A0A087XNB4_POEFO Loading...

lysoplasmalogenase

AlphaFold DB , UniProt , Accession A0A087XNB4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 213 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
1M60.9Low78.6Confident194 Ų194117.8 Ų117.896%0.95660%0.597SS**  0111.60-149.3163.69200105.6T6M1-T6 HydrophobicContact CE-CG2 3.27Å
2D81.3Confident79.2Confident117 Ų117121.3 Ų121.363%0.62660%0.597SS**  trans-71142.9-172.8-87.8-30.4000110.9L4 E5 T6D2-L4 PolarHBondContact O-N 3.22Å; D2-L4 VanDerWaalsContact O-N 3.08Å; D2-E5 HydrophobicContact CB-CG 4.34Å; D2-E5 WeakPolarHBondContact O-CB 3.4Å; D2-E5 PolarHBondContact O-N 3.22Å; D2-T6 PolarHBondContact O-N 3.04Å
3I76.1Confident79.7Confident146 Ų146123.6 Ų123.675%0.74960%0.595SS**Hα-helixtrans-56.9-29.4-178.3-63.9166.1000111.3T6 D7I3-T6 VanDerWaalsContact C-OG1 3.24Å; I3-T6 VanDerWaalsContact CA-OG1 3.26Å; I3-T6 WeakPolarHBondContact CA-OG1 3.47Å; I3-T6 PolarHBondContact O-OG1 3.05Å; I3-D7 PolarHBondContact O-N 2.96Å; I3-D7 VanDerWaalsContact O-N 3.14Å
4L74.7Confident79.9Confident146 Ų146125.9 Ų125.976%0.76460%0.595SS**Hα-helixtrans-70.7-35.6175.6-71.1165.6000113D2 A8D2-L4 PolarHBondContact O-N 3.22Å; D2-L4 VanDerWaalsContact O-N 3.08Å; L4-A8 WeakPolarHBondContact O-CB 3.34Å; L4-A8 PolarHBondContact O-N 3.21Å; L4-A8 VanDerWaalsContact O-N 3.15Å
5E76.9Confident80Confident124 Ų124127.8 Ų127.858%0.57959%0.594SS**Hα-helixtrans-71.2-37.1175.8-67.2-173142.600111.3D2 Y9D2-E5 HydrophobicContact CB-CG 4.34Å; D2-E5 WeakPolarHBondContact O-CB 3.4Å; D2-E5 PolarHBondContact O-N 3.22Å; E5-Y9 VanDerWaalsContact O-CB 3.3Å; E5-Y9 WeakPolarHBondContact O-CB 3.23Å; E5-Y9 PolarHBondContact O-N 3.48Å
6T80.4Confident80.5Confident47 Ų47125.5 Ų125.529%0.28859%0.587SS.*Hα-helixtrans-64.4-43.9174.842.80000112.5M1 D2 I3 Y9 D10M1-T6 HydrophobicContact CE-CG2 3.27Å; D2-T6 PolarHBondContact O-N 3.04Å; I3-T6 VanDerWaalsContact C-OG1 3.24Å; I3-T6 VanDerWaalsContact CA-OG1 3.26Å; I3-T6 WeakPolarHBondContact CA-OG1 3.47Å; I3-T6 PolarHBondContact O-OG1 3.05Å; T6-Y9 PolarHBondContact O-N 3.17Å; T6-D10 WeakPolarHBondContact O-CB 3.13Å; T6-D10 PolarHBondContact O-N 3.14Å
7D83.2Confident80.8Confident94 Ų94124.1 Ų124.150%0.50358%0.582SS.*Hα-helixtrans-67.4-42.1179.6-176.557.4000112I3 Y9 D10 K11I3-D7 PolarHBondContact O-N 2.96Å; I3-D7 VanDerWaalsContact O-N 3.14Å; D7-Y9 VanDerWaalsContact C-N 3.34Å; D7-Y9 PolarHBondContact O-N 3.16Å; D7-D10 PolarHBondContact O-N 3.01Å; D7-K11 WeakPolarHBondContact O-CB 3.42Å; D7-K11 PolarHBondContact O-N 3.26Å
8A81.6Confident81.1Confident59 Ų59121.1 Ų121.149%0.48858%0.577SS.*Hα-helixtrans-63.1-39.6176.100000112.3L4 R12L4-A8 WeakPolarHBondContact O-CB 3.34Å; L4-A8 PolarHBondContact O-N 3.21Å; L4-A8 VanDerWaalsContact O-N 3.15Å; A8-R12 WeakPolarHBondContact O-CB 3.31Å; A8-R12 PolarHBondContact O-N 3.34Å; A8-R12 VanDerWaalsContact O-N 3.13Å
9Y82.5Confident81.4Confident152 Ų152118 Ų11860%0.59657%0.569SS**Hα-helixtrans-64-48.2174.8179.7-93.9000111.6E5 T6 D7 K11 R12 R13E5-Y9 VanDerWaalsContact O-CB 3.3Å; E5-Y9 WeakPolarHBondContact O-CB 3.23Å; E5-Y9 PolarHBondContact O-N 3.48Å; T6-Y9 PolarHBondContact O-N 3.17Å; D7-Y9 VanDerWaalsContact C-N 3.34Å; D7-Y9 PolarHBondContact O-N 3.16Å; Y9-K11 PolarHBondContact O-N 2.84Å; Y9-R12 PolarHBondContact O-N 3.28Å; Y9-R13 WeakPolarHBondContact O-CB 3.31Å; Y9-R13 PolarHBondContact O-N 3.35Å
10D83.4Confident81.8Confident70 Ų70114 Ų11437%0.37456%0.556SS.*Hα-helixtrans-63.3-40.8-179.4-80.6-15.1000112.4T6 D7 R13 R14T6-D10 WeakPolarHBondContact O-CB 3.13Å; T6-D10 PolarHBondContact O-N 3.14Å; D7-D10 PolarHBondContact O-N 3.01Å; D10-R13 PolarHBondContact O-N 3.18Å; D10-R14 PolarHBondContact O-N 3.14Å
11K83.6Confident82.1Confident147 Ų147112 Ų11264%0.63955%0.547SS*.Hα-helixtrans-63.3-42.5175.1-169.2174.3-176.8175.90111.7D7 Y9 R15D7-K11 WeakPolarHBondContact O-CB 3.42Å; D7-K11 PolarHBondContact O-N 3.26Å; Y9-K11 PolarHBondContact O-N 2.84Å; K11-R15 PolarHBondContact O-N 3.4Å; K11-R15 VanDerWaalsContact O-N 3.09Å
12R85.4Confident83.5Confident160 Ų160108 Ų10860%0.60453%0.529SS*.Hα-helixtrans-65.1-42.9176.8-170.9179.8-69.8-148.50.7111.1A8 Y9 R15 N16A8-R12 WeakPolarHBondContact O-CB 3.31Å; A8-R12 PolarHBondContact O-N 3.34Å; A8-R12 VanDerWaalsContact O-N 3.13Å; Y9-R12 PolarHBondContact O-N 3.28Å; R12-R15 PolarHBondContact O-N 3.4Å; R12-N16 VanDerWaalsContact O-CG 3.27Å; R12-N16 PolarHBondContact O-N 3.46Å; R12-N16 PolarHBondContact O-OD1 3.47Å
13R86.4Confident84Confident151 Ų151108.2 Ų108.257%0.5753%0.53SS*.Hα-helixtrans-61.8-48176.8-173.2176.9177.8-157.10.8111.7Y9 D10 R15 N16 M17Y9-R13 WeakPolarHBondContact O-CB 3.31Å; Y9-R13 PolarHBondContact O-N 3.35Å; D10-R13 PolarHBondContact O-N 3.18Å; R13-R15 PolarHBondContact O-N 3.22Å; R13-N16 PolarHBondContact O-N 2.88Å; R13-M17 VanDerWaalsContact O-CG 3.29Å; R13-M17 WeakPolarHBondContact O-CG 3.33Å; R13-M17 PolarHBondContact O-N 3.43Å
14R82.2Confident84.7Confident156 Ų156103 Ų10359%0.58951%0.506SS*.Hα-helixtrans-56.6-47.4175.5-80.8-166-72.7-109.5-2.1111.9D10 N16 M17 S18D10-R14 PolarHBondContact O-N 3.14Å; R14-N16 PolarHBondContact O-N 3.5Å; R14-M17 PolarHBondContact O-N 2.97Å; R14-S18 PolarHBondContact O-N 3.19Å; R14-S18 PolarHBondContact O-OG 3.09Å
15R81.5Confident85.6Confident154 Ų15497.6 Ų97.658%0.58148%0.478SS*.Hα-helixtrans-58.9-45.8177.4-176.5177.364.9-172.11.3112.1K11 R12 R13 M17 S18 C19K11-R15 PolarHBondContact O-N 3.4Å; K11-R15 VanDerWaalsContact O-N 3.09Å; R12-R15 PolarHBondContact O-N 3.4Å; R13-R15 PolarHBondContact O-N 3.22Å; R15-M17 VanDerWaalsContact C-N 3.32Å; R15-M17 PolarHBondContact O-N 3.13Å; R15-S18 PolarHBondContact O-N 3.31Å; R15-C19 PolarHBondContact O-N 3.12Å; R15-C19 PolarHBondContact O-SG 2.91Å; R15-C19 VanDerWaalsContact O-SG 3.42Å
16N87.7Confident86.4Confident91 Ų9196.4 Ų96.449%0.48748%0.475SS..Hα-helixtrans-63-40.4179.5-69.73.3000111.6R12 R13 R14 C19 A20R12-N16 VanDerWaalsContact O-CG 3.27Å; R12-N16 PolarHBondContact O-N 3.46Å; R12-N16 PolarHBondContact O-OD1 3.47Å; R13-N16 PolarHBondContact O-N 2.88Å; R14-N16 PolarHBondContact O-N 3.5Å; N16-C19 PolarHBondContact O-N 3.2Å; N16-A20 WeakPolarHBondContact O-CB 3.02Å; N16-A20 PolarHBondContact O-N 2.94Å
17M86.3Confident87Confident101 Ų10196.8 Ų96.850%0.49848%0.478SS..Hα-helixtrans-64.3-43175.1-66.3-65.5-77.700111.7R13 R14 R15 A20 L21 W67R13-M17 VanDerWaalsContact O-CG 3.29Å; R13-M17 WeakPolarHBondContact O-CG 3.33Å; R13-M17 PolarHBondContact O-N 3.43Å; R14-M17 PolarHBondContact O-N 2.97Å; R15-M17 VanDerWaalsContact C-N 3.32Å; R15-M17 PolarHBondContact O-N 3.13Å; M17-A20 PolarHBondContact O-N 3.29Å; M17-L21 WeakPolarHBondContact O-CB 3.16Å; M17-L21 PolarHBondContact O-N 3.37Å; M17-W67 HydrophobicContact CE-CH2 4.38Å; M17-W67 HydrophobicContact CE-CZ3 3.68Å; M17-W67 WeakPolarHBondContact O-CH2 3.13Å
18S85.8Confident87.5Confident70 Ų7094.3 Ų94.349%0.4946%0.463SS..Hα-helixtrans-63-43.1174.9-61.40000112.2R14 R15 L21 L22R14-S18 PolarHBondContact O-N 3.19Å; R14-S18 PolarHBondContact O-OG 3.09Å; R15-S18 PolarHBondContact O-N 3.31Å; S18-L21 PolarHBondContact O-N 3.48Å; S18-L22 WeakPolarHBondContact O-CB 3.43Å; S18-L22 VanDerWaalsContact O-CG 3.31Å; S18-L22 WeakPolarHBondContact O-CG 3.37Å; S18-L22 PolarHBondContact O-N 3.05Å
19C87.2Confident88.1Confident63 Ų6397.1 Ų97.143%0.42646%0.464SS..Hα-helixtrans-62.3-45.7175.1-73.60000111.6R15 N16 L21 L22 L23R15-C19 PolarHBondContact O-N 3.12Å; R15-C19 PolarHBondContact O-SG 2.91Å; R15-C19 VanDerWaalsContact O-SG 3.42Å; N16-C19 PolarHBondContact O-N 3.2Å; C19-L21 VanDerWaalsContact C-N 3.31Å; C19-L21 PolarHBondContact O-N 3.07Å; C19-L22 PolarHBondContact O-N 3.09Å; C19-L23 WeakPolarHBondContact O-CB 3.46Å; C19-L23 VanDerWaalsContact O-CG 3.28Å; C19-L23 WeakPolarHBondContact O-CG 3.44Å; C19-L23 PolarHBondContact O-N 3.1Å
20A88.9Confident88.7Confident37 Ų3795.5 Ų95.531%0.30647%0.465SS..Hα-helixtrans-62.2-39.6177.700000112N16 M17 L23 S24 W67N16-A20 WeakPolarHBondContact O-CB 3.02Å; N16-A20 PolarHBondContact O-N 2.94Å; M17-A20 PolarHBondContact O-N 3.29Å; A20-L23 PolarHBondContact O-N 2.9Å; A20-S24 WeakPolarHBondContact O-CB 3.13Å; A20-S24 PolarHBondContact O-N 3.3Å; A20-S24 PolarHBondContact O-OG 3.3Å; A20-W67 HydrophobicContact CB-CH2 3.91Å; A20-W67 HydrophobicContact CB-CZ2 3.95Å
21L88.8Confident89.2Confident72 Ų7293 Ų9338%0.37745%0.454SS..Hα-helixtrans-66.9-44.7176.5-177.4132.2000111.6M17 S18 C19 L23 S24 L25 W67M17-L21 WeakPolarHBondContact O-CB 3.16Å; M17-L21 PolarHBondContact O-N 3.37Å; S18-L21 PolarHBondContact O-N 3.48Å; C19-L21 VanDerWaalsContact C-N 3.31Å; C19-L21 PolarHBondContact O-N 3.07Å; L21-L23 VanDerWaalsContact C-N 3.34Å; L21-L23 PolarHBondContact O-N 3.42Å; L21-S24 WeakPolarHBondContact O-CB 3.25Å; L21-S24 PolarHBondContact O-N 2.7Å; L21-S24 VanDerWaalsContact O-N 3.16Å; L21-L25 HydrophobicContact CD2-CD1 3.7Å; L21-L25 HydrophobicContact CG-CD1 4.3Å; L21-L25 WeakPolarHBondContact O-CG 3.41Å; L21-L25 PolarHBondContact O-N 2.96Å; L21-W67 HydrophobicContact CB-CH2 3.82Å; L21-W67 HydrophobicContact CB-CZ2 3.88Å; L21-W67 HydrophobicContact CB-CZ3 4.38Å; L21-W67 HydrophobicContact CD1-CE3 4.39Å; L21-W67 HydrophobicContact CD1-CZ3 4.42Å
22L89.4Confident89.5Confident110 Ų11087 Ų8758%0.57643%0.431SS*.Hα-helixtrans-59.8-44.2175.2-75171.2000111.9S18 C19 S24 L25 L26S18-L22 WeakPolarHBondContact O-CB 3.43Å; S18-L22 VanDerWaalsContact O-CG 3.31Å; S18-L22 WeakPolarHBondContact O-CG 3.37Å; S18-L22 PolarHBondContact O-N 3.05Å; C19-L22 PolarHBondContact O-N 3.09Å; L22-S24 VanDerWaalsContact C-N 3.31Å; L22-S24 PolarHBondContact O-N 2.97Å; L22-L25 PolarHBondContact O-N 3.45Å; L22-L26 PolarHBondContact O-N 3.29Å; L22-L26 VanDerWaalsContact O-N 3.1Å
23L91.3Very high89.8Confident123 Ų12382.1 Ų82.164%0.64442%0.424SS*.Hα-helixtrans-63.9-37.4175.5-71.2170.6000111.8C19 A20 L21 L25 L26C19-L23 WeakPolarHBondContact O-CB 3.46Å; C19-L23 VanDerWaalsContact O-CG 3.28Å; C19-L23 WeakPolarHBondContact O-CG 3.44Å; C19-L23 PolarHBondContact O-N 3.1Å; A20-L23 PolarHBondContact O-N 2.9Å; L21-L23 VanDerWaalsContact C-N 3.34Å; L21-L23 PolarHBondContact O-N 3.42Å; L23-L25 VanDerWaalsContact C-N 3.31Å; L23-L25 PolarHBondContact O-N 3.12Å; L23-L26 WeakPolarHBondContact O-CB 3.42Å; L23-L26 PolarHBondContact O-N 3.15Å
24S91.6Very high90.1Very high37 Ų3779.1 Ų79.126%0.25942%0.419SS..Hα-helixtrans-66.6-32175.9-57.60000112.4A20 L21 L22 P27 V63 W67A20-S24 WeakPolarHBondContact O-CB 3.13Å; A20-S24 PolarHBondContact O-N 3.3Å; A20-S24 PolarHBondContact O-OG 3.3Å; L21-S24 WeakPolarHBondContact O-CB 3.25Å; L21-S24 PolarHBondContact O-N 2.7Å; L21-S24 VanDerWaalsContact O-N 3.16Å; L22-S24 VanDerWaalsContact C-N 3.31Å; L22-S24 PolarHBondContact O-N 2.97Å; S24-P27 VanDerWaalsContact O-CD 3.29Å; S24-P27 WeakPolarHBondContact O-CD 3.24Å; S24-P27 VanDerWaalsContact O-CG 3.32Å; S24-P27 WeakPolarHBondContact O-CG 3.47Å; S24-V63 WeakPolarHBondContact O-CG2 3.48Å; S24-W67 PolarHBondContact OG-NE1 3.45Å
25L92.8Very high90.4Very high32 Ų3273.7 Ų73.717%0.16840%0.399CS..Hα-helixtrans-83.6-15.5178.3-70172.6000113.8L21 L22 L23 F28 F29 L60 V63L21-L25 HydrophobicContact CD2-CD1 3.7Å; L21-L25 HydrophobicContact CG-CD1 4.3Å; L21-L25 WeakPolarHBondContact O-CG 3.41Å; L21-L25 PolarHBondContact O-N 2.96Å; L22-L25 PolarHBondContact O-N 3.45Å; L23-L25 VanDerWaalsContact C-N 3.31Å; L23-L25 PolarHBondContact O-N 3.12Å; L25-F28 WeakPolarHBondContact O-CA 3.47Å; L25-F28 VanDerWaalsContact O-CB 3.31Å; L25-F28 WeakPolarHBondContact O-CB 3.11Å; L25-F28 PolarHBondContact O-N 2.95Å; L25-F29 HydrophobicContact CB-CD2 4.03Å; L25-F29 HydrophobicContact CB-CE2 3.68Å; L25-F29 HydrophobicContact CD1-CE2 4.37Å; L25-F29 VanDerWaalsContact O-CD2 3.22Å; L25-F29 WeakPolarHBondContact O-CD2 3.41Å; L25-F29 PolarHBondContact O-N 2.9Å; L25-L60 HydrophobicContact CD2-CD1 3.79Å; L25-V63 HydrophobicContact CD2-CB 4.5Å; L25-V63 HydrophobicContact CD2-CG1 3.96Å; L25-V63 HydrophobicContact CG-CG1 4.48Å
26L94.2Very high90.7Very high98 Ų9873.4 Ų73.451%0.51340%0.402SS..Hα-helixtrans-50.8-46.4177.8-166.1143.5000114L22 L23 F28 F29 L30L22-L26 PolarHBondContact O-N 3.29Å; L22-L26 VanDerWaalsContact O-N 3.1Å; L23-L26 WeakPolarHBondContact O-CB 3.42Å; L23-L26 PolarHBondContact O-N 3.15Å; L26-F28 VanDerWaalsContact C-N 3.31Å; L26-F28 PolarHBondContact O-N 3.28Å; L26-F29 PolarHBondContact O-N 3.5Å; L26-L30 WeakPolarHBondContact O-CB 3.41Å; L26-L30 PolarHBondContact O-N 2.97Å
27P93.8Very high90.7Very high55 Ų5578.1 Ų78.136%0.35741%0.414SS..Hα-helixtrans-61.8-36.8175.823.1-35000113S24 L30 S31 L59S24-P27 VanDerWaalsContact O-CD 3.29Å; S24-P27 WeakPolarHBondContact O-CD 3.24Å; S24-P27 VanDerWaalsContact O-CG 3.32Å; S24-P27 WeakPolarHBondContact O-CG 3.47Å; P27-L30 PolarHBondContact O-N 2.86Å; P27-S31 VanDerWaalsContact O-CB 3.28Å; P27-S31 WeakPolarHBondContact O-CB 3.47Å; P27-S31 PolarHBondContact O-N 3.02Å; P27-L59 HydrophobicContact CB-CD1 4.27Å; P27-L59 HydrophobicContact CB-CD2 4.28Å; P27-L59 WeakPolarHBondContact O-CD1 3.4Å
28F94.1Very high90.6Very high42 Ų4277 Ų7718%0.18441%0.41CS..Hα-helixtrans-61.5-48.5175159.7-104.8000111.4L25 L26 S31 S32 P56 L59 L60L25-F28 WeakPolarHBondContact O-CA 3.47Å; L25-F28 VanDerWaalsContact O-CB 3.31Å; L25-F28 WeakPolarHBondContact O-CB 3.11Å; L25-F28 PolarHBondContact O-N 2.95Å; L26-F28 VanDerWaalsContact C-N 3.31Å; L26-F28 PolarHBondContact O-N 3.28Å; F28-S31 PolarHBondContact O-N 3.34Å; F28-S32 WeakPolarHBondContact O-CB 3.47Å; F28-S32 PolarHBondContact O-N 3.31Å; F28-S32 PolarHBondContact O-OG 3.4Å; F28-P56 HydrophobicContact CD2-CB 4.07Å; F28-P56 VanDerWaalsContact CD2-O 3.25Å; F28-P56 WeakPolarHBondContact CD2-O 3.4Å; F28-P56 HydrophobicContact CE2-CB 4.06Å; F28-L59 HydrophobicContact CB-CB 4.41Å; F28-L60 HydrophobicContact CD2-CB 3.86Å; F28-L60 HydrophobicContact CE2-CB 4.22Å; F28-L60 HydrophobicContact CE2-CD2 4.12Å; F28-L60 HydrophobicContact CG-CB 4.36Å; F28-L60 HydrophobicContact CG-CD1 4.44Å; F28-L60 HydrophobicContact CZ-CD2 4.33Å
29F93.7Very high90.2Very high118 Ų11878.8 Ų78.852%0.51841%0.406SS..Hα-helixtrans-64.9-41.4178.7-70.6-62.3000112L25 L26 S32 A33L25-F29 HydrophobicContact CB-CD2 4.03Å; L25-F29 HydrophobicContact CB-CE2 3.68Å; L25-F29 HydrophobicContact CD1-CE2 4.37Å; L25-F29 VanDerWaalsContact O-CD2 3.22Å; L25-F29 WeakPolarHBondContact O-CD2 3.41Å; L25-F29 PolarHBondContact O-N 2.9Å; L26-F29 PolarHBondContact O-N 3.5Å; F29-S32 PolarHBondContact O-N 3Å; F29-A33 WeakPolarHBondContact O-CB 3.38Å; F29-A33 PolarHBondContact O-N 2.97Å
30L94.2Very high89.2Confident118 Ų11879.5 Ų79.562%0.61841%0.408SS*.Hα-helixtrans-64.7-43.5178.4-169.967.2000111.5L26 P27 S32 A33 L34L26-L30 WeakPolarHBondContact O-CB 3.41Å; L26-L30 PolarHBondContact O-N 2.97Å; P27-L30 PolarHBondContact O-N 2.86Å; L30-S32 VanDerWaalsContact C-N 3.35Å; L30-A33 PolarHBondContact O-N 3.14Å; L30-L34 WeakPolarHBondContact O-CB 3.42Å; L30-L34 PolarHBondContact O-N 3.29Å
31S93.6Very high87.8Confident18 Ų1883.1 Ų83.113%0.12643%0.429CS..Hα-helixtrans-65.3-38.5175.7-169.70000112P27 F28 L34 Y35 A55 P56 L59P27-S31 VanDerWaalsContact O-CB 3.28Å; P27-S31 WeakPolarHBondContact O-CB 3.47Å; P27-S31 PolarHBondContact O-N 3.02Å; F28-S31 PolarHBondContact O-N 3.34Å; S31-L34 PolarHBondContact O-N 2.93Å; S31-Y35 WeakPolarHBondContact O-CB 3.42Å; S31-Y35 PolarHBondContact O-N 2.85Å; S31-A55 WeakPolarHBondContact OG-CB 3.35Å; S31-P56 WeakPolarHBondContact OG-CD 3.25Å; S31-L59 VanDerWaalsContact CB-CD1 3.49Å
