A0A087X886_POEFO Loading...

Transmembrane protein 161A

AlphaFold DB , UniProt , Accession A0A087X886, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 497 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

 

Download Structure   PDB   PAE   Table  
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
1M34.3Very low68Low233 Ų23384.6 Ų84.6100%1.14849%0.486SS*.  093.40-75.5-160.4-8800110.3
2A37.5Very low69.7Low103 Ų10384.8 Ų84.885%0.85148%0.483SS*.  trans-151.158.1159.900000105.3
3L47.3Very low71.1Confident164 Ų16485.9 Ų85.986%0.85949%0.486SS*.  trans-88.1-5.8-162-98.3145.7000114.1
4M56.3Low72.2Confident112 Ų11280.6 Ų80.655%0.55246%0.458SS*.SBendtrans-122.9108.8173.1-62.8-146.1-75.900109.4L8 V9 L12M4-L8 HydrophobicContact CB-CD2 4.1Å; M4-L8 HydrophobicContact CG-CD2 3.97Å; M4-L8 HydrophobicContact SD-CD2 3.22Å; M4-L8 WeakPolarHBondContact SD-CD2 3.35Å; M4-V9 HydrophobicContact CB-CG2 4.21Å; M4-L12 HydrophobicContact CE-CD1 4.17Å; M4-L12 HydrophobicContact SD-CD1 4.04Å
5G74.2Confident73.2Confident30 Ų3077.1 Ų77.131%0.30944%0.443SS..  trans-57.1149.8172.200000110.7Q7 L8 V9G5-Q7 PolarHBondContact O-N 2.98Å; G5-Q7 VanDerWaalsContact O-N 3.09Å; G5-L8 WeakPolarHBondContact O-CA 3.26Å; G5-L8 WeakPolarHBondContact O-CB 3.42Å; G5-L8 PolarHBondContact O-N 2.82Å; G5-V9 PolarHBondContact O-N 3.1Å
6I80.8Confident74Confident90 Ų9075.9 Ų75.946%0.46244%0.44SS..Hα-helixtrans-53.8-36.8-175.2-69.1167.8000111.1L8 V9 V10 Y123I6-L8 VanDerWaalsContact C-N 3.28Å; I6-L8 PolarHBondContact O-N 3.34Å; I6-V9 PolarHBondContact O-N 3Å; I6-V10 WeakPolarHBondContact O-CG2 3.45Å; I6-V10 PolarHBondContact O-N 3.18Å; I6-Y123 HydrophobicContact CB-CE2 4.48Å; I6-Y123 HydrophobicContact CD1-CE2 4.13Å; I6-Y123 HydrophobicContact CG2-CE2 4.32Å
7Q78.8Confident74.7Confident4 Ų475.1 Ų75.12%0.01943%0.433CS..Hα-helixtrans-59.1-38.7175.8-60.8-168.9-0.100112.8G5 V10 S11 Y123 Y124 V133 I135G5-Q7 PolarHBondContact O-N 2.98Å; G5-Q7 VanDerWaalsContact O-N 3.09Å; Q7-V10 PolarHBondContact O-N 3.35Å; Q7-S11 WeakPolarHBondContact O-CB 3.36Å; Q7-S11 PolarHBondContact O-N 3.34Å; Q7-Y123 HydrophobicContact CG-CD1 4.21Å; Q7-Y123 HydrophobicContact CG-CE1 4.17Å; Q7-Y124 PolarHBondContact NE2-OH 2.93Å; Q7-V133 PolarHBondContact OE1-O 2.94Å; Q7-I135 VanDerWaalsContact C-CD1 3.45Å; Q7-I135 HydrophobicContact CB-CB 4.25Å; Q7-I135 HydrophobicContact CB-CD1 3.68Å; Q7-I135 HydrophobicContact CB-CG1 3.92Å; Q7-I135 VanDerWaalsContact OE1-N 3.17Å
8L82.1Confident75.3Confident68 Ų6872.4 Ų72.436%0.35642%0.416SS..Hα-helixtrans-72-38.8-177.2-166.3144.9000110.5M4 G5 I6 V10 S11 L12 I135M4-L8 HydrophobicContact CB-CD2 4.1Å; M4-L8 HydrophobicContact CG-CD2 3.97Å; M4-L8 HydrophobicContact SD-CD2 3.22Å; M4-L8 WeakPolarHBondContact SD-CD2 3.35Å; G5-L8 WeakPolarHBondContact O-CA 3.26Å; G5-L8 WeakPolarHBondContact O-CB 3.42Å; G5-L8 PolarHBondContact O-N 2.82Å; I6-L8 VanDerWaalsContact C-N 3.28Å; I6-L8 PolarHBondContact O-N 3.34Å; L8-V10 VanDerWaalsContact C-N 3.34Å; L8-V10 PolarHBondContact O-N 3.25Å; L8-S11 PolarHBondContact O-N 3.22Å; L8-L12 HydrophobicContact CD2-CD1 3.57Å; L8-L12 HydrophobicContact CD2-CG 4.07Å; L8-L12 WeakPolarHBondContact O-CB 3.41Å; L8-L12 WeakPolarHBondContact O-CG 3.21Å; L8-L12 PolarHBondContact O-N 3.31Å; L8-I135 HydrophobicContact CB-CD1 3.63Å; L8-I135 HydrophobicContact CD1-CD1 4.47Å; L8-I135 HydrophobicContact CG-CD1 4.2Å; L8-I135 VanDerWaalsContact N-CD1 3.27Å
9V85.2Confident75.7Confident74 Ų7476.3 Ų76.345%0.44843%0.431SS..Hα-helixtrans-59.6-46.3171.9179.30000110.7M4 G5 I6 S11 L12 L13M4-V9 HydrophobicContact CB-CG2 4.21Å; G5-V9 PolarHBondContact O-N 3.1Å; I6-V9 PolarHBondContact O-N 3Å; V9-S11 VanDerWaalsContact C-N 3.34Å; V9-S11 PolarHBondContact O-N 2.94Å; V9-L12 PolarHBondContact O-N 3.47Å; V9-L13 VanDerWaalsContact O-CB 3.31Å; V9-L13 WeakPolarHBondContact O-CB 3.21Å; V9-L13 PolarHBondContact O-N 3.48Å
