å
105L83.1Confident94Very high110 Ų11064.8 Ų64.858%0.57635%0.352SS*.SBendtrans-79.1-42.6-178.3-178.366.5000113.1I99 A103 A109I99-L105 HydrophobicContact CD1-CD1 3.6Å; I99-L105 HydrophobicContact CG1-CD1 4.27Å; I99-L105 HydrophobicContact CG2-CD1 4Å; A103-L105 PolarHBondContact O-N 2.79Å; L105-A109 WeakPolarHBondContact O-CB 3.34Å
106I85.7Confident94.1Very high142 Ų14263.1 Ų63.173%0.72835%0.345SS*.SBendtrans-113.6-56-170.2-57.5178000111.1S108 A109I106-S108 PolarHBondContact O-N 2.94Å; I106-S108 VanDerWaalsContact O-N 3.15Å; I106-A109 PolarHBondContact O-N 2.73Å
107E86.4Confident94.1Very high184 Ų18460.5 Ų60.586%0.8633%0.329SS*.THydrogen-bonded Turntrans-63.7-24.1-171.2-64-179179.600114.1
108S92.1Very high94.2Very high29 Ų2958.5 Ų58.520%0.20332%0.316CS..THydrogen-bonded Turntrans-134.737.5177.3-45.80000111.8I106 L110 E111 T112I106-S108 PolarHBondContact O-N 2.94Å; I106-S108 VanDerWaalsContact O-N 3.15Å; S108-L110 VanDerWaalsContact C-N 3.27Å; S108-L110 PolarHBondContact O-N 2.93Å; S108-E111 VanDerWaalsContact C-OE2 3.25Å; S108-E111 WeakPolarHBondContact CA-OE2 3.28Å; S108-E111 PolarHBondContact O-N 3.48Å; S108-T112 WeakPolarHBondContact O-CB 3.18Å; S108-T112 PolarHBondContact O-N 3.44Å; S108-T112 PolarHBondContact O-OG1 2.9Å
109A94.6Very high94.3Very high37 Ų3757.9 Ų57.931%0.30631%0.312SS..Hα-helixtrans-60.1-38.6-177.900000112.1L105 I106 T112 F113L105-A109 WeakPolarHBondContact O-CB 3.34Å; I106-A109 PolarHBondContact O-N 2.73Å; A109-T112 PolarHBondContact O-N 2.89Å; A109-F113 VanDerWaalsContact O-CB 3.32Å; A109-F113 WeakPolarHBondContact O-CB 3.16Å; A109-F113 PolarHBondContact O-N 2.98Å
110L96.1Very high94.4Very high91 Ų9156 Ų5648%0.47630%0.303SS..Hα-helixtrans-66.7-4317917861.4000111.3L41 S108 F113 S114L41-L110 HydrophobicContact CD1-CD2 3.79Å; L41-L110 HydrophobicContact CD1-CG 4.24Å; S108-L110 VanDerWaalsContact C-N 3.27Å; S108-L110 PolarHBondContact O-N 2.93Å; L110-F113 PolarHBondContact O-N 2.74Å; L110-S114 VanDerWaalsContact O-CB 3.26Å; L110-S114 WeakPolarHBondContact O-CB 3.41Å; L110-S114 PolarHBondContact O-N 3.28Å; L110-S114 PolarHBondContact O-OG 3.5Å
111E96.9Very high94.4Very high43 Ų4349.5 Ų49.520%0.20127%0.269CS..Hα-helixtrans-62.6-48.1176-71.574.2-164.500110.6L41 S108 F113 S114 L115 P185L41-E111 HydrophobicContact CD2-CG 4.31Å; S108-E111 VanDerWaalsContact C-OE2 3.25Å; S108-E111 WeakPolarHBondContact CA-OE2 3.28Å; S108-E111 PolarHBondContact O-N 3.48Å; E111-F113 VanDerWaalsContact C-N 3.33Å; E111-F113 PolarHBondContact O-N 2.9Å; E111-S114 WeakPolarHBondContact O-CB 3.17Å; E111-S114 PolarHBondContact O-N 2.92Å; E111-L115 PolarHBondContact O-N 3.1Å; E111-P185 HydrophobicContact CB-CG 3.88Å
112T97.5Very high94.7Very high0 Ų041 Ų410%024%0.236CC..Hα-helixtrans-61.3-42177-59.70000111.2V98 I99 A103 P104 S108 A109 A116 W184V98-T112 HydrophobicContact CB-CG2 4.38Å; V98-T112 HydrophobicContact CG1-CG2 3.87Å; I99-T112 HydrophobicContact CG1-CG2 4.04Å; A103-T112 HydrophobicContact CB-CG2 4.07Å; P104-T112 PolarHBondContact O-OG1 3.41Å; S108-T112 WeakPolarHBondContact O-CB 3.18Å; S108-T112 PolarHBondContact O-N 3.44Å; S108-T112 PolarHBondContact O-OG1 2.9Å; A109-T112 PolarHBondContact O-N 2.89Å; T112-A116 PolarHBondContact O-N 2.94Å; T112-A116 VanDerWaalsContact O-N 3.11Å; T112-W184 HydrophobicContact CG2-CZ2 4.28Å; T112-W184 PolarHBondContact OG1-NE1 3.39Å
113F97.8Very high94.9Very high61 Ų6137.9 Ų37.927%0.26820%0.203SC..Hα-helixtrans-68-38.2175-171.3-103.3000112.2C91 L92 H95 A109 L110 E111 L115 A116 V117C91-F113 HydrophobicContact CB-CE2 4.11Å; C91-F113 HydrophobicContact CB-CZ 4.2Å; L92-F113 HydrophobicContact CD2-CE2 4.26Å; H95-F113 HydrophobicContact CB-CD2 4.23Å; H95-F113 VanDerWaalsContact ND1-CA 3.35Å; H95-F113 WeakPolarHBondContact ND1-CA 3.44Å; H95-F113 AromaticContact ND1-CD2 3.93Å; H95-F113 PolarHBondContact ND1-N 3.44Å; A109-F113 VanDerWaalsContact O-CB 3.32Å; A109-F113 WeakPolarHBondContact O-CB 3.16Å; A109-F113 PolarHBondContact O-N 2.98Å; L110-F113 PolarHBondContact O-N 2.74Å; E111-F113 VanDerWaalsContact C-N 3.33Å; E111-F113 PolarHBondContact O-N 2.9Å; F113-L115 PolarHBondContact O-N 2.91Å; F113-A116 WeakPolarHBondContact O-CA 3.45Å; F113-A116 WeakPolarHBondContact O-CB 3.34Å; F113-A116 PolarHBondContact O-N 3.28Å; F113-A116 VanDerWaalsContact O-N 3.09Å; F113-V117 HydrophobicContact CD1-CG2 4.08Å; F113-V117 HydrophobicContact CE1-CG2 3.74Å; F113-V117 HydrophobicContact CZ-CG2 4.19Å; F113-V117 WeakPolarHBondContact O-CG2 3.25Å; F113-V117 PolarHBondContact O-N 3.43Å
114S98.1Very high95.1Very high0 Ų038.1 Ų38.10%020%0.203CC..Hα-helixtrans-61.8-41.2175.3-61.60000112.2L41 Y45 L110 E111 A116 V117 L118L41-S114 WeakPolarHBondContact CD2-OG 3.17Å; Y45-S114 PolarHBondContact OH-OG 3.46Å; L110-S114 VanDerWaalsContact O-CB 3.26Å; L110-S114 WeakPolarHBondContact O-CB 3.41Å; L110-S114 PolarHBondContact O-N 3.28Å; L110-S114 PolarHBondContact O-OG 3.5Å; E111-S114 WeakPolarHBondContact O-CB 3.17Å; E111-S114 PolarHBondContact O-N 2.92Å; S114-A116 VanDerWaalsContact C-N 3.33Å; S114-V117 PolarHBondContact O-N 3.42Å; S114-L118 PolarHBondContact O-N 2.91Å
115L98.4Very high95.6Very high4 Ų436.6 Ų36.62%0.02119%0.192CC..Hα-helixtrans-62-41.3171176.760.7000111.4V98 E111 F113 V117 L118 L119 W184 P185 C188V98-L115 HydrophobicContact CG1-CD2 4.24Å; V98-L115 HydrophobicContact CG2-CD2 4.48Å; E111-L115 PolarHBondContact O-N 3.1Å; F113-L115 PolarHBondContact O-N 2.91Å; L115-V117 VanDerWaalsContact C-N 3.34Å; L115-V117 PolarHBondContact O-N 3.48Å; L115-L118 HydrophobicContact CD1-CD2 4.41Å; L115-L118 WeakPolarHBondContact O-CB 3.43Å; L115-L118 PolarHBondContact O-N 3.37Å; L115-L119 HydrophobicContact CD1-CD1 4.39Å; L115-L119 HydrophobicContact CD1-CG 4.19Å; L115-L119 HydrophobicContact CG-CD1 4.19Å; L115-L119 HydrophobicContact CG-CG 4.43Å; L115-L119 WeakPolarHBondContact O-CG 3.39Å; L115-L119 PolarHBondContact O-N 2.93Å; L115-W184 HydrophobicContact CD2-CH2 3.54Å; L115-W184 HydrophobicContact CD2-CZ2 3.8Å; L115-W184 HydrophobicContact CD2-CZ3 4.34Å; L115-P185 HydrophobicContact CB-CB 4Å; L115-P185 HydrophobicContact CB-CG 4.49Å; L115-P185 HydrophobicContact CD2-CB 4.15Å; L115-C188 HydrophobicContact CD1-CB 4.33Å; L115-C188 HydrophobicContact CD2-CB 3.86Å
116A98.4Very high96.1Very high0 Ų031.5 Ų31.50%017%0.165CC..Hα-helixtrans-64.6-36.6177.100000113C91 F94 H95 T112 F113 S114 T120C91-A116 WeakPolarHBondContact O-CB 3.31Å; F94-A116 HydrophobicContact CB-CB 3.77Å; H95-A116 HydrophobicContact CB-CB 3.81Å; T112-A116 PolarHBondContact O-N 2.94Å; T112-A116 VanDerWaalsContact O-N 3.11Å; F113-A116 WeakPolarHBondContact O-CA 3.45Å; F113-A116 WeakPolarHBondContact O-CB 3.34Å; F113-A116 PolarHBondContact O-N 3.28Å; F113-A116 VanDerWaalsContact O-N 3.09Å; S114-A116 VanDerWaalsContact C-N 3.33Å; A116-T120 VanDerWaalsContact O-CB 3.29Å; A116-T120 WeakPolarHBondContact O-CB 3.31Å; A116-T120 PolarHBondContact O-N 2.93Å; A116-T120 PolarHBondContact O-OG1 2.89Å
117V98.6Very high96.5Very high22 Ų2225 Ų2513%0.13313%0.132CC..Hα-helixtrans-63.6-43.9171.4171.30000110.8F113 S114 L115 T120 S121F113-V117 HydrophobicContact CD1-CG2 4.08Å; F113-V117 HydrophobicContact CE1-CG2 3.74Å; F113-V117 HydrophobicContact CZ-CG2 4.19Å; F113-V117 WeakPolarHBondContact O-CG2 3.25Å; F113-V117 PolarHBondContact O-N 3.43Å; S114-V117 PolarHBondContact O-N 3.42Å; L115-V117 VanDerWaalsContact C-N 3.34Å; L115-V117 PolarHBondContact O-N 3.48Å; V117-T120 PolarHBondContact O-N 2.74Å; V117-S121 WeakPolarHBondContact O-CB 3.46Å; V117-S121 PolarHBondContact O-N 2.98Å; V117-S121 PolarHBondContact O-OG 2.63Å
118L98.6Very high96.9Very high1 Ų116.9 Ų16.91%0.00510%0.095CC..Hα-helixtrans-59.3-54.9175.3-175.874.4000110.6L44 V47 S48 S114 L115 T120 S121 L122 A192 M193L44-L118 HydrophobicContact CD2-CB 4.35Å; L44-L118 HydrophobicContact CD2-CD1 4.28Å; L44-L118 HydrophobicContact CD2-CD2 3.65Å; L44-L118 HydrophobicContact CD2-CG 4.29Å; V47-L118 HydrophobicContact CB-CD1 4.39Å; V47-L118 HydrophobicContact CG1-CD1 3.96Å; S48-L118 WeakPolarHBondContact OG-CA 3.45Å; S114-L118 PolarHBondContact O-N 2.91Å; L115-L118 HydrophobicContact CD1-CD2 4.41Å; L115-L118 WeakPolarHBondContact O-CB 3.43Å; L115-L118 PolarHBondContact O-N 3.37Å; L118-T120 VanDerWaalsContact C-N 3.28Å; L118-T120 PolarHBondContact O-N 2.66Å; L118-S121 WeakPolarHBondContact O-CB 3.19Å; L118-S121 PolarHBondContact O-N 3.09Å; L118-L122 HydrophobicContact CD1-CD1 4.31Å; L118-L122 HydrophobicContact CD1-CG 4.44Å; L118-L122 HydrophobicContact CD2-CD1 4.38Å; L118-L122 HydrophobicContact CG-CD1 3.95Å; L118-L122 HydrophobicContact CG-CG 4.35Å; L118-L122 VanDerWaalsContact O-CG 3.31Å; L118-L122 WeakPolarHBondContact O-CG 3.32Å; L118-L122 PolarHBondContact O-N 3.17Å; L118-A192 HydrophobicContact CD2-CB 4.34Å; L118-M193 HydrophobicContact CD1-SD 3.94Å; L118-M193 HydrophobicContact CD2-CG 4.41Å; L118-M193 HydrophobicContact CD2-SD 4.39Å; L118-M193 HydrophobicContact CG-SD 4.5Å
119L98.7Very high96.9Very high6 Ų616 Ų163%0.0319%0.089CC..Hα-helixtrans-56.3-43179.7-69.4175.1000111.7F94 V98 L115 S121 L122 T123 T162 L163 A166 A192F94-L119 HydrophobicContact CD1-CB 4.17Å; F94-L119 HydrophobicContact CD1-CD1 3.95Å; F94-L119 HydrophobicContact CD2-CB 4.11Å; F94-L119 HydrophobicContact CE1-CB 4.39Å; F94-L119 HydrophobicContact CE1-CD1 4.5Å; F94-L119 HydrophobicContact CE2-CB 4.3Å; F94-L119 HydrophobicContact CG-CB 4.04Å; F94-L119 HydrophobicContact CG-CD1 4.33Å; F94-L119 HydrophobicContact CZ-CB 4.44Å; V98-L119 HydrophobicContact CG2-CD1 4.26Å; L115-L119 HydrophobicContact CD1-CD1 4.39Å; L115-L119 HydrophobicContact CD1-CG 4.19Å; L115-L119 HydrophobicContact CG-CD1 4.19Å; L115-L119 HydrophobicContact CG-CG 4.43Å; L115-L119 WeakPolarHBondContact O-CG 3.39Å; L115-L119 PolarHBondContact O-N 2.93Å; L119-S121 VanDerWaalsContact C-N 3.35Å; L119-S121 PolarHBondContact O-N 3.48Å; L119-L122 PolarHBondContact O-N 3.21Å; L119-T123 WeakPolarHBondContact O-CB 3.5Å; L119-T123 WeakPolarHBondContact O-CG2 3.45Å; L119-T123 PolarHBondContact O-N 2.98Å; L119-T123 PolarHBondContact O-OG1 3.02Å; L119-T162 HydrophobicContact CD2-CG2 4.33Å; L119-L163 HydrophobicContact CD2-CD2 4.4Å; L119-A166 HydrophobicContact CD2-CB 3.77Å; L119-A192 HydrophobicContact CD2-CB 3.83Å