32S91.1Very high86.2Confident22 Ų2286.9 Ų86.915%0.15445%0.449CS..Hα-helixtrans-63.5-46.3175.8-58.40000111F28 F29 L30 L34 Y35 F36 P56F28-S32 WeakPolarHBondContact O-CB 3.47Å; F28-S32 PolarHBondContact O-N 3.31Å; F28-S32 PolarHBondContact O-OG 3.4Å; F29-S32 PolarHBondContact O-N 3Å; L30-S32 VanDerWaalsContact C-N 3.35Å; S32-L34 VanDerWaalsContact C-N 3.35Å; S32-L34 PolarHBondContact O-N 3.47Å; S32-Y35 PolarHBondContact O-N 3.44Å; S32-F36 WeakPolarHBondContact O-CD2 3.42Å; S32-F36 PolarHBondContact O-N 2.97Å; S32-P56 WeakPolarHBondContact OG-CB 3.42Å
33A92.1Very high84.8Confident57 Ų5786 Ų8647%0.47145%0.445SS..Hα-helixtrans-62.4-42.1176.600000111.7F29 L30 F36 Y37F29-A33 WeakPolarHBondContact O-CB 3.38Å; F29-A33 PolarHBondContact O-N 2.97Å; L30-A33 PolarHBondContact O-N 3.14Å; A33-F36 PolarHBondContact O-N 3.46Å; A33-Y37 VanDerWaalsContact O-CB 3.26Å; A33-Y37 WeakPolarHBondContact O-CB 3.49Å; A33-Y37 PolarHBondContact O-N 3.32Å
34L91.1Very high83.9Confident88 Ų8885.6 Ų85.646%0.46145%0.447SS..Hα-helixtrans-62.8-42.2175.7-176.664.7000111.8L30 S31 S32 Y37 L38L30-L34 WeakPolarHBondContact O-CB 3.42Å; L30-L34 PolarHBondContact O-N 3.29Å; S31-L34 PolarHBondContact O-N 2.93Å; S32-L34 VanDerWaalsContact C-N 3.35Å; S32-L34 PolarHBondContact O-N 3.47Å; L34-Y37 PolarHBondContact O-N 3.38Å; L34-L38 HydrophobicContact CD1-CD1 3.81Å; L34-L38 HydrophobicContact CD1-CG 3.97Å; L34-L38 HydrophobicContact CD2-CD1 4.43Å; L34-L38 HydrophobicContact CG-CD1 3.81Å; L34-L38 HydrophobicContact CG-CG 4.3Å; L34-L38 WeakPolarHBondContact O-CB 3.43Å; L34-L38 VanDerWaalsContact O-CG 3.31Å; L34-L38 WeakPolarHBondContact O-CG 3.33Å; L34-L38 PolarHBondContact O-N 2.99Å
35Y89.4Confident83.3Confident41 Ų4187 Ų8716%0.16146%0.456CS..Hα-helixtrans-59.4-48.5175.3166.4-102000111.7S31 S32 Y37 L38 W39 V52 K53S31-Y35 WeakPolarHBondContact O-CB 3.42Å; S31-Y35 PolarHBondContact O-N 2.85Å; S32-Y35 PolarHBondContact O-N 3.44Å; Y35-Y37 VanDerWaalsContact C-N 3.33Å; Y35-Y37 PolarHBondContact O-N 3.19Å; Y35-L38 PolarHBondContact O-N 2.86Å; Y35-W39 HydrophobicContact CE1-CE3 4.07Å; Y35-W39 HydrophobicContact CE1-CZ3 4.34Å; Y35-W39 AromaticContact CE2-CE3 3.79Å; Y35-W39 HydrophobicContact CE2-CE3 3.79Å; Y35-W39 AromaticContact CE2-CZ3 3.92Å; Y35-W39 HydrophobicContact CE2-CZ3 3.92Å; Y35-W39 AromaticContact CZ-CE3 3.48Å; Y35-W39 VanDerWaalsContact CZ-CE3 3.48Å; Y35-W39 AromaticContact CZ-CZ3 3.48Å; Y35-W39 VanDerWaalsContact CZ-CZ3 3.48Å; Y35-W39 WeakPolarHBondContact O-CB 3.31Å; Y35-W39 PolarHBondContact O-N 3.41Å; Y35-W39 WeakPolarHBondContact OH-CZ3 3.34Å; Y35-V52 HydrophobicContact CD2-CG1 4.26Å; Y35-K53 HydrophobicContact CD2-CB 4.29Å; Y35-K53 HydrophobicContact CD2-CG 4.5Å; Y35-K53 HydrophobicContact CE2-CB 3.8Å; Y35-K53 HydrophobicContact CE2-CD 4.43Å; Y35-K53 HydrophobicContact CE2-CG 3.63Å; Y35-K53 PolarHBondContact OH-NZ 3.47Å
36F87.8Confident83Confident148 Ų14887.5 Ų87.565%0.64946%0.461SS*.Hα-helixtrans-67.8-31.3177-74.2-64.5000113.1S32 A33 W39S32-F36 WeakPolarHBondContact O-CD2 3.42Å; S32-F36 PolarHBondContact O-N 2.97Å; A33-F36 PolarHBondContact O-N 3.46Å; F36-W39 WeakPolarHBondContact O-CB 3.22Å; F36-W39 PolarHBondContact O-N 2.88Å
37Y87.9Confident82.7Confident191 Ų19188.2 Ų88.275%0.74947%0.47SS*.Hα-helixtrans-69.8-41.1175.5176.8-100.4000112.3A33 L34 Y35 W39A33-Y37 VanDerWaalsContact O-CB 3.26Å; A33-Y37 WeakPolarHBondContact O-CB 3.49Å; A33-Y37 PolarHBondContact O-N 3.32Å; L34-Y37 PolarHBondContact O-N 3.38Å; Y35-Y37 VanDerWaalsContact C-N 3.33Å; Y35-Y37 PolarHBondContact O-N 3.19Å; Y37-W39 VanDerWaalsContact C-N 3.26Å
38L84.4Confident82.3Confident78 Ų7890.9 Ų90.941%0.40849%0.485SS..SBendtrans-82.3-3.4177.5-65.7177.3000113.1L34 Y35 T40 L43 V52L34-L38 HydrophobicContact CD1-CD1 3.81Å; L34-L38 HydrophobicContact CD1-CG 3.97Å; L34-L38 HydrophobicContact CD2-CD1 4.43Å; L34-L38 HydrophobicContact CG-CD1 3.81Å; L34-L38 HydrophobicContact CG-CG 4.3Å; L34-L38 WeakPolarHBondContact O-CB 3.43Å; L34-L38 VanDerWaalsContact O-CG 3.31Å; L34-L38 WeakPolarHBondContact O-CG 3.33Å; L34-L38 PolarHBondContact O-N 2.99Å; Y35-L38 PolarHBondContact O-N 2.86Å; L38-T40 PolarHBondContact O-N 3.48Å; L38-L43 WeakPolarHBondContact O-CD1 3.41Å; L38-V52 HydrophobicContact CD1-CG1 4.29Å
39W77.1Confident82Confident107 Ų10790.1 Ų90.141%0.40548%0.484SS..  trans-64.3100.7-178.5-178.5-90.8000110.2Y35 F36 Y37Y35-W39 HydrophobicContact CE1-CE3 4.07Å; Y35-W39 HydrophobicContact CE1-CZ3 4.34Å; Y35-W39 AromaticContact CE2-CE3 3.79Å; Y35-W39 HydrophobicContact CE2-CE3 3.79Å; Y35-W39 AromaticContact CE2-CZ3 3.92Å; Y35-W39 HydrophobicContact CE2-CZ3 3.92Å; Y35-W39 AromaticContact CZ-CE3 3.48Å; Y35-W39 VanDerWaalsContact CZ-CE3 3.48Å; Y35-W39 AromaticContact CZ-CZ3 3.48Å; Y35-W39 VanDerWaalsContact CZ-CZ3 3.48Å; Y35-W39 WeakPolarHBondContact O-CB 3.31Å; Y35-W39 PolarHBondContact O-N 3.41Å; Y35-W39 WeakPolarHBondContact OH-CZ3 3.34Å; F36-W39 WeakPolarHBondContact O-CB 3.22Å; F36-W39 PolarHBondContact O-N 2.88Å; Y37-W39 VanDerWaalsContact C-N 3.26Å
40T66.4Low81.8Confident77 Ų7784.7 Ų84.747%0.47246%0.461SS..  trans-119.6128.7167.756.30000109.4L38 D42 L43L38-T40 PolarHBondContact O-N 3.48Å; T40-D42 PolarHBondContact O-N 3.2Å; T40-D42 VanDerWaalsContact O-N 3.09Å; T40-L43 PolarHBondContact O-N 3.44Å; T40-L43 WeakPolarHBondContact OG1-CD1 3.47Å; T40-L43 WeakPolarHBondContact OG1-CG 3.45Å
41P59Low81.6Confident114 Ų11480.9 Ų80.974%0.7445%0.451SS*.THydrogen-bonded Turntrans-64.2-15.5-174.723-31.5000113.9
42D56.3Low81.5Confident150 Ų15081.9 Ų81.980%0.80246%0.456SS*.THydrogen-bonded Turntrans-102.611.7-176.8-57.7-49.3000114.3T40 V44T40-D42 PolarHBondContact O-N 3.2Å; T40-D42 VanDerWaalsContact O-N 3.09Å; D42-V44 PolarHBondContact O-N 3.43Å
43L59.1Low81.5Confident93 Ų9382.1 Ų82.149%0.48745%0.454SS..PPolyproline II helixtrans-63.4121.2176.8-91.4149.8000110.8L38 T40L38-L43 WeakPolarHBondContact O-CD1 3.41Å; T40-L43 PolarHBondContact O-N 3.44Å; T40-L43 WeakPolarHBondContact OG1-CD1 3.47Å; T40-L43 WeakPolarHBondContact OG1-CG 3.45Å
44V72.8Confident81.5Confident113 Ų11379.4 Ų79.469%0.68543%0.432SS*.PPolyproline II helixtrans-53.4130.3172.1-179.20000109D42 S46D42-V44 PolarHBondContact O-N 3.43Å; V44-S46 PolarHBondContact O-N 3.31Å
45P78.9Confident81.7Confident68 Ų6876.5 Ų76.544%0.44242%0.421SS..PPolyproline II helixtrans-58.3117.1178.624.4-34.3000109.4V91P45-V91 HydrophobicContact CB-CG1 3.86Å; P45-V91 WeakPolarHBondContact CB-O 3.31Å
46S86.2Confident81.9Confident41 Ų4175.1 Ų75.129%0.28742%0.416SS..  trans-141.7156.8-173.868.10000110.5V44 V48 S49 A50V44-S46 PolarHBondContact O-N 3.31Å; S46-V48 PolarHBondContact O-N 2.87Å; S46-S49 PolarHBondContact N-OG 3.04Å; S46-S49 VanDerWaalsContact N-OG 3.14Å; S46-S49 PolarHBondContact O-N 2.99Å; S46-S49 PolarHBondContact O-OG 3.46Å; S46-S49 PolarHBondContact OG-N 3.29Å; S46-S49 VanDerWaalsContact OG-N 3.13Å; S46-S49 PolarHBondContact OG-OG 3.5Å; S46-A50 PolarHBondContact O-N 3.41Å
47V87.1Confident82.2Confident114 Ų11468.9 Ų68.969%0.69139%0.39SS*.Hα-helixtrans-59.6-31.4175.2-179.10000111.1G51 W92V47-G51 PolarHBondContact O-N 2.95Å; V47-W92 HydrophobicContact CG2-CH2 4.37Å; V47-W92 HydrophobicContact CG2-CZ2 4.33Å
48V87.2Confident82.6Confident111 Ų11163.5 Ų63.567%0.67337%0.374SS*.Hα-helixtrans-67.9-46.3176.8-178.90000111S46 A50 G51 V52S46-V48 PolarHBondContact O-N 2.87Å; V48-A50 VanDerWaalsContact C-N 3.3Å; V48-A50 PolarHBondContact O-N 3.39Å; V48-G51 PolarHBondContact O-N 3.21Å; V48-V52 HydrophobicContact CG1-CG2 4.4Å; V48-V52 WeakPolarHBondContact O-CG2 3.36Å; V48-V52 PolarHBondContact O-N 2.95Å
49S86.9Confident83.1Confident25 Ų2562.5 Ų62.518%0.17537%0.369CS..Hα-helixtrans-65.7-34.4177.658.70000112.2S46 V52 K53 V91S46-S49 PolarHBondContact N-OG 3.04Å; S46-S49 VanDerWaalsContact N-OG 3.14Å; S46-S49 PolarHBondContact O-N 2.99Å; S46-S49 PolarHBondContact O-OG 3.46Å; S46-S49 PolarHBondContact OG-N 3.29Å; S46-S49 VanDerWaalsContact OG-N 3.13Å; S46-S49 PolarHBondContact OG-OG 3.5Å; S49-V52 PolarHBondContact O-N 3.16Å; S49-K53 VanDerWaalsContact O-CB 3.31Å; S49-K53 WeakPolarHBondContact O-CB 3.36Å; S49-K53 PolarHBondContact O-N 2.92Å; S49-V91 WeakPolarHBondContact OG-CG1 3.42Å
50A89.9Confident83.9Confident4 Ų459.1 Ų59.13%0.03336%0.359CS..Hα-helixtrans-61.7-47170.800000111.8S46 V48 V52 K53 A54 C88 V91 W92S46-A50 PolarHBondContact O-N 3.41Å; V48-A50 VanDerWaalsContact C-N 3.3Å; V48-A50 PolarHBondContact O-N 3.39Å; A50-V52 PolarHBondContact O-N 3.29Å; A50-K53 PolarHBondContact O-N 2.99Å; A50-A54 WeakPolarHBondContact O-CB 3.07Å; A50-A54 PolarHBondContact O-N 3.21Å; A50-C88 HydrophobicContact CB-CB 4.37Å; A50-V91 VanDerWaalsContact CA-CG2 3.48Å; A50-V91 HydrophobicContact CB-CB 4.15Å; A50-V91 HydrophobicContact CB-CG1 4.46Å; A50-V91 HydrophobicContact CB-CG2 3.8Å; A50-W92 HydrophobicContact CB-CH2 3.88Å; A50-W92 HydrophobicContact CB-CZ3 3.89Å
51G89.4Confident85.3Confident38 Ų3855.6 Ų55.639%0.39234%0.337SS..Hα-helixtrans-60.4-45175.600000112.9V47 V48 K53 A54 A55V47-G51 PolarHBondContact O-N 2.95Å; V48-G51 PolarHBondContact O-N 3.21Å; G51-K53 VanDerWaalsContact C-N 3.33Å; G51-K53 PolarHBondContact O-N 3.47Å; G51-A54 PolarHBondContact O-N 2.85Å; G51-A55 WeakPolarHBondContact O-CB 3.41Å; G51-A55 PolarHBondContact O-N 3.49Å
52V90.9Very high86.9Confident39 Ų3954.2 Ų54.224%0.23633%0.327CS..Hα-helixtrans-65.1-37.1178.6174.90000111.4Y35 L38 V48 S49 A50 P56Y35-V52 HydrophobicContact CD2-CG1 4.26Å; L38-V52 HydrophobicContact CD1-CG1 4.29Å; V48-V52 HydrophobicContact CG1-CG2 4.4Å; V48-V52 WeakPolarHBondContact O-CG2 3.36Å; V48-V52 PolarHBondContact O-N 2.95Å; S49-V52 PolarHBondContact O-N 3.16Å; A50-V52 PolarHBondContact O-N 3.29Å; V52-P56 WeakPolarHBondContact O-CD 3.42Å
53K90.9Very high88.7Confident28 Ų2847.8 Ų47.812%0.12229%0.293CS..Hα-helixtrans-69.2-41177.1-169.8175.8176.5890112.7Y35 S49 A50 G51 P56 D87 V91Y35-K53 HydrophobicContact CD2-CB 4.29Å; Y35-K53 HydrophobicContact CD2-CG 4.5Å; Y35-K53 HydrophobicContact CE2-CB 3.8Å; Y35-K53 HydrophobicContact CE2-CD 4.43Å; Y35-K53 HydrophobicContact CE2-CG 3.63Å; Y35-K53 PolarHBondContact OH-NZ 3.47Å; S49-K53 VanDerWaalsContact O-CB 3.31Å; S49-K53 WeakPolarHBondContact O-CB 3.36Å; S49-K53 PolarHBondContact O-N 2.92Å; A50-K53 PolarHBondContact O-N 2.99Å; G51-K53 VanDerWaalsContact C-N 3.33Å; G51-K53 PolarHBondContact O-N 3.47Å; K53-P56 WeakPolarHBondContact O-CD 3.21Å; K53-D87 WeakPolarHBondContact CD-O 3.42Å; K53-D87 HydrophobicContact CG-CB 4.07Å; K53-V91 HydrophobicContact CD-CG2 4.08Å
54A93.5Very high90.2Very high0 Ų044.5 Ų44.50%028%0.277CS..Hα-helixtrans-84.3-16.118000000114.3A50 G51 T57 L58 A84 D87 C88A50-A54 WeakPolarHBondContact O-CB 3.07Å; A50-A54 PolarHBondContact O-N 3.21Å; G51-A54 PolarHBondContact O-N 2.85Å; A54-T57 PolarHBondContact O-N 3.37Å; A54-T57 PolarHBondContact O-OG1 2.97Å; A54-L58 WeakPolarHBondContact O-CG 3.32Å; A54-L58 PolarHBondContact O-N 3.39Å; A54-A84 HydrophobicContact CB-CB 4.18Å; A54-A84 WeakPolarHBondContact CB-O 3.19Å; A54-D87 HydrophobicContact CB-CB 3.96Å; A54-C88 WeakPolarHBondContact CB-SG 3.34Å
55A93.8Very high91.1Very high27 Ų2741.5 Ų41.522%0.22326%0.256CS..Hα-helixtrans-58-44.8-176.400000113.9S31 G51 T57 L58 L59S31-A55 WeakPolarHBondContact OG-CB 3.35Å; G51-A55 WeakPolarHBondContact O-CB 3.41Å; G51-A55 PolarHBondContact O-N 3.49Å; A55-T57 PolarHBondContact O-N 2.84Å; A55-L58 PolarHBondContact O-N 3.34Å; A55-L59 WeakPolarHBondContact O-CB 3.47Å; A55-L59 VanDerWaalsContact O-CG 3.24Å; A55-L59 WeakPolarHBondContact O-CG 3.29Å; A55-L59 PolarHBondContact O-N 3.22Å
56P94.1Very high91.6Very high11 Ų1142.3 Ų42.37%0.07126%0.264CS..Hα-helixtrans-58.8-48.2177-22.433000112F28 S31 S32 V52 K53 L58 L59 L60F28-P56 HydrophobicContact CD2-CB 4.07Å; F28-P56 VanDerWaalsContact CD2-O 3.25Å; F28-P56 WeakPolarHBondContact CD2-O 3.4Å; F28-P56 HydrophobicContact CE2-CB 4.06Å; S31-P56 WeakPolarHBondContact OG-CD 3.25Å; S32-P56 WeakPolarHBondContact OG-CB 3.42Å; V52-P56 WeakPolarHBondContact O-CD 3.42Å; K53-P56 WeakPolarHBondContact O-CD 3.21Å; P56-L58 PolarHBondContact O-N 2.91Å; P56-L59 PolarHBondContact O-N 2.99Å; P56-L60 PolarHBondContact O-N 3.23Å
57T94.4Very high91.8Very high17 Ų1744.7 Ų44.710%0.10427%0.267CS..Hα-helixtrans-65.6-38.3-177.744.20000111.9A54 A55 L60 A61 A84 D87 F197A54-T57 PolarHBondContact O-N 3.37Å; A54-T57 PolarHBondContact O-OG1 2.97Å; A55-T57 PolarHBondContact O-N 2.84Å; T57-L60 PolarHBondContact O-N 3.48Å; T57-A61 PolarHBondContact O-N 3.36Å; T57-A84 WeakPolarHBondContact OG1-CA 3.41Å; T57-A84 WeakPolarHBondContact OG1-CB 3.29Å; T57-D87 WeakPolarHBondContact CG2-OD2 3.11Å; T57-D87 PolarHBondContact OG1-OD2 3.44Å; T57-F197 HydrophobicContact CG2-CZ 4.46Å
58L95.6Very high91.7Very high79 Ų7943.6 Ų43.641%0.41426%0.257SS..Hα-helixtrans-66.7-40.2173.4-71.3176.6000113.8A54 A55 P56 L60 A61 T62 A84A54-L58 WeakPolarHBondContact O-CG 3.32Å; A54-L58 PolarHBondContact O-N 3.39Å; A55-L58 PolarHBondContact O-N 3.34Å; P56-L58 PolarHBondContact O-N 2.91Å; L58-L60 VanDerWaalsContact C-N 3.32Å; L58-A61 WeakPolarHBondContact O-CB 3.46Å; L58-A61 PolarHBondContact O-N 3.04Å; L58-T62 PolarHBondContact O-N 3.41Å; L58-T62 PolarHBondContact O-OG1 3.29Å; L58-A84 HydrophobicContact CD1-CB 4.44Å; L58-A84 HydrophobicContact CD2-CB 3.43Å; L58-A84 VanDerWaalsContact CD2-CB 3.43Å; L58-A84 HydrophobicContact CG-CB 3.53Å
59L95.6Very high91.6Very high57 Ų5739.8 Ų39.830%0.29824%0.241SC..Hα-helixtrans-64.4-41.6176.2-72.7167.6000110.5P27 F28 S31 A55 P56 A61 T62 V63P27-L59 HydrophobicContact CB-CD1 4.27Å; P27-L59 HydrophobicContact CB-CD2 4.28Å; P27-L59 WeakPolarHBondContact O-CD1 3.4Å; F28-L59 HydrophobicContact CB-CB 4.41Å; S31-L59 VanDerWaalsContact CB-CD1 3.49Å; A55-L59 WeakPolarHBondContact O-CB 3.47Å; A55-L59 VanDerWaalsContact O-CG 3.24Å; A55-L59 WeakPolarHBondContact O-CG 3.29Å; A55-L59 PolarHBondContact O-N 3.22Å; P56-L59 PolarHBondContact O-N 2.99Å; L59-A61 VanDerWaalsContact C-N 3.34Å; L59-A61 PolarHBondContact O-N 3.41Å; L59-T62 WeakPolarHBondContact O-CB 3.18Å; L59-T62 PolarHBondContact O-N 2.82Å; L59-V63 WeakPolarHBondContact O-CG2 3.48Å; L59-V63 PolarHBondContact O-N 3.1Å
60L94.4Very high91.2Very high36 Ų3641.2 Ų41.219%0.18826%0.259CS..Hα-helixtrans-62.6-41.3173.9-171.559.3000111.6L25 F28 P56 T57 L58 T62 V63 V64 L80L25-L60 HydrophobicContact CD2-CD1 3.79Å; F28-L60 HydrophobicContact CD2-CB 3.86Å; F28-L60 HydrophobicContact CE2-CB 4.22Å; F28-L60 HydrophobicContact CE2-CD2 4.12Å; F28-L60 HydrophobicContact CG-CB 4.36Å; F28-L60 HydrophobicContact CG-CD1 4.44Å; F28-L60 HydrophobicContact CZ-CD2 4.33Å; P56-L60 PolarHBondContact O-N 3.23Å; T57-L60 PolarHBondContact O-N 3.48Å; L58-L60 VanDerWaalsContact C-N 3.32Å; L60-T62 VanDerWaalsContact C-N 3.3Å; L60-T62 PolarHBondContact O-N 3.19Å; L60-V63 PolarHBondContact O-N 3.1Å; L60-V64 WeakPolarHBondContact O-CG2 3.33Å; L60-V64 PolarHBondContact O-N 3.43Å; L60-L80 HydrophobicContact CB-CD1 4.45Å; L60-L80 HydrophobicContact CB-CD2 4.49Å; L60-L80 HydrophobicContact CD2-CD1 4.39Å; L60-L80 HydrophobicContact CD2-CD2 3.82Å; L60-L80 HydrophobicContact CG-CD1 3.96Å; L60-L80 HydrophobicContact CG-CD2 4.18Å