10V85Confident76.2Confident33 Ų3382.8 Ų82.820%0.245%0.448CS..Hα-helixtrans-65.6-38.7179172.30000111.6I6 Q7 L8 L13 A14 F119I6-V10 WeakPolarHBondContact O-CG2 3.45Å; I6-V10 PolarHBondContact O-N 3.18Å; Q7-V10 PolarHBondContact O-N 3.35Å; L8-V10 VanDerWaalsContact C-N 3.34Å; L8-V10 PolarHBondContact O-N 3.25Å; V10-L13 PolarHBondContact O-N 3.14Å; V10-A14 WeakPolarHBondContact O-CB 3.47Å; V10-A14 PolarHBondContact O-N 3Å; V10-F119 HydrophobicContact CB-CD1 4.28Å; V10-F119 HydrophobicContact CB-CE1 4.06Å; V10-F119 HydrophobicContact CG1-CD1 3.71Å; V10-F119 HydrophobicContact CG1-CE1 3.96Å; V10-F119 HydrophobicContact CG1-CG 4.1Å; V10-F119 HydrophobicContact CG2-CD1 4.23Å; V10-F119 HydrophobicContact CG2-CE1 3.58Å; V10-F119 HydrophobicContact CG2-CE2 4.41Å; V10-F119 HydrophobicContact CG2-CZ 3.68Å
11S86.9Confident76.2Confident20 Ų2082.3 Ų82.314%0.1444%0.444CS..Hα-helixtrans-64.1-45174.8-178.70000112.3Q7 L8 V9 L13 A14 A15 W139Q7-S11 WeakPolarHBondContact O-CB 3.36Å; Q7-S11 PolarHBondContact O-N 3.34Å; L8-S11 PolarHBondContact O-N 3.22Å; V9-S11 VanDerWaalsContact C-N 3.34Å; V9-S11 PolarHBondContact O-N 2.94Å; S11-L13 VanDerWaalsContact C-N 3.33Å; S11-A14 PolarHBondContact O-N 3.43Å; S11-A15 WeakPolarHBondContact O-CB 3.21Å; S11-A15 PolarHBondContact O-N 3.16Å; S11-W139 PolarHBondContact OG-NE1 3.49Å
12L87.6Confident78Confident86 Ų8672.8 Ų72.845%0.4540%0.402SS..Hα-helixtrans-64.9-38.6176-71.9177000111.7M4 L8 V9 A15 S16M4-L12 HydrophobicContact CE-CD1 4.17Å; M4-L12 HydrophobicContact SD-CD1 4.04Å; L8-L12 HydrophobicContact CD2-CD1 3.57Å; L8-L12 HydrophobicContact CD2-CG 4.07Å; L8-L12 WeakPolarHBondContact O-CB 3.41Å; L8-L12 WeakPolarHBondContact O-CG 3.21Å; L8-L12 PolarHBondContact O-N 3.31Å; V9-L12 PolarHBondContact O-N 3.47Å; L12-A15 PolarHBondContact O-N 3.42Å; L12-S16 VanDerWaalsContact O-CB 3.31Å; L12-S16 WeakPolarHBondContact O-CB 3.38Å; L12-S16 PolarHBondContact O-N 2.9Å; L12-S16 PolarHBondContact O-OG 2.81Å
13L87.9Confident79.6Confident100 Ų10071.4 Ų71.452%0.52438%0.384SS..Hα-helixtrans-63-47.9174-178.965.5000110.8V9 V10 S11 A15 S16 I17V9-L13 VanDerWaalsContact O-CB 3.31Å; V9-L13 WeakPolarHBondContact O-CB 3.21Å; V9-L13 PolarHBondContact O-N 3.48Å; V10-L13 PolarHBondContact O-N 3.14Å; S11-L13 VanDerWaalsContact C-N 3.33Å; L13-A15 VanDerWaalsContact C-N 3.35Å; L13-A15 PolarHBondContact O-N 3.32Å; L13-S16 PolarHBondContact O-N 3.25Å; L13-I17 HydrophobicContact CD1-CD1 4.02Å; L13-I17 HydrophobicContact CD1-CG1 4.24Å; L13-I17 HydrophobicContact CD2-CD1 4.42Å; L13-I17 HydrophobicContact CG-CD1 3.78Å; L13-I17 HydrophobicContact CG-CG1 4.38Å; L13-I17 WeakPolarHBondContact O-CB 3.45Å; L13-I17 VanDerWaalsContact O-CG1 3.24Å; L13-I17 WeakPolarHBondContact O-CG1 3.47Å; L13-I17 PolarHBondContact O-N 2.93Å
14A86.6Confident80.9Confident12 Ų1270.7 Ų70.710%0.09938%0.376CS..Hα-helixtrans-60.1-43.3177.300000111.8V10 S11 I17 M18 V116 W139V10-A14 WeakPolarHBondContact O-CB 3.47Å; V10-A14 PolarHBondContact O-N 3Å; S11-A14 PolarHBondContact O-N 3.43Å; A14-I17 PolarHBondContact O-N 3.24Å; A14-M18 VanDerWaalsContact O-CB 3.31Å; A14-M18 WeakPolarHBondContact O-CB 3.38Å; A14-M18 PolarHBondContact O-N 3.38Å; A14-V116 HydrophobicContact CB-CG2 3.55Å; A14-W139 HydrophobicContact CB-CH2 4.29Å; A14-W139 HydrophobicContact CB-CZ2 4.28Å
15A86.9Confident81.9Confident27 Ų2768.7 Ų68.722%0.22337%0.373CS..Hα-helixtrans-63.2-42.4175.100000112.3S11 L12 L13 M18 Q19S11-A15 WeakPolarHBondContact O-CB 3.21Å; S11-A15 PolarHBondContact O-N 3.16Å; L12-A15 PolarHBondContact O-N 3.42Å; L13-A15 VanDerWaalsContact C-N 3.35Å; L13-A15 PolarHBondContact O-N 3.32Å; A15-M18 PolarHBondContact O-N 2.97Å; A15-Q19 WeakPolarHBondContact O-CG 3.1Å; A15-Q19 PolarHBondContact O-N 3.19Å
16S86.5Confident82.4Confident58 Ų5867.9 Ų67.941%0.40636%0.362SS..Hα-helixtrans-66.3-42.1177.8-60.60000112.1L12 L13 Q19 R20L12-S16 VanDerWaalsContact O-CB 3.31Å; L12-S16 WeakPolarHBondContact O-CB 3.38Å; L12-S16 PolarHBondContact O-N 2.9Å; L12-S16 PolarHBondContact O-OG 2.81Å; L13-S16 PolarHBondContact O-N 3.25Å; S16-Q19 PolarHBondContact O-N 3.3Å; S16-R20 WeakPolarHBondContact O-CB 3.37Å; S16-R20 WeakPolarHBondContact O-CG 3.08Å; S16-R20 PolarHBondContact O-N 3.3Å