120T98.6Very high96.8Very high0 Ų014.7 Ų14.70%08%0.077CC..Hα-helixtrans-62.7-41176.3-60.60000112.1F87 S90 C91 F94 A116 V117 L118 T123 T124 L125F87-T120 HydrophobicContact CD1-CG2 4.07Å; F87-T120 HydrophobicContact CD2-CG2 3.61Å; F87-T120 HydrophobicContact CE1-CG2 4.04Å; F87-T120 HydrophobicContact CE2-CG2 3.6Å; F87-T120 HydrophobicContact CG-CG2 3.86Å; F87-T120 HydrophobicContact CZ-CG2 3.81Å; F87-T120 WeakPolarHBondContact O-CG2 3.22Å; S90-T120 PolarHBondContact O-OG1 3.27Å; S90-T120 PolarHBondContact OG-OG1 3.49Å; C91-T120 WeakPolarHBondContact CA-OG1 3.25Å; C91-T120 PolarHBondContact N-OG1 3.36Å; F94-T120 WeakPolarHBondContact CD2-OG1 3.26Å; A116-T120 VanDerWaalsContact O-CB 3.29Å; A116-T120 WeakPolarHBondContact O-CB 3.31Å; A116-T120 PolarHBondContact O-N 2.93Å; A116-T120 PolarHBondContact O-OG1 2.89Å; V117-T120 PolarHBondContact O-N 2.74Å; L118-T120 VanDerWaalsContact C-N 3.28Å; L118-T120 PolarHBondContact O-N 2.66Å; T120-T123 PolarHBondContact O-N 3.45Å; T120-T124 PolarHBondContact O-N 2.75Å; T120-T124 VanDerWaalsContact O-N 3.09Å; T120-L125 PolarHBondContact O-N 2.91Å
121S98.3Very high96.6Very high2 Ų211.1 Ų11.11%0.0146%0.058CC..Hα-helixtrans-66.2-39178.1-57.60000112.2V117 L118 L119 L125V117-S121 WeakPolarHBondContact O-CB 3.46Å; V117-S121 PolarHBondContact O-N 2.98Å; V117-S121 PolarHBondContact O-OG 2.63Å; L118-S121 WeakPolarHBondContact O-CB 3.19Å; L118-S121 PolarHBondContact O-N 3.09Å; L119-S121 VanDerWaalsContact C-N 3.35Å; L119-S121 PolarHBondContact O-N 3.48Å; S121-L125 WeakPolarHBondContact O-CB 3.44Å
122L98.1Very high96.3Very high0 Ų09.5 Ų9.50%05%0.053CC..Hα-helixtrans-77.6-29.2179-59.8179.5000112.7V51 L118 L119 T162 A192 M193 Y196V51-L122 HydrophobicContact CG1-CD2 4.26Å; V51-L122 HydrophobicContact CG2-CD2 4.16Å; L118-L122 HydrophobicContact CD1-CD1 4.31Å; L118-L122 HydrophobicContact CD1-CG 4.44Å; L118-L122 HydrophobicContact CD2-CD1 4.38Å; L118-L122 HydrophobicContact CG-CD1 3.95Å; L118-L122 HydrophobicContact CG-CG 4.35Å; L118-L122 VanDerWaalsContact O-CG 3.31Å; L118-L122 WeakPolarHBondContact O-CG 3.32Å; L118-L122 PolarHBondContact O-N 3.17Å; L119-L122 PolarHBondContact O-N 3.21Å; L122-T162 HydrophobicContact CB-CG2 3.78Å; L122-T162 HydrophobicContact CD1-CG2 3.86Å; L122-A192 HydrophobicContact CD1-CB 4.15Å; L122-M193 HydrophobicContact CD1-SD 3.61Å; L122-M193 HydrophobicContact CD2-CE 4.45Å; L122-M193 HydrophobicContact CD2-SD 3.88Å; L122-M193 HydrophobicContact CG-SD 4.31Å; L122-Y196 HydrophobicContact CB-CD2 3.88Å; L122-Y196 HydrophobicContact CB-CE2 4.25Å; L122-Y196 HydrophobicContact CB-CG 4.22Å; L122-Y196 HydrophobicContact CD1-CG 4.43Å; L122-Y196 HydrophobicContact CD2-CD1 3.76Å; L122-Y196 HydrophobicContact CD2-CD2 4.2Å; L122-Y196 HydrophobicContact CD2-CE1 3.98Å; L122-Y196 HydrophobicContact CD2-CE2 4.42Å; L122-Y196 HydrophobicContact CD2-CG 3.86Å; L122-Y196 HydrophobicContact CG-CG 4.37Å; L122-Y196 WeakPolarHBondContact O-CE2 3.28Å
123T97.9Very high96.2Very high3 Ų310.5 Ų10.52%0.0186%0.059CC..THydrogen-bonded Turntrans-110.3-80.8-173.5640000112.7F94 L119 T120 L125 R126 C127 V159 T162 L163F94-T123 WeakPolarHBondContact CE2-OG1 3.35Å; F94-T123 WeakPolarHBondContact CZ-OG1 3.41Å; L119-T123 WeakPolarHBondContact O-CB 3.5Å; L119-T123 WeakPolarHBondContact O-CG2 3.45Å; L119-T123 PolarHBondContact O-N 2.98Å; L119-T123 PolarHBondContact O-OG1 3.02Å; T120-T123 PolarHBondContact O-N 3.45Å; T123-L125 VanDerWaalsContact C-N 3.26Å; T123-L125 PolarHBondContact O-N 2.9Å; T123-L125 VanDerWaalsContact O-N 3.17Å; T123-R126 WeakPolarHBondContact O-CB 3.41Å; T123-R126 PolarHBondContact O-N 3.5Å; T123-C127 PolarHBondContact O-N 3.28Å; T123-V159 HydrophobicContact CG2-CB 4.38Å; T123-V159 HydrophobicContact CG2-CG1 4.11Å; T123-V159 HydrophobicContact CG2-CG2 4.15Å; T123-T162 HydrophobicContact CG2-CG2 3.79Å; T123-L163 HydrophobicContact CG2-CD2 4.28Å
124T97.3Very high95.9Very high17 Ų1711.4 Ų11.410%0.1047%0.067CC..Hα-helixtrans-56.8-35.7-172.4-58.50000113.3S90 T120 R126 C127 L128 W138S90-T124 WeakPolarHBondContact OG-CB 3.38Å; S90-T124 PolarHBondContact OG-OG1 3.31Å; T120-T124 PolarHBondContact O-N 2.75Å; T120-T124 VanDerWaalsContact O-N 3.09Å; T124-R126 VanDerWaalsContact C-N 3.26Å; T124-R126 PolarHBondContact O-N 3.42Å; T124-C127 WeakPolarHBondContact O-CB 3.33Å; T124-C127 PolarHBondContact O-N 3.5Å; T124-C127 VanDerWaalsContact O-N 3.11Å; T124-L128 HydrophobicContact CG2-CD1 4.18Å; T124-L128 HydrophobicContact CG2-CG 4.43Å; T124-L128 PolarHBondContact O-N 3.5Å; T124-W138 HydrophobicContact CG2-CH2 3.75Å; T124-W138 HydrophobicContact CG2-CZ3 4.01Å
125L96.4Very high95.7Very high17 Ų1715.1 Ų15.19%0.0899%0.086CC..Hα-helixtrans-61.1-36.4178-174.861.9000112.8A52 V56 F87 T120 S121 T123 C127 L128 C129A52-L125 HydrophobicContact CB-CD2 3.38Å; V56-L125 HydrophobicContact CG2-CD1 4.28Å; F87-L125 HydrophobicContact CD2-CB 4.24Å; F87-L125 HydrophobicContact CD2-CD1 4.08Å; F87-L125 HydrophobicContact CE2-CB 4.05Å; F87-L125 HydrophobicContact CE2-CD1 4.28Å; F87-L125 HydrophobicContact CE2-CD2 4.4Å; F87-L125 HydrophobicContact CE2-CG 4.48Å; T120-L125 PolarHBondContact O-N 2.91Å; S121-L125 WeakPolarHBondContact O-CB 3.44Å; T123-L125 VanDerWaalsContact C-N 3.26Å; T123-L125 PolarHBondContact O-N 2.9Å; T123-L125 VanDerWaalsContact O-N 3.17Å; L125-C127 VanDerWaalsContact C-N 3.35Å; L125-L128 WeakPolarHBondContact O-CB 3.48Å; L125-L128 PolarHBondContact O-N 3.11Å; L125-C129 PolarHBondContact O-N 2.89Å; L125-C129 PolarHBondContact O-SG 3.01Å
126R93.2Very high95.5Very high2 Ų221.3 Ų21.31%0.00812%0.115CC..Hα-helixtrans-64.3-43.3175.4-65-83.6-65.5-175.6-0.1110.4H13 F59 T123 T124 L128 C129 V130 L155H13-R126 PolarHBondContact NE2-NH2 2.87Å; F59-R126 VanDerWaalsContact CZ-CZ 3.48Å; T123-R126 WeakPolarHBondContact O-CB 3.41Å; T123-R126 PolarHBondContact O-N 3.5Å; T124-R126 VanDerWaalsContact C-N 3.26Å; T124-R126 PolarHBondContact O-N 3.42Å; R126-L128 VanDerWaalsContact C-N 3.32Å; R126-L128 PolarHBondContact O-N 3.06Å; R126-C129 PolarHBondContact O-N 3.33Å; R126-V130 WeakPolarHBondContact O-CG2 3.29Å; R126-V130 PolarHBondContact O-N 3.43Å; R126-L155 HydrophobicContact CB-CD2 3.63Å
127C94.6Very high95.3Very high6 Ų622 Ų224%0.04112%0.121CC..Hα-helixtrans-60-42.6173.9-61.40000111.4T123 T124 L125 C129 L131 G132 W138T123-C127 PolarHBondContact O-N 3.28Å; T124-C127 WeakPolarHBondContact O-CB 3.33Å; T124-C127 PolarHBondContact O-N 3.5Å; T124-C127 VanDerWaalsContact O-N 3.11Å; L125-C127 VanDerWaalsContact C-N 3.35Å; C127-C129 PolarHBondContact O-N 3.5Å; C127-L131 WeakPolarHBondContact O-CA 3.39Å; C127-L131 VanDerWaalsContact O-CB 3.28Å; C127-L131 WeakPolarHBondContact O-CB 3.41Å; C127-L131 PolarHBondContact O-N 3.49Å; C127-G132 PolarHBondContact O-N 3.35Å; C127-W138 HydrophobicContact CB-CD2 4.38Å; C127-W138 HydrophobicContact CB-CZ2 4.19Å
128L94.9Very high95.1Very high13 Ų1322.7 Ų22.77%0.06812%0.121CC..Hα-helixtrans-62-41.3175.3-75.4166.3000112.3S83 Y86 F87 T124 L125 R126 G132 P133 W138S83-L128 WeakPolarHBondContact O-CD1 3.38Å; Y86-L128 HydrophobicContact CD2-CD2 4.31Å; F87-L128 HydrophobicContact CB-CD1 3.95Å; F87-L128 HydrophobicContact CD2-CD1 4.39Å; T124-L128 HydrophobicContact CG2-CD1 4.18Å; T124-L128 HydrophobicContact CG2-CG 4.43Å; T124-L128 PolarHBondContact O-N 3.5Å; L125-L128 WeakPolarHBondContact O-CB 3.48Å; L125-L128 PolarHBondContact O-N 3.11Å; R126-L128 VanDerWaalsContact C-N 3.32Å; R126-L128 PolarHBondContact O-N 3.06Å; L128-G132 WeakPolarHBondContact O-CA 3.44Å; L128-G132 PolarHBondContact O-N 3.04Å; L128-P133 HydrophobicContact CD2-CB 4.2Å; L128-W138 HydrophobicContact CD2-CH2 3.81Å; L128-W138 HydrophobicContact CD2-CZ2 3.51Å; L128-W138 HydrophobicContact CG-CH2 3.9Å; L128-W138 HydrophobicContact CG-CZ2 3.71Å
129C92.3Very high95Very high12 Ų1226.9 Ų26.98%0.08114%0.142CC..Hα-helixtrans-69.6-41.7179.8-67.10000112.8F59 S65 L125 R126 C127F59-C129 HydrophobicContact CB-CB 3.7Å; F59-C129 HydrophobicContact CD1-CB 4.47Å; F59-C129 HydrophobicContact CD2-CB 3.32Å; F59-C129 HydrophobicContact CE2-CB 4.07Å; F59-C129 HydrophobicContact CG-CB 3.58Å; S65-C129 PolarHBondContact OG-O 3.42Å; L125-C129 PolarHBondContact O-N 2.89Å; L125-C129 PolarHBondContact O-SG 3.01Å; R126-C129 PolarHBondContact O-N 3.33Å; C127-C129 PolarHBondContact O-N 3.5Å
130V91.3Very high94.8Very high9 Ų930.9 Ų30.96%0.05516%0.157CC..Hα-helixtrans-87-43.5-174.3175.80000112.5F59 I64 P66 R126 W151 L155F59-V130 HydrophobicContact CD1-CG2 3.89Å; F59-V130 HydrophobicContact CE1-CG2 3.37Å; F59-V130 HydrophobicContact CE2-CG2 4.34Å; F59-V130 HydrophobicContact CZ-CG2 3.62Å; I64-V130 HydrophobicContact CG2-CG1 4.5Å; I64-V130 HydrophobicContact CG2-CG2 4.47Å; P66-V130 WeakPolarHBondContact CD-O 3.38Å; R126-V130 WeakPolarHBondContact O-CG2 3.29Å; R126-V130 PolarHBondContact O-N 3.43Å; V130-W151 HydrophobicContact CG1-CB 3.94Å; V130-L155 HydrophobicContact CB-CD1 4.01Å; V130-L155 HydrophobicContact CG1-CD1 3.94Å; V130-L155 HydrophobicContact CG2-CD2 4.25Å
131L91.9Very high94.7Very high16 Ų1630.9 Ų30.98%0.08416%0.157CC..Hα-helixtrans-102.7-14.1-173.2-53.6175.5000112.5C127 A137 W138 V141 L155C127-L131 WeakPolarHBondContact O-CA 3.39Å; C127-L131 VanDerWaalsContact O-CB 3.28Å; C127-L131 WeakPolarHBondContact O-CB 3.41Å; C127-L131 PolarHBondContact O-N 3.49Å; L131-A137 HydrophobicContact CB-CB 4.29Å; L131-W138 HydrophobicContact CD1-CG 4.38Å; L131-V141 HydrophobicContact CD1-CB 4.13Å; L131-V141 HydrophobicContact CD1-CG1 4.5Å; L131-V141 HydrophobicContact CD1-CG2 3.77Å; L131-V141 HydrophobicContact CD2-CG2 4.04Å; L131-L155 HydrophobicContact CD1-CD1 3.77Å; L131-L155 HydrophobicContact CD2-CD1 4.29Å; L131-L155 HydrophobicContact CG-CD1 3.83Å
132G92.3Very high94.5Very high9 Ų935.2 Ų35.29%0.09318%0.176CC..  trans71-178.4-169.500000112.4C127 L128 N134 W138C127-G132 PolarHBondContact O-N 3.35Å; L128-G132 WeakPolarHBondContact O-CA 3.44Å; L128-G132 PolarHBondContact O-N 3.04Å; G132-N134 PolarHBondContact O-N 3.19Å; G132-W138 PolarHBondContact O-NE1 2.8Å