61A94.5Very high90.9Very high2 Ų247.9 Ų47.92%0.01729%0.29CS..Hα-helixtrans-57.9-43.7174.400000111.7T57 L58 L59 V63 V64 L65 L80 I81T57-A61 PolarHBondContact O-N 3.36Å; L58-A61 WeakPolarHBondContact O-CB 3.46Å; L58-A61 PolarHBondContact O-N 3.04Å; L59-A61 VanDerWaalsContact C-N 3.34Å; L59-A61 PolarHBondContact O-N 3.41Å; A61-V63 PolarHBondContact O-N 2.94Å; A61-V64 PolarHBondContact O-N 3.49Å; A61-L65 WeakPolarHBondContact O-CB 3.45Å; A61-L65 VanDerWaalsContact O-CG 3.29Å; A61-L65 WeakPolarHBondContact O-CG 3.45Å; A61-L65 PolarHBondContact O-N 3.2Å; A61-L80 HydrophobicContact CB-CB 3.62Å; A61-L80 HydrophobicContact CB-CD1 4.35Å; A61-I81 HydrophobicContact CB-CG1 4.13Å
62T93.3Very high90.6Very high85 Ų8546.8 Ų46.852%0.52128%0.276SS..Hα-helixtrans-63.9-40.3178.7-55.40000111.9L58 L59 L60 L65 S66L58-T62 PolarHBondContact O-N 3.41Å; L58-T62 PolarHBondContact O-OG1 3.29Å; L59-T62 WeakPolarHBondContact O-CB 3.18Å; L59-T62 PolarHBondContact O-N 2.82Å; L60-T62 VanDerWaalsContact C-N 3.3Å; L60-T62 PolarHBondContact O-N 3.19Å; T62-L65 PolarHBondContact O-N 3.22Å; T62-S66 WeakPolarHBondContact O-CB 3.47Å; T62-S66 PolarHBondContact O-N 3.4Å; T62-S66 PolarHBondContact O-OG 3.29Å
63V93.6Very high90.2Very high16 Ų1648.2 Ų48.210%0.09729%0.285CS..Hα-helixtrans-63.6-46.7173.8175.10000110.5S24 L25 L59 L60 A61 L65 S66 W67S24-V63 WeakPolarHBondContact O-CG2 3.48Å; L25-V63 HydrophobicContact CD2-CB 4.5Å; L25-V63 HydrophobicContact CD2-CG1 3.96Å; L25-V63 HydrophobicContact CG-CG1 4.48Å; L59-V63 WeakPolarHBondContact O-CG2 3.48Å; L59-V63 PolarHBondContact O-N 3.1Å; L60-V63 PolarHBondContact O-N 3.1Å; A61-V63 PolarHBondContact O-N 2.94Å; V63-L65 VanDerWaalsContact C-N 3.3Å; V63-L65 PolarHBondContact O-N 2.93Å; V63-S66 WeakPolarHBondContact CA-OG 3.37Å; V63-S66 PolarHBondContact O-N 2.97Å; V63-S66 PolarHBondContact O-OG 2.95Å; V63-W67 PolarHBondContact O-N 3.26Å; V63-W67 VanDerWaalsContact O-N 3.12Å
64V91.5Very high89.9Confident24 Ų2453.7 Ų53.715%0.14532%0.315CS..Hα-helixtrans-61.1-40.2178.3171.10000111.5L60 A61 N68 S72 V76 A77 L80L60-V64 WeakPolarHBondContact O-CG2 3.33Å; L60-V64 PolarHBondContact O-N 3.43Å; A61-V64 PolarHBondContact O-N 3.49Å; V64-N68 VanDerWaalsContact O-CB 3.31Å; V64-N68 WeakPolarHBondContact O-CB 3.44Å; V64-N68 PolarHBondContact O-N 3.42Å; V64-N68 PolarHBondContact O-ND2 2.94Å; V64-S72 WeakPolarHBondContact CG1-OG 3.47Å; V64-V76 HydrophobicContact CG1-CB 4.15Å; V64-V76 HydrophobicContact CG1-CG1 4.13Å; V64-V76 HydrophobicContact CG2-CG1 4.39Å; V64-A77 HydrophobicContact CG1-CB 4.04Å; V64-L80 HydrophobicContact CB-CD1 4.22Å; V64-L80 HydrophobicContact CG2-CD1 3.75Å
65L91.5Very high89.7Confident49 Ų4954 Ų5426%0.25732%0.317SS..Hα-helixtrans-65.7-45176.9-75.9163.4000112.9A61 T62 V63 W67 G69 V73 A77A61-L65 WeakPolarHBondContact O-CB 3.45Å; A61-L65 VanDerWaalsContact O-CG 3.29Å; A61-L65 WeakPolarHBondContact O-CG 3.45Å; A61-L65 PolarHBondContact O-N 3.2Å; T62-L65 PolarHBondContact O-N 3.22Å; V63-L65 VanDerWaalsContact C-N 3.3Å; V63-L65 PolarHBondContact O-N 2.93Å; L65-W67 VanDerWaalsContact C-N 3.3Å; L65-W67 PolarHBondContact O-N 3.23Å; L65-G69 WeakPolarHBondContact O-CA 3.16Å; L65-G69 PolarHBondContact O-N 3.43Å; L65-V73 HydrophobicContact CD2-CG2 3.37Å; L65-A77 HydrophobicContact CD1-CB 4.23Å; L65-A77 HydrophobicContact CD2-CB 3.55Å; L65-A77 HydrophobicContact CG-CB 3.54Å
66S90.1Very high89.6Confident86 Ų8653.9 Ų53.960%0.60131%0.314SS*.Hα-helixtrans-66.7-32.7-178.452.70000112.5T62 V63T62-S66 WeakPolarHBondContact O-CB 3.47Å; T62-S66 PolarHBondContact O-N 3.4Å; T62-S66 PolarHBondContact O-OG 3.29Å; V63-S66 WeakPolarHBondContact CA-OG 3.37Å; V63-S66 PolarHBondContact O-N 2.97Å; V63-S66 PolarHBondContact O-OG 2.95Å
67W88.8Confident89.6Confident90 Ų9053.4 Ų53.434%0.34131%0.311SS..Hα-helixtrans-88.7-34.4-179.2-76.273.9000114.2M17 A20 L21 S24 V63 L65M17-W67 HydrophobicContact CE-CH2 4.38Å; M17-W67 HydrophobicContact CE-CZ3 3.68Å; M17-W67 WeakPolarHBondContact O-CH2 3.13Å; A20-W67 HydrophobicContact CB-CH2 3.91Å; A20-W67 HydrophobicContact CB-CZ2 3.95Å; L21-W67 HydrophobicContact CB-CH2 3.82Å; L21-W67 HydrophobicContact CB-CZ2 3.88Å; L21-W67 HydrophobicContact CB-CZ3 4.38Å; L21-W67 HydrophobicContact CD1-CE3 4.39Å; L21-W67 HydrophobicContact CD1-CZ3 4.42Å; S24-W67 PolarHBondContact OG-NE1 3.45Å; V63-W67 PolarHBondContact O-N 3.26Å; V63-W67 VanDerWaalsContact O-N 3.12Å; L65-W67 VanDerWaalsContact C-N 3.3Å; L65-W67 PolarHBondContact O-N 3.23Å
68N85.4Confident89.6Confident91 Ų9152.9 Ų52.949%0.48731%0.309SS..Hα-helixtrans-104.4-6.9-176.4-61.6-74.5000113.8V64V64-N68 VanDerWaalsContact O-CB 3.31Å; V64-N68 WeakPolarHBondContact O-CB 3.44Å; V64-N68 PolarHBondContact O-N 3.42Å; V64-N68 PolarHBondContact O-ND2 2.94Å
69G85Confident89.6Confident32 Ų3249.1 Ų49.133%0.3329%0.289SS..  trans72.2-178.2-177.100000113.9L65 Q71 S72L65-G69 WeakPolarHBondContact O-CA 3.16Å; L65-G69 PolarHBondContact O-N 3.43Å; G69-Q71 PolarHBondContact O-N 2.88Å; G69-Q71 VanDerWaalsContact O-N 3.1Å; G69-S72 WeakPolarHBondContact O-CB 3.48Å; G69-S72 PolarHBondContact O-N 2.9Å
70G80Confident89.6Confident55 Ų5546.6 Ų46.657%0.56728%0.276SS*.G310 helixtrans-62.2-19.6-174.700000115.2S72 V73G70-S72 PolarHBondContact O-N 3.27Å; G70-V73 VanDerWaalsContact O-CB 3.28Å; G70-V73 WeakPolarHBondContact O-CB 3.24Å; G70-V73 WeakPolarHBondContact O-CG2 3.43Å; G70-V73 PolarHBondContact O-N 2.93Å
71Q81.9Confident89.7Confident143 Ų14348 Ų4867%0.66828%0.283SS*.G310 helixtrans-63.4-22.1174.5-64.1-62.9-48.200112.6G69 V73G69-Q71 PolarHBondContact O-N 2.88Å; G69-Q71 VanDerWaalsContact O-N 3.1Å; Q71-V73 VanDerWaalsContact C-N 3.26Å; Q71-V73 PolarHBondContact O-N 3.45Å
72S83.6Confident89.8Confident15 Ų1552 Ų5211%0.10530%0.3CS..G310 helixtrans-73.2-15.6175.4-163.60000113.5V64 G69 G70 L74 G75 V76 A77V64-S72 WeakPolarHBondContact CG1-OG 3.47Å; G69-S72 WeakPolarHBondContact O-CB 3.48Å; G69-S72 PolarHBondContact O-N 2.9Å; G70-S72 PolarHBondContact O-N 3.27Å; S72-L74 VanDerWaalsContact C-N 3.28Å; S72-L74 PolarHBondContact O-N 3.21Å; S72-G75 CarbonylContact O-C 3.3Å; S72-G75 VanDerWaalsContact O-C 3.3Å; S72-G75 WeakPolarHBondContact O-CA 3.45Å; S72-G75 PolarHBondContact O-N 3.13Å; S72-V76 PolarHBondContact O-N 3.04Å; S72-A77 WeakPolarHBondContact O-CB 3.4Å; S72-A77 PolarHBondContact O-N 2.92Å
73V82.8Confident90Very high69 Ų6948 Ų4842%0.41828%0.275SS..G310 helixtrans-60.6-37.9178.11770000111.1L65 G70 Q71 G75 G78L65-V73 HydrophobicContact CD2-CG2 3.37Å; G70-V73 VanDerWaalsContact O-CB 3.28Å; G70-V73 WeakPolarHBondContact O-CB 3.24Å; G70-V73 WeakPolarHBondContact O-CG2 3.43Å; G70-V73 PolarHBondContact O-N 2.93Å; Q71-V73 VanDerWaalsContact C-N 3.26Å; Q71-V73 PolarHBondContact O-N 3.45Å; V73-G75 PolarHBondContact O-N 3.41Å; V73-G78 WeakPolarHBondContact O-CA 3.49Å; V73-G78 PolarHBondContact O-N 2.97Å
74L85.4Confident90.1Very high144 Ų14447.3 Ų47.375%0.75427%0.271SS*.G310 helixtrans-79.57.1175.4-67.2174.9000113.2S72S72-L74 VanDerWaalsContact C-N 3.28Å; S72-L74 PolarHBondContact O-N 3.21Å
75G89.6Confident90.3Very high5 Ų549.5 Ų49.55%0.05229%0.285CS..THydrogen-bonded Turntrans-137.9-120.3-179.600000113.5S72 V73 A77 G78 G79 T113S72-G75 CarbonylContact O-C 3.3Å; S72-G75 VanDerWaalsContact O-C 3.3Å; S72-G75 WeakPolarHBondContact O-CA 3.45Å; S72-G75 PolarHBondContact O-N 3.13Å; V73-G75 PolarHBondContact O-N 3.41Å; G75-A77 VanDerWaalsContact C-N 3.35Å; G75-A77 PolarHBondContact O-N 3.42Å; G75-G78 PolarHBondContact O-N 3.33Å; G75-G79 PolarHBondContact O-N 3.38Å; G75-T113 WeakPolarHBondContact CA-OG1 3.25Å
76V91.8Very high90.4Very high26 Ų2647.1 Ų47.116%0.15827%0.272CS..Hα-helixtrans-60.2-40.8-173.4-1780000112.4V64 S72 G79 L80 Y110 T113 F114V64-V76 HydrophobicContact CG1-CB 4.15Å; V64-V76 HydrophobicContact CG1-CG1 4.13Å; V64-V76 HydrophobicContact CG2-CG1 4.39Å; S72-V76 PolarHBondContact O-N 3.04Å; V76-G79 PolarHBondContact O-N 2.89Å; V76-L80 HydrophobicContact CG1-CD1 4Å; V76-L80 HydrophobicContact CG1-CG 4.43Å; V76-L80 WeakPolarHBondContact O-CG 3.37Å; V76-L80 PolarHBondContact O-N 3.03Å; V76-Y110 HydrophobicContact CG1-CD1 4.44Å; V76-Y110 HydrophobicContact CG1-CE1 4.12Å; V76-Y110 WeakPolarHBondContact O-CE1 3.49Å; V76-T113 HydrophobicContact CG2-CG2 3.88Å; V76-F114 HydrophobicContact CG2-CE1 4.27Å
77A93.4Very high90.6Very high0 Ų044 Ų440%025%0.249CC..Hα-helixtrans-67.1-39.9178.800000112.4V64 L65 S72 G75 L80 I81V64-A77 HydrophobicContact CG1-CB 4.04Å; L65-A77 HydrophobicContact CD1-CB 4.23Å; L65-A77 HydrophobicContact CD2-CB 3.55Å; L65-A77 HydrophobicContact CG-CB 3.54Å; S72-A77 WeakPolarHBondContact O-CB 3.4Å; S72-A77 PolarHBondContact O-N 2.92Å; G75-A77 VanDerWaalsContact C-N 3.35Å; G75-A77 PolarHBondContact O-N 3.42Å; A77-L80 PolarHBondContact O-N 3.19Å; A77-I81 VanDerWaalsContact O-CG1 3.29Å; A77-I81 WeakPolarHBondContact O-CG1 3.36Å; A77-I81 PolarHBondContact O-N 3.04Å
78G94.1Very high90.8Very high6 Ų641.7 Ų41.76%0.06225%0.246CC..Hα-helixtrans-61.9-44.917400000111.7V73 G75 L80 I81 F82V73-G78 WeakPolarHBondContact O-CA 3.49Å; V73-G78 PolarHBondContact O-N 2.97Å; G75-G78 PolarHBondContact O-N 3.33Å; G78-L80 VanDerWaalsContact C-N 3.31Å; G78-L80 PolarHBondContact O-N 2.92Å; G78-I81 PolarHBondContact O-N 2.89Å; G78-F82 WeakPolarHBondContact O-CD2 3.43Å; G78-F82 PolarHBondContact O-N 3.43Å
79G95.5Very high91.1Very high0 Ų038.4 Ų38.40%023%0.23CC..Hα-helixtrans-55.3-46.2173.400000111.9G75 V76 I81 F82 S83 A106 Y110G75-G79 PolarHBondContact O-N 3.38Å; V76-G79 PolarHBondContact O-N 2.89Å; G79-I81 VanDerWaalsContact C-N 3.34Å; G79-I81 PolarHBondContact O-N 3.38Å; G79-F82 PolarHBondContact O-N 3.29Å; G79-S83 PolarHBondContact O-N 2.91Å; G79-S83 PolarHBondContact O-OG 3.4Å; G79-S83 VanDerWaalsContact O-OG 3.1Å; G79-A106 WeakPolarHBondContact O-CB 2.91Å; G79-Y110 VanDerWaalsContact C-CZ 3.42Å; G79-Y110 PolarHBondContact O-OH 3.46Å
80L96.1Very high91.3Very high4 Ų438.2 Ų38.22%0.02122%0.221CC..Hα-helixtrans-65.4-35.9179.6-72.1165.8000112.7L60 A61 V64 V76 A77 G78 S83 A84 Y110 F197L60-L80 HydrophobicContact CB-CD1 4.45Å; L60-L80 HydrophobicContact CB-CD2 4.49Å; L60-L80 HydrophobicContact CD2-CD1 4.39Å; L60-L80 HydrophobicContact CD2-CD2 3.82Å; L60-L80 HydrophobicContact CG-CD1 3.96Å; L60-L80 HydrophobicContact CG-CD2 4.18Å; A61-L80 HydrophobicContact CB-CB 3.62Å; A61-L80 HydrophobicContact CB-CD1 4.35Å; V64-L80 HydrophobicContact CB-CD1 4.22Å; V64-L80 HydrophobicContact CG2-CD1 3.75Å; V76-L80 HydrophobicContact CG1-CD1 4Å; V76-L80 HydrophobicContact CG1-CG 4.43Å; V76-L80 WeakPolarHBondContact O-CG 3.37Å; V76-L80 PolarHBondContact O-N 3.03Å; A77-L80 PolarHBondContact O-N 3.19Å; G78-L80 VanDerWaalsContact C-N 3.31Å; G78-L80 PolarHBondContact O-N 2.92Å; L80-S83 PolarHBondContact O-N 2.9Å; L80-A84 PolarHBondContact O-N 3.43Å; L80-Y110 WeakPolarHBondContact CA-OH 3.45Å; L80-Y110 VanDerWaalsContact CD2-OH 3.32Å; L80-Y110 WeakPolarHBondContact CD2-OH 3.34Å; L80-Y110 HydrophobicContact CG-CE1 4.27Å; L80-Y110 WeakPolarHBondContact CG-OH 3.37Å; L80-Y110 PolarHBondContact N-OH 3.49Å; L80-F197 HydrophobicContact CD2-CE2 3.97Å; L80-F197 HydrophobicContact CD2-CZ 3.7Å
81I96.7Very high91.8Very high65 Ų6536.9 Ų36.933%0.33320%0.202SC..Hα-helixtrans-65.1-45.1173.7-67.8163.3000110.3A61 A77 G78 G79 S83 A84 V85A61-I81 HydrophobicContact CB-CG1 4.13Å; A77-I81 VanDerWaalsContact O-CG1 3.29Å; A77-I81 WeakPolarHBondContact O-CG1 3.36Å; A77-I81 PolarHBondContact O-N 3.04Å; G78-I81 PolarHBondContact O-N 2.89Å; G79-I81 VanDerWaalsContact C-N 3.34Å; G79-I81 PolarHBondContact O-N 3.38Å; I81-S83 VanDerWaalsContact C-N 3.34Å; I81-S83 PolarHBondContact O-N 3.49Å; I81-A84 WeakPolarHBondContact O-CB 3.28Å; I81-A84 PolarHBondContact O-N 2.85Å; I81-V85 WeakPolarHBondContact O-CG2 3.43Å; I81-V85 PolarHBondContact O-N 3.2Å
82F96.8Very high92.1Very high87 Ų8733.9 Ų33.938%0.38219%0.185SC..Hα-helixtrans-65.3-36.1175.4-86.7-76000112.5G78 G79 V85 G86 V105 A106 L109G78-F82 WeakPolarHBondContact O-CD2 3.43Å; G78-F82 PolarHBondContact O-N 3.43Å; G79-F82 PolarHBondContact O-N 3.29Å; F82-V85 PolarHBondContact O-N 3.05Å; F82-G86 PolarHBondContact O-N 2.93Å; F82-V105 HydrophobicContact CD1-CB 4.17Å; F82-V105 HydrophobicContact CD1-CG1 3.92Å; F82-V105 HydrophobicContact CD2-CG1 3.95Å; F82-V105 HydrophobicContact CE1-CB 4.44Å; F82-V105 HydrophobicContact CE1-CG1 3.91Å; F82-V105 HydrophobicContact CE2-CG1 3.94Å; F82-V105 HydrophobicContact CG-CB 4.39Å; F82-V105 HydrophobicContact CG-CG1 3.94Å; F82-V105 HydrophobicContact CZ-CG1 3.92Å; F82-A106 HydrophobicContact CB-CB 3.84Å; F82-L109 HydrophobicContact CD2-CD1 3.59Å; F82-L109 HydrophobicContact CE2-CD1 3.96Å
83S96.1Very high92.1Very high0 Ų038 Ų380%021%0.211CC..Hα-helixtrans-60.3-44.7171.2-62.70000111.3G79 L80 I81 V85 G86 D87 F103 A106 Y110 F197G79-S83 PolarHBondContact O-N 2.91Å; G79-S83 PolarHBondContact O-OG 3.4Å; G79-S83 VanDerWaalsContact O-OG 3.1Å; L80-S83 PolarHBondContact O-N 2.9Å; I81-S83 VanDerWaalsContact C-N 3.34Å; I81-S83 PolarHBondContact O-N 3.49Å; S83-V85 VanDerWaalsContact C-N 3.35Å; S83-V85 PolarHBondContact O-N 3.1Å; S83-G86 CarbonylContact O-C 3.57Å; S83-G86 WeakPolarHBondContact O-CA 2.9Å; S83-G86 PolarHBondContact O-N 3.25Å; S83-G86 VanDerWaalsContact O-N 3.12Å; S83-D87 PolarHBondContact O-N 2.92Å; S83-F103 WeakPolarHBondContact O-CE1 3.32Å; S83-F103 WeakPolarHBondContact O-CZ 3.34Å; S83-A106 WeakPolarHBondContact OG-CB 3.16Å; S83-Y110 PolarHBondContact OG-OH 3.43Å; S83-Y110 VanDerWaalsContact OG-OH 3.12Å; S83-F197 WeakPolarHBondContact OG-CE1 3.26Å
84A95.9Very high92.4Very high2 Ų242.8 Ų42.82%0.01723%0.229CC..Hα-helixtrans-63.9-37175.700000113.3A54 T57 L58 L80 I81 G86 D87 C88A54-A84 HydrophobicContact CB-CB 4.18Å; A54-A84 WeakPolarHBondContact CB-O 3.19Å; T57-A84 WeakPolarHBondContact OG1-CA 3.41Å; T57-A84 WeakPolarHBondContact OG1-CB 3.29Å; L58-A84 HydrophobicContact CD1-CB 4.44Å; L58-A84 HydrophobicContact CD2-CB 3.43Å; L58-A84 VanDerWaalsContact CD2-CB 3.43Å; L58-A84 HydrophobicContact CG-CB 3.53Å; L80-A84 PolarHBondContact O-N 3.43Å; I81-A84 WeakPolarHBondContact O-CB 3.28Å; I81-A84 PolarHBondContact O-N 2.85Å; A84-G86 VanDerWaalsContact C-N 3.32Å; A84-D87 WeakPolarHBondContact O-CB 3.28Å; A84-D87 PolarHBondContact O-N 3.37Å; A84-C88 PolarHBondContact O-N 3.06Å; A84-C88 PolarHBondContact O-SG 3.1Å
85V95.7Very high92.6Very high70 Ų7039 Ų3942%0.42421%0.209SC..Hα-helixtrans-62.9-42.9171.7172.50000110.3I81 F82 S83 D87 C88 C89 A102I81-V85 WeakPolarHBondContact O-CG2 3.43Å; I81-V85 PolarHBondContact O-N 3.2Å; F82-V85 PolarHBondContact O-N 3.05Å; S83-V85 VanDerWaalsContact C-N 3.35Å; S83-V85 PolarHBondContact O-N 3.1Å; V85-D87 PolarHBondContact O-N 3.21Å; V85-C88 WeakPolarHBondContact O-CB 3.38Å; V85-C88 PolarHBondContact O-N 3.17Å; V85-C89 PolarHBondContact O-N 3.35Å; V85-C89 PolarHBondContact O-SG 3.33Å; V85-C89 VanDerWaalsContact O-SG 3.34Å; V85-A102 HydrophobicContact CB-CB 4.4Å; V85-A102 HydrophobicContact CG1-CB 4.09Å
86G94.3Very high92.6Very high0 Ų040.3 Ų40.30%021%0.213CC..Hα-helixtrans-56-48.8172.500000112.2F82 S83 A84 C88 C89 L90 F103F82-G86 PolarHBondContact O-N 2.93Å; S83-G86 CarbonylContact O-C 3.57Å; S83-G86 WeakPolarHBondContact O-CA 2.9Å; S83-G86 PolarHBondContact O-N 3.25Å; S83-G86 VanDerWaalsContact O-N 3.12Å; A84-G86 VanDerWaalsContact C-N 3.32Å; G86-C88 VanDerWaalsContact C-N 3.32Å; G86-C88 PolarHBondContact O-N 3.03Å; G86-C89 PolarHBondContact O-N 2.94Å; G86-C89 VanDerWaalsContact O-N 3.14Å; G86-L90 VanDerWaalsContact O-CG 3.31Å; G86-L90 WeakPolarHBondContact O-CG 3.37Å; G86-L90 PolarHBondContact O-N 3.32Å; G86-F103 VanDerWaalsContact C-CZ 3.4Å