17I86.1Confident82.7Confident63 Ų6367.9 Ų67.932%0.32336%0.359SS..Hα-helixtrans-62.5-46.7174.2-70.7170.7000109.4L13 A14 Q19 R20 M21 Y112L13-I17 HydrophobicContact CD1-CD1 4.02Å; L13-I17 HydrophobicContact CD1-CG1 4.24Å; L13-I17 HydrophobicContact CD2-CD1 4.42Å; L13-I17 HydrophobicContact CG-CD1 3.78Å; L13-I17 HydrophobicContact CG-CG1 4.38Å; L13-I17 WeakPolarHBondContact O-CB 3.45Å; L13-I17 VanDerWaalsContact O-CG1 3.24Å; L13-I17 WeakPolarHBondContact O-CG1 3.47Å; L13-I17 PolarHBondContact O-N 2.93Å; A14-I17 PolarHBondContact O-N 3.24Å; I17-Q19 VanDerWaalsContact C-N 3.32Å; I17-Q19 PolarHBondContact O-N 2.94Å; I17-R20 PolarHBondContact O-N 3.49Å; I17-M21 HydrophobicContact CG2-CB 4.33Å; I17-M21 HydrophobicContact CG2-CG 3.87Å; I17-M21 HydrophobicContact CG2-SD 3.76Å; I17-M21 WeakPolarHBondContact O-CA 3.18Å; I17-M21 WeakPolarHBondContact O-CB 3.49Å; I17-M21 WeakPolarHBondContact O-CG 3.2Å; I17-M21 PolarHBondContact O-N 3.36Å; I17-Y112 HydrophobicContact CG2-CE1 3.83Å
18M85.5Confident83.1Confident26 Ų2667.7 Ų67.713%0.12836%0.358CS..Hα-helixtrans-56.9-46.7177.9-177.2-176.572.200111.2A14 A15 R20 A22 F109 Y112A14-M18 VanDerWaalsContact O-CB 3.31Å; A14-M18 WeakPolarHBondContact O-CB 3.38Å; A14-M18 PolarHBondContact O-N 3.38Å; A15-M18 PolarHBondContact O-N 2.97Å; M18-R20 PolarHBondContact O-N 3.37Å; M18-A22 WeakPolarHBondContact O-CB 3.45Å; M18-A22 PolarHBondContact O-N 2.74Å; M18-F109 HydrophobicContact CE-CD2 4.21Å; M18-F109 HydrophobicContact SD-CB 4.26Å; M18-F109 HydrophobicContact SD-CD2 3.77Å; M18-Y112 HydrophobicContact CB-CD2 3.84Å; M18-Y112 HydrophobicContact CB-CE2 3.87Å; M18-Y112 HydrophobicContact CB-CG 4.3Å; M18-Y112 HydrophobicContact CG-CD2 3.69Å; M18-Y112 HydrophobicContact CG-CE2 3.78Å; M18-Y112 HydrophobicContact SD-CD2 4.16Å
19Q83.6Confident83.4Confident147 Ų14766.8 Ų66.869%0.68735%0.35SS*.Hα-helixtrans-63.7-40.4178.5-72.7177.5-2.900112.8A15 S16 I17A15-Q19 WeakPolarHBondContact O-CG 3.1Å; A15-Q19 PolarHBondContact O-N 3.19Å; S16-Q19 PolarHBondContact O-N 3.3Å; I17-Q19 VanDerWaalsContact C-N 3.32Å; I17-Q19 PolarHBondContact O-N 2.94Å
20R84.4Confident83.7Confident205 Ų20568.9 Ų68.977%0.77435%0.35SS*.Hα-helixtrans-82.1-33.6-177.4-70.5-174.2176.5-155.40.3114S16 I17 M18 P23S16-R20 WeakPolarHBondContact O-CB 3.37Å; S16-R20 WeakPolarHBondContact O-CG 3.08Å; S16-R20 PolarHBondContact O-N 3.3Å; I17-R20 PolarHBondContact O-N 3.49Å; M18-R20 PolarHBondContact O-N 3.37Å; R20-P23 WeakPolarHBondContact O-CD 3.45Å
21M76.5Confident83.9Confident74 Ų7467.8 Ų67.837%0.36534%0.343SS..Hα-helixtrans-93.4-16.9-175.8-65.5-155.373.800113.5I17 P23 H24 C25I17-M21 HydrophobicContact CG2-CB 4.33Å; I17-M21 HydrophobicContact CG2-CG 3.87Å; I17-M21 HydrophobicContact CG2-SD 3.76Å; I17-M21 WeakPolarHBondContact O-CA 3.18Å; I17-M21 WeakPolarHBondContact O-CB 3.49Å; I17-M21 WeakPolarHBondContact O-CG 3.2Å; I17-M21 PolarHBondContact O-N 3.36Å; M21-P23 VanDerWaalsContact C-CD 3.4Å; M21-P23 VanDerWaalsContact C-N 3.28Å; M21-P23 VanDerWaalsContact O-N 3.13Å; M21-H24 PolarHBondContact O-N 3.24Å; M21-C25 HydrophobicContact CE-CB 3.9Å; M21-C25 PolarHBondContact O-N 2.85Å; M21-C25 VanDerWaalsContact O-O 3.11Å
22A72.4Confident83.9Confident32 Ų3266.8 Ų66.826%0.26434%0.336SS..THydrogen-bonded Turntrans-44.4-42.3174.200000114.8M18 R29 Q104M18-A22 WeakPolarHBondContact O-CB 3.45Å; M18-A22 PolarHBondContact O-N 2.74Å; A22-R29 PolarHBondContact O-NH2 2.87Å; A22-Q104 PolarHBondContact O-NE2 3.44Å; A22-Q104 VanDerWaalsContact O-NE2 3.11Å
23P70.5Confident83.8Confident75 Ų7563.5 Ų63.549%0.48732%0.32SS..THydrogen-bonded Turntrans-77.2-23.8177.127.6-33.8000114.4R20 M21 R29R20-P23 WeakPolarHBondContact O-CD 3.45Å; M21-P23 VanDerWaalsContact C-CD 3.4Å; M21-P23 VanDerWaalsContact C-N 3.28Å; M21-P23 VanDerWaalsContact O-N 3.13Å; P23-R29 PolarHBondContact O-NH1 3.07Å; P23-R29 VanDerWaalsContact O-NH1 3.08Å; P23-R29 PolarHBondContact O-NH2 2.79Å
24H75.1Confident83.6Confident149 Ų14962.7 Ų62.769%0.6932%0.316SS*.THydrogen-bonded Turntrans-101.2-42.7-173.1-61.4-64.3000114.2M21M21-H24 PolarHBondContact O-N 3.24Å
25C76.9Confident83.3Confident70 Ų7063.9 Ų63.947%0.47333%0.33SS..  trans-131.2115.5-179.4-62.20000109.3M21M21-C25 HydrophobicContact CE-CB 3.9Å; M21-C25 PolarHBondContact O-N 2.85Å; M21-C25 VanDerWaalsContact O-O 3.11Å
26S85.6Confident83.1Confident13 Ų1365 Ų659%0.09134%0.336CS..  trans-133.3124178167.90000109.3A28 R29 W30 Q104 D108S26-A28 VanDerWaalsContact C-N 3.25Å; S26-A28 PolarHBondContact OG-N 3.21Å; S26-R29 VanDerWaalsContact CB-NE 3.34Å; S26-R29 PolarHBondContact O-N 3.07Å; S26-R29 PolarHBondContact OG-N 3.08Å; S26-W30 PolarHBondContact O-N 3.15Å; S26-W30 VanDerWaalsContact O-N 3.1Å; S26-Q104 WeakPolarHBondContact OG-CG 3.3Å; S26-D108 WeakPolarHBondContact CB-OD2 3.15Å; S26-D108 VanDerWaalsContact OG-CG 3.24Å; S26-D108 PolarHBondContact OG-OD1 3.4Å; S26-D108 VanDerWaalsContact OG-OD1 3.06Å; S26-D108 PolarHBondContact OG-OD2 3.47Å