133P93.6Very high94.3Very high21 Ų2137.7 Ų37.714%0.13619%0.193CC..SBendtrans-7661.917333.2-35.7000110.7R79 R82 Y86 L128R79-P133 HydrophobicContact CG-CG 3.98Å; R82-P133 HydrophobicContact CB-CB 3.91Å; R82-P133 HydrophobicContact CB-CG 3.95Å; Y86-P133 HydrophobicContact CD2-CB 3.5Å; Y86-P133 VanDerWaalsContact CD2-CB 3.5Å; Y86-P133 HydrophobicContact CE2-CB 3.49Å; Y86-P133 VanDerWaalsContact CE2-CB 3.49Å; Y86-P133 HydrophobicContact CG-CB 4.48Å; L128-P133 HydrophobicContact CD2-CB 4.2Å
134N93.1Very high93.8Very high79 Ų7948.2 Ų48.242%0.42223%0.233SC..  trans-121.894178.7-177.9-8.7000110G132 Q136 A137 W138G132-N134 PolarHBondContact O-N 3.19Å; N134-Q136 PolarHBondContact O-N 2.98Å; N134-Q136 WeakPolarHBondContact OD1-CB 3.31Å; N134-Q136 PolarHBondContact OD1-N 3.32Å; N134-A137 HydrophobicContact CB-CB 4.07Å; N134-A137 WeakPolarHBondContact O-CB 3.27Å; N134-A137 PolarHBondContact O-N 2.84Å; N134-A137 PolarHBondContact OD1-N 3.39Å; N134-W138 PolarHBondContact O-N 2.85Å; N134-W138 VanDerWaalsContact O-N 3.16Å
135I93Very high93.2Very high79 Ų7954.9 Ų54.941%0.40526%0.262SS..Hα-helixtrans-58.9-33.3-176.9-167.861.4000113A137 W138 I139I135-A137 VanDerWaalsContact C-N 3.31Å; I135-A137 PolarHBondContact O-N 3.27Å; I135-W138 HydrophobicContact CD1-CB 4.41Å; I135-W138 HydrophobicContact CD1-CE3 4.01Å; I135-W138 WeakPolarHBondContact O-CB 3.44Å; I135-W138 PolarHBondContact O-N 3.19Å; I135-W138 VanDerWaalsContact O-N 3.11Å; I135-I139 HydrophobicContact CG1-CD1 4.05Å; I135-I139 HydrophobicContact CG1-CG1 4.36Å; I135-I139 WeakPolarHBondContact O-CG1 3.5Å; I135-I139 PolarHBondContact O-N 3.33Å
136Q94.9Very high92.8Very high133 Ų13354.6 Ų54.662%0.62126%0.263SS*.Hα-helixtrans-65.8-37.1177.7-63.1-62-2700111.3N134 W138 R140N134-Q136 PolarHBondContact O-N 2.98Å; N134-Q136 WeakPolarHBondContact OD1-CB 3.31Å; N134-Q136 PolarHBondContact OD1-N 3.32Å; Q136-W138 VanDerWaalsContact C-N 3.33Å; Q136-R140 VanDerWaalsContact O-CB 3.29Å; Q136-R140 WeakPolarHBondContact O-CB 3.31Å; Q136-R140 PolarHBondContact O-N 2.88Å
137A93.9Very high92.6Very high15 Ų1555.3 Ų55.312%0.12427%0.269CS..Hα-helixtrans-66.7-36.9172.900000111.5L131 N134 I135 V141L131-A137 HydrophobicContact CB-CB 4.29Å; N134-A137 HydrophobicContact CB-CB 4.07Å; N134-A137 WeakPolarHBondContact O-CB 3.27Å; N134-A137 PolarHBondContact O-N 2.84Å; N134-A137 PolarHBondContact OD1-N 3.39Å; I135-A137 VanDerWaalsContact C-N 3.31Å; I135-A137 PolarHBondContact O-N 3.27Å; A137-V141 WeakPolarHBondContact O-CB 3.42Å; A137-V141 VanDerWaalsContact O-CG2 3.28Å; A137-V141 WeakPolarHBondContact O-CG2 3.3Å; A137-V141 PolarHBondContact O-N 3Å
138W95.4Very high92.3Very high36 Ų3659.4 Ų59.414%0.13629%0.289CS..Hα-helixtrans-68.2-49.9178.8-61.310.1000111Y86 T124 C127 L128 L131 G132 N134 I135 Q136 R140 V141 F142Y86-W138 HydrophobicContact CD2-CH2 4.04Å; Y86-W138 HydrophobicContact CD2-CZ2 4.33Å; T124-W138 HydrophobicContact CG2-CH2 3.75Å; T124-W138 HydrophobicContact CG2-CZ3 4.01Å; C127-W138 HydrophobicContact CB-CD2 4.38Å; C127-W138 HydrophobicContact CB-CZ2 4.19Å; L128-W138 HydrophobicContact CD2-CH2 3.81Å; L128-W138 HydrophobicContact CD2-CZ2 3.51Å; L128-W138 HydrophobicContact CG-CH2 3.9Å; L128-W138 HydrophobicContact CG-CZ2 3.71Å; L131-W138 HydrophobicContact CD1-CG 4.38Å; G132-W138 PolarHBondContact O-NE1 2.8Å; N134-W138 PolarHBondContact O-N 2.85Å; N134-W138 VanDerWaalsContact O-N 3.16Å; I135-W138 HydrophobicContact CD1-CB 4.41Å; I135-W138 HydrophobicContact CD1-CE3 4.01Å; I135-W138 WeakPolarHBondContact O-CB 3.44Å; I135-W138 PolarHBondContact O-N 3.19Å; I135-W138 VanDerWaalsContact O-N 3.11Å; Q136-W138 VanDerWaalsContact C-N 3.33Å; W138-R140 VanDerWaalsContact C-N 3.27Å; W138-R140 PolarHBondContact O-N 2.9Å; W138-V141 PolarHBondContact O-N 2.92Å; W138-V141 VanDerWaalsContact O-N 3.12Å; W138-F142 WeakPolarHBondContact O-CD2 3.33Å; W138-F142 PolarHBondContact O-N 3.34Å
139I95.6Very high92.1Very high89 Ų8959.9 Ų59.946%0.45629%0.294SS..Hα-helixtrans-54.6-47.7175.5-68.2167.2000109.7I135 F142 S143I135-I139 HydrophobicContact CG1-CD1 4.05Å; I135-I139 HydrophobicContact CG1-CG1 4.36Å; I135-I139 WeakPolarHBondContact O-CG1 3.5Å; I135-I139 PolarHBondContact O-N 3.33Å; I139-F142 PolarHBondContact O-N 3.46Å; I139-S143 WeakPolarHBondContact O-CB 3.37Å; I139-S143 PolarHBondContact O-N 2.96Å; I139-S143 PolarHBondContact O-OG 3.06Å
140R95.1Very high92Very high90 Ų9059.4 Ų59.434%0.3429%0.29SS..Hα-helixtrans-56.2-54.3175.4179.5-168.46384.6-2.8111.2Q136 W138 F142 S143 G146 D152Q136-R140 VanDerWaalsContact O-CB 3.29Å; Q136-R140 WeakPolarHBondContact O-CB 3.31Å; Q136-R140 PolarHBondContact O-N 2.88Å; W138-R140 VanDerWaalsContact C-N 3.27Å; W138-R140 PolarHBondContact O-N 2.9Å; R140-F142 VanDerWaalsContact C-N 3.29Å; R140-F142 PolarHBondContact O-N 3.39Å; R140-S143 WeakPolarHBondContact O-CB 3.39Å; R140-S143 PolarHBondContact O-N 3.48Å; R140-S143 VanDerWaalsContact O-N 3.11Å; R140-G146 PolarHBondContact NH1-O 2.95Å; R140-G146 CarbonylContact O-C 3.46Å; R140-G146 WeakPolarHBondContact O-CA 3.33Å; R140-D152 IonicContact CZ-OD2 3.32Å; R140-D152 VanDerWaalsContact CZ-OD2 3.32Å; R140-D152 IonicContact NH1-OD2 2.73Å; R140-D152 PolarHBondContact NH1-OD2 3.46Å; R140-D152 IonicContact NH2-OD1 3.67Å; R140-D152 IonicContact NH2-OD2 2.95Å; R140-D152 PolarHBondContact NH2-OD2 2.96Å
141V94.9Very high91.9Very high0 Ų060.2 Ų60.20%029%0.292CS..Hα-helixtrans-59.4-39.4-176.7168.30000111.7L131 A137 W138 D152 L155 Q156L131-V141 HydrophobicContact CD1-CB 4.13Å; L131-V141 HydrophobicContact CD1-CG1 4.5Å; L131-V141 HydrophobicContact CD1-CG2 3.77Å; L131-V141 HydrophobicContact CD2-CG2 4.04Å; A137-V141 WeakPolarHBondContact O-CB 3.42Å; A137-V141 VanDerWaalsContact O-CG2 3.28Å; A137-V141 WeakPolarHBondContact O-CG2 3.3Å; A137-V141 PolarHBondContact O-N 3Å; W138-V141 PolarHBondContact O-N 2.92Å; W138-V141 VanDerWaalsContact O-N 3.12Å; V141-D152 HydrophobicContact CG1-CB 4.09Å; V141-D152 HydrophobicContact CG2-CB 3.86Å; V141-D152 VanDerWaalsContact CG2-CG 3.44Å; V141-L155 HydrophobicContact CG1-CB 4.49Å; V141-Q156 HydrophobicContact CG1-CG 4.16Å; V141-Q156 PolarHBondContact O-NE2 3.09Å
142F95Very high92Very high94 Ų9459.8 Ų59.841%0.41229%0.29SS..Hα-helixtrans-91.17.2180-68.4-78.6000114.3W138 I139 R140 Q156 V159W138-F142 WeakPolarHBondContact O-CD2 3.33Å; W138-F142 PolarHBondContact O-N 3.34Å; I139-F142 PolarHBondContact O-N 3.46Å; R140-F142 VanDerWaalsContact C-N 3.29Å; R140-F142 PolarHBondContact O-N 3.39Å; F142-Q156 HydrophobicContact CD1-CG 4.34Å; F142-Q156 HydrophobicContact CE1-CG 4.37Å; F142-V159 HydrophobicContact CE1-CB 4.08Å; F142-V159 HydrophobicContact CE1-CG1 4.12Å; F142-V159 HydrophobicContact CE1-CG2 4.35Å; F142-V159 HydrophobicContact CZ-CB 4.22Å; F142-V159 HydrophobicContact CZ-CG1 4.36Å; F142-V159 HydrophobicContact CZ-CG2 3.98Å
143S93.7Very high92.1Very high52 Ų5259.7 Ų59.736%0.36429%0.288SS..SBendtrans-83.5158.6171.5-67.10000111.8I139 R140 H145 G146I139-S143 WeakPolarHBondContact O-CB 3.37Å; I139-S143 PolarHBondContact O-N 2.96Å; I139-S143 PolarHBondContact O-OG 3.06Å; R140-S143 WeakPolarHBondContact O-CB 3.39Å; R140-S143 PolarHBondContact O-N 3.48Å; R140-S143 VanDerWaalsContact O-N 3.11Å; S143-H145 PolarHBondContact O-N 3.32Å; S143-G146 PolarHBondContact O-N 3.44Å
144R87.8Confident92.1Very high224 Ų22458.7 Ų58.785%0.84528%0.281SS*.THydrogen-bonded Turntrans-56.2121.3176.2-164.2-172.6176.7175.7-1.5110.3G146R144-G146 PolarHBondContact O-N 3.3Å
145H85.2Confident92.2Very high157 Ų15755 Ų5573%0.72726%0.262SS*.THydrogen-bonded Turntrans57.919.7-175.6-44.2111.1000115.6S143S143-H145 PolarHBondContact O-N 3.32Å
146G87.3Confident92.4Very high10 Ų1053.9 Ų53.910%0.10325%0.254CS..  trans-87.1-3.6-17600000115.4R140 S143 R144 M148R140-G146 PolarHBondContact NH1-O 2.95Å; R140-G146 CarbonylContact O-C 3.46Å; R140-G146 WeakPolarHBondContact O-CA 3.33Å; S143-G146 PolarHBondContact O-N 3.44Å; R144-G146 PolarHBondContact O-N 3.3Å; G146-M148 PolarHBondContact O-N 2.77Å
147A89.9Confident92.5Very high17 Ų1748.6 Ų48.614%0.1423%0.23CC..  trans-73115.4173.200000110.5D152 T153A147-D152 HydrophobicContact CB-CB 3.74Å; A147-T153 WeakPolarHBondContact CB-OG1 3.29Å
148M88.2Confident92.7Very high93 Ų9348 Ų4846%0.45823%0.225SC..  trans-1110.1-173.9-60.4-65.6-70.700112.6G146 D152 Y216G146-M148 PolarHBondContact O-N 2.77Å; M148-D152 PolarHBondContact N-OD2 2.86Å; M148-Y216 WeakPolarHBondContact O-CD1 3.45Å
149S89.2Confident92.9Very high23 Ų2347.1 Ų47.116%0.16122%0.224CC..SBendtrans-142.2162.2179.379.70000111.9W151 D152 T153S149-W151 PolarHBondContact O-N 2.94Å; S149-W151 PolarHBondContact OG-N 3.15Å; S149-D152 PolarHBondContact N-OD2 3.31Å; S149-D152 WeakPolarHBondContact O-CB 3.33Å; S149-D152 PolarHBondContact O-N 2.86Å; S149-D152 VanDerWaalsContact O-N 3.15Å; S149-D152 PolarHBondContact OG-N 2.61Å; S149-D152 PolarHBondContact OG-OD1 3.45Å; S149-T153 PolarHBondContact O-N 3.35Å; S149-T153 VanDerWaalsContact O-N 3.16Å; S149-T153 PolarHBondContact O-OG1 2.93Å
150V90.1Very high93Very high2 Ų244.9 Ų44.91%0.01222%0.219CC..Hα-helixtrans-53.7-44172.3-1770000109.6W2 I6 M9 T153 C154 I207 Y216W2-V150 HydrophobicContact CD2-CG2 4.39Å; W2-V150 HydrophobicContact CE3-CG2 3.87Å; W2-V150 HydrophobicContact CH2-CG2 4.22Å; W2-V150 HydrophobicContact CZ3-CG2 3.79Å; I6-V150 HydrophobicContact CG1-CG1 4.42Å; M9-V150 HydrophobicContact CE-CB 4.23Å; M9-V150 HydrophobicContact CE-CG1 3.33Å; M9-V150 HydrophobicContact SD-CG1 4.18Å; V150-T153 PolarHBondContact O-N 3.4Å; V150-C154 WeakPolarHBondContact O-CB 3.42Å; V150-C154 PolarHBondContact O-N 3.29Å; V150-I207 HydrophobicContact CG1-CD1 3.92Å; V150-I207 HydrophobicContact CG1-CG2 3.89Å; V150-I207 WeakPolarHBondContact O-CD1 3.42Å; V150-Y216 VanDerWaalsContact CA-CE2 3.5Å; V150-Y216 HydrophobicContact CB-CD2 4.34Å; V150-Y216 HydrophobicContact CB-CE2 4.18Å; V150-Y216 HydrophobicContact CG2-CD2 3.54Å; V150-Y216 HydrophobicContact CG2-CE2 3.71Å; V150-Y216 VanDerWaalsContact N-CD2 3.31Å; V150-Y216 VanDerWaalsContact N-CE2 3.34Å