87D93.4Very high92.6Very high19 Ų1943 Ų4310%0.10223%0.226CC..Hα-helixtrans-56.1-44.9177-77-38.7000111.7K53 A54 T57 S83 A84 V85 L90 F103K53-D87 WeakPolarHBondContact CD-O 3.42Å; K53-D87 HydrophobicContact CG-CB 4.07Å; A54-D87 HydrophobicContact CB-CB 3.96Å; T57-D87 WeakPolarHBondContact CG2-OD2 3.11Å; T57-D87 PolarHBondContact OG1-OD2 3.44Å; S83-D87 PolarHBondContact O-N 2.92Å; A84-D87 WeakPolarHBondContact O-CB 3.28Å; A84-D87 PolarHBondContact O-N 3.37Å; V85-D87 PolarHBondContact O-N 3.21Å; D87-L90 PolarHBondContact O-N 2.99Å; D87-F103 HydrophobicContact CB-CZ 4.49Å; D87-F103 VanDerWaalsContact N-CZ 3.27Å; D87-F103 WeakPolarHBondContact OD1-CZ 3.46Å
88C92.6Very high92.6Very high42 Ų4249 Ų4928%0.28425%0.254SS..Hα-helixtrans-61.9-47175.3-75.10000112.2A50 A54 A84 V85 G86 L90 V91 W92A50-C88 HydrophobicContact CB-CB 4.37Å; A54-C88 WeakPolarHBondContact CB-SG 3.34Å; A84-C88 PolarHBondContact O-N 3.06Å; A84-C88 PolarHBondContact O-SG 3.1Å; V85-C88 WeakPolarHBondContact O-CB 3.38Å; V85-C88 PolarHBondContact O-N 3.17Å; G86-C88 VanDerWaalsContact C-N 3.32Å; G86-C88 PolarHBondContact O-N 3.03Å; C88-L90 VanDerWaalsContact C-N 3.3Å; C88-L90 PolarHBondContact O-N 3.37Å; C88-V91 PolarHBondContact O-N 3.37Å; C88-W92 VanDerWaalsContact O-CZ3 3.31Å; C88-W92 WeakPolarHBondContact O-CZ3 3.4Å
89C92.3Very high92.6Very high23 Ų2348.7 Ų48.716%0.15525%0.251CS..Hα-helixtrans-63.8-34.9-178.8-71.70000112.4V85 G86 V91 W92 L95 G99V85-C89 PolarHBondContact O-N 3.35Å; V85-C89 PolarHBondContact O-SG 3.33Å; V85-C89 VanDerWaalsContact O-SG 3.34Å; G86-C89 PolarHBondContact O-N 2.94Å; G86-C89 VanDerWaalsContact O-N 3.14Å; C89-V91 PolarHBondContact O-N 2.88Å; C89-W92 PolarHBondContact O-N 2.9Å; C89-W92 VanDerWaalsContact O-O 3.12Å; C89-L95 HydrophobicContact CB-CB 4.11Å; C89-L95 WeakPolarHBondContact O-CB 3.47Å; C89-G99 VanDerWaalsContact CB-CA 3.43Å
90L89.8Confident92.6Very high28 Ų2849.9 Ų49.915%0.14726%0.256CS..THydrogen-bonded Turntrans-65.6-16.4-179-74.7175.7000114.7G86 D87 C88 W92 F96 F103 L204G86-L90 VanDerWaalsContact O-CG 3.31Å; G86-L90 WeakPolarHBondContact O-CG 3.37Å; G86-L90 PolarHBondContact O-N 3.32Å; D87-L90 PolarHBondContact O-N 2.99Å; C88-L90 VanDerWaalsContact C-N 3.3Å; C88-L90 PolarHBondContact O-N 3.37Å; L90-W92 PolarHBondContact O-N 3.23Å; L90-F96 HydrophobicContact CD2-CD2 3.47Å; L90-F96 VanDerWaalsContact CD2-CD2 3.47Å; L90-F96 HydrophobicContact CD2-CE2 3.76Å; L90-F103 HydrophobicContact CD1-CD2 4.42Å; L90-F103 HydrophobicContact CD1-CE2 3.39Å; L90-F103 HydrophobicContact CD1-CZ 3.94Å; L90-F103 HydrophobicContact CG-CE2 3.94Å; L90-L204 HydrophobicContact CD1-CD1 3.9Å; L90-L204 HydrophobicContact CD1-CD2 3.25Å; L90-L204 HydrophobicContact CD1-CG 4.19Å; L90-L204 HydrophobicContact CD2-CD2 3.99Å; L90-L204 HydrophobicContact CG-CD2 4.25Å
91V89.3Confident92.5Very high27 Ų2751.3 Ų51.316%0.16427%0.272CS..THydrogen-bonded Turntrans-65.8-29.5176.3172.70000111.7P45 S49 A50 K53 C88 C89P45-V91 HydrophobicContact CB-CG1 3.86Å; P45-V91 WeakPolarHBondContact CB-O 3.31Å; S49-V91 WeakPolarHBondContact OG-CG1 3.42Å; A50-V91 VanDerWaalsContact CA-CG2 3.48Å; A50-V91 HydrophobicContact CB-CB 4.15Å; A50-V91 HydrophobicContact CB-CG1 4.46Å; A50-V91 HydrophobicContact CB-CG2 3.8Å; K53-V91 HydrophobicContact CD-CG2 4.08Å; C88-V91 PolarHBondContact O-N 3.37Å; C89-V91 PolarHBondContact O-N 2.88Å
92W88.1Confident92.5Very high80 Ų8048.8 Ų48.830%0.30326%0.261SS..SBendtrans-106.3126.2177.1-63.7-84.3000110.6V47 A50 C88 C89 L90 E94 L95 F96V47-W92 HydrophobicContact CG2-CH2 4.37Å; V47-W92 HydrophobicContact CG2-CZ2 4.33Å; A50-W92 HydrophobicContact CB-CH2 3.88Å; A50-W92 HydrophobicContact CB-CZ3 3.89Å; C88-W92 VanDerWaalsContact O-CZ3 3.31Å; C88-W92 WeakPolarHBondContact O-CZ3 3.4Å; C89-W92 PolarHBondContact O-N 2.9Å; C89-W92 VanDerWaalsContact O-O 3.12Å; L90-W92 PolarHBondContact O-N 3.23Å; W92-E94 PolarHBondContact O-N 3.38Å; W92-L95 HydrophobicContact CB-CB 4.36Å; W92-L95 HydrophobicContact CB-CD1 4.27Å; W92-L95 HydrophobicContact CB-CG 4.31Å; W92-L95 HydrophobicContact CE3-CD1 4.08Å; W92-L95 PolarHBondContact O-N 2.97Å; W92-F96 PolarHBondContact O-N 3.19Å
93P84.9Confident92.5Very high100 Ų10044.9 Ų44.965%0.64924%0.244SC*.G310 helixtrans-60.3-34.2-178.623.5-32.9000112.5L95 F96P93-L95 PolarHBondContact O-N 3.13Å; P93-F96 VanDerWaalsContact O-CB 3.23Å; P93-F96 WeakPolarHBondContact O-CB 3.46Å; P93-F96 PolarHBondContact O-N 3.45Å; P93-F96 VanDerWaalsContact O-N 3.16Å
94E88.2Confident92.5Very high170 Ų17045.8 Ų45.879%0.79425%0.251SS*.G310 helixtrans-63.3-26.1177.3-53.5-54.3150.700113.4W92W92-E94 PolarHBondContact O-N 3.38Å
95L90.4Very high92.6Very high65 Ų6548.4 Ų48.434%0.3427%0.267SS..G310 helixtrans-97.76.1-179.3-64.9179.2000112.5C89 W92 P93 I97 H98 G99C89-L95 HydrophobicContact CB-CB 4.11Å; C89-L95 WeakPolarHBondContact O-CB 3.47Å; W92-L95 HydrophobicContact CB-CB 4.36Å; W92-L95 HydrophobicContact CB-CD1 4.27Å; W92-L95 HydrophobicContact CB-CG 4.31Å; W92-L95 HydrophobicContact CE3-CD1 4.08Å; W92-L95 PolarHBondContact O-N 2.97Å; P93-L95 PolarHBondContact O-N 3.13Å; L95-I97 VanDerWaalsContact C-N 3.33Å; L95-I97 PolarHBondContact O-N 3.43Å; L95-H98 WeakPolarHBondContact O-CB 3.29Å; L95-H98 PolarHBondContact O-N 3.09Å; L95-H98 VanDerWaalsContact O-N 3.07Å; L95-G99 PolarHBondContact O-N 3.27Å
96F90.3Very high92.6Very high33 Ų3345.1 Ų45.115%0.14525%0.247CC..Hα-helixtrans-53.8-46.3-177.9177.6-105.2000113L90 W92 P93 H98 G99 M100 L164 V208 F209L90-F96 HydrophobicContact CD2-CD2 3.47Å; L90-F96 VanDerWaalsContact CD2-CD2 3.47Å; L90-F96 HydrophobicContact CD2-CE2 3.76Å; W92-F96 PolarHBondContact O-N 3.19Å; P93-F96 VanDerWaalsContact O-CB 3.23Å; P93-F96 WeakPolarHBondContact O-CB 3.46Å; P93-F96 PolarHBondContact O-N 3.45Å; P93-F96 VanDerWaalsContact O-N 3.16Å; F96-H98 PolarHBondContact O-N 3.26Å; F96-G99 PolarHBondContact O-N 3.32Å; F96-M100 HydrophobicContact CD1-CE 4.03Å; F96-M100 HydrophobicContact CE1-CE 3.22Å; F96-M100 HydrophobicContact CZ-CE 3.62Å; F96-M100 WeakPolarHBondContact O-CB 3.33Å; F96-M100 PolarHBondContact O-N 3.42Å; F96-L164 HydrophobicContact CD1-CD2 4.07Å; F96-L164 HydrophobicContact CE1-CD2 3.63Å; F96-V208 HydrophobicContact CD2-CG1 4.25Å; F96-V208 HydrophobicContact CE1-CG1 4.49Å; F96-V208 HydrophobicContact CE2-CB 4.33Å; F96-V208 HydrophobicContact CE2-CG1 3.75Å; F96-V208 HydrophobicContact CE2-CG2 3.99Å; F96-V208 HydrophobicContact CZ-CG1 3.88Å; F96-F209 HydrophobicContact CE1-CZ 4.13Å; F96-F209 HydrophobicContact CZ-CE2 4.48Å; F96-F209 HydrophobicContact CZ-CZ 4.04Å
97I91.3Very high92.7Very high81 Ų8145.1 Ų45.142%0.41525%0.247SC..Hα-helixtrans-65.6-39.9179.6-62.9168.3000111.1L95 M100 G101 L163L95-I97 VanDerWaalsContact C-N 3.33Å; L95-I97 PolarHBondContact O-N 3.43Å; I97-M100 PolarHBondContact O-N 3.02Å; I97-G101 PolarHBondContact O-N 3.35Å; I97-L163 HydrophobicContact CD1-CD2 3.71Å; I97-L163 HydrophobicContact CG1-CD2 4.48Å; I97-L163 HydrophobicContact CG2-CD2 4.49Å
98H93.8Very high92.8Very high127 Ų12747.9 Ų47.959%0.58826%0.261SS*.Hα-helixtrans-65.6-40.7176.5-64.987.4000111.1L95 F96 G101 A102L95-H98 WeakPolarHBondContact O-CB 3.29Å; L95-H98 PolarHBondContact O-N 3.09Å; L95-H98 VanDerWaalsContact O-N 3.07Å; F96-H98 PolarHBondContact O-N 3.26Å; H98-G101 PolarHBondContact O-N 3.41Å; H98-A102 PolarHBondContact O-N 3.27Å
99G94Very high92.9Very high0 Ų047.9 Ų47.90%026%0.258CS..Hα-helixtrans-62.7-47.1174.500000112.1C89 L95 F96 G101 A102 F103C89-G99 VanDerWaalsContact CB-CA 3.43Å; L95-G99 PolarHBondContact O-N 3.27Å; F96-G99 PolarHBondContact O-N 3.32Å; G99-G101 VanDerWaalsContact C-N 3.28Å; G99-G101 PolarHBondContact O-N 3.26Å; G99-A102 WeakPolarHBondContact O-CB 3.42Å; G99-A102 PolarHBondContact O-N 2.95Å; G99-A102 VanDerWaalsContact O-N 3.12Å; G99-F103 WeakPolarHBondContact O-CD2 3.45Å; G99-F103 PolarHBondContact O-N 2.93Å
100M94.6Very high93Very high24 Ų2447.1 Ų47.112%0.11825%0.252CS..Hα-helixtrans-57.6-42.2173.6-172.7-167.9-52.100111.6F96 I97 F103 A104 L164 V168 Y171F96-M100 HydrophobicContact CD1-CE 4.03Å; F96-M100 HydrophobicContact CE1-CE 3.22Å; F96-M100 HydrophobicContact CZ-CE 3.62Å; F96-M100 WeakPolarHBondContact O-CB 3.33Å; F96-M100 PolarHBondContact O-N 3.42Å; I97-M100 PolarHBondContact O-N 3.02Å; M100-F103 PolarHBondContact O-N 2.88Å; M100-A104 WeakPolarHBondContact O-CB 3.4Å; M100-A104 PolarHBondContact O-N 3.4Å; M100-L164 HydrophobicContact CE-CD2 4.29Å; M100-V168 HydrophobicContact CE-CG2 3.74Å; M100-V168 HydrophobicContact SD-CG2 4.24Å; M100-Y171 HydrophobicContact CG-CD2 3.78Å; M100-Y171 HydrophobicContact CG-CE2 4.29Å; M100-Y171 HydrophobicContact CG-CG 4.1Å
101G95.3Very high93.2Very high34 Ų3446 Ų4635%0.35125%0.246SC..Hα-helixtrans-60.9-43.717400000112.8I97 H98 G99 A104 V105I97-G101 PolarHBondContact O-N 3.35Å; H98-G101 PolarHBondContact O-N 3.41Å; G99-G101 VanDerWaalsContact C-N 3.28Å; G99-G101 PolarHBondContact O-N 3.26Å; G101-A104 WeakPolarHBondContact O-CB 3.39Å; G101-A104 PolarHBondContact O-N 3.49Å; G101-V105 WeakPolarHBondContact O-CG2 3.44Å; G101-V105 PolarHBondContact O-N 3.37Å
102A96.7Very high93.4Very high12 Ų1249.4 Ų49.410%0.09927%0.267CS..Hα-helixtrans-62-44.4175.700000111.8V85 H98 G99 A104 V105 A106V85-A102 HydrophobicContact CB-CB 4.4Å; V85-A102 HydrophobicContact CG1-CB 4.09Å; H98-A102 PolarHBondContact O-N 3.27Å; G99-A102 WeakPolarHBondContact O-CB 3.42Å; G99-A102 PolarHBondContact O-N 2.95Å; G99-A102 VanDerWaalsContact O-N 3.12Å; A102-A104 VanDerWaalsContact C-N 3.34Å; A102-A104 PolarHBondContact O-N 3.12Å; A102-V105 PolarHBondContact O-N 3.38Å; A102-A106 PolarHBondContact O-N 2.9Å
103F96.3Very high93.5Very high5 Ų546.4 Ų46.42%0.02226%0.258CS..Hα-helixtrans-63.8-37.3173.2-73.1-65.2000112.8S83 G86 D87 L90 G99 M100 V105 A106 H107 Y171S83-F103 WeakPolarHBondContact O-CE1 3.32Å; S83-F103 WeakPolarHBondContact O-CZ 3.34Å; G86-F103 VanDerWaalsContact C-CZ 3.4Å; D87-F103 HydrophobicContact CB-CZ 4.49Å; D87-F103 VanDerWaalsContact N-CZ 3.27Å; D87-F103 WeakPolarHBondContact OD1-CZ 3.46Å; L90-F103 HydrophobicContact CD1-CD2 4.42Å; L90-F103 HydrophobicContact CD1-CE2 3.39Å; L90-F103 HydrophobicContact CD1-CZ 3.94Å; L90-F103 HydrophobicContact CG-CE2 3.94Å; G99-F103 WeakPolarHBondContact O-CD2 3.45Å; G99-F103 PolarHBondContact O-N 2.93Å; M100-F103 PolarHBondContact O-N 2.88Å; F103-V105 VanDerWaalsContact C-N 3.33Å; F103-V105 PolarHBondContact O-N 2.68Å; F103-A106 WeakPolarHBondContact O-CB 3.18Å; F103-A106 PolarHBondContact O-N 2.87Å; F103-A106 VanDerWaalsContact O-N 3.16Å; F103-H107 PolarHBondContact O-CD2 2.99Å; F103-H107 VanDerWaalsContact O-CD2 3.23Å; F103-H107 PolarHBondContact O-N 2.89Å; F103-Y171 HydrophobicContact CB-CE2 3.56Å
104A96.3Very high93.8Very high19 Ų1942.6 Ų42.616%0.15723%0.231CC..Hα-helixtrans-60.9-43.5175.200000111.4M100 G101 A102 A106 H107 L108 Y171 L174M100-A104 WeakPolarHBondContact O-CB 3.4Å; M100-A104 PolarHBondContact O-N 3.4Å; G101-A104 WeakPolarHBondContact O-CB 3.39Å; G101-A104 PolarHBondContact O-N 3.49Å; A102-A104 VanDerWaalsContact C-N 3.34Å; A102-A104 PolarHBondContact O-N 3.12Å; A104-A106 VanDerWaalsContact C-N 3.33Å; A104-H107 PolarHBondContact O-N 3.15Å; A104-L108 WeakPolarHBondContact O-CG 3.37Å; A104-L108 PolarHBondContact O-N 3.03Å; A104-Y171 HydrophobicContact CB-CD2 4.21Å; A104-L174 HydrophobicContact CB-CD1 3.73Å
105V96.9Very high93.7Very high58 Ų5839.6 Ų39.635%0.35222%0.22SC..Hα-helixtrans-62.7-40.5173.5175.30000110.9F82 G101 A102 F103 L108 L109F82-V105 HydrophobicContact CD1-CB 4.17Å; F82-V105 HydrophobicContact CD1-CG1 3.92Å; F82-V105 HydrophobicContact CD2-CG1 3.95Å; F82-V105 HydrophobicContact CE1-CB 4.44Å; F82-V105 HydrophobicContact CE1-CG1 3.91Å; F82-V105 HydrophobicContact CE2-CG1 3.94Å; F82-V105 HydrophobicContact CG-CB 4.39Å; F82-V105 HydrophobicContact CG-CG1 3.94Å; F82-V105 HydrophobicContact CZ-CG1 3.92Å; G101-V105 WeakPolarHBondContact O-CG2 3.44Å; G101-V105 PolarHBondContact O-N 3.37Å; A102-V105 PolarHBondContact O-N 3.38Å; F103-V105 VanDerWaalsContact C-N 3.33Å; F103-V105 PolarHBondContact O-N 2.68Å; V105-L108 PolarHBondContact O-N 3.26Å; V105-L109 HydrophobicContact CG1-CD1 4.31Å; V105-L109 WeakPolarHBondContact O-CG 3.44Å; V105-L109 PolarHBondContact O-N 3.48Å
106A96.6Very high93.4Very high0 Ų039 Ų390%022%0.222CC..Hα-helixtrans-58.8-50.4174.700000112G79 F82 S83 A102 F103 A104 L108 L109 Y110G79-A106 WeakPolarHBondContact O-CB 2.91Å; F82-A106 HydrophobicContact CB-CB 3.84Å; S83-A106 WeakPolarHBondContact OG-CB 3.16Å; A102-A106 PolarHBondContact O-N 2.9Å; F103-A106 WeakPolarHBondContact O-CB 3.18Å; F103-A106 PolarHBondContact O-N 2.87Å; F103-A106 VanDerWaalsContact O-N 3.16Å; A104-A106 VanDerWaalsContact C-N 3.33Å; A106-L108 VanDerWaalsContact C-N 3.28Å; A106-L108 PolarHBondContact O-N 3.49Å; A106-L109 PolarHBondContact O-N 3.49Å; A106-L109 VanDerWaalsContact O-N 3.1Å; A106-Y110 HydrophobicContact CB-CE2 4.01Å; A106-Y110 WeakPolarHBondContact O-CD2 3.03Å; A106-Y110 VanDerWaalsContact O-CG 3.28Å; A106-Y110 PolarHBondContact O-N 3.4Å
107H96.3Very high92.1Very high0 Ų042 Ų420%025%0.246CC..Hα-helixtrans-61-35.3178.5-66.9-36.7000112.5F103 A104 Y110 S111 Y171 L174 I175 M178 D201F103-H107 PolarHBondContact O-CD2 2.99Å; F103-H107 VanDerWaalsContact O-CD2 3.23Å; F103-H107 PolarHBondContact O-N 2.89Å; A104-H107 PolarHBondContact O-N 3.15Å; H107-Y110 AromaticContact ND1-CD2 3.9Å; H107-S111 VanDerWaalsContact O-CB 3.28Å; H107-S111 WeakPolarHBondContact O-CB 3.46Å; H107-S111 PolarHBondContact O-N 3.29Å; H107-S111 PolarHBondContact O-OG 3.28Å; H107-Y171 AromaticContact CD2-CE2 3.76Å; H107-Y171 AromaticContact CD2-CZ 3.89Å; H107-Y171 AromaticContact NE2-CZ 3.76Å; H107-Y171 PolarHBondContact NE2-OH 2.85Å; H107-L174 HydrophobicContact CB-CB 4.38Å; H107-I175 WeakPolarHBondContact NE2-CD1 3.44Å; H107-M178 PolarHBondContact ND1-SD 2.92Å; H107-M178 VanDerWaalsContact ND1-SD 3.37Å; H107-D201 IonicContact CE1-OD2 3.4Å; H107-D201 PolarHBondContact CE1-OD2 2.96Å; H107-D201 IonicContact NE2-OD2 2.9Å; H107-D201 PolarHBondContact NE2-OD2 2.95Å
108L95.3Very high91Very high78 Ų7846.6 Ų46.641%0.40826%0.258SS..Hα-helixtrans-65.9-46.2171.5-76.6172000112.3A104 V105 A106 Y110 S111 V112 L174A104-L108 WeakPolarHBondContact O-CG 3.37Å; A104-L108 PolarHBondContact O-N 3.03Å; V105-L108 PolarHBondContact O-N 3.26Å; A106-L108 VanDerWaalsContact C-N 3.28Å; A106-L108 PolarHBondContact O-N 3.49Å; L108-Y110 VanDerWaalsContact C-N 3.35Å; L108-Y110 PolarHBondContact O-N 2.97Å; L108-S111 WeakPolarHBondContact O-CB 3.31Å; L108-S111 PolarHBondContact O-N 2.97Å; L108-V112 WeakPolarHBondContact O-CG2 3.38Å; L108-V112 PolarHBondContact O-N 2.94Å; L108-L174 HydrophobicContact CD2-CD2 3.52Å; L108-L174 HydrophobicContact CG-CD1 4.32Å; L108-L174 HydrophobicContact CG-CD2 3.97Å
109L94.9Very high89.7Confident42 Ų4243 Ų4322%0.2224%0.24CC..Hα-helixtrans-61.2-43.6177-72.6173.5000111.6F82 V105 A106 V112 T113F82-L109 HydrophobicContact CD2-CD1 3.59Å; F82-L109 HydrophobicContact CE2-CD1 3.96Å; V105-L109 HydrophobicContact CG1-CD1 4.31Å; V105-L109 WeakPolarHBondContact O-CG 3.44Å; V105-L109 PolarHBondContact O-N 3.48Å; A106-L109 PolarHBondContact O-N 3.49Å; A106-L109 VanDerWaalsContact O-N 3.1Å; L109-V112 PolarHBondContact O-N 3.46Å; L109-T113 WeakPolarHBondContact O-CB 3.44Å; L109-T113 PolarHBondContact O-N 3.24Å; L109-T113 PolarHBondContact O-OG1 3.38Å