27F86.7Confident83.2Confident90 Ų9062.3 Ų62.340%0.39532%0.317SS..Hα-helixtrans-66.5-34.8175.3-178.4-97.9000110.4R29 W30 L31 V107 D108 V111F27-R29 VanDerWaalsContact C-N 3.34Å; F27-R29 PolarHBondContact O-N 2.93Å; F27-W30 AromaticContact CD2-CE3 3.77Å; F27-W30 HydrophobicContact CD2-CE3 3.77Å; F27-W30 HydrophobicContact CD2-CZ3 4.16Å; F27-W30 HydrophobicContact CE2-CD2 4.47Å; F27-W30 AromaticContact CE2-CE3 3.41Å; F27-W30 HydrophobicContact CE2-CE3 3.41Å; F27-W30 VanDerWaalsContact CE2-CE3 3.41Å; F27-W30 HydrophobicContact CE2-CH2 4.32Å; F27-W30 AromaticContact CE2-CZ3 3.32Å; F27-W30 HydrophobicContact CE2-CZ3 3.32Å; F27-W30 AromaticContact CZ-CE3 3.87Å; F27-W30 HydrophobicContact CZ-CE3 3.87Å; F27-W30 AromaticContact CZ-CZ3 3.57Å; F27-W30 HydrophobicContact CZ-CZ3 3.57Å; F27-W30 WeakPolarHBondContact O-CB 3.21Å; F27-W30 PolarHBondContact O-N 3.46Å; F27-L31 PolarHBondContact O-N 2.8Å; F27-V107 HydrophobicContact CD1-CG1 3.7Å; F27-V107 HydrophobicContact CE1-CG1 4.37Å; F27-D108 PolarHBondContact N-OD1 3.46Å; F27-V111 HydrophobicContact CB-CG2 4Å; F27-V111 HydrophobicContact CD1-CG2 3.63Å; F27-V111 HydrophobicContact CE1-CG2 4.22Å; F27-V111 HydrophobicContact CG-CG2 3.8Å
28A88.3Confident83.4Confident0 Ų063.5 Ų63.50%032%0.32CS..Hα-helixtrans-59.7-44.4174.700000112S26 L31 V32 Y103 Q104 V107 D108S26-A28 VanDerWaalsContact C-N 3.25Å; S26-A28 PolarHBondContact OG-N 3.21Å; A28-L31 PolarHBondContact O-N 3.04Å; A28-V32 PolarHBondContact O-N 2.75Å; A28-Y103 HydrophobicContact CB-CD1 4.26Å; A28-Y103 HydrophobicContact CB-CE1 3.65Å; A28-Y103 PolarHBondContact O-OH 3.26Å; A28-Y103 VanDerWaalsContact O-OH 3.09Å; A28-Q104 HydrophobicContact CB-CB 4.21Å; A28-Q104 HydrophobicContact CB-CG 4.13Å; A28-V107 HydrophobicContact CB-CB 3.77Å; A28-V107 HydrophobicContact CB-CG1 3.79Å; A28-D108 PolarHBondContact N-OD1 3.42Å
29R88.2Confident83.6Confident48 Ų4864.2 Ų64.218%0.18132%0.321CS..Hα-helixtrans-62.5-42.8173.9-81.2-174.8-81.1154.52.2111.9A22 P23 S26 F27 L31 V32 C33 F100A22-R29 PolarHBondContact O-NH2 2.87Å; P23-R29 PolarHBondContact O-NH1 3.07Å; P23-R29 VanDerWaalsContact O-NH1 3.08Å; P23-R29 PolarHBondContact O-NH2 2.79Å; S26-R29 VanDerWaalsContact CB-NE 3.34Å; S26-R29 PolarHBondContact O-N 3.07Å; S26-R29 PolarHBondContact OG-N 3.08Å; F27-R29 VanDerWaalsContact C-N 3.34Å; F27-R29 PolarHBondContact O-N 2.93Å; R29-L31 VanDerWaalsContact C-N 3.32Å; R29-L31 PolarHBondContact O-N 3.31Å; R29-V32 PolarHBondContact O-N 3.05Å; R29-C33 WeakPolarHBondContact O-CA 3.07Å; R29-C33 WeakPolarHBondContact O-CB 3.45Å; R29-C33 PolarHBondContact O-N 2.8Å; R29-F100 HydrophobicContact CG-CE2 4.46Å; R29-F100 HydrophobicContact CG-CZ 3.74Å
30W90.1Very high83.8Confident118 Ų11857.7 Ų57.745%0.44729%0.29SS..Hα-helixtrans-61.6-39.5175174.283.4000112.3S26 F27 V32 N34 R332S26-W30 PolarHBondContact O-N 3.15Å; S26-W30 VanDerWaalsContact O-N 3.1Å; F27-W30 AromaticContact CD2-CE3 3.77Å; F27-W30 HydrophobicContact CD2-CE3 3.77Å; F27-W30 HydrophobicContact CD2-CZ3 4.16Å; F27-W30 HydrophobicContact CE2-CD2 4.47Å; F27-W30 AromaticContact CE2-CE3 3.41Å; F27-W30 HydrophobicContact CE2-CE3 3.41Å; F27-W30 VanDerWaalsContact CE2-CE3 3.41Å; F27-W30 HydrophobicContact CE2-CH2 4.32Å; F27-W30 AromaticContact CE2-CZ3 3.32Å; F27-W30 HydrophobicContact CE2-CZ3 3.32Å; F27-W30 AromaticContact CZ-CE3 3.87Å; F27-W30 HydrophobicContact CZ-CE3 3.87Å; F27-W30 AromaticContact CZ-CZ3 3.57Å; F27-W30 HydrophobicContact CZ-CZ3 3.57Å; F27-W30 WeakPolarHBondContact O-CB 3.21Å; F27-W30 PolarHBondContact O-N 3.46Å; W30-V32 VanDerWaalsContact C-N 3.28Å; W30-V32 PolarHBondContact O-N 3.42Å; W30-N34 HydrophobicContact CG-CB 4.44Å; W30-N34 PolarHBondContact NE1-OD1 2.85Å; W30-N34 WeakPolarHBondContact O-CB 3.45Å; W30-N34 PolarHBondContact O-N 3.27Å; W30-R332 VanDerWaalsContact CZ3-NH2 3.27Å; W30-R332 PolarHBondContact O-NH2 3.29Å