151W90.9Very high93.2Very high25 Ų2544.2 Ų44.210%0.09522%0.218CC..Hα-helixtrans-68.2-36.5178.8-67.3104.5000113.5M9 T12 F59 I64 V130 S149 T153 C154 L155M9-W151 HydrophobicContact CB-CH2 3.84Å; M9-W151 HydrophobicContact CB-CZ2 4.11Å; M9-W151 HydrophobicContact CB-CZ3 4.21Å; M9-W151 HydrophobicContact CE-CD2 3.82Å; M9-W151 HydrophobicContact CE-CE3 3.71Å; M9-W151 HydrophobicContact CE-CG 4.31Å; M9-W151 HydrophobicContact CE-CZ3 4.09Å; M9-W151 HydrophobicContact CG-CH2 4.21Å; M9-W151 HydrophobicContact CG-CZ3 4.08Å; T12-W151 HydrophobicContact CG2-CH2 4.38Å; F59-W151 HydrophobicContact CE1-CE3 4.13Å; F59-W151 HydrophobicContact CE1-CH2 4.29Å; F59-W151 AromaticContact CE1-CZ3 3.8Å; F59-W151 HydrophobicContact CE1-CZ3 3.8Å; F59-W151 HydrophobicContact CZ-CZ3 4.15Å; I64-W151 HydrophobicContact CD1-CH2 3.58Å; I64-W151 HydrophobicContact CD1-CZ2 3.39Å; I64-W151 HydrophobicContact CD1-CZ3 4.35Å; I64-W151 HydrophobicContact CG1-CZ2 4.08Å; I64-W151 HydrophobicContact CG2-CD2 4.13Å; I64-W151 HydrophobicContact CG2-CG 4.28Å; V130-W151 HydrophobicContact CG1-CB 3.94Å; S149-W151 PolarHBondContact O-N 2.94Å; S149-W151 PolarHBondContact OG-N 3.15Å; W151-T153 VanDerWaalsContact C-N 3.32Å; W151-T153 PolarHBondContact O-N 3.16Å; W151-C154 WeakPolarHBondContact O-CB 3.43Å; W151-C154 PolarHBondContact O-N 3.47Å; W151-L155 WeakPolarHBondContact O-CG 3.1Å; W151-L155 PolarHBondContact O-N 3.32Å
152D93.2Very high93.4Very high7 Ų744.2 Ų44.24%0.03722%0.218CC..Hα-helixtrans-61.1-44.3175.6-66.82.8000110.6R140 V141 A147 M148 S149 L155 Q156R140-D152 IonicContact CZ-OD2 3.32Å; R140-D152 VanDerWaalsContact CZ-OD2 3.32Å; R140-D152 IonicContact NH1-OD2 2.73Å; R140-D152 PolarHBondContact NH1-OD2 3.46Å; R140-D152 IonicContact NH2-OD1 3.67Å; R140-D152 IonicContact NH2-OD2 2.95Å; R140-D152 PolarHBondContact NH2-OD2 2.96Å; V141-D152 HydrophobicContact CG1-CB 4.09Å; V141-D152 HydrophobicContact CG2-CB 3.86Å; V141-D152 VanDerWaalsContact CG2-CG 3.44Å; A147-D152 HydrophobicContact CB-CB 3.74Å; M148-D152 PolarHBondContact N-OD2 2.86Å; S149-D152 PolarHBondContact N-OD2 3.31Å; S149-D152 WeakPolarHBondContact O-CB 3.33Å; S149-D152 PolarHBondContact O-N 2.86Å; S149-D152 VanDerWaalsContact O-N 3.15Å; S149-D152 PolarHBondContact OG-N 2.61Å; S149-D152 PolarHBondContact OG-OD1 3.45Å; D152-L155 WeakPolarHBondContact O-CB 3.38Å; D152-L155 PolarHBondContact O-N 3.17Å; D152-Q156 PolarHBondContact O-N 2.98Å; D152-Q156 VanDerWaalsContact O-N 3.1Å
153T93.5Very high93.5Very high8 Ų842.8 Ų42.85%0.04922%0.215CC..Hα-helixtrans-71.1-37179.7-60.20000111.6A147 S149 V150 W151 L155 Q156 I157 W206 I207 Y216A147-T153 WeakPolarHBondContact CB-OG1 3.29Å; S149-T153 PolarHBondContact O-N 3.35Å; S149-T153 VanDerWaalsContact O-N 3.16Å; S149-T153 PolarHBondContact O-OG1 2.93Å; V150-T153 PolarHBondContact O-N 3.4Å; W151-T153 VanDerWaalsContact C-N 3.32Å; W151-T153 PolarHBondContact O-N 3.16Å; T153-L155 VanDerWaalsContact C-N 3.32Å; T153-L155 PolarHBondContact O-N 3.46Å; T153-Q156 PolarHBondContact O-N 3.15Å; T153-I157 HydrophobicContact CG2-CD1 3.95Å; T153-I157 HydrophobicContact CG2-CG1 4.48Å; T153-I157 WeakPolarHBondContact O-CG1 3.37Å; T153-I157 PolarHBondContact O-N 3.33Å; T153-W206 HydrophobicContact CG2-CE3 4.03Å; T153-W206 HydrophobicContact CG2-CH2 4.48Å; T153-W206 HydrophobicContact CG2-CZ3 3.61Å; T153-I207 HydrophobicContact CG2-CD1 4.15Å; T153-I207 HydrophobicContact CG2-CG1 4Å; T153-Y216 WeakPolarHBondContact CB-OH 3.47Å; T153-Y216 PolarHBondContact OG1-OH 3.35Å
154C94.6Very high93.8Very high0 Ų044.9 Ų44.90%022%0.221CC..Hα-helixtrans-58.1-43.1170.5164.80000112.3M9 H13 V150 W151 I157 T158 A203 I207M9-C154 HydrophobicContact CE-CB 3.4Å; M9-C154 VanDerWaalsContact CE-CB 3.4Å; M9-C154 HydrophobicContact SD-CB 3.74Å; H13-C154 PolarHBondContact CE1-SG 3.11Å; H13-C154 PolarHBondContact NE2-SG 3Å; V150-C154 WeakPolarHBondContact O-CB 3.42Å; V150-C154 PolarHBondContact O-N 3.29Å; W151-C154 WeakPolarHBondContact O-CB 3.43Å; W151-C154 PolarHBondContact O-N 3.47Å; C154-I157 PolarHBondContact O-N 2.69Å; C154-T158 VanDerWaalsContact O-CB 3.31Å; C154-T158 WeakPolarHBondContact O-CB 3.38Å; C154-T158 PolarHBondContact O-N 2.92Å; C154-T158 PolarHBondContact O-OG1 3.14Å; C154-A203 HydrophobicContact CB-CB 4.23Å; C154-I207 HydrophobicContact CB-CD1 4.3Å
155L95.8Very high94.3Very high1 Ų134.7 Ų34.71%0.00519%0.185CC..Hα-helixtrans-60.8-48.1175.5-71173000111.1R126 V130 L131 V141 W151 D152 T153 I157 T158 V159R126-L155 HydrophobicContact CB-CD2 3.63Å; V130-L155 HydrophobicContact CB-CD1 4.01Å; V130-L155 HydrophobicContact CG1-CD1 3.94Å; V130-L155 HydrophobicContact CG2-CD2 4.25Å; L131-L155 HydrophobicContact CD1-CD1 3.77Å; L131-L155 HydrophobicContact CD2-CD1 4.29Å; L131-L155 HydrophobicContact CG-CD1 3.83Å; V141-L155 HydrophobicContact CG1-CB 4.49Å; W151-L155 WeakPolarHBondContact O-CG 3.1Å; W151-L155 PolarHBondContact O-N 3.32Å; D152-L155 WeakPolarHBondContact O-CB 3.38Å; D152-L155 PolarHBondContact O-N 3.17Å; T153-L155 VanDerWaalsContact C-N 3.32Å; T153-L155 PolarHBondContact O-N 3.46Å; L155-I157 PolarHBondContact O-N 2.89Å; L155-T158 PolarHBondContact O-N 3.3Å; L155-V159 VanDerWaalsContact O-CB 3.32Å; L155-V159 WeakPolarHBondContact O-CB 3.4Å; L155-V159 VanDerWaalsContact O-CG2 3.25Å; L155-V159 WeakPolarHBondContact O-CG2 3.46Å; L155-V159 PolarHBondContact O-N 3.49Å
156Q96.8Very high94.9Very high55 Ų5527.7 Ų27.726%0.25716%0.155SC..Hα-helixtrans-55.9-51.9177.8-71.1-179.2-31.200112V141 F142 D152 T153 A160V141-Q156 HydrophobicContact CG1-CG 4.16Å; V141-Q156 PolarHBondContact O-NE2 3.09Å; F142-Q156 HydrophobicContact CD1-CG 4.34Å; F142-Q156 HydrophobicContact CE1-CG 4.37Å; D152-Q156 PolarHBondContact O-N 2.98Å; D152-Q156 VanDerWaalsContact O-N 3.1Å; T153-Q156 PolarHBondContact O-N 3.15Å; Q156-A160 VanDerWaalsContact O-CB 3.22Å; Q156-A160 WeakPolarHBondContact O-CB 3.18Å; Q156-A160 PolarHBondContact O-N 2.84Å
157I97.3Very high95.4Very high22 Ų2233.4 Ų33.411%0.11317%0.174CC..Hα-helixtrans-62.1-49.9-178.9-67170.8000110.2T153 C154 L155 V159 A160 F161 V202 A203 W206T153-I157 HydrophobicContact CG2-CD1 3.95Å; T153-I157 HydrophobicContact CG2-CG1 4.48Å; T153-I157 WeakPolarHBondContact O-CG1 3.37Å; T153-I157 PolarHBondContact O-N 3.33Å; C154-I157 PolarHBondContact O-N 2.69Å; L155-I157 PolarHBondContact O-N 2.89Å; I157-V159 PolarHBondContact O-N 3.46Å; I157-A160 PolarHBondContact O-N 3.11Å; I157-F161 HydrophobicContact CG2-CD2 3.79Å; I157-F161 HydrophobicContact CG2-CE2 3.91Å; I157-F161 VanDerWaalsContact O-CD2 3.3Å; I157-F161 WeakPolarHBondContact O-CD2 3.46Å; I157-F161 PolarHBondContact O-N 3.12Å; I157-V202 HydrophobicContact CG2-CB 4.42Å; I157-V202 HydrophobicContact CG2-CG1 4.1Å; I157-A203 HydrophobicContact CB-CB 4.1Å; I157-A203 HydrophobicContact CD1-CB 4.3Å; I157-A203 HydrophobicContact CG2-CB 3.93Å; I157-W206 HydrophobicContact CD1-CB 4.17Å; I157-W206 HydrophobicContact CD1-CD2 4.03Å; I157-W206 HydrophobicContact CD1-CE3 3.84Å; I157-W206 HydrophobicContact CD1-CG 4.18Å
158T97.8Very high95.7Very high2 Ų236.7 Ų36.71%0.01219%0.188CC..Hα-helixtrans-64.1-43.2-175.9-50.60000111.6C154 L155 T162 Y196 L200C154-T158 VanDerWaalsContact O-CB 3.31Å; C154-T158 WeakPolarHBondContact O-CB 3.38Å; C154-T158 PolarHBondContact O-N 2.92Å; C154-T158 PolarHBondContact O-OG1 3.14Å; L155-T158 PolarHBondContact O-N 3.3Å; T158-T162 WeakPolarHBondContact O-CB 3.35Å; T158-T162 PolarHBondContact O-N 3.4Å; T158-T162 PolarHBondContact O-OG1 3.34Å; T158-Y196 HydrophobicContact CG2-CD2 3.52Å; T158-Y196 HydrophobicContact CG2-CE2 3.47Å; T158-Y196 VanDerWaalsContact CG2-CE2 3.47Å; T158-L200 HydrophobicContact CG2-CD2 4.14Å
159V98.3Very high96.1Very high18 Ų1832.5 Ų32.511%0.10917%0.169CC..Hα-helixtrans-64.8-46.3176.9171.50000110.7T123 F142 L155 I157 F161 T162 L163T123-V159 HydrophobicContact CG2-CB 4.38Å; T123-V159 HydrophobicContact CG2-CG1 4.11Å; T123-V159 HydrophobicContact CG2-CG2 4.15Å; F142-V159 HydrophobicContact CE1-CB 4.08Å; F142-V159 HydrophobicContact CE1-CG1 4.12Å; F142-V159 HydrophobicContact CE1-CG2 4.35Å; F142-V159 HydrophobicContact CZ-CB 4.22Å; F142-V159 HydrophobicContact CZ-CG1 4.36Å; F142-V159 HydrophobicContact CZ-CG2 3.98Å; L155-V159 VanDerWaalsContact O-CB 3.32Å; L155-V159 WeakPolarHBondContact O-CB 3.4Å; L155-V159 VanDerWaalsContact O-CG2 3.25Å; L155-V159 WeakPolarHBondContact O-CG2 3.46Å; L155-V159 PolarHBondContact O-N 3.49Å; I157-V159 PolarHBondContact O-N 3.46Å; V159-F161 PolarHBondContact O-N 3.31Å; V159-T162 PolarHBondContact O-N 2.94Å; V159-L163 HydrophobicContact CG1-CD1 3.89Å; V159-L163 HydrophobicContact CG1-CG 4.28Å; V159-L163 WeakPolarHBondContact O-CG 3.22Å; V159-L163 PolarHBondContact O-N 3.02Å
160A98.4Very high96.4Very high43 Ų4333.1 Ų33.136%0.35518%0.175SC..Hα-helixtrans-58.7-50.4179.400000111.8Q156 I157 T162 L163 I164Q156-A160 VanDerWaalsContact O-CB 3.22Å; Q156-A160 WeakPolarHBondContact O-CB 3.18Å; Q156-A160 PolarHBondContact O-N 2.84Å; I157-A160 PolarHBondContact O-N 3.11Å; A160-T162 VanDerWaalsContact C-N 3.32Å; A160-T162 PolarHBondContact O-N 2.98Å; A160-L163 PolarHBondContact O-N 2.92Å; A160-I164 WeakPolarHBondContact O-CB 3.45Å; A160-I164 VanDerWaalsContact O-CG1 3.23Å; A160-I164 WeakPolarHBondContact O-CG1 3.35Å; A160-I164 PolarHBondContact O-N 2.63Å
161F98.8Very high96.6Very high75 Ų7537.9 Ų37.933%0.32920%0.196SC..Hα-helixtrans-63-37.4178.8-87.7-99000112.6I157 V159 G165 G195 T198 V202I157-F161 HydrophobicContact CG2-CD2 3.79Å; I157-F161 HydrophobicContact CG2-CE2 3.91Å; I157-F161 VanDerWaalsContact O-CD2 3.3Å; I157-F161 WeakPolarHBondContact O-CD2 3.46Å; I157-F161 PolarHBondContact O-N 3.12Å; V159-F161 PolarHBondContact O-N 3.31Å; F161-G165 PolarHBondContact O-N 2.97Å; F161-G195 VanDerWaalsContact CB-O 3.29Å; F161-G195 WeakPolarHBondContact CB-O 3.39Å; F161-G195 VanDerWaalsContact O-CA 3.24Å; F161-G195 WeakPolarHBondContact O-CA 3.42Å; F161-T198 HydrophobicContact CD1-CG2 3.67Å; F161-T198 HydrophobicContact CE1-CG2 3.63Å; F161-V202 HydrophobicContact CE1-CG2 4.3Å; F161-V202 HydrophobicContact CE2-CB 4.42Å; F161-V202 HydrophobicContact CE2-CG1 3.93Å; F161-V202 HydrophobicContact CZ-CB 4.27Å; F161-V202 HydrophobicContact CZ-CG1 3.9Å; F161-V202 HydrophobicContact CZ-CG2 4.13Å