110Y94.6Very high88Confident7 Ų745.6 Ų45.63%0.02726%0.261CS..Hα-helixtrans-59.1-48173.3-61.7-42.3000111.2V76 G79 L80 S83 A106 H107 L108 V112 T113 F114 M178V76-Y110 HydrophobicContact CG1-CD1 4.44Å; V76-Y110 HydrophobicContact CG1-CE1 4.12Å; V76-Y110 WeakPolarHBondContact O-CE1 3.49Å; G79-Y110 VanDerWaalsContact C-CZ 3.42Å; G79-Y110 PolarHBondContact O-OH 3.46Å; L80-Y110 WeakPolarHBondContact CA-OH 3.45Å; L80-Y110 VanDerWaalsContact CD2-OH 3.32Å; L80-Y110 WeakPolarHBondContact CD2-OH 3.34Å; L80-Y110 HydrophobicContact CG-CE1 4.27Å; L80-Y110 WeakPolarHBondContact CG-OH 3.37Å; L80-Y110 PolarHBondContact N-OH 3.49Å; S83-Y110 PolarHBondContact OG-OH 3.43Å; S83-Y110 VanDerWaalsContact OG-OH 3.12Å; A106-Y110 HydrophobicContact CB-CE2 4.01Å; A106-Y110 WeakPolarHBondContact O-CD2 3.03Å; A106-Y110 VanDerWaalsContact O-CG 3.28Å; A106-Y110 PolarHBondContact O-N 3.4Å; H107-Y110 AromaticContact ND1-CD2 3.9Å; L108-Y110 VanDerWaalsContact C-N 3.35Å; L108-Y110 PolarHBondContact O-N 2.97Å; Y110-V112 PolarHBondContact O-N 3.39Å; Y110-T113 WeakPolarHBondContact O-CB 3.49Å; Y110-T113 PolarHBondContact O-N 2.92Å; Y110-T113 VanDerWaalsContact O-N 3.15Å; Y110-F114 WeakPolarHBondContact O-CD1 3.42Å; Y110-F114 WeakPolarHBondContact O-CD2 3.1Å; Y110-F114 WeakPolarHBondContact O-CG 3.45Å; Y110-F114 PolarHBondContact O-N 2.97Å; Y110-M178 HydrophobicContact CD2-SD 3.34Å; Y110-M178 WeakPolarHBondContact CD2-SD 3.42Å; Y110-M178 HydrophobicContact CE2-SD 4.27Å; Y110-M178 HydrophobicContact CG-SD 3.88Å
111S93.6Very high85.9Confident3 Ų349 Ų492%0.02128%0.284CS..Hα-helixtrans-58.4-49.1178.9-64.80000112.5H107 L108 T113 F114 L115 M178 L181H107-S111 VanDerWaalsContact O-CB 3.28Å; H107-S111 WeakPolarHBondContact O-CB 3.46Å; H107-S111 PolarHBondContact O-N 3.29Å; H107-S111 PolarHBondContact O-OG 3.28Å; L108-S111 WeakPolarHBondContact O-CB 3.31Å; L108-S111 PolarHBondContact O-N 2.97Å; S111-T113 VanDerWaalsContact C-N 3.27Å; S111-T113 PolarHBondContact O-N 2.94Å; S111-F114 PolarHBondContact O-N 3.44Å; S111-L115 PolarHBondContact O-N 2.9Å; S111-M178 WeakPolarHBondContact OG-CA 3.21Å; S111-L181 WeakPolarHBondContact O-CD1 3.46Å
112V92.6Very high83.7Confident99 Ų9955.9 Ų55.960%0.630%0.3SS*.Hα-helixtrans-61-39.9176.7171.40000110.7L108 L109 Y110 L115 S116L108-V112 WeakPolarHBondContact O-CG2 3.38Å; L108-V112 PolarHBondContact O-N 2.94Å; L109-V112 PolarHBondContact O-N 3.46Å; Y110-V112 PolarHBondContact O-N 3.39Å; V112-L115 PolarHBondContact O-N 3.03Å; V112-S116 PolarHBondContact O-N 2.83Å
113T90.9Very high81.2Confident18 Ų1860.7 Ų60.711%0.1133%0.333CS..Hα-helixtrans-65.1-43.7178.1-54.50000112.1G75 V76 L109 Y110 S111 L115 S116 Y119G75-T113 WeakPolarHBondContact CA-OG1 3.25Å; V76-T113 HydrophobicContact CG2-CG2 3.88Å; L109-T113 WeakPolarHBondContact O-CB 3.44Å; L109-T113 PolarHBondContact O-N 3.24Å; L109-T113 PolarHBondContact O-OG1 3.38Å; Y110-T113 WeakPolarHBondContact O-CB 3.49Å; Y110-T113 PolarHBondContact O-N 2.92Å; Y110-T113 VanDerWaalsContact O-N 3.15Å; S111-T113 VanDerWaalsContact C-N 3.27Å; S111-T113 PolarHBondContact O-N 2.94Å; T113-L115 PolarHBondContact O-N 3.28Å; T113-S116 WeakPolarHBondContact O-CB 3.32Å; T113-S116 PolarHBondContact O-N 3.1Å; T113-S116 VanDerWaalsContact O-N 3.08Å; T113-Y119 HydrophobicContact CG2-CD2 4.07Å; T113-Y119 HydrophobicContact CG2-CE2 3.63Å; T113-Y119 VanDerWaalsContact O-CD2 3.28Å; T113-Y119 WeakPolarHBondContact O-CD2 3.31Å
114F90.3Very high78.5Confident20 Ų2065.5 Ų65.59%0.08837%0.368CS..Hα-helixtrans-68.9-23.1179.3-59-15.9000112.3V76 Y110 S111 Y119 M178 L181 A182 T185 T190V76-F114 HydrophobicContact CG2-CE1 4.27Å; Y110-F114 WeakPolarHBondContact O-CD1 3.42Å; Y110-F114 WeakPolarHBondContact O-CD2 3.1Å; Y110-F114 WeakPolarHBondContact O-CG 3.45Å; Y110-F114 PolarHBondContact O-N 2.97Å; S111-F114 PolarHBondContact O-N 3.44Å; F114-Y119 HydrophobicContact CD1-CD1 4.48Å; F114-M178 HydrophobicContact CD2-CG 4.3Å; F114-M178 HydrophobicContact CE2-CG 3.75Å; F114-L181 HydrophobicContact CB-CB 4Å; F114-L181 HydrophobicContact CD2-CB 4.3Å; F114-A182 HydrophobicContact CD2-CB 4.06Å; F114-A182 HydrophobicContact CE2-CB 3.94Å; F114-T185 HydrophobicContact CB-CG2 3.91Å; F114-T185 HydrophobicContact CG-CG2 4.24Å; F114-T190 HydrophobicContact CD1-CG2 3.7Å; F114-T190 HydrophobicContact CD2-CG2 4.27Å; F114-T190 HydrophobicContact CE1-CG2 3.33Å; F114-T190 HydrophobicContact CE2-CG2 3.92Å; F114-T190 HydrophobicContact CG-CG2 4.18Å; F114-T190 HydrophobicContact CZ-CG2 3.45Å; F114-T190 VanDerWaalsContact CZ-CG2 3.45Å
115L87.6Confident75.9Confident107 Ų10769.1 Ų69.156%0.5639%0.392SS*.Hα-helixtrans-81.5-17.5173.2-15767.9000113S111 V112 T113 L181S111-L115 PolarHBondContact O-N 2.9Å; V112-L115 PolarHBondContact O-N 3.03Å; T113-L115 PolarHBondContact O-N 3.28Å; L115-L181 HydrophobicContact CD1-CD2 4.01Å
116S84.1Confident73.5Confident53 Ų5369.1 Ų69.137%0.37139%0.394SS..SBendtrans-66152.6-178.7-173.40000112.5V112 T113 R118 Y119 A120V112-S116 PolarHBondContact O-N 2.83Å; T113-S116 WeakPolarHBondContact O-CB 3.32Å; T113-S116 PolarHBondContact O-N 3.1Å; T113-S116 VanDerWaalsContact O-N 3.08Å; S116-R118 PolarHBondContact O-N 3.05Å; S116-Y119 PolarHBondContact O-N 2.78Å; S116-A120 WeakPolarHBondContact O-CB 3.29Å; S116-A120 PolarHBondContact O-N 3.43Å
117S62.4Low71Confident94 Ų9475.3 Ų75.366%0.65744%0.438SS*.THydrogen-bonded Turntrans-54.1-27-179.360.20000113.8Y119 A120S117-Y119 PolarHBondContact O-N 3.15Å; S117-A120 PolarHBondContact O-N 3.39Å
118R68.1Low68.7Low179 Ų17980.7 Ų80.768%0.67548%0.475SS*.THydrogen-bonded Turntrans-64.2-26.5175.6-65.3-157.6-178.2-171.13.1114.2S116S116-R118 PolarHBondContact O-N 3.05Å
119Y67.3Low67Low51 Ų5179 Ų7920%0.247%0.47CS..THydrogen-bonded Turntrans-109.5-8.3177.9-71.2-93.7000112.1T113 F114 S116 S117 T121 T185T113-Y119 HydrophobicContact CG2-CD2 4.07Å; T113-Y119 HydrophobicContact CG2-CE2 3.63Å; T113-Y119 VanDerWaalsContact O-CD2 3.28Å; T113-Y119 WeakPolarHBondContact O-CD2 3.31Å; F114-Y119 HydrophobicContact CD1-CD1 4.48Å; S116-Y119 PolarHBondContact O-N 2.78Å; S117-Y119 PolarHBondContact O-N 3.15Å; Y119-T121 VanDerWaalsContact C-N 3.29Å; Y119-T121 PolarHBondContact O-N 2.95Å; Y119-T185 HydrophobicContact CD1-CG2 4.11Å; Y119-T185 HydrophobicContact CG-CG2 4.48Å
120A58.4Low65.9Low54 Ų5480.2 Ų80.245%0.44648%0.482SS..SBendtrans-82.715.9-173.300000115.1S116 S117S116-A120 WeakPolarHBondContact O-CB 3.29Å; S116-A120 PolarHBondContact O-N 3.43Å; S117-A120 PolarHBondContact O-N 3.39Å
121T50.3Low65.2Low97 Ų9783.6 Ų83.660%0.59551%0.507SS*.  trans-138.386.9-171.7-39.30000113.9Y119Y119-T121 VanDerWaalsContact C-N 3.29Å; Y119-T121 PolarHBondContact O-N 2.95Å
122Y48.8Very low64.7Low177 Ų17788.1 Ų88.169%0.69453%0.53SS*.  trans-146.132.5143.6-103.7-79.8000110.4S124Y122-S124 PolarHBondContact O-N 3.18Å
123S43.6Very low64.3Low114 Ų11485.7 Ų85.780%0.79751%0.514SS*.THydrogen-bonded Turntrans-78.91.4-179.3-59.50000114.4
124S39.8Very low64.1Low106 Ų10692.2 Ų92.274%0.74154%0.536SS*.THydrogen-bonded Turntrans-108.6-1.4-166.9-19.50000116.3Y122Y122-S124 PolarHBondContact O-N 3.18Å
125S42.4Very low64.1Low95 Ų9597.1 Ų97.166%0.66456%0.558SS**SBendtrans-135.68.9-17222.90000116.9
126S45.5Very low64.1Low58 Ų5895 Ų9541%0.40655%0.546SS..  trans-143.379.5178.553.40000112.7S128 S129S126-S128 PolarHBondContact O-N 3.3Å; S126-S129 PolarHBondContact O-N 3.47Å; S126-S129 PolarHBondContact OG-OG 3.48Å
127S44.6Very low64.2Low130 Ų13094.7 Ų94.791%0.90954%0.539SS*.THydrogen-bonded Turntrans-58.6-8.3169.6-51.30000113.7
128S48.2Very low65.6Low112 Ų11295.5 Ų95.578%0.78354%0.535SS*.THydrogen-bonded Turntrans-91.8-11.9172.4-59.30000115.2S126S126-S128 PolarHBondContact O-N 3.3Å
129S58.8Low66.8Low44 Ų4489.8 Ų89.831%0.30852%0.52SS..Hα-helixtrans-88-10.6-176.8-71.60000114.8S126 N133S126-S129 PolarHBondContact O-N 3.47Å; S126-S129 PolarHBondContact OG-OG 3.48Å; S129-N133 VanDerWaalsContact O-CB 3.28Å; S129-N133 WeakPolarHBondContact O-CB 3.38Å; S129-N133 PolarHBondContact O-N 3.47Å; S129-N133 PolarHBondContact O-ND2 2.68Å
130S71.4Confident67.9Low66 Ų6688.1 Ų88.146%0.46252%0.515SS..Hα-helixtrans-67.1-40-178161.20000113.1R134S130-R134 WeakPolarHBondContact O-CB 3.37Å; S130-R134 WeakPolarHBondContact O-CG 3.36Å; S130-R134 PolarHBondContact O-N 2.87Å; S130-R134 VanDerWaalsContact O-N 3.17Å; S130-R134 PolarHBondContact O-NE 2.94Å
131S81.1Confident69.5Low79 Ų7989.8 Ų89.855%0.55252%0.519SS*.Hα-helixtrans-72.2-45.1180-166.70000111.4N133 R134 F135S131-N133 PolarHBondContact O-N 2.86Å; S131-R134 PolarHBondContact O-N 2.87Å; S131-F135 WeakPolarHBondContact O-CB 3.34Å; S131-F135 PolarHBondContact O-N 2.91Å
132L83.2Confident71.5Confident97 Ų9790.7 Ų90.751%0.50852%0.519SS..Hα-helixtrans-62.2-44.9177.4-175.568.4000111.6R134 F135 L136L132-R134 VanDerWaalsContact C-N 3.35Å; L132-R134 PolarHBondContact O-N 2.73Å; L132-F135 WeakPolarHBondContact O-CB 3.49Å; L132-F135 PolarHBondContact O-N 3.21Å; L132-L136 HydrophobicContact CD1-CG 4.45Å; L132-L136 HydrophobicContact CG-CD1 4.11Å; L132-L136 HydrophobicContact CG-CG 4.37Å; L132-L136 WeakPolarHBondContact O-CB 3.41Å; L132-L136 VanDerWaalsContact O-CG 3.31Å; L132-L136 WeakPolarHBondContact O-CG 3.33Å; L132-L136 PolarHBondContact O-N 3.43Å
133N84.4Confident73.6Confident48 Ų4886.5 Ų86.526%0.25751%0.512SS..Hα-helixtrans-62.7-41.9177.8-73-5.6000111.6S129 S131 L136 H137 I183S129-N133 VanDerWaalsContact O-CB 3.28Å; S129-N133 WeakPolarHBondContact O-CB 3.38Å; S129-N133 PolarHBondContact O-N 3.47Å; S129-N133 PolarHBondContact O-ND2 2.68Å; S131-N133 PolarHBondContact O-N 2.86Å; N133-L136 PolarHBondContact O-N 3.3Å; N133-H137 WeakPolarHBondContact O-CB 3.4Å; N133-H137 PolarHBondContact O-N 2.84Å; N133-H137 PolarHBondContact O-ND1 2.99Å; N133-I183 HydrophobicContact CB-CG2 4.15Å
134R85.8Confident75.8Confident155 Ų15581.5 Ų81.559%0.58548%0.479SS*.Hα-helixtrans-61.8-43.7173.7-79.1-175.4-72.4159.4-3.8111.9S130 S131 L132 H137 L138S130-R134 WeakPolarHBondContact O-CB 3.37Å; S130-R134 WeakPolarHBondContact O-CG 3.36Å; S130-R134 PolarHBondContact O-N 2.87Å; S130-R134 VanDerWaalsContact O-N 3.17Å; S130-R134 PolarHBondContact O-NE 2.94Å; S131-R134 PolarHBondContact O-N 2.87Å; L132-R134 VanDerWaalsContact C-N 3.35Å; L132-R134 PolarHBondContact O-N 2.73Å; R134-H137 PolarHBondContact O-N 3.49Å; R134-L138 WeakPolarHBondContact O-CG 3.21Å; R134-L138 PolarHBondContact O-N 3.12Å
135F89.4Confident78.3Confident124 Ų12478 Ų7854%0.54446%0.46SS..Hα-helixtrans-60.2-49.6175.8175.1-101.9000111.7S131 L132 H137 L138 V139S131-F135 WeakPolarHBondContact O-CB 3.34Å; S131-F135 PolarHBondContact O-N 2.91Å; L132-F135 WeakPolarHBondContact O-CB 3.49Å; L132-F135 PolarHBondContact O-N 3.21Å; F135-H137 VanDerWaalsContact C-N 3.31Å; F135-H137 PolarHBondContact O-N 3.47Å; F135-L138 PolarHBondContact O-N 3.02Å; F135-L138 VanDerWaalsContact O-N 3.14Å; F135-V139 HydrophobicContact CD1-CG2 4.21Å; F135-V139 HydrophobicContact CD2-CG2 4.34Å; F135-V139 HydrophobicContact CE1-CG2 3.77Å; F135-V139 HydrophobicContact CE2-CG2 3.9Å; F135-V139 HydrophobicContact CG-CG2 4.49Å; F135-V139 HydrophobicContact CZ-CG2 3.6Å; F135-V139 WeakPolarHBondContact O-CG2 3.22Å; F135-V139 PolarHBondContact O-N 3.04Å
136L87.6Confident80.6Confident61 Ų6176.2 Ų76.232%0.31945%0.45SS..Hα-helixtrans-61.2-38.7177.9-68.7174.7000112.3L132 N133 V139 L140 I183L132-L136 HydrophobicContact CD1-CG 4.45Å; L132-L136 HydrophobicContact CG-CD1 4.11Å; L132-L136 HydrophobicContact CG-CG 4.37Å; L132-L136 WeakPolarHBondContact O-CB 3.41Å; L132-L136 VanDerWaalsContact O-CG 3.31Å; L132-L136 WeakPolarHBondContact O-CG 3.33Å; L132-L136 PolarHBondContact O-N 3.43Å; N133-L136 PolarHBondContact O-N 3.3Å; L136-V139 PolarHBondContact O-N 3.07Å; L136-L140 WeakPolarHBondContact O-CB 3.42Å; L136-L140 PolarHBondContact O-N 2.68Å; L136-I183 HydrophobicContact CB-CD1 3.94Å; L136-I183 HydrophobicContact CB-CG2 4.36Å; L136-I183 HydrophobicContact CD1-CG2 4.37Å
137H88.1Confident82.9Confident47 Ų4775.5 Ų75.522%0.21844%0.44CS..Hα-helixtrans-61.8-46.1173.2-81.866.8000111.9N133 R134 F135 L140 V141 A180N133-H137 WeakPolarHBondContact O-CB 3.4Å; N133-H137 PolarHBondContact O-N 2.84Å; N133-H137 PolarHBondContact O-ND1 2.99Å; R134-H137 PolarHBondContact O-N 3.49Å; F135-H137 VanDerWaalsContact C-N 3.31Å; F135-H137 PolarHBondContact O-N 3.47Å; H137-L140 PolarHBondContact O-N 3.31Å; H137-V141 WeakPolarHBondContact O-CG2 3.37Å; H137-V141 PolarHBondContact O-N 2.99Å; H137-A180 PolarHBondContact CE1-O 3.42Å; H137-A180 PolarHBondContact NE2-O 2.86Å
138L90.7Very high85.2Confident111 Ų11171.8 Ų71.858%0.58141%0.406SS*.Hα-helixtrans-62.3-45.4177.9-72.2173.6000111.4R134 F135 L140 V141 I142R134-L138 WeakPolarHBondContact O-CG 3.21Å; R134-L138 PolarHBondContact O-N 3.12Å; F135-L138 PolarHBondContact O-N 3.02Å; F135-L138 VanDerWaalsContact O-N 3.14Å; L138-L140 VanDerWaalsContact C-N 3.31Å; L138-L140 PolarHBondContact O-N 3.45Å; L138-V141 PolarHBondContact O-N 3.4Å; L138-I142 WeakPolarHBondContact O-CB 3.36Å; L138-I142 VanDerWaalsContact O-CG1 3.24Å; L138-I142 WeakPolarHBondContact O-CG1 3.44Å; L138-I142 PolarHBondContact O-N 3.23Å
139V92.6Very high87.3Confident59 Ų5972.3 Ų72.336%0.35840%0.399SS..Hα-helixtrans-57.2-47175.5170.90000110.3F135 L136 V141 I142 V143F135-V139 HydrophobicContact CD1-CG2 4.21Å; F135-V139 HydrophobicContact CD2-CG2 4.34Å; F135-V139 HydrophobicContact CE1-CG2 3.77Å; F135-V139 HydrophobicContact CE2-CG2 3.9Å; F135-V139 HydrophobicContact CG-CG2 4.49Å; F135-V139 HydrophobicContact CZ-CG2 3.6Å; F135-V139 WeakPolarHBondContact O-CG2 3.22Å; F135-V139 PolarHBondContact O-N 3.04Å; L136-V139 PolarHBondContact O-N 3.07Å; V139-V141 PolarHBondContact O-N 3.42Å; V139-I142 PolarHBondContact O-N 3Å; V139-V143 HydrophobicContact CG1-CG2 4.14Å; V139-V143 WeakPolarHBondContact O-CB 3.42Å; V139-V143 WeakPolarHBondContact O-CG2 3.35Å; V139-V143 PolarHBondContact O-N 3.25Å
140L92Very high88.9Confident17 Ų1776.2 Ų76.29%0.08941%0.408CS..Hα-helixtrans-60.7-45.3-179.9-168.777.5000112.3L136 H137 L138 G144 T176 A179 A180 I183 M198L136-L140 WeakPolarHBondContact O-CB 3.42Å; L136-L140 PolarHBondContact O-N 2.68Å; H137-L140 PolarHBondContact O-N 3.31Å; L138-L140 VanDerWaalsContact C-N 3.31Å; L138-L140 PolarHBondContact O-N 3.45Å; L140-G144 PolarHBondContact O-N 2.97Å; L140-T176 HydrophobicContact CD2-CG2 4.1Å; L140-T176 WeakPolarHBondContact CD2-O 3.48Å; L140-T176 HydrophobicContact CG-CG2 4.15Å; L140-A179 HydrophobicContact CD1-CB 4.16Å; L140-A179 HydrophobicContact CD2-CB 3.63Å; L140-A179 HydrophobicContact CG-CB 4.49Å; L140-A180 HydrophobicContact CD2-CB 4.08Å; L140-I183 HydrophobicContact CD2-CD1 4.36Å; L140-M198 HydrophobicContact CD1-CE 3.89Å; L140-M198 HydrophobicContact CD1-SD 3.71Å; L140-M198 HydrophobicContact CG-CE 4.36Å
141V90.7Very high89.8Confident88 Ų8873 Ų7353%0.53339%0.386SS..Hα-helixtrans-66.2-42.4178.61720000111.4H137 L138 V139 G145 T176H137-V141 WeakPolarHBondContact O-CG2 3.37Å; H137-V141 PolarHBondContact O-N 2.99Å; L138-V141 PolarHBondContact O-N 3.4Å; V139-V141 PolarHBondContact O-N 3.42Å; V141-G145 PolarHBondContact O-N 3.29Å; V141-T176 HydrophobicContact CG2-CG2 4.26Å
142I93.6Very high90.3Very high116 Ų11673 Ų7360%0.59538%0.376SS*.Hα-helixtrans-64.3-47.2177.7-69.5166.7000110.3L138 V139 G145 A146L138-I142 WeakPolarHBondContact O-CB 3.36Å; L138-I142 VanDerWaalsContact O-CG1 3.24Å; L138-I142 WeakPolarHBondContact O-CG1 3.44Å; L138-I142 PolarHBondContact O-N 3.23Å; V139-I142 PolarHBondContact O-N 3Å; I142-G145 PolarHBondContact O-N 2.99Å; I142-A146 VanDerWaalsContact O-CB 3.22Å; I142-A146 WeakPolarHBondContact O-CB 3.33Å; I142-A146 PolarHBondContact O-N 3.36Å