31L89.4Confident83.9Confident10 Ų1052.2 Ų52.25%0.05227%0.272CS..Hα-helixtrans-61.1-38.2-178.6-171.367.4000112.3F27 A28 R29 Y103 T331 R332 T376 L380F27-L31 PolarHBondContact O-N 2.8Å; A28-L31 PolarHBondContact O-N 3.04Å; R29-L31 VanDerWaalsContact C-N 3.32Å; R29-L31 PolarHBondContact O-N 3.31Å; L31-Y103 WeakPolarHBondContact CD2-OH 3.35Å; L31-T331 HydrophobicContact CD2-CG2 4.31Å; L31-R332 HydrophobicContact CD1-CG 4.37Å; L31-T376 HydrophobicContact CD2-CG2 4.31Å; L31-L380 HydrophobicContact CD2-CD1 3.72Å
32V88.1Confident84.2Confident0 Ų053.5 Ų53.50%028%0.277CS..Hα-helixtrans-94.4-36.2-177.2176.40000113.2A28 R29 W30 V89 Y103 L372A28-V32 PolarHBondContact O-N 2.75Å; R29-V32 PolarHBondContact O-N 3.05Å; W30-V32 VanDerWaalsContact C-N 3.28Å; W30-V32 PolarHBondContact O-N 3.42Å; V32-V89 HydrophobicContact CG1-CG1 3.85Å; V32-Y103 HydrophobicContact CG2-CE1 3.91Å; V32-Y103 WeakPolarHBondContact CG2-OH 3.48Å; V32-L372 HydrophobicContact CG1-CD2 3.83Å
33C85.5Confident84.7Confident17 Ų1752.1 Ų52.112%0.11527%0.266CS..Hα-helixtrans-108.99.6-166.3-52.70000115R29 G35 M91R29-C33 WeakPolarHBondContact O-CA 3.07Å; R29-C33 WeakPolarHBondContact O-CB 3.45Å; R29-C33 PolarHBondContact O-N 2.8Å; C33-G35 PolarHBondContact O-N 2.91Å; C33-M91 HydrophobicContact CB-CG 4.12Å
34N83.1Confident85.2Confident83 Ų8351.5 Ų51.544%0.44426%0.263SS..SBendtrans-73.120.5-179.6-172.562.9000114.2W30 S36 R332W30-N34 HydrophobicContact CG-CB 4.44Å; W30-N34 PolarHBondContact NE1-OD1 2.85Å; W30-N34 WeakPolarHBondContact O-CB 3.45Å; W30-N34 PolarHBondContact O-N 3.27Å; N34-S36 PolarHBondContact O-N 2.78Å; N34-S36 VanDerWaalsContact O-N 3.08Å; N34-R332 PolarHBondContact ND2-NH1 2.95Å
35G79Confident85.3Confident37 Ų3748 Ų4838%0.38125%0.247SC..SBendtrans72.1-3.9177.700000116.2C33C33-G35 PolarHBondContact O-N 2.91Å
36S83.9Confident85.1Confident50 Ų5046 Ų4635%0.3524%0.238SC..  trans-83.1-16.417961.80000114.1N34 R332N34-S36 PolarHBondContact O-N 2.78Å; N34-S36 VanDerWaalsContact O-N 3.08Å; S36-R332 PolarHBondContact OG-NH1 3.31Å
37L88.9Confident84.8Confident1 Ų148.4 Ų48.41%0.00525%0.248CC..  trans-99.3133.2178-67.5178.2000110.1V89 L335 Q336 L339L37-V89 HydrophobicContact CB-CG2 4.02Å; L37-V89 PolarHBondContact O-N 2.74Å; L37-L335 HydrophobicContact CD1-CB 4.17Å; L37-L335 HydrophobicContact CD1-CD1 4.05Å; L37-L335 HydrophobicContact CD2-CB 4.05Å; L37-Q336 HydrophobicContact CD2-CB 3.99Å; L37-L339 HydrophobicContact CB-CD1 4.15Å
38F89.8Confident84.4Confident88 Ų8844.2 Ų44.239%0.38623%0.23SC..EExtended strand (participates in β ladder)trans-113.2120.1179-63.5-86.4000109.9A87 Q336 L339F38-A87 CarbonylContact C-O 3.58Å; F38-A87 WeakPolarHBondContact CA-O 3.43Å; F38-Q336 PolarHBondContact O-NE2 3.08Å; F38-L339 WeakPolarHBondContact O-CD1 3.22Å
39R89.7Confident83.7Confident41 Ų4144.8 Ų44.816%0.15523%0.232CC..EExtended strand (participates in β ladder)trans-93.9159.3170.570.5-179.4-173.996.3-9.4110.5K86 A87 V89 D93 L339 F369R39-K86 CarbonylContact O-C 3.52Å; R39-K86 WeakPolarHBondContact O-CA 3.46Å; R39-A87 HydrophobicContact CG-CB 4.34Å; R39-A87 WeakPolarHBondContact CG-O 3.38Å; R39-A87 PolarHBondContact N-O 3.27Å; R39-A87 PolarHBondContact O-N 3.42Å; R39-V89 HydrophobicContact CB-CG2 4.05Å; R39-V89 HydrophobicContact CG-CG2 4.32Å; R39-D93 IonicContact CZ-OD2 3.96Å; R39-D93 VanDerWaalsContact CZ-OD2 3.28Å; R39-D93 IonicContact NE-OD2 3.28Å; R39-D93 PolarHBondContact NE-OD2 3.11Å; R39-D93 VanDerWaalsContact NH2-CG 3.26Å; R39-D93 IonicContact NH2-OD1 3.18Å; R39-D93 PolarHBondContact NH2-OD1 3.34Å; R39-D93 IonicContact NH2-OD2 3.35Å; R39-D93 PolarHBondContact NH2-OD2 3.25Å; R39-L339 HydrophobicContact CB-CD2 4.45Å; R39-F369 HydrophobicContact CB-CD2 3.73Å; R39-F369 HydrophobicContact CB-CE2 4Å; R39-F369 HydrophobicContact CB-CG 4.45Å; R39-F369 VanDerWaalsContact CD-CZ 3.41Å; R39-F369 HydrophobicContact CG-CD2 4.32Å; R39-F369 HydrophobicContact CG-CE2 4.26Å