162T98.8Very high96.7Very high0 Ų038 Ų380%020%0.2CC..Hα-helixtrans-62.7-48.6176.3-55.10000111.5L119 L122 T123 T158 V159 A160 G165 A166 A192 Y196L119-T162 HydrophobicContact CD2-CG2 4.33Å; L122-T162 HydrophobicContact CB-CG2 3.78Å; L122-T162 HydrophobicContact CD1-CG2 3.86Å; T123-T162 HydrophobicContact CG2-CG2 3.79Å; T158-T162 WeakPolarHBondContact O-CB 3.35Å; T158-T162 PolarHBondContact O-N 3.4Å; T158-T162 PolarHBondContact O-OG1 3.34Å; V159-T162 PolarHBondContact O-N 2.94Å; A160-T162 VanDerWaalsContact C-N 3.32Å; A160-T162 PolarHBondContact O-N 2.98Å; T162-G165 PolarHBondContact O-N 2.87Å; T162-A166 WeakPolarHBondContact O-CB 3.32Å; T162-A166 PolarHBondContact O-N 3.38Å; T162-A192 HydrophobicContact CG2-CB 4.32Å; T162-Y196 WeakPolarHBondContact OG1-CA 3.48Å; T162-Y196 WeakPolarHBondContact OG1-CB 3.4Å; T162-Y196 WeakPolarHBondContact OG1-CD2 3.28Å
163L98.5Very high96.7Very high65 Ų6540.3 Ų40.334%0.3421%0.212SC..Hα-helixtrans-70-41.3-178-63.2-178.3000112.1F94 L119 T123 V159 A160 G165 A166 W167F94-L163 HydrophobicContact CE1-CD2 3.55Å; F94-L163 HydrophobicContact CZ-CD2 3.91Å; L119-L163 HydrophobicContact CD2-CD2 4.4Å; T123-L163 HydrophobicContact CG2-CD2 4.28Å; V159-L163 HydrophobicContact CG1-CD1 3.89Å; V159-L163 HydrophobicContact CG1-CG 4.28Å; V159-L163 WeakPolarHBondContact O-CG 3.22Å; V159-L163 PolarHBondContact O-N 3.02Å; A160-L163 PolarHBondContact O-N 2.92Å; L163-G165 VanDerWaalsContact C-N 3.33Å; L163-A166 PolarHBondContact O-N 2.75Å; L163-W167 WeakPolarHBondContact O-CB 3.45Å; L163-W167 PolarHBondContact O-N 3.39Å
164I98.6Very high96.6Very high95 Ų9545.1 Ų45.149%0.48724%0.243SC..Hα-helixtrans-61.4-44.9173.5-68.9166.9000109.7A160 A166 W167 L168A160-I164 WeakPolarHBondContact O-CB 3.45Å; A160-I164 VanDerWaalsContact O-CG1 3.23Å; A160-I164 WeakPolarHBondContact O-CG1 3.35Å; A160-I164 PolarHBondContact O-N 2.63Å; I164-A166 PolarHBondContact O-N 2.86Å; I164-W167 PolarHBondContact O-N 3.31Å; I164-L168 HydrophobicContact CG2-CD1 3.87Å; I164-L168 HydrophobicContact CG2-CG 4.17Å; I164-L168 WeakPolarHBondContact O-CB 3.48Å; I164-L168 VanDerWaalsContact O-CG 3.28Å; I164-L168 WeakPolarHBondContact O-CG 3.34Å; I164-L168 PolarHBondContact O-N 3.24Å
165G98.6Very high96.4Very high10 Ų1049.7 Ų49.710%0.10327%0.267CS..Hα-helixtrans-59.5-46.1176.900000112.4F161 T162 L163 W167 L168 G169 G191F161-G165 PolarHBondContact O-N 2.97Å; T162-G165 PolarHBondContact O-N 2.87Å; L163-G165 VanDerWaalsContact C-N 3.33Å; G165-W167 VanDerWaalsContact C-N 3.34Å; G165-W167 PolarHBondContact O-N 2.86Å; G165-L168 PolarHBondContact O-N 3.1Å; G165-G169 PolarHBondContact O-N 3.31Å; G165-G191 CarbonylContact C-O 3.6Å; G165-G191 VanDerWaalsContact C-O 3.31Å; G165-G191 VanDerWaalsContact CA-O 3.25Å; G165-G191 WeakPolarHBondContact CA-O 3.11Å; G165-G191 CarbonylContact O-C 3.31Å; G165-G191 VanDerWaalsContact O-C 3.31Å; G165-G191 WeakPolarHBondContact O-CA 3.33Å
166A98.3Very high95.8Very high11 Ų1155 Ų559%0.09130%0.296CS..Hα-helixtrans-60.1-44.5176.500000112.1L119 T162 L163 I164 G169 A170 A192L119-A166 HydrophobicContact CD2-CB 3.77Å; T162-A166 WeakPolarHBondContact O-CB 3.32Å; T162-A166 PolarHBondContact O-N 3.38Å; L163-A166 PolarHBondContact O-N 2.75Å; I164-A166 PolarHBondContact O-N 2.86Å; A166-G169 PolarHBondContact O-N 3.04Å; A166-A170 PolarHBondContact O-N 3.32Å; A166-A192 HydrophobicContact CB-CB 3.8Å
167W97.3Very high95.5Very high130 Ų13059.3 Ų59.349%0.49231%0.31SS..Hα-helixtrans-65.4-44.9178.3177.872.7000112.4L163 I164 G165 G169 A170 F171L163-W167 WeakPolarHBondContact O-CB 3.45Å; L163-W167 PolarHBondContact O-N 3.39Å; I164-W167 PolarHBondContact O-N 3.31Å; G165-W167 VanDerWaalsContact C-N 3.34Å; G165-W167 PolarHBondContact O-N 2.86Å; W167-G169 PolarHBondContact O-N 2.97Å; W167-A170 VanDerWaalsContact O-CB 3.27Å; W167-A170 WeakPolarHBondContact O-CB 3.37Å; W167-A170 PolarHBondContact O-N 2.87Å; W167-F171 HydrophobicContact CD2-CZ 4.39Å; W167-F171 HydrophobicContact CE3-CZ 4.19Å; W167-F171 HydrophobicContact CH2-CE1 4.18Å; W167-F171 HydrophobicContact CH2-CE2 4.25Å; W167-F171 AromaticContact CH2-CZ 3.41Å; W167-F171 HydrophobicContact CH2-CZ 3.41Å; W167-F171 VanDerWaalsContact CH2-CZ 3.41Å; W167-F171 AromaticContact CZ2-CE1 3.88Å; W167-F171 HydrophobicContact CZ2-CE1 3.88Å; W167-F171 AromaticContact CZ2-CZ 3.59Å; W167-F171 HydrophobicContact CZ2-CZ 3.59Å; W167-F171 HydrophobicContact CZ3-CE2 4.2Å; W167-F171 AromaticContact CZ3-CZ 3.72Å; W167-F171 HydrophobicContact CZ3-CZ 3.72Å
168L97.5Very high95.1Very high85 Ų8564.9 Ų64.945%0.44534%0.34SS..Hα-helixtrans-62-33.4173.5-70177.4000111.8I164 G165 A170 F171 P172I164-L168 HydrophobicContact CG2-CD1 3.87Å; I164-L168 HydrophobicContact CG2-CG 4.17Å; I164-L168 WeakPolarHBondContact O-CB 3.48Å; I164-L168 VanDerWaalsContact O-CG 3.28Å; I164-L168 WeakPolarHBondContact O-CG 3.34Å; I164-L168 PolarHBondContact O-N 3.24Å; G165-L168 PolarHBondContact O-N 3.1Å; L168-A170 PolarHBondContact O-N 3.4Å; L168-F171 HydrophobicContact CD2-CD2 3.9Å; L168-F171 HydrophobicContact CD2-CE2 3.51Å; L168-F171 HydrophobicContact CD2-CZ 4.3Å; L168-F171 WeakPolarHBondContact O-CB 3.44Å; L168-F171 PolarHBondContact O-N 3.35Å; L168-F171 VanDerWaalsContact O-N 3.1Å; L168-P172 WeakPolarHBondContact O-CD 3.47Å
169G96.9Very high95Very high6 Ų671.9 Ų71.96%0.06237%0.366CS..THydrogen-bonded Turntrans-63.5-14.4173.500000113.9G165 A166 W167 P172 S187G165-G169 PolarHBondContact O-N 3.31Å; A166-G169 PolarHBondContact O-N 3.04Å; W167-G169 PolarHBondContact O-N 2.97Å; G169-P172 WeakPolarHBondContact O-CD 3.29Å; G169-S187 CarbonylContact O-C 3.53Å; G169-S187 WeakPolarHBondContact O-CB 3.32Å; G169-S187 PolarHBondContact O-OG 3.45Å
170A95.1Very high94.8Very high35 Ų3574.4 Ų74.429%0.28938%0.383SS..THydrogen-bonded Turntrans-79.4-2517300000112.8A166 W167 L168 I173 P174A166-A170 PolarHBondContact O-N 3.32Å; W167-A170 VanDerWaalsContact O-CB 3.27Å; W167-A170 WeakPolarHBondContact O-CB 3.37Å; W167-A170 PolarHBondContact O-N 2.87Å; L168-A170 PolarHBondContact O-N 3.4Å; A170-I173 HydrophobicContact CB-CD1 4.47Å; A170-I173 WeakPolarHBondContact O-CB 3.45Å; A170-I173 WeakPolarHBondContact O-CG1 3.37Å; A170-I173 PolarHBondContact O-N 2.85Å; A170-P174 WeakPolarHBondContact O-CD 3.21Å
171F94Very high94.6Very high103 Ų10375.8 Ų75.845%0.45238%0.379SS..THydrogen-bonded Turntrans-63-35.8-176-67-13.9000115.3W167 L168 I173 P174W167-F171 HydrophobicContact CD2-CZ 4.39Å; W167-F171 HydrophobicContact CE3-CZ 4.19Å; W167-F171 HydrophobicContact CH2-CE1 4.18Å; W167-F171 HydrophobicContact CH2-CE2 4.25Å; W167-F171 AromaticContact CH2-CZ 3.41Å; W167-F171 HydrophobicContact CH2-CZ 3.41Å; W167-F171 VanDerWaalsContact CH2-CZ 3.41Å; W167-F171 AromaticContact CZ2-CE1 3.88Å; W167-F171 HydrophobicContact CZ2-CE1 3.88Å; W167-F171 AromaticContact CZ2-CZ 3.59Å; W167-F171 HydrophobicContact CZ2-CZ 3.59Å; W167-F171 HydrophobicContact CZ3-CE2 4.2Å; W167-F171 AromaticContact CZ3-CZ 3.72Å; W167-F171 HydrophobicContact CZ3-CZ 3.72Å; L168-F171 HydrophobicContact CD2-CD2 3.9Å; L168-F171 HydrophobicContact CD2-CE2 3.51Å; L168-F171 HydrophobicContact CD2-CZ 4.3Å; L168-F171 WeakPolarHBondContact O-CB 3.44Å; L168-F171 PolarHBondContact O-N 3.35Å; L168-F171 VanDerWaalsContact O-N 3.1Å; F171-I173 PolarHBondContact O-N 2.8Å; F171-P174 VanDerWaalsContact O-CD 3.22Å; F171-P174 WeakPolarHBondContact O-CD 3.37Å; F171-P174 WeakPolarHBondContact O-CG 3.35Å
172P93.3Very high94.4Very high26 Ų2672.7 Ų72.717%0.16937%0.366CS..THydrogen-bonded Turntrans-69.8-16.9177.1-23.135.5000114.7L168 G169 L175 W181 Q182L168-P172 WeakPolarHBondContact O-CD 3.47Å; G169-P172 WeakPolarHBondContact O-CD 3.29Å; P172-L175 PolarHBondContact O-N 2.91Å; P172-W181 HydrophobicContact CB-CH2 3.96Å; P172-W181 HydrophobicContact CB-CZ3 3.52Å; P172-W181 HydrophobicContact CG-CZ3 4.07Å; P172-Q182 HydrophobicContact CB-CG 4.2Å; P172-Q182 PolarHBondContact O-NE2 3.44Å
173I92.8Very high94.1Very high56 Ų5676.6 Ų76.629%0.28739%0.389SS..SBendtrans-61.2-54.1-177.9-56.5175000111.3A170 F171 L175 D176 W184A170-I173 HydrophobicContact CB-CD1 4.47Å; A170-I173 WeakPolarHBondContact O-CB 3.45Å; A170-I173 WeakPolarHBondContact O-CG1 3.37Å; A170-I173 PolarHBondContact O-N 2.85Å; F171-I173 PolarHBondContact O-N 2.8Å; I173-L175 PolarHBondContact O-N 2.85Å; I173-D176 PolarHBondContact O-N 3.33Å; I173-W184 HydrophobicContact CD1-CE3 3.85Å; I173-W184 HydrophobicContact CD1-CZ3 4.22Å
174P91.8Very high94Very high109 Ų10975.5 Ų75.571%0.70838%0.38SS*.THydrogen-bonded Turntrans-71.2-10.5178.929-39000114.7A170 F171A170-P174 WeakPolarHBondContact O-CD 3.21Å; F171-P174 VanDerWaalsContact O-CD 3.22Å; F171-P174 WeakPolarHBondContact O-CD 3.37Å; F171-P174 WeakPolarHBondContact O-CG 3.35Å
175L90.5Very high93.9Very high97 Ų9771 Ų7151%0.50836%0.357SS..THydrogen-bonded Turntrans-76.4-16175.8-63.9178.7000112.5P172 I173 W177P172-L175 PolarHBondContact O-N 2.91Å; I173-L175 PolarHBondContact O-N 2.85Å; L175-W177 HydrophobicContact CB-CD2 4.49Å; L175-W177 HydrophobicContact CB-CZ2 4.43Å; L175-W177 HydrophobicContact CD1-CH2 4.13Å; L175-W177 HydrophobicContact CD1-CZ2 3.68Å; L175-W177 VanDerWaalsContact O-CD1 3.28Å; L175-W177 PolarHBondContact O-N 3.43Å
176D82Confident93.8Very high113 Ų11370.6 Ų70.660%0.60435%0.353SS*.  trans41.362171.4-156.620.2000113.5I173 D178I173-D176 PolarHBondContact O-N 3.33Å; D176-D178 PolarHBondContact O-N 2.98Å
177W90.8Very high93.7Very high145 Ų14570.5 Ų70.555%0.54935%0.351SS..  trans-82.813.3177.1-60.7-28.4000111.9L175 R179 W181 Q182L175-W177 HydrophobicContact CB-CD2 4.49Å; L175-W177 HydrophobicContact CB-CZ2 4.43Å; L175-W177 HydrophobicContact CD1-CH2 4.13Å; L175-W177 HydrophobicContact CD1-CZ2 3.68Å; L175-W177 VanDerWaalsContact O-CD1 3.28Å; L175-W177 PolarHBondContact O-N 3.43Å; W177-R179 HydrophobicContact CB-CG 4.04Å; W177-R179 WeakPolarHBondContact O-CD 3.46Å; W177-R179 VanDerWaalsContact O-CG 3.29Å; W177-R179 WeakPolarHBondContact O-CG 3.29Å; W177-R179 PolarHBondContact O-N 2.69Å; W177-R179 PolarHBondContact O-NE 2.95Å; W177-W181 AromaticContact CE3-CH2 3.36Å; W177-W181 HydrophobicContact CE3-CH2 3.36Å; W177-W181 AromaticContact CE3-CZ2 3.46Å; W177-W181 HydrophobicContact CE3-CZ2 3.46Å; W177-W181 VanDerWaalsContact CE3-CZ2 3.46Å; W177-W181 AromaticContact CZ3-CH2 3.45Å; W177-W181 HydrophobicContact CZ3-CH2 3.45Å; W177-W181 VanDerWaalsContact CZ3-CH2 3.45Å; W177-W181 AromaticContact CZ3-CZ2 3.8Å; W177-W181 HydrophobicContact CZ3-CZ2 3.8Å; W177-Q182 VanDerWaalsContact CA-OE1 3.24Å; W177-Q182 VanDerWaalsContact CB-OE1 3.27Å; W177-Q182 VanDerWaalsContact N-NE2 3.19Å