143V92.9Very high90.6Very high89 Ų8971.1 Ų71.154%0.53937%0.369SS..Hα-helixtrans-63.6-46.5179.4170.70000110.8V139 A146 F147V139-V143 HydrophobicContact CG1-CG2 4.14Å; V139-V143 WeakPolarHBondContact O-CB 3.42Å; V139-V143 WeakPolarHBondContact O-CG2 3.35Å; V139-V143 PolarHBondContact O-N 3.25Å; V143-A146 PolarHBondContact O-N 3.38Å; V143-F147 WeakPolarHBondContact O-CB 3.28Å; V143-F147 PolarHBondContact O-N 2.9Å
144G89.6Confident90.8Very high10 Ų1071.4 Ų71.410%0.10337%0.369CS..Hα-helixtrans-62.2-43.7177.100000112.6L140 F147 Y148L140-G144 PolarHBondContact O-N 2.97Å; G144-F147 PolarHBondContact O-N 2.94Å; G144-Y148 PolarHBondContact O-N 2.9Å
145G90.8Very high90.8Very high33 Ų3364 Ų6434%0.3434%0.341SS..Hα-helixtrans-64.1-45.617600000112.7V141 I142 F147 Y148 I149V141-G145 PolarHBondContact O-N 3.29Å; I142-G145 PolarHBondContact O-N 2.99Å; G145-F147 VanDerWaalsContact C-N 3.32Å; G145-F147 PolarHBondContact O-N 3.48Å; G145-Y148 PolarHBondContact O-N 3.21Å; G145-I149 VanDerWaalsContact O-CG1 3.28Å; G145-I149 WeakPolarHBondContact O-CG1 3.12Å; G145-I149 PolarHBondContact O-N 3Å
146A92.7Very high90.7Very high56 Ų5663.3 Ų63.346%0.46334%0.339SS..Hα-helixtrans-61.5-41.3176.200000111.6I142 V143 I149 Y150I142-A146 VanDerWaalsContact O-CB 3.22Å; I142-A146 WeakPolarHBondContact O-CB 3.33Å; I142-A146 PolarHBondContact O-N 3.36Å; V143-A146 PolarHBondContact O-N 3.38Å; A146-I149 PolarHBondContact O-N 2.92Å; A146-Y150 WeakPolarHBondContact O-CB 3.24Å; A146-Y150 PolarHBondContact O-N 3.34Å
147F92.6Very high90.6Very high43 Ų4368.5 Ų68.519%0.18936%0.359CS..Hα-helixtrans-63.6-43.9176.5-171.4-85.3000112V143 G144 G145 Y150 L151 F172 A202 A205 L206V143-F147 WeakPolarHBondContact O-CB 3.28Å; V143-F147 PolarHBondContact O-N 2.9Å; G144-F147 PolarHBondContact O-N 2.94Å; G145-F147 VanDerWaalsContact C-N 3.32Å; G145-F147 PolarHBondContact O-N 3.48Å; F147-Y150 WeakPolarHBondContact O-CB 3.47Å; F147-Y150 PolarHBondContact O-N 2.94Å; F147-L151 HydrophobicContact CE1-CD2 4.44Å; F147-L151 WeakPolarHBondContact O-CB 3.4Å; F147-L151 PolarHBondContact O-N 2.73Å; F147-F172 AromaticContact CD1-CE1 3.43Å; F147-F172 HydrophobicContact CD1-CE1 3.43Å; F147-F172 VanDerWaalsContact CD1-CE1 3.43Å; F147-F172 HydrophobicContact CD1-CE2 4.25Å; F147-F172 AromaticContact CD1-CZ 3.26Å; F147-F172 HydrophobicContact CD1-CZ 3.26Å; F147-F172 AromaticContact CE1-CE1 3.98Å; F147-F172 HydrophobicContact CE1-CE1 3.98Å; F147-F172 HydrophobicContact CE1-CE2 4.33Å; F147-F172 AromaticContact CE1-CZ 3.38Å; F147-F172 HydrophobicContact CE1-CZ 3.38Å; F147-F172 HydrophobicContact CG-CE1 4.34Å; F147-F172 HydrophobicContact CG-CZ 4.49Å; F147-A202 HydrophobicContact CE1-CB 4.36Å; F147-A202 HydrophobicContact CE2-CB 4.16Å; F147-A202 HydrophobicContact CZ-CB 3.86Å; F147-A205 HydrophobicContact CE1-CB 4.42Å; F147-L206 HydrophobicContact CE2-CD1 4.26Å; F147-L206 HydrophobicContact CE2-CD2 4.07Å; F147-L206 HydrophobicContact CE2-CG 4.21Å; F147-L206 HydrophobicContact CZ-CD1 4.37Å; F147-L206 HydrophobicContact CZ-CD2 3.86Å; F147-L206 HydrophobicContact CZ-CG 3.88Å
148Y92.6Very high90.4Very high53 Ų5367.2 Ų67.221%0.20836%0.356CS..Hα-helixtrans-63.4-43.5176.1177.6-101000112.3G144 G145 Y150 L151 F152 L155 T165 V168 G169 F172G144-Y148 PolarHBondContact O-N 2.9Å; G145-Y148 PolarHBondContact O-N 3.21Å; Y148-Y150 VanDerWaalsContact C-N 3.28Å; Y148-Y150 PolarHBondContact O-N 2.9Å; Y148-L151 PolarHBondContact O-N 3.47Å; Y148-L151 VanDerWaalsContact O-N 3.15Å; Y148-F152 HydrophobicContact CE1-CD2 4.41Å; Y148-F152 PolarHBondContact O-N 3.16Å; Y148-L155 HydrophobicContact CE2-CD1 3.99Å; Y148-T165 WeakPolarHBondContact OH-CG2 3.28Å; Y148-T165 PolarHBondContact OH-O 3.48Å; Y148-V168 HydrophobicContact CD2-CG1 4.39Å; Y148-V168 HydrophobicContact CE2-CG1 4.28Å; Y148-G169 VanDerWaalsContact CE2-CA 3.5Å; Y148-F172 AromaticContact CD2-CD2 3.89Å; Y148-F172 HydrophobicContact CD2-CD2 3.89Å; Y148-F172 HydrophobicContact CD2-CG 4.38Å
149I92.8Very high89.6Confident123 Ų12367 Ų6763%0.63136%0.361SS*.Hα-helixtrans-60.1-40.7175.5-68.3165.3000110.7G145 A146 L151 F152 P153G145-I149 VanDerWaalsContact O-CG1 3.28Å; G145-I149 WeakPolarHBondContact O-CG1 3.12Å; G145-I149 PolarHBondContact O-N 3Å; A146-I149 PolarHBondContact O-N 2.92Å; I149-L151 VanDerWaalsContact C-N 3.35Å; I149-F152 WeakPolarHBondContact O-CB 3.43Å; I149-F152 PolarHBondContact O-N 3.38Å; I149-P153 WeakPolarHBondContact O-CD 3.38Å
150Y93.1Very high89.1Confident125 Ų12569.9 Ų69.949%0.4938%0.375SS..Hα-helixtrans-64.7-37.9175.8175.7-108.7000112.6A146 F147 Y148 P153 F154 L206 V211A146-Y150 WeakPolarHBondContact O-CB 3.24Å; A146-Y150 PolarHBondContact O-N 3.34Å; F147-Y150 WeakPolarHBondContact O-CB 3.47Å; F147-Y150 PolarHBondContact O-N 2.94Å; Y148-Y150 VanDerWaalsContact C-N 3.28Å; Y148-Y150 PolarHBondContact O-N 2.9Å; Y150-P153 WeakPolarHBondContact O-CD 3.19Å; Y150-F154 WeakPolarHBondContact O-CD2 3.31Å; Y150-L206 HydrophobicContact CE1-CD2 4.19Å; Y150-V211 HydrophobicContact CE1-CG1 3.51Å; Y150-V211 WeakPolarHBondContact OH-CG1 3.47Å
151L90.3Very high88.7Confident0 Ų070.6 Ų70.60%038%0.382CS..Hα-helixtrans-75.1-29.1179-16269.7000112.9F147 Y148 I149 F154 L155 V168 F172 A205 F209 V211F147-L151 HydrophobicContact CE1-CD2 4.44Å; F147-L151 WeakPolarHBondContact O-CB 3.4Å; F147-L151 PolarHBondContact O-N 2.73Å; Y148-L151 PolarHBondContact O-N 3.47Å; Y148-L151 VanDerWaalsContact O-N 3.15Å; I149-L151 VanDerWaalsContact C-N 3.35Å; L151-F154 WeakPolarHBondContact O-CA 3.28Å; L151-F154 WeakPolarHBondContact O-CB 3.33Å; L151-F154 PolarHBondContact O-N 3.49Å; L151-L155 HydrophobicContact CD2-CD1 4.22Å; L151-L155 HydrophobicContact CD2-CD2 4.06Å; L151-L155 HydrophobicContact CD2-CG 4.24Å; L151-L155 HydrophobicContact CG-CD1 4.3Å; L151-L155 HydrophobicContact CG-CD2 4.18Å; L151-L155 HydrophobicContact CG-CG 4.01Å; L151-L155 PolarHBondContact O-N 2.96Å; L151-V168 HydrophobicContact CD2-CG1 4.04Å; L151-F172 HydrophobicContact CD2-CE2 4.06Å; L151-A205 HydrophobicContact CD2-CB 4.14Å; L151-F209 HydrophobicContact CD1-CB 4.19Å; L151-F209 HydrophobicContact CD1-CD2 3.97Å; L151-F209 HydrophobicContact CD1-CG 4.44Å; L151-F209 HydrophobicContact CD2-CD2 3.89Å; L151-F209 HydrophobicContact CD2-CE2 4.12Å; L151-F209 HydrophobicContact CG-CD2 4.16Å; L151-V211 HydrophobicContact CD1-CG2 3.67Å
152F90Very high88.5Confident77 Ų7773.6 Ų73.634%0.33840%0.395SS..Hα-helixtrans-45.7-51.1-175.5-173.6-100.9000115.6Y148 I149 F154 L155 Q156 T165Y148-F152 HydrophobicContact CE1-CD2 4.41Å; Y148-F152 PolarHBondContact O-N 3.16Å; I149-F152 WeakPolarHBondContact O-CB 3.43Å; I149-F152 PolarHBondContact O-N 3.38Å; F152-F154 PolarHBondContact O-N 2.92Å; F152-L155 WeakPolarHBondContact O-CB 3.42Å; F152-L155 PolarHBondContact O-N 3.43Å; F152-Q156 HydrophobicContact CE1-CG 4.23Å; F152-Q156 HydrophobicContact CZ-CG 4.31Å; F152-Q156 PolarHBondContact O-N 3.45Å; F152-Q156 VanDerWaalsContact O-N 3.1Å; F152-T165 HydrophobicContact CD2-CG2 4.01Å; F152-T165 HydrophobicContact CE2-CG2 3.63Å
153P89.8Confident88.2Confident58 Ų5873 Ų7338%0.37739%0.392SS..Hα-helixtrans-65.2-22.4179.126-36.2000113.9I149 Y150 K157I149-P153 WeakPolarHBondContact O-CD 3.38Å; Y150-P153 WeakPolarHBondContact O-CD 3.19Å; P153-K157 WeakPolarHBondContact O-CG 3.37Å
154F88.6Confident88Confident55 Ų5569.5 Ų69.524%0.24137%0.37CS..Hα-helixtrans-82.8-36.4175.6-59.9-91000111.3Y150 L151 F152 Q156 K157 A158 F209 V211Y150-F154 WeakPolarHBondContact O-CD2 3.31Å; L151-F154 WeakPolarHBondContact O-CA 3.28Å; L151-F154 WeakPolarHBondContact O-CB 3.33Å; L151-F154 PolarHBondContact O-N 3.49Å; F152-F154 PolarHBondContact O-N 2.92Å; F154-Q156 VanDerWaalsContact C-N 3.29Å; F154-Q156 PolarHBondContact O-N 2.92Å; F154-K157 PolarHBondContact O-N 3.05Å; F154-A158 PolarHBondContact O-N 3Å; F154-F209 HydrophobicContact CB-CB 4.23Å; F154-V211 HydrophobicContact CB-CG2 4.11Å; F154-V211 HydrophobicContact CD1-CG2 4.02Å; F154-V211 HydrophobicContact CD2-CG1 4.34Å; F154-V211 HydrophobicContact CD2-CG2 3.93Å; F154-V211 HydrophobicContact CE1-CB 4.49Å; F154-V211 HydrophobicContact CE1-CG1 4.34Å; F154-V211 HydrophobicContact CE1-CG2 4.42Å; F154-V211 HydrophobicContact CE2-CG1 3.93Å; F154-V211 HydrophobicContact CE2-CG2 4.34Å; F154-V211 HydrophobicContact CG-CG2 3.77Å; F154-V211 HydrophobicContact CZ-CG1 3.93Å
155L86.4Confident88.1Confident0 Ų070.1 Ų70.10%037%0.372CS..Hα-helixtrans-59.8-40.5172.4-63.2176.6000111.7Y148 L151 F152 K157 A158 S161 V168 F209Y148-L155 HydrophobicContact CE2-CD1 3.99Å; L151-L155 HydrophobicContact CD2-CD1 4.22Å; L151-L155 HydrophobicContact CD2-CD2 4.06Å; L151-L155 HydrophobicContact CD2-CG 4.24Å; L151-L155 HydrophobicContact CG-CD1 4.3Å; L151-L155 HydrophobicContact CG-CD2 4.18Å; L151-L155 HydrophobicContact CG-CG 4.01Å; L151-L155 PolarHBondContact O-N 2.96Å; F152-L155 WeakPolarHBondContact O-CB 3.42Å; F152-L155 PolarHBondContact O-N 3.43Å; L155-K157 PolarHBondContact O-N 3.23Å; L155-A158 WeakPolarHBondContact O-CB 3.33Å; L155-A158 PolarHBondContact O-N 3.47Å; L155-A158 VanDerWaalsContact O-N 3.14Å; L155-S161 WeakPolarHBondContact O-CB 3.39Å; L155-V168 HydrophobicContact CD1-CB 4.12Å; L155-V168 HydrophobicContact CD1-CG1 3.92Å; L155-V168 HydrophobicContact CD2-CB 4.4Å; L155-V168 HydrophobicContact CD2-CG1 4.32Å; L155-V168 HydrophobicContact CD2-CG2 4.05Å; L155-F209 HydrophobicContact CD2-CD1 3.69Å; L155-F209 HydrophobicContact CD2-CD2 3.7Å; L155-F209 HydrophobicContact CD2-CE1 3.4Å; L155-F209 HydrophobicContact CD2-CE2 3.41Å; L155-F209 VanDerWaalsContact CD2-CE2 3.41Å; L155-F209 HydrophobicContact CD2-CG 3.84Å; L155-F209 HydrophobicContact CD2-CZ 3.25Å
156Q87.1Confident88.2Confident108 Ų10871.8 Ų71.851%0.50538%0.377SS..THydrogen-bonded Turntrans-65.6-24.3179.1-72.2-170.2-31.700113.7F152 F154F152-Q156 HydrophobicContact CE1-CG 4.23Å; F152-Q156 HydrophobicContact CZ-CG 4.31Å; F152-Q156 PolarHBondContact O-N 3.45Å; F152-Q156 VanDerWaalsContact O-N 3.1Å; F154-Q156 VanDerWaalsContact C-N 3.29Å; F154-Q156 PolarHBondContact O-N 2.92Å
157K85.4Confident88.1Confident170 Ų17070.4 Ų70.474%0.73937%0.368SS*.THydrogen-bonded Turntrans-84-14.4177-66.8173.5-175.11770112.9P153 F154 L155P153-K157 WeakPolarHBondContact O-CG 3.37Å; F154-K157 PolarHBondContact O-N 3.05Å; L155-K157 PolarHBondContact O-N 3.23Å
158A83.2Confident88.1Confident20 Ų2068.6 Ų68.617%0.16536%0.36CS..SBendtrans-74.2148.7-179.500000111.3F154 L155 S161 L164 F209F154-A158 PolarHBondContact O-N 3Å; L155-A158 WeakPolarHBondContact O-CB 3.33Å; L155-A158 PolarHBondContact O-N 3.47Å; L155-A158 VanDerWaalsContact O-N 3.14Å; A158-S161 PolarHBondContact O-N 3.34Å; A158-L164 HydrophobicContact CB-CD1 4.28Å; A158-F209 HydrophobicContact CB-CD1 4.46Å; A158-F209 HydrophobicContact CB-CE1 4.49Å
159P74.6Confident88.2Confident106 Ų10666.8 Ų66.869%0.68836%0.358SS*.THydrogen-bonded Turntrans-60.9138.7170.127.6-33.8000109.5L164P159-L164 WeakPolarHBondContact O-CD1 3.37Å
160N81.6Confident88.2Confident121 Ų12166.1 Ų66.165%0.64735%0.354SS*.THydrogen-bonded Turntrans6635.5-175.6-49.9-48.9000115.1D162 L163 L164N160-D162 PolarHBondContact O-N 2.89Å; N160-D162 VanDerWaalsContact O-N 3.15Å; N160-L163 PolarHBondContact O-N 3.08Å; N160-L163 VanDerWaalsContact O-N 3.1Å; N160-L164 HydrophobicContact CB-CD1 4.37Å; N160-L164 PolarHBondContact O-N 3.31Å
161S83.8Confident88.3Confident32 Ų3261.2 Ų61.222%0.22434%0.335CS..Hα-helixtrans-54-31.1178.255.80000114L155 A158 L163 T165L155-S161 WeakPolarHBondContact O-CB 3.39Å; A158-S161 PolarHBondContact O-N 3.34Å; S161-L163 VanDerWaalsContact C-N 3.26Å; S161-L163 PolarHBondContact O-N 3.23Å; S161-T165 VanDerWaalsContact O-CB 3.24Å; S161-T165 WeakPolarHBondContact O-CB 3.45Å; S161-T165 PolarHBondContact O-N 3.06Å; S161-T165 PolarHBondContact O-OG1 3.29Å
162D86.9Confident88.4Confident151 Ų15162.4 Ų62.481%0.80734%0.34SS*.Hα-helixtrans-59.1-34.4177.6-65.3-28.7000113.2N160 P166N160-D162 PolarHBondContact O-N 2.89Å; N160-D162 VanDerWaalsContact O-N 3.15Å; D162-P166 WeakPolarHBondContact O-CD 3.28Å; D162-P166 VanDerWaalsContact O-CG 3.25Å; D162-P166 WeakPolarHBondContact O-CG 3.4Å
163L88.3Confident88.6Confident103 Ų10363.4 Ų63.454%0.53935%0.353SS..Hα-helixtrans-98-36.5179.5-171.3129.9000112.2I97 N160 S161 P166 G167I97-L163 HydrophobicContact CD1-CD2 3.71Å; I97-L163 HydrophobicContact CG1-CD2 4.48Å; I97-L163 HydrophobicContact CG2-CD2 4.49Å; N160-L163 PolarHBondContact O-N 3.08Å; N160-L163 VanDerWaalsContact O-N 3.1Å; S161-L163 VanDerWaalsContact C-N 3.26Å; S161-L163 PolarHBondContact O-N 3.23Å; L163-P166 WeakPolarHBondContact O-CD 3.48Å; L163-P166 WeakPolarHBondContact O-CG 3.43Å; L163-G167 PolarHBondContact O-N 2.91Å; L163-G167 VanDerWaalsContact O-N 3.09Å
164L88.8Confident88.9Confident16 Ų1661.9 Ų61.98%0.08434%0.341CS..Hα-helixtrans-66.4-40.5179.6-88.7152.8000112.8F96 M100 A158 P159 N160 G167 V168 F209F96-L164 HydrophobicContact CD1-CD2 4.07Å; F96-L164 HydrophobicContact CE1-CD2 3.63Å; M100-L164 HydrophobicContact CE-CD2 4.29Å; A158-L164 HydrophobicContact CB-CD1 4.28Å; P159-L164 WeakPolarHBondContact O-CD1 3.37Å; N160-L164 HydrophobicContact CB-CD1 4.37Å; N160-L164 PolarHBondContact O-N 3.31Å; L164-G167 PolarHBondContact O-N 3.29Å; L164-V168 HydrophobicContact CD2-CG2 4.46Å; L164-V168 VanDerWaalsContact O-CB 3.32Å; L164-V168 WeakPolarHBondContact O-CB 3.19Å; L164-V168 VanDerWaalsContact O-CG2 3.25Å; L164-V168 WeakPolarHBondContact O-CG2 3.45Å; L164-V168 PolarHBondContact O-N 3.39Å; L164-F209 HydrophobicContact CD2-CE1 4.27Å; L164-F209 HydrophobicContact CD2-CZ 4.2Å
165T90.8Very high89.2Confident23 Ų2359.4 Ų59.414%0.14133%0.33CS..Hα-helixtrans-60.1-55.8-178.7-54.30000111.9Y148 F152 S161 G167 G169Y148-T165 WeakPolarHBondContact OH-CG2 3.28Å; Y148-T165 PolarHBondContact OH-O 3.48Å; F152-T165 HydrophobicContact CD2-CG2 4.01Å; F152-T165 HydrophobicContact CE2-CG2 3.63Å; S161-T165 VanDerWaalsContact O-CB 3.24Å; S161-T165 WeakPolarHBondContact O-CB 3.45Å; S161-T165 PolarHBondContact O-N 3.06Å; S161-T165 PolarHBondContact O-OG1 3.29Å; T165-G167 VanDerWaalsContact C-N 3.35Å; T165-G167 PolarHBondContact O-N 2.88Å; T165-G169 PolarHBondContact O-N 3.07Å
166P91.9Very high89.6Confident68 Ų6860.2 Ų60.244%0.44234%0.335SS..Hα-helixtrans-67-34.8176.326.6-34.2000112.5D162 L163 G169 I170D162-P166 WeakPolarHBondContact O-CD 3.28Å; D162-P166 VanDerWaalsContact O-CG 3.25Å; D162-P166 WeakPolarHBondContact O-CG 3.4Å; L163-P166 WeakPolarHBondContact O-CD 3.48Å; L163-P166 WeakPolarHBondContact O-CG 3.43Å; P166-G169 PolarHBondContact O-N 2.72Å; P166-I170 VanDerWaalsContact O-CG1 3.29Å; P166-I170 WeakPolarHBondContact O-CG1 3.38Å; P166-I170 PolarHBondContact O-N 3.48Å
167G92.4Very high89.9Confident26 Ų2659.2 Ų59.227%0.26833%0.332SS..Hα-helixtrans-61.7-49.8178.200000113L163 L164 T165 G169 I170 Y171L163-G167 PolarHBondContact O-N 2.91Å; L163-G167 VanDerWaalsContact O-N 3.09Å; L164-G167 PolarHBondContact O-N 3.29Å; T165-G167 VanDerWaalsContact C-N 3.35Å; T165-G167 PolarHBondContact O-N 2.88Å; G167-G169 VanDerWaalsContact C-N 3.33Å; G167-G169 PolarHBondContact O-N 3.11Å; G167-I170 PolarHBondContact O-N 3.46Å; G167-Y171 WeakPolarHBondContact O-CB 3.34Å; G167-Y171 PolarHBondContact O-N 2.88Å