40F88.1Confident83.3Confident10 Ų1046.1 Ų46.14%0.04425%0.253CS..EExtended strand (participates in β ladder)trans-94.7135.5170.5-65.9-83.5000110.1L84 E85 K86 L339 N340 A342 Q343 V365F40-L84 HydrophobicContact CB-CB 4.04Å; F40-L84 HydrophobicContact CB-CD1 3.95Å; F40-L84 HydrophobicContact CD1-CB 3.39Å; F40-L84 HydrophobicContact CD1-CD1 4.12Å; F40-L84 HydrophobicContact CD1-CG 4.43Å; F40-L84 HydrophobicContact CE1-CB 4.18Å; F40-L84 HydrophobicContact CG-CB 4.02Å; F40-L84 HydrophobicContact CG-CD1 4.04Å; F40-E85 WeakPolarHBondContact CA-O 3.5Å; F40-K86 HydrophobicContact CD1-CG 3.97Å; F40-K86 HydrophobicContact CE1-CD 4.24Å; F40-K86 HydrophobicContact CE1-CG 3.5Å; F40-K86 HydrophobicContact CZ-CD 4.45Å; F40-K86 HydrophobicContact CZ-CG 4.06Å; F40-L339 WeakPolarHBondContact CD2-O 3.49Å; F40-L339 WeakPolarHBondContact CE2-O 3.29Å; F40-N340 WeakPolarHBondContact CE2-OD1 3.36Å; F40-A342 HydrophobicContact CB-CB 4.42Å; F40-A342 HydrophobicContact CD2-CB 4.14Å; F40-Q343 HydrophobicContact CE1-CB 4.04Å; F40-Q343 HydrophobicContact CE1-CG 4.42Å; F40-Q343 HydrophobicContact CE2-CB 4.04Å; F40-Q343 HydrophobicContact CZ-CB 3.69Å; F40-Q343 HydrophobicContact CZ-CG 4.3Å; F40-V365 HydrophobicContact CB-CG1 4.28Å
41K85.4Confident82.7Confident90 Ų9044.1 Ų44.139%0.39125%0.251SS..PPolyproline II helixtrans-73.5145.5171-64.4-176.6-166.1159.90109.4E85 A87K41-E85 HydrophobicContact CD-CB 4.33Å; K41-E85 PolarHBondContact N-O 3.39Å; K41-E85 IonicContact NZ-OE2 2.82Å; K41-E85 PolarHBondContact NZ-OE2 3.31Å; K41-A87 HydrophobicContact CG-CB 4.08Å
42H83.6Confident81.9Confident101 Ų10144.8 Ų44.847%0.46826%0.258SS..PPolyproline II helixtrans-71.4136.3169.362.9-91.7000108.5Q362 V365H42-Q362 HydrophobicContact CB-CB 4.41Å; H42-Q362 HydrophobicContact CB-CG 4.41Å; H42-V365 HydrophobicContact CB-CG1 4.5Å
43P83Confident80.9Confident4 Ų448.2 Ų48.23%0.02629%0.293CS..PPolyproline II helixtrans-69.514218029.4-35.3000110.2L48 L82 I361 Q362P43-L48 HydrophobicContact CB-CD1 4.43Å; P43-L48 HydrophobicContact CB-CD2 4.04Å; P43-L48 HydrophobicContact CB-CG 4Å; P43-L48 HydrophobicContact CG-CD1 4.05Å; P43-L48 HydrophobicContact CG-CD2 3.92Å; P43-L48 HydrophobicContact CG-CG 4.07Å; P43-L82 HydrophobicContact CB-CD1 3.92Å; P43-L82 HydrophobicContact CG-CD1 4.31Å; P43-L82 HydrophobicContact CG-CD2 4.2Å; P43-I361 HydrophobicContact CG-CG2 3.93Å; P43-Q362 WeakPolarHBondContact O-CG 3.5Å; P43-Q362 PolarHBondContact O-NE2 3.17Å
44S81.4Confident79.8Confident61 Ų6151 Ų5143%0.42730%0.303SS..PPolyproline II helixtrans-70.8152.7176.770.40000110.5G46 E47 L48S44-G46 PolarHBondContact O-N 2.75Å; S44-E47 PolarHBondContact N-OE2 2.86Å; S44-E47 PolarHBondContact O-N 3.1Å; S44-E47 WeakPolarHBondContact OG-CB 3.41Å; S44-E47 PolarHBondContact OG-N 3.44Å; S44-E47 VanDerWaalsContact OG-N 3.14Å; S44-L48 PolarHBondContact O-N 3.22Å; S44-L48 VanDerWaalsContact O-N 3.07Å
45E76.6Confident78.3Confident75 Ų7556.1 Ų56.135%0.3533%0.325SS..Hα-helixtrans-57.3-42.1174.8-67.1-171.1159.500110.4E47 L48 F49 M56E45-E47 VanDerWaalsContact C-N 3.32Å; E45-E47 PolarHBondContact O-N 2.84Å; E45-L48 PolarHBondContact O-N 3.32Å; E45-F49 WeakPolarHBondContact O-CB 3.38Å; E45-F49 WeakPolarHBondContact O-CD2 3.42Å; E45-F49 PolarHBondContact O-N 3.4Å; E45-M56 HydrophobicContact CB-CE 3.84Å
46G73.1Confident77.1Confident28 Ų2859.2 Ų59.229%0.28933%0.331SS..Hα-helixtrans-58.9-40.2178.600000113.6S44 F49 A50S44-G46 PolarHBondContact O-N 2.75Å; G46-F49 PolarHBondContact O-N 3.47Å; G46-A50 WeakPolarHBondContact O-CB 3.3Å; G46-A50 PolarHBondContact O-N 2.9Å
47E78.8Confident75.7Confident65 Ų6561.2 Ų61.230%0.30434%0.342SS..Hα-helixtrans-67.4-45.3176.5-176.9-176.6-177.200111.9S44 E45 F49 A50 L51S44-E47 PolarHBondContact N-OE2 2.86Å; S44-E47 PolarHBondContact O-N 3.1Å; S44-E47 WeakPolarHBondContact OG-CB 3.41Å; S44-E47 PolarHBondContact OG-N 3.44Å; S44-E47 VanDerWaalsContact OG-N 3.14Å; E45-E47 VanDerWaalsContact C-N 3.32Å; E45-E47 PolarHBondContact O-N 2.84Å; E47-F49 VanDerWaalsContact C-N 3.26Å; E47-F49 PolarHBondContact O-N 2.91Å; E47-A50 PolarHBondContact O-N 3.11Å; E47-L51 HydrophobicContact CG-CD1 4.11Å; E47-L51 WeakPolarHBondContact O-CB 3.46Å; E47-L51 VanDerWaalsContact O-CG 3.26Å; E47-L51 WeakPolarHBondContact O-CG 3.45Å; E47-L51 PolarHBondContact O-N 3.28Å
48L79.1Confident73.8Confident2 Ų270.9 Ų70.91%0.0138%0.384CS..Hα-helixtrans-60.3-37.8175-69.6172.3000111.9P43 S44 E45 A52 V76 L82 A358 I361P43-L48 HydrophobicContact CB-CD1 4.43Å; P43-L48 HydrophobicContact CB-CD2 4.04Å; P43-L48 HydrophobicContact CB-CG 4Å; P43-L48 HydrophobicContact CG-CD1 4.05Å; P43-L48 HydrophobicContact CG-CD2 3.92Å; P43-L48 HydrophobicContact CG-CG 4.07Å; S44-L48 PolarHBondContact O-N 3.22Å; S44-L48 VanDerWaalsContact O-N 3.07Å; E45-L48 PolarHBondContact O-N 3.32Å; L48-A52 WeakPolarHBondContact O-CB 3.14Å; L48-A52 PolarHBondContact O-N 3.39Å; L48-V76 HydrophobicContact CB-CG2 4.4Å; L48-L82 HydrophobicContact CD2-CD1 3.93Å; L48-L82 HydrophobicContact CD2-CD2 4.02Å; L48-A358 HydrophobicContact CD1-CB 3.71Å; L48-I361 HydrophobicContact CD1-CD1 4.44Å; L48-I361 HydrophobicContact CD2-CD1 4.18Å