178D90.1Very high93.8Very high139 Ų13964.6 Ų64.674%0.74333%0.33SS*.  trans50.636.2-175.9-69.8-53.7000113.2D176D176-D178 PolarHBondContact O-N 2.98Å
179R94.8Very high93.8Very high148 Ų14860.5 Ų60.556%0.55831%0.309SS*.  trans-102.9141.1-178.5-57.9-48.5-178.5173.5-1.9112.5W177 W181 Q182W177-R179 HydrophobicContact CB-CG 4.04Å; W177-R179 WeakPolarHBondContact O-CD 3.46Å; W177-R179 VanDerWaalsContact O-CG 3.29Å; W177-R179 WeakPolarHBondContact O-CG 3.29Å; W177-R179 PolarHBondContact O-N 2.69Å; W177-R179 PolarHBondContact O-NE 2.95Å; R179-W181 HydrophobicContact CB-CD2 4.17Å; R179-W181 HydrophobicContact CB-CG 4.14Å; R179-W181 HydrophobicContact CB-CZ2 4.17Å; R179-W181 HydrophobicContact CG-CZ2 4.22Å; R179-W181 PolarHBondContact O-N 3.39Å; R179-Q182 HydrophobicContact CB-CG 4.44Å; R179-Q182 VanDerWaalsContact N-OE1 3.14Å; R179-Q182 WeakPolarHBondContact O-CB 3.35Å; R179-Q182 PolarHBondContact O-N 2.95Å
180P94.1Very high93.8Very high72 Ų7262.2 Ų62.247%0.46832%0.316SS..THydrogen-bonded Turntrans-63-21.2-178.226.2-36.1000113.5Y37 Q182Y37-P180 HydrophobicContact CD2-CB 4.28Å; Y37-P180 HydrophobicContact CD2-CG 4.04Å; Y37-P180 HydrophobicContact CG-CB 4.4Å; P180-Q182 VanDerWaalsContact C-N 3.35Å
181W93.9Very high94Very high72 Ų7261.2 Ų61.227%0.27331%0.309SS..THydrogen-bonded Turntrans-79.5-14.4175.960.5-102.6000113.4Y37 P172 W177 R179 S187 L190Y37-W181 HydrophobicContact CD1-CB 4.16Å; Y37-W181 HydrophobicContact CE1-CB 3.84Å; Y37-W181 HydrophobicContact CE2-CB 4.37Å; P172-W181 HydrophobicContact CB-CH2 3.96Å; P172-W181 HydrophobicContact CB-CZ3 3.52Å; P172-W181 HydrophobicContact CG-CZ3 4.07Å; W177-W181 AromaticContact CE3-CH2 3.36Å; W177-W181 HydrophobicContact CE3-CH2 3.36Å; W177-W181 AromaticContact CE3-CZ2 3.46Å; W177-W181 HydrophobicContact CE3-CZ2 3.46Å; W177-W181 VanDerWaalsContact CE3-CZ2 3.46Å; W177-W181 AromaticContact CZ3-CH2 3.45Å; W177-W181 HydrophobicContact CZ3-CH2 3.45Å; W177-W181 VanDerWaalsContact CZ3-CH2 3.45Å; W177-W181 AromaticContact CZ3-CZ2 3.8Å; W177-W181 HydrophobicContact CZ3-CZ2 3.8Å; R179-W181 HydrophobicContact CB-CD2 4.17Å; R179-W181 HydrophobicContact CB-CG 4.14Å; R179-W181 HydrophobicContact CB-CZ2 4.17Å; R179-W181 HydrophobicContact CG-CZ2 4.22Å; R179-W181 PolarHBondContact O-N 3.39Å; W181-S187 VanDerWaalsContact O-CA 3.3Å; W181-S187 WeakPolarHBondContact O-CA 3.26Å; W181-S187 VanDerWaalsContact O-CB 3.26Å; W181-S187 WeakPolarHBondContact O-CB 3.33Å; W181-S187 PolarHBondContact O-N 3.22Å; W181-S187 VanDerWaalsContact O-N 3.15Å; W181-L190 HydrophobicContact CB-CD1 4.31Å
182Q95.2Very high94.2Very high10 Ų1056.3 Ų56.35%0.04729%0.287CS..THydrogen-bonded Turntrans-83-19.8174.9-72.2172.2-52.700113P172 W177 R179 P180P172-Q182 HydrophobicContact CB-CG 4.2Å; P172-Q182 PolarHBondContact O-NE2 3.44Å; W177-Q182 VanDerWaalsContact CA-OE1 3.24Å; W177-Q182 VanDerWaalsContact CB-OE1 3.27Å; W177-Q182 VanDerWaalsContact N-NE2 3.19Å; R179-Q182 HydrophobicContact CB-CG 4.44Å; R179-Q182 VanDerWaalsContact N-OE1 3.14Å; R179-Q182 WeakPolarHBondContact O-CB 3.35Å; R179-Q182 PolarHBondContact O-N 2.95Å; P180-Q182 VanDerWaalsContact C-N 3.35Å
183V93.3Very high94.4Very high81 Ų8155.5 Ų55.549%0.49128%0.282SS..SBendtrans-59.1139.2-176.21790000110.8V186V183-V186 WeakPolarHBondContact O-CA 3.46Å; V183-V186 WeakPolarHBondContact O-CB 3.11Å; V183-V186 WeakPolarHBondContact O-CG2 3.37Å; V183-V186 PolarHBondContact O-N 2.99Å
184W94.8Very high94.7Very high43 Ų4358.1 Ų58.116%0.16330%0.295CS..THydrogen-bonded Turntrans-63.8132.8175.1-178.3-102.1000111.1V98 A103 T112 L115 I173 C188V98-W184 HydrophobicContact CG1-CH2 3.38Å; V98-W184 HydrophobicContact CG1-CZ2 3.49Å; V98-W184 VanDerWaalsContact CG1-CZ2 3.49Å; A103-W184 HydrophobicContact CB-CH2 3.67Å; A103-W184 HydrophobicContact CB-CZ2 3.36Å; A103-W184 HydrophobicContact CB-CZ3 4.44Å; T112-W184 HydrophobicContact CG2-CZ2 4.28Å; T112-W184 PolarHBondContact OG1-NE1 3.39Å; L115-W184 HydrophobicContact CD2-CH2 3.54Å; L115-W184 HydrophobicContact CD2-CZ2 3.8Å; L115-W184 HydrophobicContact CD2-CZ3 4.34Å; I173-W184 HydrophobicContact CD1-CE3 3.85Å; I173-W184 HydrophobicContact CD1-CZ3 4.22Å; W184-C188 HydrophobicContact CZ3-CB 4.37Å; W184-C188 VanDerWaalsContact CZ3-SG 3.57Å
185P96.4Very high95Very high0 Ų053.2 Ų53.20%026%0.264CS..THydrogen-bonded Turncis-102.819.10.640.2-28.9000112L44 E111 L115 S187 C188 S189L44-P185 HydrophobicContact CD1-CG 4.14Å; E111-P185 HydrophobicContact CB-CG 3.88Å; L115-P185 HydrophobicContact CB-CB 4Å; L115-P185 HydrophobicContact CB-CG 4.49Å; L115-P185 HydrophobicContact CD2-CB 4.15Å; P185-S187 PolarHBondContact O-N 3.48Å; P185-C188 PolarHBondContact O-N 3.16Å; P185-S189 WeakPolarHBondContact O-CB 3.35Å; P185-S189 PolarHBondContact O-N 3.26Å; P185-S189 PolarHBondContact O-OG 3.35Å
186V96.9Very high95.4Very high1 Ų148.6 Ų48.61%0.00624%0.24CC..Hα-helixtrans-58.2-50.3-167.8-178.40000111.4Y37 H40 V183 C188 S189 L190Y37-V186 HydrophobicContact CD1-CG1 3.68Å; Y37-V186 HydrophobicContact CE1-CG1 4.31Å; H40-V186 HydrophobicContact CB-CG2 3.73Å; V183-V186 WeakPolarHBondContact O-CA 3.46Å; V183-V186 WeakPolarHBondContact O-CB 3.11Å; V183-V186 WeakPolarHBondContact O-CG2 3.37Å; V183-V186 PolarHBondContact O-N 2.99Å; V186-C188 PolarHBondContact O-N 2.91Å; V186-S189 WeakPolarHBondContact O-CB 3.25Å; V186-S189 PolarHBondContact O-N 2.96Å; V186-S189 VanDerWaalsContact O-N 3.14Å; V186-L190 HydrophobicContact CG1-CD1 3.94Å; V186-L190 HydrophobicContact CG1-CG 4.4Å; V186-L190 WeakPolarHBondContact O-CG 3.27Å; V186-L190 PolarHBondContact O-N 2.92Å
187S97Very high96.2Very high9 Ų945 Ų456%0.06322%0.22CC..Hα-helixtrans-60-48-178.4-171.70000112.2G169 W181 P185 S189 L190 G191G169-S187 CarbonylContact O-C 3.53Å; G169-S187 WeakPolarHBondContact O-CB 3.32Å; G169-S187 PolarHBondContact O-OG 3.45Å; W181-S187 VanDerWaalsContact O-CA 3.3Å; W181-S187 WeakPolarHBondContact O-CA 3.26Å; W181-S187 VanDerWaalsContact O-CB 3.26Å; W181-S187 WeakPolarHBondContact O-CB 3.33Å; W181-S187 PolarHBondContact O-N 3.22Å; W181-S187 VanDerWaalsContact O-N 3.15Å; P185-S187 PolarHBondContact O-N 3.48Å; S187-S189 VanDerWaalsContact C-N 3.3Å; S187-S189 PolarHBondContact O-N 2.91Å; S187-L190 PolarHBondContact O-N 2.95Å; S187-G191 PolarHBondContact O-N 2.83Å
188C97.9Very high96.6Very high6 Ų640.8 Ų40.84%0.04121%0.211CC..Hα-helixtrans-62.2-37.6175.3-64.50000112.4L115 W184 P185 V186 G191 A192L115-C188 HydrophobicContact CD1-CB 4.33Å; L115-C188 HydrophobicContact CD2-CB 3.86Å; W184-C188 HydrophobicContact CZ3-CB 4.37Å; W184-C188 VanDerWaalsContact CZ3-SG 3.57Å; P185-C188 PolarHBondContact O-N 3.16Å; V186-C188 PolarHBondContact O-N 2.91Å; C188-G191 PolarHBondContact O-N 2.81Å; C188-A192 WeakPolarHBondContact O-CB 3.13Å; C188-A192 PolarHBondContact O-N 2.9Å
189S98.3Very high96.9Very high0 Ų034.1 Ų34.10%018%0.175CC..Hα-helixtrans-66.9-45.2178.5-58.10000111.8L44 P185 V186 S187 G191 A192 M193L44-S189 WeakPolarHBondContact CD2-OG 3.27Å; P185-S189 WeakPolarHBondContact O-CB 3.35Å; P185-S189 PolarHBondContact O-N 3.26Å; P185-S189 PolarHBondContact O-OG 3.35Å; V186-S189 WeakPolarHBondContact O-CB 3.25Å; V186-S189 PolarHBondContact O-N 2.96Å; V186-S189 VanDerWaalsContact O-N 3.14Å; S187-S189 VanDerWaalsContact C-N 3.3Å; S187-S189 PolarHBondContact O-N 2.91Å; S189-G191 VanDerWaalsContact C-N 3.34Å; S189-A192 PolarHBondContact O-N 3.5Å; S189-M193 VanDerWaalsContact O-CG 3.28Å; S189-M193 WeakPolarHBondContact O-CG 3.38Å; S189-M193 PolarHBondContact O-N 3.47Å
190L97.9Very high97.1Very high42 Ų4227.3 Ų27.322%0.2215%0.15CC..Hα-helixtrans-60.9-44.6173.6-69.7167.6000111V36 Y37 W43 W181 V186 S187 A192 M193 I194V36-L190 HydrophobicContact CG1-CD2 4.29Å; Y37-L190 HydrophobicContact CE1-CD1 4Å; W43-L190 HydrophobicContact CH2-CD2 3.61Å; W43-L190 HydrophobicContact CH2-CG 4.16Å; W43-L190 HydrophobicContact CZ2-CD2 4.12Å; W43-L190 HydrophobicContact CZ3-CD2 4.3Å; W181-L190 HydrophobicContact CB-CD1 4.31Å; V186-L190 HydrophobicContact CG1-CD1 3.94Å; V186-L190 HydrophobicContact CG1-CG 4.4Å; V186-L190 WeakPolarHBondContact O-CG 3.27Å; V186-L190 PolarHBondContact O-N 2.92Å; S187-L190 PolarHBondContact O-N 2.95Å; L190-A192 PolarHBondContact O-N 3.35Å; L190-M193 PolarHBondContact O-N 2.73Å; L190-I194 VanDerWaalsContact O-CG1 3.3Å; L190-I194 WeakPolarHBondContact O-CG1 3.26Å; L190-I194 PolarHBondContact O-N 2.87Å
191G98.4Very high97.2Very high13 Ų1328.9 Ų28.913%0.13416%0.158CC..Hα-helixtrans-57.3-46.8174.700000112.4G165 S187 C188 S189 M193 I194 G195G165-G191 CarbonylContact C-O 3.6Å; G165-G191 VanDerWaalsContact C-O 3.31Å; G165-G191 VanDerWaalsContact CA-O 3.25Å; G165-G191 WeakPolarHBondContact CA-O 3.11Å; G165-G191 CarbonylContact O-C 3.31Å; G165-G191 VanDerWaalsContact O-C 3.31Å; G165-G191 WeakPolarHBondContact O-CA 3.33Å; S187-G191 PolarHBondContact O-N 2.83Å; C188-G191 PolarHBondContact O-N 2.81Å; S189-G191 VanDerWaalsContact C-N 3.34Å; G191-M193 VanDerWaalsContact C-N 3.33Å; G191-M193 PolarHBondContact O-N 3.46Å; G191-I194 PolarHBondContact O-N 3.37Å; G191-G195 PolarHBondContact O-N 3.11Å
192A98.6Very high97.4Very high0 Ų027.5 Ų27.50%016%0.157CC..Hα-helixtrans-59.5-43.217600000111.9L118 L119 L122 T162 A166 C188 S189 L190 G195 Y196L118-A192 HydrophobicContact CD2-CB 4.34Å; L119-A192 HydrophobicContact CD2-CB 3.83Å; L122-A192 HydrophobicContact CD1-CB 4.15Å; T162-A192 HydrophobicContact CG2-CB 4.32Å; A166-A192 HydrophobicContact CB-CB 3.8Å; C188-A192 WeakPolarHBondContact O-CB 3.13Å; C188-A192 PolarHBondContact O-N 2.9Å; S189-A192 PolarHBondContact O-N 3.5Å; L190-A192 PolarHBondContact O-N 3.35Å; A192-G195 PolarHBondContact O-N 3.16Å; A192-Y196 VanDerWaalsContact O-CB 3.27Å; A192-Y196 WeakPolarHBondContact O-CB 3.44Å; A192-Y196 PolarHBondContact O-N 3.31Å