168V92.5Very high90.3Very high5 Ų551.2 Ų51.23%0.0330%0.297CS..Hα-helixtrans-64.5-39.3175.7173.40000110.5M100 Y148 L151 L155 L164 Y171 F172 F209M100-V168 HydrophobicContact CE-CG2 3.74Å; M100-V168 HydrophobicContact SD-CG2 4.24Å; Y148-V168 HydrophobicContact CD2-CG1 4.39Å; Y148-V168 HydrophobicContact CE2-CG1 4.28Å; L151-V168 HydrophobicContact CD2-CG1 4.04Å; L155-V168 HydrophobicContact CD1-CB 4.12Å; L155-V168 HydrophobicContact CD1-CG1 3.92Å; L155-V168 HydrophobicContact CD2-CB 4.4Å; L155-V168 HydrophobicContact CD2-CG1 4.32Å; L155-V168 HydrophobicContact CD2-CG2 4.05Å; L164-V168 HydrophobicContact CD2-CG2 4.46Å; L164-V168 VanDerWaalsContact O-CB 3.32Å; L164-V168 WeakPolarHBondContact O-CB 3.19Å; L164-V168 VanDerWaalsContact O-CG2 3.25Å; L164-V168 WeakPolarHBondContact O-CG2 3.45Å; L164-V168 PolarHBondContact O-N 3.39Å; V168-Y171 WeakPolarHBondContact O-CB 3.23Å; V168-Y171 PolarHBondContact O-N 3.44Å; V168-F172 HydrophobicContact CG1-CD2 3.64Å; V168-F172 HydrophobicContact CG1-CE2 3.68Å; V168-F172 VanDerWaalsContact O-CD2 3.31Å; V168-F172 WeakPolarHBondContact O-CD2 3.47Å; V168-F172 PolarHBondContact O-N 2.99Å; V168-F209 HydrophobicContact CG2-CE2 4.25Å; V168-F209 HydrophobicContact CG2-CZ 3.96Å
169G93Very high90.9Very high15 Ų1550.3 Ų50.316%0.15529%0.289CS..Hα-helixtrans-59.1-49174.900000113Y148 T165 P166 G167 Y171 F172 V173Y148-G169 VanDerWaalsContact CE2-CA 3.5Å; T165-G169 PolarHBondContact O-N 3.07Å; P166-G169 PolarHBondContact O-N 2.72Å; G167-G169 VanDerWaalsContact C-N 3.33Å; G167-G169 PolarHBondContact O-N 3.11Å; G169-Y171 VanDerWaalsContact C-N 3.3Å; G169-Y171 PolarHBondContact O-N 2.91Å; G169-F172 PolarHBondContact O-N 3.33Å; G169-V173 WeakPolarHBondContact O-CG2 3.49Å; G169-V173 PolarHBondContact O-N 2.99Å; G169-V173 VanDerWaalsContact O-N 3.09Å
170I94.2Very high91.7Very high109 Ų10946 Ų4656%0.55926%0.262SS*.Hα-helixtrans-59.7-44.3175.6-68.8164.8000110.2P166 G167 F172 V173 L174P166-I170 VanDerWaalsContact O-CG1 3.29Å; P166-I170 WeakPolarHBondContact O-CG1 3.38Å; P166-I170 PolarHBondContact O-N 3.48Å; G167-I170 PolarHBondContact O-N 3.46Å; I170-F172 PolarHBondContact O-N 3.46Å; I170-V173 WeakPolarHBondContact O-CB 3.32Å; I170-V173 PolarHBondContact O-N 2.87Å; I170-L174 HydrophobicContact CG2-CD1 4.26Å; I170-L174 WeakPolarHBondContact O-CG 3.44Å; I170-L174 PolarHBondContact O-N 2.88Å
171Y94.4Very high92.1Very high22 Ų2241.1 Ų41.19%0.08624%0.236CC..Hα-helixtrans-58.6-45.2177.1-178.2-93.7000112.6M100 F103 A104 H107 G167 V168 G169 V173 L174 I175 D201M100-Y171 HydrophobicContact CG-CD2 3.78Å; M100-Y171 HydrophobicContact CG-CE2 4.29Å; M100-Y171 HydrophobicContact CG-CG 4.1Å; F103-Y171 HydrophobicContact CB-CE2 3.56Å; A104-Y171 HydrophobicContact CB-CD2 4.21Å; H107-Y171 AromaticContact CD2-CE2 3.76Å; H107-Y171 AromaticContact CD2-CZ 3.89Å; H107-Y171 AromaticContact NE2-CZ 3.76Å; H107-Y171 PolarHBondContact NE2-OH 2.85Å; G167-Y171 WeakPolarHBondContact O-CB 3.34Å; G167-Y171 PolarHBondContact O-N 2.88Å; V168-Y171 WeakPolarHBondContact O-CB 3.23Å; V168-Y171 PolarHBondContact O-N 3.44Å; G169-Y171 VanDerWaalsContact C-N 3.3Å; G169-Y171 PolarHBondContact O-N 2.91Å; Y171-V173 VanDerWaalsContact C-N 3.29Å; Y171-V173 PolarHBondContact O-N 3.34Å; Y171-L174 PolarHBondContact O-N 2.99Å; Y171-L174 VanDerWaalsContact O-N 3.13Å; Y171-I175 HydrophobicContact CE1-CD1 4.4Å; Y171-I175 PolarHBondContact O-N 3.43Å; Y171-D201 HydrophobicContact CE1-CB 4.23Å; Y171-D201 PolarHBondContact OH-OD2 3.46Å
172F93.3Very high92.5Very high26 Ų2639.6 Ų39.611%0.11423%0.226CC..Hα-helixtrans-59.4-39.8175.5-97-77.5000112.5F147 Y148 L151 V168 G169 I170 I175 T176F147-F172 AromaticContact CD1-CE1 3.43Å; F147-F172 HydrophobicContact CD1-CE1 3.43Å; F147-F172 VanDerWaalsContact CD1-CE1 3.43Å; F147-F172 HydrophobicContact CD1-CE2 4.25Å; F147-F172 AromaticContact CD1-CZ 3.26Å; F147-F172 HydrophobicContact CD1-CZ 3.26Å; F147-F172 AromaticContact CE1-CE1 3.98Å; F147-F172 HydrophobicContact CE1-CE1 3.98Å; F147-F172 HydrophobicContact CE1-CE2 4.33Å; F147-F172 AromaticContact CE1-CZ 3.38Å; F147-F172 HydrophobicContact CE1-CZ 3.38Å; F147-F172 HydrophobicContact CG-CE1 4.34Å; F147-F172 HydrophobicContact CG-CZ 4.49Å; Y148-F172 AromaticContact CD2-CD2 3.89Å; Y148-F172 HydrophobicContact CD2-CD2 3.89Å; Y148-F172 HydrophobicContact CD2-CG 4.38Å; L151-F172 HydrophobicContact CD2-CE2 4.06Å; V168-F172 HydrophobicContact CG1-CD2 3.64Å; V168-F172 HydrophobicContact CG1-CE2 3.68Å; V168-F172 VanDerWaalsContact O-CD2 3.31Å; V168-F172 WeakPolarHBondContact O-CD2 3.47Å; V168-F172 PolarHBondContact O-N 2.99Å; G169-F172 PolarHBondContact O-N 3.33Å; I170-F172 PolarHBondContact O-N 3.46Å; F172-I175 WeakPolarHBondContact O-CG2 3.43Å; F172-T176 WeakPolarHBondContact O-CB 3.29Å; F172-T176 PolarHBondContact O-N 3.01Å; F172-T176 PolarHBondContact O-OG1 3.42Å
173V94.4Very high92.6Very high98 Ų9833 Ų3359%0.59419%0.19SC*.Hα-helixtrans-63.2-44.6175.2173.10000110.6G169 I170 Y171 T176 M177G169-V173 WeakPolarHBondContact O-CG2 3.49Å; G169-V173 PolarHBondContact O-N 2.99Å; G169-V173 VanDerWaalsContact O-N 3.09Å; I170-V173 WeakPolarHBondContact O-CB 3.32Å; I170-V173 PolarHBondContact O-N 2.87Å; Y171-V173 VanDerWaalsContact C-N 3.29Å; Y171-V173 PolarHBondContact O-N 3.34Å; V173-T176 PolarHBondContact O-N 3.12Å; V173-M177 VanDerWaalsContact O-CB 3.24Å; V173-M177 WeakPolarHBondContact O-CB 3.39Å; V173-M177 PolarHBondContact O-N 2.84Å
174L95.5Very high92.5Very high25 Ų2535.7 Ų35.713%0.13119%0.194CC..Hα-helixtrans-64.7-47-179.3-69177.3000112.9A104 H107 L108 I170 Y171 T176 M177 M178A104-L174 HydrophobicContact CB-CD1 3.73Å; H107-L174 HydrophobicContact CB-CB 4.38Å; L108-L174 HydrophobicContact CD2-CD2 3.52Å; L108-L174 HydrophobicContact CG-CD1 4.32Å; L108-L174 HydrophobicContact CG-CD2 3.97Å; I170-L174 HydrophobicContact CG2-CD1 4.26Å; I170-L174 WeakPolarHBondContact O-CG 3.44Å; I170-L174 PolarHBondContact O-N 2.88Å; Y171-L174 PolarHBondContact O-N 2.99Å; Y171-L174 VanDerWaalsContact O-N 3.13Å; L174-T176 VanDerWaalsContact C-N 3.34Å; L174-T176 PolarHBondContact O-N 3.08Å; L174-M177 WeakPolarHBondContact O-CB 3.27Å; L174-M177 PolarHBondContact O-N 2.85Å; L174-M178 PolarHBondContact O-N 3.45Å
175I94.6Very high92.3Very high3 Ų335.1 Ų35.12%0.01519%0.191CC..Hα-helixtrans-68.2-35.9179.7-163.1171.9000111.8H107 Y171 F172 M178 A179 M198 D201H107-I175 WeakPolarHBondContact NE2-CD1 3.44Å; Y171-I175 HydrophobicContact CE1-CD1 4.4Å; Y171-I175 PolarHBondContact O-N 3.43Å; F172-I175 WeakPolarHBondContact O-CG2 3.43Å; I175-M178 HydrophobicContact CG1-CE 3.96Å; I175-M178 PolarHBondContact O-N 3.4Å; I175-A179 PolarHBondContact O-N 3.3Å; I175-A179 VanDerWaalsContact O-N 3.07Å; I175-M198 HydrophobicContact CD1-CB 4.21Å; I175-M198 HydrophobicContact CD1-CG 4.42Å; I175-M198 HydrophobicContact CG1-CB 4.36Å; I175-M198 HydrophobicContact CG1-CE 4.37Å; I175-M198 HydrophobicContact CG2-CE 4.48Å; I175-M198 WeakPolarHBondContact O-CE 3.31Å; I175-D201 HydrophobicContact CD1-CB 3.67Å; I175-D201 WeakPolarHBondContact CD1-OD2 3.33Å
176T94.1Very high91.7Very high17 Ų1736.9 Ų36.910%0.10421%0.213CC..Hα-helixtrans-66.7-41.7173.7-56.60000111L140 V141 F172 V173 L174 A179 A180L140-T176 HydrophobicContact CD2-CG2 4.1Å; L140-T176 WeakPolarHBondContact CD2-O 3.48Å; L140-T176 HydrophobicContact CG-CG2 4.15Å; V141-T176 HydrophobicContact CG2-CG2 4.26Å; F172-T176 WeakPolarHBondContact O-CB 3.29Å; F172-T176 PolarHBondContact O-N 3.01Å; F172-T176 PolarHBondContact O-OG1 3.42Å; V173-T176 PolarHBondContact O-N 3.12Å; L174-T176 VanDerWaalsContact C-N 3.34Å; L174-T176 PolarHBondContact O-N 3.08Å; T176-A179 PolarHBondContact O-N 3.39Å; T176-A180 VanDerWaalsContact O-CB 3.32Å; T176-A180 WeakPolarHBondContact O-CB 3.22Å; T176-A180 PolarHBondContact O-N 3.26Å
177M93.4Very high91.3Very high87 Ų8737.2 Ų37.243%0.42921%0.209SC..Hα-helixtrans-60.4-46.3174.5178.3-171.7173.600111.2V173 L174 A179 A180 L181V173-M177 VanDerWaalsContact O-CB 3.24Å; V173-M177 WeakPolarHBondContact O-CB 3.39Å; V173-M177 PolarHBondContact O-N 2.84Å; L174-M177 WeakPolarHBondContact O-CB 3.27Å; L174-M177 PolarHBondContact O-N 2.85Å; M177-A179 PolarHBondContact O-N 2.99Å; M177-A180 WeakPolarHBondContact O-CB 3.36Å; M177-A180 PolarHBondContact O-N 3.26Å; M177-L181 HydrophobicContact CE-CD1 3.87Å; M177-L181 HydrophobicContact CG-CD1 4.17Å; M177-L181 WeakPolarHBondContact O-CG 3.45Å; M177-L181 PolarHBondContact O-N 3.33Å
178M95.4Very high91Very high2 Ų241.7 Ų41.71%0.0123%0.231CC..Hα-helixtrans-56.4-51.5176.3176.1-16363.100111.2H107 Y110 S111 F114 L174 I175 A180 L181 A182 F197H107-M178 PolarHBondContact ND1-SD 2.92Å; H107-M178 VanDerWaalsContact ND1-SD 3.37Å; Y110-M178 HydrophobicContact CD2-SD 3.34Å; Y110-M178 WeakPolarHBondContact CD2-SD 3.42Å; Y110-M178 HydrophobicContact CE2-SD 4.27Å; Y110-M178 HydrophobicContact CG-SD 3.88Å; S111-M178 WeakPolarHBondContact OG-CA 3.21Å; F114-M178 HydrophobicContact CD2-CG 4.3Å; F114-M178 HydrophobicContact CE2-CG 3.75Å; L174-M178 PolarHBondContact O-N 3.45Å; I175-M178 HydrophobicContact CG1-CE 3.96Å; I175-M178 PolarHBondContact O-N 3.4Å; M178-A180 VanDerWaalsContact C-N 3.34Å; M178-A180 PolarHBondContact O-N 2.9Å; M178-L181 PolarHBondContact O-N 3.15Å; M178-A182 PolarHBondContact O-N 3.35Å; M178-F197 HydrophobicContact CE-CB 4.21Å
179A94.1Very high90.7Very high1 Ų145.2 Ų45.21%0.00826%0.26CS..Hα-helixtrans-66.1-35.1-179.200000112.4L140 I175 T176 M177 A182 I183 M198L140-A179 HydrophobicContact CD1-CB 4.16Å; L140-A179 HydrophobicContact CD2-CB 3.63Å; L140-A179 HydrophobicContact CG-CB 4.49Å; I175-A179 PolarHBondContact O-N 3.3Å; I175-A179 VanDerWaalsContact O-N 3.07Å; T176-A179 PolarHBondContact O-N 3.39Å; M177-A179 PolarHBondContact O-N 2.99Å; A179-A182 WeakPolarHBondContact O-CB 3.44Å; A179-A182 PolarHBondContact O-N 3.24Å; A179-I183 WeakPolarHBondContact O-CG1 3.33Å; A179-I183 PolarHBondContact O-N 2.92Å; A179-I183 VanDerWaalsContact O-N 3.11Å; A179-M198 HydrophobicContact CB-CE 3.46Å; A179-M198 VanDerWaalsContact CB-CE 3.46Å; A179-M198 HydrophobicContact CB-SD 4.48Å
180A91.9Very high90.5Very high15 Ų1545.3 Ų45.312%0.12426%0.258CS..Hα-helixtrans-60.5-47.5171.300000111.4H137 L140 T176 M177 M178 A182 I183 R184H137-A180 PolarHBondContact CE1-O 3.42Å; H137-A180 PolarHBondContact NE2-O 2.86Å; L140-A180 HydrophobicContact CD2-CB 4.08Å; T176-A180 VanDerWaalsContact O-CB 3.32Å; T176-A180 WeakPolarHBondContact O-CB 3.22Å; T176-A180 PolarHBondContact O-N 3.26Å; M177-A180 WeakPolarHBondContact O-CB 3.36Å; M177-A180 PolarHBondContact O-N 3.26Å; M178-A180 VanDerWaalsContact C-N 3.34Å; M178-A180 PolarHBondContact O-N 2.9Å; A180-A182 VanDerWaalsContact C-N 3.3Å; A180-A182 PolarHBondContact O-N 3.32Å; A180-I183 WeakPolarHBondContact O-CB 3.31Å; A180-I183 PolarHBondContact O-N 3.34Å; A180-R184 PolarHBondContact O-N 3.06Å
181L91.6Very high90.3Very high19 Ų1942.5 Ų42.510%0.09924%0.244CC..Hα-helixtrans-63.7-36.5176.2-68.7175.6000112.1S111 F114 L115 M177 M178 I183 R184 T185S111-L181 WeakPolarHBondContact O-CD1 3.46Å; F114-L181 HydrophobicContact CB-CB 4Å; F114-L181 HydrophobicContact CD2-CB 4.3Å; L115-L181 HydrophobicContact CD1-CD2 4.01Å; M177-L181 HydrophobicContact CE-CD1 3.87Å; M177-L181 HydrophobicContact CG-CD1 4.17Å; M177-L181 WeakPolarHBondContact O-CG 3.45Å; M177-L181 PolarHBondContact O-N 3.33Å; M178-L181 PolarHBondContact O-N 3.15Å; L181-I183 VanDerWaalsContact C-N 3.33Å; L181-I183 PolarHBondContact O-N 3.29Å; L181-R184 WeakPolarHBondContact O-CB 3.49Å; L181-R184 PolarHBondContact O-N 3.34Å; L181-T185 WeakPolarHBondContact O-CG2 3.44Å; L181-T185 PolarHBondContact O-N 3.22Å
182A91.4Very high90.1Very high0 Ų044 Ų440%026%0.257CS..Hα-helixtrans-59.8-40.8174.800000112.2F114 M178 A179 A180 R184 T185 T190 S194F114-A182 HydrophobicContact CD2-CB 4.06Å; F114-A182 HydrophobicContact CE2-CB 3.94Å; M178-A182 PolarHBondContact O-N 3.35Å; A179-A182 WeakPolarHBondContact O-CB 3.44Å; A179-A182 PolarHBondContact O-N 3.24Å; A180-A182 VanDerWaalsContact C-N 3.3Å; A180-A182 PolarHBondContact O-N 3.32Å; A182-R184 VanDerWaalsContact C-N 3.26Å; A182-R184 PolarHBondContact O-N 3.35Å; A182-T185 WeakPolarHBondContact O-CB 3.39Å; A182-T185 PolarHBondContact O-N 3.41Å; A182-T185 VanDerWaalsContact O-N 3.15Å; A182-T185 PolarHBondContact O-OG1 3.21Å; A182-T190 HydrophobicContact CB-CG2 4.16Å; A182-S194 VanDerWaalsContact CB-OG 3.23Å; A182-S194 WeakPolarHBondContact CB-OG 3.36Å
183I89Confident90.1Very high13 Ų1344 Ų447%0.06727%0.265CS..Hα-helixtrans-58.2-40.2173.6-64.7162.6000110.8N133 L136 L140 A179 A180 L181 T185 G186 L191N133-I183 HydrophobicContact CB-CG2 4.15Å; L136-I183 HydrophobicContact CB-CD1 3.94Å; L136-I183 HydrophobicContact CB-CG2 4.36Å; L136-I183 HydrophobicContact CD1-CG2 4.37Å; L140-I183 HydrophobicContact CD2-CD1 4.36Å; A179-I183 WeakPolarHBondContact O-CG1 3.33Å; A179-I183 PolarHBondContact O-N 2.92Å; A179-I183 VanDerWaalsContact O-N 3.11Å; A180-I183 WeakPolarHBondContact O-CB 3.31Å; A180-I183 PolarHBondContact O-N 3.34Å; L181-I183 VanDerWaalsContact C-N 3.33Å; L181-I183 PolarHBondContact O-N 3.29Å; I183-T185 VanDerWaalsContact C-N 3.26Å; I183-T185 PolarHBondContact O-N 3.04Å; I183-G186 PolarHBondContact O-N 3.3Å; I183-L191 HydrophobicContact CG1-CD1 3.56Å
184R86.4Confident90Very high160 Ų16039.6 Ų39.660%0.60424%0.238SC*.Hα-helixtrans-66.3-26.1-179.8-63-177.166.6-161.6-0.8113.3A180 L181 A182 G186A180-R184 PolarHBondContact O-N 3.06Å; L181-R184 WeakPolarHBondContact O-CB 3.49Å; L181-R184 PolarHBondContact O-N 3.34Å; A182-R184 VanDerWaalsContact C-N 3.26Å; A182-R184 PolarHBondContact O-N 3.35Å; R184-G186 PolarHBondContact O-N 3.42Å
185T84.3Confident89.9Confident4 Ų442 Ų423%0.02525%0.251CS..Hα-helixtrans-67.3-23.5179.172.50000113F114 Y119 L181 A182 I183 Q187 T190F114-T185 HydrophobicContact CB-CG2 3.91Å; F114-T185 HydrophobicContact CG-CG2 4.24Å; Y119-T185 HydrophobicContact CD1-CG2 4.11Å; Y119-T185 HydrophobicContact CG-CG2 4.48Å; L181-T185 WeakPolarHBondContact O-CG2 3.44Å; L181-T185 PolarHBondContact O-N 3.22Å; A182-T185 WeakPolarHBondContact O-CB 3.39Å; A182-T185 PolarHBondContact O-N 3.41Å; A182-T185 VanDerWaalsContact O-N 3.15Å; A182-T185 PolarHBondContact O-OG1 3.21Å; I183-T185 VanDerWaalsContact C-N 3.26Å; I183-T185 PolarHBondContact O-N 3.04Å; T185-Q187 PolarHBondContact O-N 3.1Å; T185-Q187 VanDerWaalsContact O-N 3.1Å; T185-Q187 PolarHBondContact OG1-N 3.3Å; T185-T190 HydrophobicContact CG2-CG2 4.22Å
186G77.6Confident89.9Confident60 Ų6047.4 Ų47.462%0.61928%0.279SS*.  trans66.62.6-17500000114.6I183 R184I183-G186 PolarHBondContact O-N 3.3Å; R184-G186 PolarHBondContact O-N 3.42Å
187Q83.9Confident89.8Confident75 Ų7548.1 Ų48.135%0.3528%0.281SS..  trans-91.4116.3-179.2-66.4176.82.800110.1T185 A189 T190 L191T185-Q187 PolarHBondContact O-N 3.1Å; T185-Q187 VanDerWaalsContact O-N 3.1Å; T185-Q187 PolarHBondContact OG1-N 3.3Å; Q187-A189 VanDerWaalsContact C-N 3.26Å; Q187-A189 PolarHBondContact O-N 2.75Å; Q187-T190 PolarHBondContact O-N 3.38Å; Q187-T190 VanDerWaalsContact O-N 3.12Å; Q187-T190 PolarHBondContact OE1-OG1 3.37Å; Q187-T190 VanDerWaalsContact OE1-OG1 3.07Å; Q187-L191 PolarHBondContact O-N 3.42Å
188V86.1Confident89.8Confident120 Ų12045.6 Ų45.673%0.72727%0.268SS*.Hα-helixtrans-57.4-38.9-177.3179.10000112.1L191 S192V188-L191 PolarHBondContact O-N 3.3Å; V188-S192 WeakPolarHBondContact O-CB 3.47Å; V188-S192 PolarHBondContact O-N 2.92Å; V188-S192 PolarHBondContact O-OG 2.68Å; V188-S192 VanDerWaalsContact O-OG 3.08Å