49F73.3Confident71.8Confident12 Ų1272.6 Ų72.65%0.05339%0.393CS..Hα-helixtrans-70.8-43.7177.1-92.2-82000112.9E45 G46 E47 L51 A52 G53 K54 M56 L74E45-F49 WeakPolarHBondContact O-CB 3.38Å; E45-F49 WeakPolarHBondContact O-CD2 3.42Å; E45-F49 PolarHBondContact O-N 3.4Å; G46-F49 PolarHBondContact O-N 3.47Å; E47-F49 VanDerWaalsContact C-N 3.26Å; E47-F49 PolarHBondContact O-N 2.91Å; F49-L51 VanDerWaalsContact C-N 3.32Å; F49-L51 PolarHBondContact O-N 3.14Å; F49-A52 PolarHBondContact O-N 2.91Å; F49-G53 PolarHBondContact O-N 3.12Å; F49-K54 CarbonylContact C-O 3.41Å; F49-K54 HydrophobicContact CD1-CB 3.61Å; F49-K54 HydrophobicContact CD1-CD 4.33Å; F49-K54 HydrophobicContact CE1-CB 4.1Å; F49-K54 HydrophobicContact CE1-CD 4.03Å; F49-K54 PolarHBondContact O-N 3.36Å; F49-M56 HydrophobicContact CB-CG 4.37Å; F49-M56 HydrophobicContact CG-CG 4.49Å; F49-L74 HydrophobicContact CE1-CD2 4.46Å; F49-L74 HydrophobicContact CE2-CB 3.75Å; F49-L74 HydrophobicContact CE2-CD1 3.91Å; F49-L74 HydrophobicContact CE2-CD2 4.11Å; F49-L74 HydrophobicContact CE2-CG 4.11Å; F49-L74 HydrophobicContact CZ-CB 3.68Å; F49-L74 HydrophobicContact CZ-CD1 4.21Å; F49-L74 HydrophobicContact CZ-CD2 3.54Å; F49-L74 HydrophobicContact CZ-CG 3.98Å
50A78.5Confident69.6Low75 Ų7576.1 Ų76.162%0.6242%0.415SS*.Hα-helixtrans-58.9-45.6175.200000111.1G46 E47 A52 G53G46-A50 WeakPolarHBondContact O-CB 3.3Å; G46-A50 PolarHBondContact O-N 2.9Å; E47-A50 PolarHBondContact O-N 3.11Å; A50-A52 VanDerWaalsContact C-N 3.33Å; A50-A52 PolarHBondContact O-N 2.87Å; A50-G53 PolarHBondContact O-N 2.99Å
51L77.5Confident67.8Low77 Ų7786.1 Ų86.140%0.40345%0.453SS..Hα-helixtrans-69.6-28.7177.3-66.5171.4000112.9E47 F49 G53 I80 L82E47-L51 HydrophobicContact CG-CD1 4.11Å; E47-L51 WeakPolarHBondContact O-CB 3.46Å; E47-L51 VanDerWaalsContact O-CG 3.26Å; E47-L51 WeakPolarHBondContact O-CG 3.45Å; E47-L51 PolarHBondContact O-N 3.28Å; F49-L51 VanDerWaalsContact C-N 3.32Å; F49-L51 PolarHBondContact O-N 3.14Å; L51-G53 PolarHBondContact O-N 3.49Å; L51-I80 HydrophobicContact CB-CG2 3.5Å; L51-I80 HydrophobicContact CD1-CG2 4.34Å; L51-I80 HydrophobicContact CG-CG2 4.5Å; L51-L82 HydrophobicContact CD1-CD1 4.02Å
52A73.8Confident65.8Low24 Ų2492.6 Ų92.620%0.19848%0.475CS..THydrogen-bonded Turntrans-76.6-1.8173.600000113.9L48 F49 A50 K54 V76 I80L48-A52 WeakPolarHBondContact O-CB 3.14Å; L48-A52 PolarHBondContact O-N 3.39Å; F49-A52 PolarHBondContact O-N 2.91Å; A50-A52 VanDerWaalsContact C-N 3.33Å; A50-A52 PolarHBondContact O-N 2.87Å; A52-K54 PolarHBondContact O-N 3.49Å; A52-V76 HydrophobicContact CB-CG1 4.19Å; A52-I80 HydrophobicContact CB-CD1 3.51Å
53G66.1Low64.2Low72 Ų7291.5 Ų91.574%0.74247%0.472SS*.THydrogen-bonded Turntrans66.918.3-174.300000114.1F49 A50 L51F49-G53 PolarHBondContact O-N 3.12Å; A50-G53 PolarHBondContact O-N 2.99Å; L51-G53 PolarHBondContact O-N 3.49Å
54K63.2Low62.6Low74 Ų7499 Ų9932%0.32250%0.5SS..  trans-106.3127.4-179.9-74.8-177.8-176.3176.40110.2F49 A52 T75F49-K54 CarbonylContact C-O 3.41Å; F49-K54 HydrophobicContact CD1-CB 3.61Å; F49-K54 HydrophobicContact CD1-CD 4.33Å; F49-K54 HydrophobicContact CE1-CB 4.1Å; F49-K54 HydrophobicContact CE1-CD 4.03Å; F49-K54 PolarHBondContact O-N 3.36Å; A52-K54 PolarHBondContact O-N 3.49Å; K54-T75 PolarHBondContact NZ-O 2.9Å; K54-T75 VanDerWaalsContact NZ-O 3.15Å
55Q52.4Low60.9Low192 Ų192107.4 Ų107.490%0.89752%0.522SS*.  trans-67.3137.3170.6-68.7-173.80.400110.3
56M53.1Low59.3Low102 Ų102114.8 Ų114.850%0.50255%0.547SS..  trans-58.5132.3174.8-100.1-159.9153.200110.4E45 F49 K58E45-M56 HydrophobicContact CB-CE 3.84Å; F49-M56 HydrophobicContact CB-CG 4.37Å; F49-M56 HydrophobicContact CG-CG 4.49Å; M56-K58 PolarHBondContact O-N 3.44Å; M56-K58 VanDerWaalsContact O-N 3.1Å
57P55Low58.2Low91 Ų91118 Ų11859%0.59156%0.555SS**  trans-64.4114.9172.724-29.1000109.1Q59P57-Q59 PolarHBondContact O-N 3.06Å