193M97.9Very high97.5Very high10 Ų1027 Ų275%0.04916%0.155CC..Hα-helixtrans-66-46.4178.9-71.3-52.6-57.700112.7V20 W43 V47 L118 L122 S189 L190 G191 G195 Y196 L197V20-M193 HydrophobicContact CB-CE 4.03Å; V20-M193 HydrophobicContact CG1-CE 3.12Å; V20-M193 HydrophobicContact CG2-CE 3.68Å; W43-M193 HydrophobicContact CH2-CG 4.09Å; W43-M193 HydrophobicContact CZ2-CG 4.21Å; V47-M193 HydrophobicContact CG1-CE 3.49Å; V47-M193 VanDerWaalsContact CG1-CE 3.49Å; V47-M193 HydrophobicContact CG1-SD 3.55Å; V47-M193 VanDerWaalsContact CG1-SD 3.55Å; L118-M193 HydrophobicContact CD1-SD 3.94Å; L118-M193 HydrophobicContact CD2-CG 4.41Å; L118-M193 HydrophobicContact CD2-SD 4.39Å; L118-M193 HydrophobicContact CG-SD 4.5Å; L122-M193 HydrophobicContact CD1-SD 3.61Å; L122-M193 HydrophobicContact CD2-CE 4.45Å; L122-M193 HydrophobicContact CD2-SD 3.88Å; L122-M193 HydrophobicContact CG-SD 4.31Å; S189-M193 VanDerWaalsContact O-CG 3.28Å; S189-M193 WeakPolarHBondContact O-CG 3.38Å; S189-M193 PolarHBondContact O-N 3.47Å; L190-M193 PolarHBondContact O-N 2.73Å; G191-M193 VanDerWaalsContact C-N 3.33Å; G191-M193 PolarHBondContact O-N 3.46Å; M193-G195 VanDerWaalsContact C-N 3.34Å; M193-Y196 PolarHBondContact O-N 3.43Å; M193-L197 WeakPolarHBondContact O-CB 3.41Å; M193-L197 WeakPolarHBondContact O-CG 3.41Å; M193-L197 PolarHBondContact O-N 3.02Å
194I98.3Very high97.5Very high110 Ų11024 Ų2456%0.56414%0.137SC*.Hα-helixtrans-62.5-45.2176.9-68165.5000109.9L190 G191 L197 T198L190-I194 VanDerWaalsContact O-CG1 3.3Å; L190-I194 WeakPolarHBondContact O-CG1 3.26Å; L190-I194 PolarHBondContact O-N 2.87Å; G191-I194 PolarHBondContact O-N 3.37Å; I194-L197 PolarHBondContact O-N 3.21Å; I194-T198 VanDerWaalsContact O-CB 3.29Å; I194-T198 WeakPolarHBondContact O-CB 3.47Å; I194-T198 PolarHBondContact O-N 2.88Å; I194-T198 PolarHBondContact O-OG1 2.89Å
195G98.6Very high97.6Very high6 Ų624.8 Ų24.86%0.06215%0.153CC..Hα-helixtrans-57.3-49.8174.500000111.7F161 G191 A192 M193 L197 T198 G199F161-G195 VanDerWaalsContact CB-O 3.29Å; F161-G195 WeakPolarHBondContact CB-O 3.39Å; F161-G195 VanDerWaalsContact O-CA 3.24Å; F161-G195 WeakPolarHBondContact O-CA 3.42Å; G191-G195 PolarHBondContact O-N 3.11Å; A192-G195 PolarHBondContact O-N 3.16Å; M193-G195 VanDerWaalsContact C-N 3.34Å; G195-L197 PolarHBondContact O-N 2.96Å; G195-T198 PolarHBondContact O-N 3.34Å; G195-G199 PolarHBondContact O-N 3.43Å
196Y98.5Very high97.5Very high0 Ų029.5 Ų29.50%017%0.171CC..Hα-helixtrans-57.9-52178.1-179.5-108.3000112.6I16 V20 L122 T158 T162 A192 M193 T198 G199 L200I16-Y196 HydrophobicContact CG2-CE1 3.94Å; I16-Y196 VanDerWaalsContact CG2-OH 3.3Å; I16-Y196 WeakPolarHBondContact CG2-OH 3.27Å; V20-Y196 HydrophobicContact CG2-CE1 4.49Å; L122-Y196 HydrophobicContact CB-CD2 3.88Å; L122-Y196 HydrophobicContact CB-CE2 4.25Å; L122-Y196 HydrophobicContact CB-CG 4.22Å; L122-Y196 HydrophobicContact CD1-CG 4.43Å; L122-Y196 HydrophobicContact CD2-CD1 3.76Å; L122-Y196 HydrophobicContact CD2-CD2 4.2Å; L122-Y196 HydrophobicContact CD2-CE1 3.98Å; L122-Y196 HydrophobicContact CD2-CE2 4.42Å; L122-Y196 HydrophobicContact CD2-CG 3.86Å; L122-Y196 HydrophobicContact CG-CG 4.37Å; L122-Y196 WeakPolarHBondContact O-CE2 3.28Å; T158-Y196 HydrophobicContact CG2-CD2 3.52Å; T158-Y196 HydrophobicContact CG2-CE2 3.47Å; T158-Y196 VanDerWaalsContact CG2-CE2 3.47Å; T162-Y196 WeakPolarHBondContact OG1-CA 3.48Å; T162-Y196 WeakPolarHBondContact OG1-CB 3.4Å; T162-Y196 WeakPolarHBondContact OG1-CD2 3.28Å; A192-Y196 VanDerWaalsContact O-CB 3.27Å; A192-Y196 WeakPolarHBondContact O-CB 3.44Å; A192-Y196 PolarHBondContact O-N 3.31Å; M193-Y196 PolarHBondContact O-N 3.43Å; Y196-T198 VanDerWaalsContact C-N 3.29Å; Y196-T198 PolarHBondContact O-N 3.41Å; Y196-G199 PolarHBondContact O-N 3.29Å; Y196-G199 VanDerWaalsContact O-N 3.11Å; Y196-L200 HydrophobicContact CD1-CD1 4.09Å; Y196-L200 HydrophobicContact CD1-CG 4.41Å; Y196-L200 HydrophobicContact CE1-CD1 3.6Å; Y196-L200 HydrophobicContact CE1-CD2 4.47Å; Y196-L200 HydrophobicContact CE1-CG 4.12Å; Y196-L200 HydrophobicContact CE2-CD2 4.36Å; Y196-L200 WeakPolarHBondContact O-CG 3.29Å; Y196-L200 PolarHBondContact O-N 3.08Å
197L98.4Very high97.3Very high38 Ų3829.5 Ų29.520%0.19917%0.17CC..Hα-helixtrans-60.7-39.6178.3-69.2175000111.7A17 V20 F21 M193 I194 G195 L200 V201A17-L197 HydrophobicContact CB-CD2 3.83Å; V20-L197 HydrophobicContact CB-CD2 4.27Å; V20-L197 HydrophobicContact CG1-CD1 4.25Å; V20-L197 HydrophobicContact CG1-CD2 4.23Å; V20-L197 HydrophobicContact CG2-CD2 4.39Å; F21-L197 HydrophobicContact CZ-CD1 4.2Å; M193-L197 WeakPolarHBondContact O-CB 3.41Å; M193-L197 WeakPolarHBondContact O-CG 3.41Å; M193-L197 PolarHBondContact O-N 3.02Å; I194-L197 PolarHBondContact O-N 3.21Å; G195-L197 PolarHBondContact O-N 2.96Å; L197-L200 HydrophobicContact CD2-CD1 4.4Å; L197-L200 WeakPolarHBondContact O-CB 3.5Å; L197-L200 PolarHBondContact O-N 3.46Å; L197-V201 PolarHBondContact O-N 2.91Å
198T98.5Very high97.1Very high56 Ų5633 Ų3334%0.34419%0.185SC..Hα-helixtrans-62.9-45.1174.3-56.80000110.7F161 I194 G195 Y196 L200 V201 V202F161-T198 HydrophobicContact CD1-CG2 3.67Å; F161-T198 HydrophobicContact CE1-CG2 3.63Å; I194-T198 VanDerWaalsContact O-CB 3.29Å; I194-T198 WeakPolarHBondContact O-CB 3.47Å; I194-T198 PolarHBondContact O-N 2.88Å; I194-T198 PolarHBondContact O-OG1 2.89Å; G195-T198 PolarHBondContact O-N 3.34Å; Y196-T198 VanDerWaalsContact C-N 3.29Å; Y196-T198 PolarHBondContact O-N 3.41Å; T198-L200 VanDerWaalsContact C-N 3.31Å; T198-L200 PolarHBondContact O-N 3.38Å; T198-V201 PolarHBondContact O-N 2.97Å; T198-V202 HydrophobicContact CG2-CG2 3.82Å; T198-V202 WeakPolarHBondContact O-CB 3.38Å; T198-V202 VanDerWaalsContact O-CG2 3.3Å; T198-V202 WeakPolarHBondContact O-CG2 3.49Å; T198-V202 PolarHBondContact O-N 2.71Å
199G98.2Very high96.8Very high0 Ų041.6 Ų41.60%022%0.218CC..Hα-helixtrans-59.8-38.5176.200000113G195 Y196 V201 A203G195-G199 PolarHBondContact O-N 3.43Å; Y196-G199 PolarHBondContact O-N 3.29Å; Y196-G199 VanDerWaalsContact O-N 3.11Å; G199-V201 VanDerWaalsContact C-N 3.26Å; G199-V201 PolarHBondContact O-N 3.44Å; G199-A203 WeakPolarHBondContact O-CB 3.47Å; G199-A203 PolarHBondContact O-N 3.05Å
200L97.4Very high96.4Very high4 Ų443.6 Ų43.62%0.02123%0.228CC..Hα-helixtrans-61.9-31.8174.3-68.9-175.9000112.7H13 I16 A17 T158 Y196 L197 T198 P204H13-L200 HydrophobicContact CB-CB 4.08Å; H13-L200 HydrophobicContact CB-CD2 4.22Å; H13-L200 PolarHBondContact ND1-O 3.48Å; I16-L200 HydrophobicContact CB-CD1 4.45Å; I16-L200 HydrophobicContact CG2-CD1 4.17Å; A17-L200 HydrophobicContact CB-CD1 4.22Å; T158-L200 HydrophobicContact CG2-CD2 4.14Å; Y196-L200 HydrophobicContact CD1-CD1 4.09Å; Y196-L200 HydrophobicContact CD1-CG 4.41Å; Y196-L200 HydrophobicContact CE1-CD1 3.6Å; Y196-L200 HydrophobicContact CE1-CD2 4.47Å; Y196-L200 HydrophobicContact CE1-CG 4.12Å; Y196-L200 HydrophobicContact CE2-CD2 4.36Å; Y196-L200 WeakPolarHBondContact O-CG 3.29Å; Y196-L200 PolarHBondContact O-N 3.08Å; L197-L200 HydrophobicContact CD2-CD1 4.4Å; L197-L200 WeakPolarHBondContact O-CB 3.5Å; L197-L200 PolarHBondContact O-N 3.46Å; T198-L200 VanDerWaalsContact C-N 3.31Å; T198-L200 PolarHBondContact O-N 3.38Å; L200-P204 WeakPolarHBondContact O-CD 3.08Å; L200-P204 WeakPolarHBondContact O-CG 3.18Å
201V97.6Very high95.7Very high105 Ų10546.1 Ų46.164%0.63623%0.234SC*.Hα-helixtrans-85.5-45.9176.9176.80000111.5L197 T198 G199 A203 P204 A205L197-V201 PolarHBondContact O-N 2.91Å; T198-V201 PolarHBondContact O-N 2.97Å; G199-V201 VanDerWaalsContact C-N 3.26Å; G199-V201 PolarHBondContact O-N 3.44Å; V201-A203 PolarHBondContact O-N 3.39Å; V201-P204 WeakPolarHBondContact O-CD 3.41Å; V201-P204 WeakPolarHBondContact O-CG 3.31Å; V201-A205 PolarHBondContact O-N 2.99Å
202V97.6Very high94.9Very high44 Ų4454.8 Ų54.827%0.26727%0.269SS..Hα-helixtrans-66.5-39.2-175.9171.40000111.4I157 F161 T198 A205 W206I157-V202 HydrophobicContact CG2-CB 4.42Å; I157-V202 HydrophobicContact CG2-CG1 4.1Å; F161-V202 HydrophobicContact CE1-CG2 4.3Å; F161-V202 HydrophobicContact CE2-CB 4.42Å; F161-V202 HydrophobicContact CE2-CG1 3.93Å; F161-V202 HydrophobicContact CZ-CB 4.27Å; F161-V202 HydrophobicContact CZ-CG1 3.9Å; F161-V202 HydrophobicContact CZ-CG2 4.13Å; T198-V202 HydrophobicContact CG2-CG2 3.82Å; T198-V202 WeakPolarHBondContact O-CB 3.38Å; T198-V202 VanDerWaalsContact O-CG2 3.3Å; T198-V202 WeakPolarHBondContact O-CG2 3.49Å; T198-V202 PolarHBondContact O-N 2.71Å; V202-A205 PolarHBondContact O-N 3.37Å; V202-W206 HydrophobicContact CG1-CB 4.42Å; V202-W206 WeakPolarHBondContact O-CB 3.12Å; V202-W206 PolarHBondContact O-N 3.35Å
203A96.3Very high94Very high0 Ų062.1 Ų62.10%030%0.303CS..Hα-helixtrans-55.3-59-178.300000113.6C154 I157 G199 V201 A205 W206 I207C154-A203 HydrophobicContact CB-CB 4.23Å; I157-A203 HydrophobicContact CB-CB 4.1Å; I157-A203 HydrophobicContact CD1-CB 4.3Å; I157-A203 HydrophobicContact CG2-CB 3.93Å; G199-A203 WeakPolarHBondContact O-CB 3.47Å; G199-A203 PolarHBondContact O-N 3.05Å; V201-A203 PolarHBondContact O-N 3.39Å; A203-A205 VanDerWaalsContact C-N 3.32Å; A203-A205 PolarHBondContact O-N 2.89Å; A203-W206 PolarHBondContact O-N 2.89Å; A203-I207 WeakPolarHBondContact O-CB 3.38Å; A203-I207 WeakPolarHBondContact O-CD1 3.28Å; A203-I207 WeakPolarHBondContact O-CG1 3.28Å; A203-I207 PolarHBondContact O-N 3.47Å
204P94.8Very high93.1Very high16 Ų1663.2 Ų63.210%0.10431%0.309CS..Hα-helixtrans-63.8-35.9179.124.3-33.7000112.6I6 M9 A10 L200 V201 H208I6-P204 HydrophobicContact CG2-CB 4.33Å; M9-P204 HydrophobicContact CG-CB 4.47Å; M9-P204 HydrophobicContact SD-CB 4.24Å; A10-P204 HydrophobicContact CB-CB 4.45Å; L200-P204 WeakPolarHBondContact O-CD 3.08Å; L200-P204 WeakPolarHBondContact O-CG 3.18Å; V201-P204 WeakPolarHBondContact O-CD 3.41Å; V201-P204 WeakPolarHBondContact O-CG 3.31Å; P204-H208 VanDerWaalsContact O-CB 3.23Å; P204-H208 WeakPolarHBondContact O-CB 3.39Å; P204-H208 PolarHBondContact O-N 2.7Å