189A85.7Confident89.7Confident78 Ų7850 Ų5065%0.64530%0.295SS*.Hα-helixtrans-65.6-39.5178.900000113Q187 S192 G193Q187-A189 VanDerWaalsContact C-N 3.26Å; Q187-A189 PolarHBondContact O-N 2.75Å; A189-S192 PolarHBondContact O-OG 2.94Å; A189-S192 VanDerWaalsContact O-OG 3.08Å; A189-G193 PolarHBondContact O-N 3.47Å
190T89.6Confident89.6Confident18 Ų1853 Ų5311%0.1132%0.316CS..Hα-helixtrans-69.7-43177.7-54.50000110.7F114 A182 T185 Q187 S194F114-T190 HydrophobicContact CD1-CG2 3.7Å; F114-T190 HydrophobicContact CD2-CG2 4.27Å; F114-T190 HydrophobicContact CE1-CG2 3.33Å; F114-T190 HydrophobicContact CE2-CG2 3.92Å; F114-T190 HydrophobicContact CG-CG2 4.18Å; F114-T190 HydrophobicContact CZ-CG2 3.45Å; F114-T190 VanDerWaalsContact CZ-CG2 3.45Å; A182-T190 HydrophobicContact CB-CG2 4.16Å; T185-T190 HydrophobicContact CG2-CG2 4.22Å; Q187-T190 PolarHBondContact O-N 3.38Å; Q187-T190 VanDerWaalsContact O-N 3.12Å; Q187-T190 PolarHBondContact OE1-OG1 3.37Å; Q187-T190 VanDerWaalsContact OE1-OG1 3.07Å; T190-S194 WeakPolarHBondContact O-CB 3.42Å; T190-S194 PolarHBondContact O-N 2.98Å; T190-S194 PolarHBondContact O-OG 3Å
191L90.6Very high89.6Confident50 Ų5052.8 Ų52.826%0.26231%0.313SS..Hα-helixtrans-61.9-51.4175179.160000111.4I183 Q187 V188 G193 S194 L195I183-L191 HydrophobicContact CG1-CD1 3.56Å; Q187-L191 PolarHBondContact O-N 3.42Å; V188-L191 PolarHBondContact O-N 3.3Å; L191-G193 VanDerWaalsContact C-N 3.34Å; L191-G193 PolarHBondContact O-N 2.88Å; L191-S194 PolarHBondContact O-N 3.24Å; L191-S194 PolarHBondContact O-OG 3.43Å; L191-L195 HydrophobicContact CD1-CD1 4.15Å; L191-L195 HydrophobicContact CD1-CG 4.24Å; L191-L195 HydrophobicContact CG-CD1 4.14Å; L191-L195 WeakPolarHBondContact O-CG 3.46Å; L191-L195 PolarHBondContact O-N 3.43Å
192S90.3Very high89.5Confident53 Ų5352.9 Ų52.937%0.37132%0.316SS..Hα-helixtrans-61.5-42.8-179.764.10000111.8V188 A189 S194 L195 I196V188-S192 WeakPolarHBondContact O-CB 3.47Å; V188-S192 PolarHBondContact O-N 2.92Å; V188-S192 PolarHBondContact O-OG 2.68Å; V188-S192 VanDerWaalsContact O-OG 3.08Å; A189-S192 PolarHBondContact O-OG 2.94Å; A189-S192 VanDerWaalsContact O-OG 3.08Å; S192-S194 PolarHBondContact O-N 3.08Å; S192-L195 PolarHBondContact O-N 3.38Å; S192-I196 VanDerWaalsContact O-CG1 3.27Å; S192-I196 WeakPolarHBondContact O-CG1 3.24Å; S192-I196 PolarHBondContact O-N 3.38Å
193G91.5Very high89.5Confident27 Ų2755.4 Ų55.428%0.27833%0.334SS..Hα-helixtrans-57-49.1173.700000112.2A189 L191 L195 I196 F197A189-G193 PolarHBondContact O-N 3.47Å; L191-G193 VanDerWaalsContact C-N 3.34Å; L191-G193 PolarHBondContact O-N 2.88Å; G193-L195 VanDerWaalsContact C-N 3.31Å; G193-L195 PolarHBondContact O-N 3.14Å; G193-I196 PolarHBondContact O-N 2.86Å; G193-F197 WeakPolarHBondContact O-CD2 3.28Å; G193-F197 PolarHBondContact O-N 3.27Å
194S93.4Very high89.5Confident4 Ų456.2 Ų56.23%0.02834%0.338CS..Hα-helixtrans-61.3-37.7179.274.20000113.3A182 T190 L191 S192 M198A182-S194 VanDerWaalsContact CB-OG 3.23Å; A182-S194 WeakPolarHBondContact CB-OG 3.36Å; T190-S194 WeakPolarHBondContact O-CB 3.42Å; T190-S194 PolarHBondContact O-N 2.98Å; T190-S194 PolarHBondContact O-OG 3Å; L191-S194 PolarHBondContact O-N 3.24Å; L191-S194 PolarHBondContact O-OG 3.43Å; S192-S194 PolarHBondContact O-N 3.08Å; S194-M198 WeakPolarHBondContact O-CB 3.44Å; S194-M198 PolarHBondContact O-N 3.24Å
195L93.9Very high89.6Confident76 Ų7649.1 Ų49.140%0.39831%0.314SS..Hα-helixtrans-71.1-39.6177.7-69175.3000111.7L191 S192 G193 M198 V199L191-L195 HydrophobicContact CD1-CD1 4.15Å; L191-L195 HydrophobicContact CD1-CG 4.24Å; L191-L195 HydrophobicContact CG-CD1 4.14Å; L191-L195 WeakPolarHBondContact O-CG 3.46Å; L191-L195 PolarHBondContact O-N 3.43Å; S192-L195 PolarHBondContact O-N 3.38Å; G193-L195 VanDerWaalsContact C-N 3.31Å; G193-L195 PolarHBondContact O-N 3.14Å; L195-M198 PolarHBondContact O-N 3.09Å; L195-V199 WeakPolarHBondContact O-CG2 3.35Å; L195-V199 PolarHBondContact O-N 2.9Å
196I93.6Very high89.9Confident117 Ų11750.4 Ų50.460%0.632%0.32SS*.Hα-helixtrans-61.6-45.6175.2-70.1165.1000110.3S192 G193 V199 S200S192-I196 VanDerWaalsContact O-CG1 3.27Å; S192-I196 WeakPolarHBondContact O-CG1 3.24Å; S192-I196 PolarHBondContact O-N 3.38Å; G193-I196 PolarHBondContact O-N 2.86Å; I196-V199 PolarHBondContact O-N 3.43Å; I196-S200 WeakPolarHBondContact O-CB 3.48Å; I196-S200 PolarHBondContact O-N 3.44Å
197F92Very high90.3Very high32 Ų3252.2 Ų52.214%0.1431%0.313CS..Hα-helixtrans-59.5-46.2174.2-92.8-81.2000111.8T57 L80 S83 M178 G193 V199 S200 D201T57-F197 HydrophobicContact CG2-CZ 4.46Å; L80-F197 HydrophobicContact CD2-CE2 3.97Å; L80-F197 HydrophobicContact CD2-CZ 3.7Å; S83-F197 WeakPolarHBondContact OG-CE1 3.26Å; M178-F197 HydrophobicContact CE-CB 4.21Å; G193-F197 WeakPolarHBondContact O-CD2 3.28Å; G193-F197 PolarHBondContact O-N 3.27Å; F197-V199 PolarHBondContact O-N 3.15Å; F197-S200 WeakPolarHBondContact O-CB 3.49Å; F197-S200 PolarHBondContact O-N 3.49Å; F197-D201 VanDerWaalsContact O-CG 3.28Å; F197-D201 PolarHBondContact O-N 3.5Å
198M93.9Very high90.4Very high34 Ų3451.5 Ų51.517%0.16731%0.313CS..Hα-helixtrans-59.9-43.9177.5-176.6176.6-80.300113.3L140 I175 A179 S194 L195 D201 A202L140-M198 HydrophobicContact CD1-CE 3.89Å; L140-M198 HydrophobicContact CD1-SD 3.71Å; L140-M198 HydrophobicContact CG-CE 4.36Å; I175-M198 HydrophobicContact CD1-CB 4.21Å; I175-M198 HydrophobicContact CD1-CG 4.42Å; I175-M198 HydrophobicContact CG1-CB 4.36Å; I175-M198 HydrophobicContact CG1-CE 4.37Å; I175-M198 HydrophobicContact CG2-CE 4.48Å; I175-M198 WeakPolarHBondContact O-CE 3.31Å; A179-M198 HydrophobicContact CB-CE 3.46Å; A179-M198 VanDerWaalsContact CB-CE 3.46Å; A179-M198 HydrophobicContact CB-SD 4.48Å; S194-M198 WeakPolarHBondContact O-CB 3.44Å; S194-M198 PolarHBondContact O-N 3.24Å; L195-M198 PolarHBondContact O-N 3.09Å; M198-D201 PolarHBondContact O-N 3Å; M198-A202 WeakPolarHBondContact O-CB 3.36Å; M198-A202 PolarHBondContact O-N 2.87Å
199V93Very high90.4Very high93 Ų9346.9 Ų46.956%0.56428%0.283SS*.Hα-helixtrans-69.1-37.8178.3172.20000111.6L195 I196 F197 A202 S203L195-V199 WeakPolarHBondContact O-CG2 3.35Å; L195-V199 PolarHBondContact O-N 2.9Å; I196-V199 PolarHBondContact O-N 3.43Å; F197-V199 PolarHBondContact O-N 3.15Å; V199-A202 PolarHBondContact O-N 3.35Å; V199-S203 WeakPolarHBondContact O-CB 3.43Å; V199-S203 PolarHBondContact O-N 2.83Å; V199-S203 PolarHBondContact O-OG 3.44Å
200S91.4Very high90.2Very high65 Ų6551.6 Ų51.646%0.45529%0.29SS..Hα-helixtrans-58.5-50.3173.9178.30000111I196 F197 A202 S203 L204I196-S200 WeakPolarHBondContact O-CB 3.48Å; I196-S200 PolarHBondContact O-N 3.44Å; F197-S200 WeakPolarHBondContact O-CB 3.49Å; F197-S200 PolarHBondContact O-N 3.49Å; S200-A202 PolarHBondContact O-N 3.21Å; S200-S203 PolarHBondContact O-N 3.3Å; S200-L204 PolarHBondContact O-N 3Å
201D91.9Very high89.8Confident11 Ų1151.6 Ų51.66%0.05929%0.289CS..Hα-helixtrans-69.9-34.8-177.4-63.8-11.6000111.6H107 Y171 I175 F197 M198 L204 A205H107-D201 IonicContact CE1-OD2 3.4Å; H107-D201 PolarHBondContact CE1-OD2 2.96Å; H107-D201 IonicContact NE2-OD2 2.9Å; H107-D201 PolarHBondContact NE2-OD2 2.95Å; Y171-D201 HydrophobicContact CE1-CB 4.23Å; Y171-D201 PolarHBondContact OH-OD2 3.46Å; I175-D201 HydrophobicContact CD1-CB 3.67Å; I175-D201 WeakPolarHBondContact CD1-OD2 3.33Å; F197-D201 VanDerWaalsContact O-CG 3.28Å; F197-D201 PolarHBondContact O-N 3.5Å; M198-D201 PolarHBondContact O-N 3Å; D201-L204 PolarHBondContact O-N 3.21Å; D201-A205 WeakPolarHBondContact O-CB 3.43Å; D201-A205 PolarHBondContact O-N 3.44Å
202A90.9Very high88.6Confident21 Ų2154.1 Ų54.117%0.17430%0.302CS..Hα-helixtrans-63.8-43.4172.200000111.8F147 M198 V199 S200 L204 A205 L206F147-A202 HydrophobicContact CE1-CB 4.36Å; F147-A202 HydrophobicContact CE2-CB 4.16Å; F147-A202 HydrophobicContact CZ-CB 3.86Å; M198-A202 WeakPolarHBondContact O-CB 3.36Å; M198-A202 PolarHBondContact O-N 2.87Å; V199-A202 PolarHBondContact O-N 3.35Å; S200-A202 PolarHBondContact O-N 3.21Å; A202-L204 VanDerWaalsContact C-N 3.34Å; A202-A205 PolarHBondContact O-N 3.13Å; A202-L206 WeakPolarHBondContact O-CG 3.36Å; A202-L206 PolarHBondContact O-N 2.96Å
203S90.1Very high86.7Confident53 Ų5361 Ų6137%0.37135%0.346SS..Hα-helixtrans-64-41.7177.4-60.60000111.3V199 S200 L206 Q207V199-S203 WeakPolarHBondContact O-CB 3.43Å; V199-S203 PolarHBondContact O-N 2.83Å; V199-S203 PolarHBondContact O-OG 3.44Å; S200-S203 PolarHBondContact O-N 3.3Å; S203-L206 PolarHBondContact O-N 3.33Å; S203-Q207 WeakPolarHBondContact O-CG 3.49Å; S203-Q207 PolarHBondContact O-N 3.01Å; S203-Q207 VanDerWaalsContact O-N 3.13Å
204L88.8Confident86.5Confident29 Ų2962.7 Ų62.715%0.15235%0.349CS..Hα-helixtrans-60.8-45.5173.2-176.780.2000111.6L90 S200 D201 A202 L206 Q207 V208L90-L204 HydrophobicContact CD1-CD1 3.9Å; L90-L204 HydrophobicContact CD1-CD2 3.25Å; L90-L204 HydrophobicContact CD1-CG 4.19Å; L90-L204 HydrophobicContact CD2-CD2 3.99Å; L90-L204 HydrophobicContact CG-CD2 4.25Å; S200-L204 PolarHBondContact O-N 3Å; D201-L204 PolarHBondContact O-N 3.21Å; A202-L204 VanDerWaalsContact C-N 3.34Å; L204-L206 VanDerWaalsContact C-N 3.33Å; L204-L206 PolarHBondContact O-N 3.01Å; L204-Q207 PolarHBondContact O-N 3.25Å; L204-V208 HydrophobicContact CD1-CG2 4.31Å; L204-V208 HydrophobicContact CG-CG2 4.19Å; L204-V208 WeakPolarHBondContact O-CB 3.3Å; L204-V208 WeakPolarHBondContact O-CG2 3.42Å; L204-V208 PolarHBondContact O-N 2.96Å
205A89.7Confident86.1Confident12 Ų1265.7 Ų65.710%0.09937%0.366CS..Hα-helixtrans-59.9-43.4178.300000111.6F147 L151 D201 A202 Q207 V208 F209F147-A205 HydrophobicContact CE1-CB 4.42Å; L151-A205 HydrophobicContact CD2-CB 4.14Å; D201-A205 WeakPolarHBondContact O-CB 3.43Å; D201-A205 PolarHBondContact O-N 3.44Å; A202-A205 PolarHBondContact O-N 3.13Å; A205-Q207 VanDerWaalsContact C-N 3.31Å; A205-Q207 PolarHBondContact O-N 3.17Å; A205-V208 PolarHBondContact O-N 3.38Å; A205-F209 HydrophobicContact CB-CD2 4.36Å; A205-F209 WeakPolarHBondContact O-CB 3.26Å; A205-F209 WeakPolarHBondContact O-CD2 3.39Å; A205-F209 PolarHBondContact O-N 3.19Å
206L89.4Confident85.7Confident30 Ų3065.2 Ų65.216%0.15736%0.364CS..Hα-helixtrans-61.9-38.9177.1-66.2173.6000112.4F147 Y150 A202 S203 L204 K210 V211 L212F147-L206 HydrophobicContact CE2-CD1 4.26Å; F147-L206 HydrophobicContact CE2-CD2 4.07Å; F147-L206 HydrophobicContact CE2-CG 4.21Å; F147-L206 HydrophobicContact CZ-CD1 4.37Å; F147-L206 HydrophobicContact CZ-CD2 3.86Å; F147-L206 HydrophobicContact CZ-CG 3.88Å; Y150-L206 HydrophobicContact CE1-CD2 4.19Å; A202-L206 WeakPolarHBondContact O-CG 3.36Å; A202-L206 PolarHBondContact O-N 2.96Å; S203-L206 PolarHBondContact O-N 3.33Å; L204-L206 VanDerWaalsContact C-N 3.33Å; L204-L206 PolarHBondContact O-N 3.01Å; L206-K210 PolarHBondContact O-N 3.15Å; L206-V211 HydrophobicContact CB-CB 4.43Å; L206-V211 HydrophobicContact CD2-CB 3.74Å; L206-V211 HydrophobicContact CD2-CG1 3.72Å; L206-V211 HydrophobicContact CD2-CG2 4.04Å; L206-V211 PolarHBondContact O-N 3.08Å; L206-L212 HydrophobicContact CB-CD1 4.15Å; L206-L212 HydrophobicContact CB-CG 4.48Å; L206-L212 HydrophobicContact CD1-CD1 3.98Å
207Q87.4Confident85.2Confident99 Ų9962.1 Ų62.146%0.46335%0.35SS..Hα-helixtrans-69.8-49.4177.5-71174.1-100112S203 L204 A205 F209 K210S203-Q207 WeakPolarHBondContact O-CG 3.49Å; S203-Q207 PolarHBondContact O-N 3.01Å; S203-Q207 VanDerWaalsContact O-N 3.13Å; L204-Q207 PolarHBondContact O-N 3.25Å; A205-Q207 VanDerWaalsContact C-N 3.31Å; A205-Q207 PolarHBondContact O-N 3.17Å; Q207-F209 PolarHBondContact O-N 3.44Å; Q207-K210 PolarHBondContact O-N 2.73Å
208V85.8Confident84.8Confident60 Ų6064 Ų6436%0.36436%0.363SS..Hα-helixtrans-64.2-41.7-176.3170.20000111.5F96 L204 A205 K210F96-V208 HydrophobicContact CD2-CG1 4.25Å; F96-V208 HydrophobicContact CE1-CG1 4.49Å; F96-V208 HydrophobicContact CE2-CB 4.33Å; F96-V208 HydrophobicContact CE2-CG1 3.75Å; F96-V208 HydrophobicContact CE2-CG2 3.99Å; F96-V208 HydrophobicContact CZ-CG1 3.88Å; L204-V208 HydrophobicContact CD1-CG2 4.31Å; L204-V208 HydrophobicContact CG-CG2 4.19Å; L204-V208 WeakPolarHBondContact O-CB 3.3Å; L204-V208 WeakPolarHBondContact O-CG2 3.42Å; L204-V208 PolarHBondContact O-N 2.96Å; A205-V208 PolarHBondContact O-N 3.38Å; V208-K210 VanDerWaalsContact C-N 3.26Å; V208-K210 PolarHBondContact O-N 2.9Å
209F85.6Confident84.2Confident22 Ų2266 Ų6610%0.09638%0.377CS..THydrogen-bonded Turntrans-89.110.7-179.7-59.9-62.2000113.5F96 L151 F154 L155 A158 L164 V168 A205 Q207 V211F96-F209 HydrophobicContact CE1-CZ 4.13Å; F96-F209 HydrophobicContact CZ-CE2 4.48Å; F96-F209 HydrophobicContact CZ-CZ 4.04Å; L151-F209 HydrophobicContact CD1-CB 4.19Å; L151-F209 HydrophobicContact CD1-CD2 3.97Å; L151-F209 HydrophobicContact CD1-CG 4.44Å; L151-F209 HydrophobicContact CD2-CD2 3.89Å; L151-F209 HydrophobicContact CD2-CE2 4.12Å; L151-F209 HydrophobicContact CG-CD2 4.16Å; F154-F209 HydrophobicContact CB-CB 4.23Å; L155-F209 HydrophobicContact CD2-CD1 3.69Å; L155-F209 HydrophobicContact CD2-CD2 3.7Å; L155-F209 HydrophobicContact CD2-CE1 3.4Å; L155-F209 HydrophobicContact CD2-CE2 3.41Å; L155-F209 VanDerWaalsContact CD2-CE2 3.41Å; L155-F209 HydrophobicContact CD2-CG 3.84Å; L155-F209 HydrophobicContact CD2-CZ 3.25Å; A158-F209 HydrophobicContact CB-CD1 4.46Å; A158-F209 HydrophobicContact CB-CE1 4.49Å; L164-F209 HydrophobicContact CD2-CE1 4.27Å; L164-F209 HydrophobicContact CD2-CZ 4.2Å; V168-F209 HydrophobicContact CG2-CE2 4.25Å; V168-F209 HydrophobicContact CG2-CZ 3.96Å; A205-F209 HydrophobicContact CB-CD2 4.36Å; A205-F209 WeakPolarHBondContact O-CB 3.26Å; A205-F209 WeakPolarHBondContact O-CD2 3.39Å; A205-F209 PolarHBondContact O-N 3.19Å; Q207-F209 PolarHBondContact O-N 3.44Å; F209-V211 HydrophobicContact CB-CG2 4.1Å; F209-V211 PolarHBondContact O-N 3.14Å
210K81.9Confident83.6Confident178 Ų17864.1 Ų64.177%0.77436%0.363SS*.THydrogen-bonded Turntrans50.941.5175.3-58.2-178.3177.7-179.20112.8L206 Q207 V208L206-K210 PolarHBondContact O-N 3.15Å; Q207-K210 PolarHBondContact O-N 2.73Å; V208-K210 VanDerWaalsContact C-N 3.26Å; V208-K210 PolarHBondContact O-N 2.9Å
211V79.4Confident83Confident18 Ų1864 Ų6411%0.10936%0.356CS..  trans-76.5-36.2178.2-175.80000110.3Y150 L151 F154 L206 F209Y150-V211 HydrophobicContact CE1-CG1 3.51Å; Y150-V211 WeakPolarHBondContact OH-CG1 3.47Å; L151-V211 HydrophobicContact CD1-CG2 3.67Å; F154-V211 HydrophobicContact CB-CG2 4.11Å; F154-V211 HydrophobicContact CD1-CG2 4.02Å; F154-V211 HydrophobicContact CD2-CG1 4.34Å; F154-V211 HydrophobicContact CD2-CG2 3.93Å; F154-V211 HydrophobicContact CE1-CB 4.49Å; F154-V211 HydrophobicContact CE1-CG1 4.34Å; F154-V211 HydrophobicContact CE1-CG2 4.42Å; F154-V211 HydrophobicContact CE2-CG1 3.93Å; F154-V211 HydrophobicContact CE2-CG2 4.34Å; F154-V211 HydrophobicContact CG-CG2 3.77Å; F154-V211 HydrophobicContact CZ-CG1 3.93Å; L206-V211 HydrophobicContact CB-CB 4.43Å; L206-V211 HydrophobicContact CD2-CB 3.74Å; L206-V211 HydrophobicContact CD2-CG1 3.72Å; L206-V211 HydrophobicContact CD2-CG2 4.04Å; L206-V211 PolarHBondContact O-N 3.08Å; F209-V211 HydrophobicContact CB-CG2 4.1Å; F209-V211 PolarHBondContact O-N 3.14Å
212L66.4Low82.2Confident102 Ų10268.4 Ų68.453%0.53438%0.381SS..  trans-99.9143.6169.3-66.7169.5000108.9L206L206-L212 HydrophobicContact CB-CD1 4.15Å; L206-L212 HydrophobicContact CB-CG 4.48Å; L206-L212 HydrophobicContact CD1-CD1 3.98Å
213P51.4Low81.5Confident197 Ų19772.7 Ų72.7100%1.27940%0.4SS*.  trans-64.90177.528.4-34.6000112.9

Retrieved 213 of 213 residues in 136.9 ms (Link to these results)