205A95Very high91.7Very high60 Ų6064.4 Ų64.450%0.49632%0.321SS..Hα-helixtrans-65.7-47.9178.100000112.2V201 V202 A203 H208 Y209V201-A205 PolarHBondContact O-N 2.99Å; V202-A205 PolarHBondContact O-N 3.37Å; A203-A205 VanDerWaalsContact C-N 3.32Å; A203-A205 PolarHBondContact O-N 2.89Å; A205-H208 PolarHBondContact O-N 3.3Å; A205-Y209 PolarHBondContact O-N 3Å
206W94.8Very high90.6Very high100 Ų10065.5 Ų65.538%0.37932%0.324SS..Hα-helixtrans-62.5-45178.6-175.893.8000111.2T153 I157 V202 A203 Y209 H210 L214T153-W206 HydrophobicContact CG2-CE3 4.03Å; T153-W206 HydrophobicContact CG2-CH2 4.48Å; T153-W206 HydrophobicContact CG2-CZ3 3.61Å; I157-W206 HydrophobicContact CD1-CB 4.17Å; I157-W206 HydrophobicContact CD1-CD2 4.03Å; I157-W206 HydrophobicContact CD1-CE3 3.84Å; I157-W206 HydrophobicContact CD1-CG 4.18Å; V202-W206 HydrophobicContact CG1-CB 4.42Å; V202-W206 WeakPolarHBondContact O-CB 3.12Å; V202-W206 PolarHBondContact O-N 3.35Å; A203-W206 PolarHBondContact O-N 2.89Å; W206-Y209 PolarHBondContact O-N 3.38Å; W206-H210 AromaticContact CD1-CE1 3.57Å; W206-H210 AromaticContact CD1-ND1 3.63Å; W206-H210 AromaticContact CD2-ND1 3.63Å; W206-H210 AromaticContact CE2-CE1 3.74Å; W206-H210 AromaticContact CE2-CG 3.96Å; W206-H210 AromaticContact CE2-ND1 3.44Å; W206-H210 AromaticContact CG-ND1 3.75Å; W206-H210 HydrophobicContact CH2-CB 4.31Å; W206-H210 HydrophobicContact CZ2-CB 4.41Å; W206-H210 AromaticContact CZ2-ND1 4Å; W206-H210 HydrophobicContact CZ3-CB 4.36Å; W206-H210 AromaticContact NE1-CE1 3.29Å; W206-H210 PolarHBondContact NE1-CE1 2.95Å; W206-H210 VanDerWaalsContact NE1-CE1 3.29Å; W206-H210 AromaticContact NE1-ND1 3.43Å; W206-H210 PolarHBondContact NE1-ND1 3.25Å; W206-H210 PolarHBondContact O-N 3.34Å; W206-H210 PolarHBondContact O-ND1 3.32Å; W206-L214 HydrophobicContact CH2-CD2 4.21Å; W206-L214 HydrophobicContact CZ3-CD1 4.06Å; W206-L214 HydrophobicContact CZ3-CD2 4.16Å
207I93.4Very high88.6Confident0 Ų073.8 Ų73.80%036%0.36CS..Hα-helixtrans-64.7-41.7178.1-65.5168.8000110.5W2 I6 M9 V150 T153 C154 A203 Y209 H210 R211 L214W2-I207 HydrophobicContact CE3-CG2 4.4Å; W2-I207 HydrophobicContact CZ3-CG2 3.75Å; I6-I207 HydrophobicContact CD1-CG2 4.34Å; I6-I207 HydrophobicContact CG1-CG2 4.38Å; M9-I207 HydrophobicContact CE-CD1 4.32Å; M9-I207 HydrophobicContact SD-CD1 4.09Å; V150-I207 HydrophobicContact CG1-CD1 3.92Å; V150-I207 HydrophobicContact CG1-CG2 3.89Å; V150-I207 WeakPolarHBondContact O-CD1 3.42Å; T153-I207 HydrophobicContact CG2-CD1 4.15Å; T153-I207 HydrophobicContact CG2-CG1 4Å; C154-I207 HydrophobicContact CB-CD1 4.3Å; A203-I207 WeakPolarHBondContact O-CB 3.38Å; A203-I207 WeakPolarHBondContact O-CD1 3.28Å; A203-I207 WeakPolarHBondContact O-CG1 3.28Å; A203-I207 PolarHBondContact O-N 3.47Å; I207-Y209 VanDerWaalsContact C-N 3.34Å; I207-Y209 PolarHBondContact O-N 3.43Å; I207-H210 PolarHBondContact O-N 3.23Å; I207-R211 WeakPolarHBondContact O-CA 3.32Å; I207-R211 WeakPolarHBondContact O-CB 3.5Å; I207-R211 PolarHBondContact O-N 2.94Å; I207-L214 HydrophobicContact CG2-CD1 4.03Å
208H91.9Very high86.2Confident82 Ų8275.3 Ų75.338%0.3837%0.373SS..Hα-helixtrans-60.6-42.7177-176.682.2000112.3I6 P204 A205 R211I6-H208 HydrophobicContact CD1-CB 4.25Å; P204-H208 VanDerWaalsContact O-CB 3.23Å; P204-H208 WeakPolarHBondContact O-CB 3.39Å; P204-H208 PolarHBondContact O-N 2.7Å; A205-H208 PolarHBondContact O-N 3.3Å; H208-R211 PolarHBondContact CD2-NH1 3.2Å; H208-R211 PolarHBondContact CE1-NH1 3.05Å; H208-R211 PolarHBondContact ND1-NH1 3.5Å; H208-R211 PolarHBondContact NE2-NH1 3Å; H208-R211 WeakPolarHBondContact O-CG 3.46Å; H208-R211 PolarHBondContact O-NH1 3.37Å
209Y92.4Very high83.9Confident187 Ų18783.7 Ų83.773%0.73340%0.404SS*.Hα-helixtrans-69-42.7179.2-174.2-92.5000112.2A205 W206 I207A205-Y209 PolarHBondContact O-N 3Å; W206-Y209 PolarHBondContact O-N 3.38Å; I207-Y209 VanDerWaalsContact C-N 3.34Å; I207-Y209 PolarHBondContact O-N 3.43Å
210H89.7Confident83.2Confident43 Ų4387.9 Ų87.920%0.19943%0.425CS..Hα-helixtrans-91.25.3-176.3-62.989.1000114.3W206 I207 K212 Q213 L214W206-H210 AromaticContact CD1-CE1 3.57Å; W206-H210 AromaticContact CD1-ND1 3.63Å; W206-H210 AromaticContact CD2-ND1 3.63Å; W206-H210 AromaticContact CE2-CE1 3.74Å; W206-H210 AromaticContact CE2-CG 3.96Å; W206-H210 AromaticContact CE2-ND1 3.44Å; W206-H210 AromaticContact CG-ND1 3.75Å; W206-H210 HydrophobicContact CH2-CB 4.31Å; W206-H210 HydrophobicContact CZ2-CB 4.41Å; W206-H210 AromaticContact CZ2-ND1 4Å; W206-H210 HydrophobicContact CZ3-CB 4.36Å; W206-H210 AromaticContact NE1-CE1 3.29Å; W206-H210 PolarHBondContact NE1-CE1 2.95Å; W206-H210 VanDerWaalsContact NE1-CE1 3.29Å; W206-H210 AromaticContact NE1-ND1 3.43Å; W206-H210 PolarHBondContact NE1-ND1 3.25Å; W206-H210 PolarHBondContact O-N 3.34Å; W206-H210 PolarHBondContact O-ND1 3.32Å; I207-H210 PolarHBondContact O-N 3.23Å; H210-K212 PolarHBondContact O-N 3.27Å; H210-Q213 PolarHBondContact O-N 2.93Å; H210-L214 HydrophobicContact CB-CD1 4.36Å; H210-L214 WeakPolarHBondContact O-CG 3.49Å; H210-L214 PolarHBondContact O-N 3.42Å
211R84.1Confident82.4Confident94 Ų9492.3 Ų92.336%0.35545%0.446SS..THydrogen-bonded Turntrans-51.6-31-173.669.9180-179.5-103.915.1115.3W2 I207 H208 Q213 L214W2-R211 HydrophobicContact CE3-CB 4.1Å; W2-R211 HydrophobicContact CZ3-CB 4.03Å; I207-R211 WeakPolarHBondContact O-CA 3.32Å; I207-R211 WeakPolarHBondContact O-CB 3.5Å; I207-R211 PolarHBondContact O-N 2.94Å; H208-R211 PolarHBondContact CD2-NH1 3.2Å; H208-R211 PolarHBondContact CE1-NH1 3.05Å; H208-R211 PolarHBondContact ND1-NH1 3.5Å; H208-R211 PolarHBondContact NE2-NH1 3Å; H208-R211 WeakPolarHBondContact O-CG 3.46Å; H208-R211 PolarHBondContact O-NH1 3.37Å; R211-Q213 VanDerWaalsContact C-N 3.29Å; R211-Q213 PolarHBondContact O-N 3.39Å; R211-L214 PolarHBondContact O-N 3.26Å
212K81.4Confident81.6Confident196 Ų19691.6 Ų91.685%0.85244%0.435SS*.THydrogen-bonded Turntrans-70.8-23.7179.9-65-175.7180-179.60113.4H210H210-K212 PolarHBondContact O-N 3.27Å
213Q79.6Confident80.7Confident153 Ų15394.4 Ų94.472%0.71545%0.445SS*.THydrogen-bonded Turntrans-95.4-16.3-179.3-62.4172.7-1.700112H210 R211 T215H210-Q213 PolarHBondContact O-N 2.93Å; R211-Q213 VanDerWaalsContact C-N 3.29Å; R211-Q213 PolarHBondContact O-N 3.39Å; Q213-T215 PolarHBondContact O-N 3.09Å
214L79.4Confident79.7Confident34 Ų34100.3 Ų100.318%0.17847%0.473CS..  trans-87.6108.1-176.3-65.2169.8000110.2W2 W206 I207 H210 R211 Y216W2-L214 HydrophobicContact CH2-CB 3.55Å; W2-L214 HydrophobicContact CH2-CD1 4.07Å; W2-L214 HydrophobicContact CH2-CG 4.48Å; W2-L214 HydrophobicContact CZ2-CB 4.34Å; W2-L214 HydrophobicContact CZ3-CB 4.41Å; W2-L214 HydrophobicContact CZ3-CD1 4.16Å; W206-L214 HydrophobicContact CH2-CD2 4.21Å; W206-L214 HydrophobicContact CZ3-CD1 4.06Å; W206-L214 HydrophobicContact CZ3-CD2 4.16Å; I207-L214 HydrophobicContact CG2-CD1 4.03Å; H210-L214 HydrophobicContact CB-CD1 4.36Å; H210-L214 WeakPolarHBondContact O-CG 3.49Å; H210-L214 PolarHBondContact O-N 3.42Å; R211-L214 PolarHBondContact O-N 3.26Å; L214-Y216 VanDerWaalsContact C-N 3.29Å; L214-Y216 HydrophobicContact CB-CD2 4.41Å; L214-Y216 HydrophobicContact CB-CE1 4.35Å; L214-Y216 HydrophobicContact CB-CE2 3.99Å; L214-Y216 HydrophobicContact CD1-CE2 3.91Å; L214-Y216 WeakPolarHBondContact CD1-OH 3.33Å; L214-Y216 HydrophobicContact CD2-CE1 4.23Å; L214-Y216 WeakPolarHBondContact CD2-OH 3.31Å; L214-Y216 HydrophobicContact CG-CE2 4.38Å; L214-Y216 PolarHBondContact O-N 3.18Å; L214-Y216 VanDerWaalsContact O-N 3.15Å
215T68.6Low78.7Confident134 Ų134105.9 Ų105.982%0.82250%0.498SS*.  trans-88.858.8177.858.20000111.3Q213Q213-T215 PolarHBondContact O-N 3.09Å
216Y74.1Confident77.5Confident30 Ų30109.2 Ų109.212%0.11850%0.498CS..PPolyproline II helixtrans-72.2137172.5-56.4-35.7000110.1W2 M148 V150 T153 L214W2-Y216 AromaticContact CH2-CD2 2.93Å; W2-Y216 HydrophobicContact CH2-CD2 2.93Å; W2-Y216 AromaticContact CH2-CE2 3.16Å; W2-Y216 HydrophobicContact CH2-CE2 3.16Å; W2-Y216 AromaticContact CH2-CG 3.87Å; W2-Y216 HydrophobicContact CH2-CG 3.87Å; W2-Y216 AromaticContact CZ2-CD2 3.27Å; W2-Y216 HydrophobicContact CZ2-CD2 3.27Å; W2-Y216 HydrophobicContact CZ2-CE2 4Å; W2-Y216 AromaticContact CZ2-CG 3.88Å; W2-Y216 HydrophobicContact CZ2-CG 3.88Å; W2-Y216 AromaticContact CZ3-CD2 3.71Å; W2-Y216 HydrophobicContact CZ3-CD2 3.71Å; W2-Y216 AromaticContact CZ3-CE2 3.65Å; W2-Y216 HydrophobicContact CZ3-CE2 3.65Å; M148-Y216 WeakPolarHBondContact O-CD1 3.45Å; V150-Y216 VanDerWaalsContact CA-CE2 3.5Å; V150-Y216 HydrophobicContact CB-CD2 4.34Å; V150-Y216 HydrophobicContact CB-CE2 4.18Å; V150-Y216 HydrophobicContact CG2-CD2 3.54Å; V150-Y216 HydrophobicContact CG2-CE2 3.71Å; V150-Y216 VanDerWaalsContact N-CD2 3.31Å; V150-Y216 VanDerWaalsContact N-CE2 3.34Å; T153-Y216 WeakPolarHBondContact CB-OH 3.47Å; T153-Y216 PolarHBondContact OG1-OH 3.35Å; L214-Y216 VanDerWaalsContact C-N 3.29Å; L214-Y216 HydrophobicContact CB-CD2 4.41Å; L214-Y216 HydrophobicContact CB-CE1 4.35Å; L214-Y216 HydrophobicContact CB-CE2 3.99Å; L214-Y216 HydrophobicContact CD1-CE2 3.91Å; L214-Y216 WeakPolarHBondContact CD1-OH 3.33Å; L214-Y216 HydrophobicContact CD2-CE1 4.23Å; L214-Y216 WeakPolarHBondContact CD2-OH 3.31Å; L214-Y216 HydrophobicContact CG-CE2 4.38Å; L214-Y216 PolarHBondContact O-N 3.18Å; L214-Y216 VanDerWaalsContact O-N 3.15Å
217K57.3Low76.2Confident174 Ų174109.9 Ų109.976%0.75751%0.507SS*.PPolyproline II helixtrans-76.6126.1167.9-66.1-172.1177.6-174.70107.8K219K217-K219 PolarHBondContact O-N 3.29Å
218C48.8Very low74.7Confident70 Ų70119.1 Ų119.147%0.47355%0.549SS..PPolyproline II helixtrans-55.9133.8168.6-91.80000109.3M1M1-C218 HydrophobicContact CE-CB 4.38Å; M1-C218 VanDerWaalsContact CE-SG 3.59Å; M1-C218 HydrophobicContact SD-CB 4.16Å; M1-C218 PolarHBondContact SD-SG 2.97Å
219K49.8Very low73.2Confident232 Ų232122.5 Ų122.5100%1.00957%0.565SS**  trans-840165.1-85.3-174.8178.1174.50110.2K217K217-K219 PolarHBondContact O-N 3.29Å

Retrieved 219 of 219 residues in 204.1 ms (Link to these results)

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