58K47.4Very low56.4Low204 Ų204122.9 Ų122.989%0.88758%0.583SS**  trans-60.8107.1171.9-82.7-177.7176.2176.30108.5M56 N60M56-K58 PolarHBondContact O-N 3.44Å; M56-K58 VanDerWaalsContact O-N 3.1Å; K58-N60 PolarHBondContact O-N 3.31Å
59Q49.5Very low54.6Low125 Ų125126.1 Ų126.158%0.58462%0.617SS**  trans-71.799.1-179.7-154178.427.900109.4P57P57-Q59 PolarHBondContact O-N 3.06Å
60N41.8Very low53.3Low114 Ų114133.7 Ų133.761%0.6165%0.652SS**  trans-77.3141.3179.1-138.1-8.7000109.3K58 R62 D63K58-N60 PolarHBondContact O-N 3.31Å; N60-R62 PolarHBondContact O-N 3.49Å; N60-D63 PolarHBondContact O-N 3.03Å
61R50.3Low52Low220 Ų220136.1 Ų136.183%0.8366%0.655SS**THydrogen-bonded Turntrans-58.8-19.1-172.6-142.3177.7-173.1-179.52113.5
62R45.3Very low51Low227 Ų227141.1 Ų141.186%0.85767%0.673SS**THydrogen-bonded Turntrans-77.8-22.1175.8-108177.5174.6174.5-1.7114.5N60N60-R62 PolarHBondContact O-N 3.49Å
63D49.5Very low50.7Low78 Ų78143.6 Ų143.642%0.41769%0.687SS.*G310 helixtrans-86.3-20.2-176.6-66.4-39.5000113.4N60 W65 R66 Q67N60-D63 PolarHBondContact O-N 3.03Å; D63-W65 PolarHBondContact O-N 3.33Å; D63-W65 VanDerWaalsContact O-N 3.16Å; D63-R66 PolarHBondContact O-N 3.29Å; D63-Q67 PolarHBondContact O-N 3.23Å
64R48.9Very low50.9Low160 Ų160143.5 Ų143.560%0.60467%0.669SS**G310 helixtrans-58.9-26.8175.7-78.6-172.8-166.8-178.33.8113.7
65W45.8Very low51.6Low238 Ų238142.7 Ų142.790%0.90267%0.671SS**G310 helixtrans-89.3-17.3-177-81.351.1000113.7D63D63-W65 PolarHBondContact O-N 3.33Å; D63-W65 VanDerWaalsContact O-N 3.16Å
66R43.7Very low53.1Low230 Ų230133.6 Ų133.687%0.86863%0.628SS**THydrogen-bonded Turntrans-98.5-9.4178.2-76.3-169.3-179.1-140.41.1114.2D63D63-R66 PolarHBondContact O-N 3.29Å
67Q48.5Very low54.5Low97 Ų97130.2 Ų130.245%0.45361%0.614SS.*  trans-96.718.6-172.5-99.3176.9-7.300115.2D63 G69D63-Q67 PolarHBondContact O-N 3.23Å; Q67-G69 PolarHBondContact O-N 3.41Å
68N41.4Very low55.7Low167 Ų167127.7 Ų127.789%0.89359%0.594SS**SBendtrans-84.719-177.2-146.526.1000114.3
69G42.4Very low57.2Low70 Ų70123.4 Ų123.472%0.72258%0.581SS**SBendtrans-122.5-40.7-173.200000116Q67Q67-G69 PolarHBondContact O-N 3.41Å
70E44.8Very low58.8Low171 Ų171118.2 Ų118.280%0.79956%0.556SS**  trans-152.481.7-177.3-68.4-171.3163.300110.7K72E70-K72 PolarHBondContact O-N 3.11Å
71N50.8Low60.6Low126 Ų126117.7 Ų117.767%0.67455%0.554SS**  trans-73.783166.9-93.6-11.6000108.8P73N71-P73 WeakPolarHBondContact O-CD 3.49Å; N71-P73 VanDerWaalsContact O-N 3.13Å
72K57.5Low62Low182 Ų182107.3 Ų107.379%0.79152%0.515SS*.PPolyproline II helixtrans-57.2118.1168-118.2169.7-174.6162.30107.4E70 L74E70-K72 PolarHBondContact O-N 3.11Å; K72-L74 PolarHBondContact O-N 3.49Å
73P66.4Low63.8Low75 Ų75102.2 Ų102.249%0.48750%0.5SS..PPolyproline II helixtrans-61.5138.4-174.725.5-33.8000109.1N71 T75 A357 I359N71-P73 WeakPolarHBondContact O-CD 3.49Å; N71-P73 VanDerWaalsContact O-N 3.13Å; P73-T75 WeakPolarHBondContact O-CG2 3.46Å; P73-T75 PolarHBondContact O-N 3.27Å; P73-T75 VanDerWaalsContact O-N 3.14Å; P73-A357 HydrophobicContact CB-CB 3.89Å; P73-A357 HydrophobicContact CG-CB 4.15Å; P73-I359 HydrophobicContact CB-CG2 4.42Å
74L71.8Confident65.5Low70 Ų7099.2 Ų99.237%0.36648%0.484SS..PPolyproline II helixtrans-59.4117.2-176.8-73.7162.6000109.6F49 K72 A357 A358F49-L74 HydrophobicContact CE1-CD2 4.46Å; F49-L74 HydrophobicContact CE2-CB 3.75Å; F49-L74 HydrophobicContact CE2-CD1 3.91Å; F49-L74 HydrophobicContact CE2-CD2 4.11Å; F49-L74 HydrophobicContact CE2-CG 4.11Å; F49-L74 HydrophobicContact CZ-CB 3.68Å; F49-L74 HydrophobicContact CZ-CD1 4.21Å; F49-L74 HydrophobicContact CZ-CD2 3.54Å; F49-L74 HydrophobicContact CZ-CG 3.98Å; K72-L74 PolarHBondContact O-N 3.49Å; L74-A357 WeakPolarHBondContact O-CA 3.22Å; L74-A358 PolarHBondContact O-N 2.71Å
75T77.8Confident67.2Low57 Ų5796.6 Ų96.635%0.3548%0.479SS..EExtended strand (participates in β ladder)trans-103.6139.2-174.851.50000113.3K54 P73 I356K54-T75 PolarHBondContact NZ-O 2.9Å; K54-T75 VanDerWaalsContact NZ-O 3.15Å; P73-T75 WeakPolarHBondContact O-CG2 3.46Å; P73-T75 PolarHBondContact O-N 3.27Å; P73-T75 VanDerWaalsContact O-N 3.14Å; T75-I356 WeakPolarHBondContact CA-O 3.41Å
76V83.1Confident69.2Low1 Ų192 Ų921%0.00647%0.466CS..EExtended strand (participates in β ladder)trans-129.9135.2-168.9177.40000107.9L48 A52 I80 R355 I356 A358L48-V76 HydrophobicContact CB-CG2 4.4Å; A52-V76 HydrophobicContact CB-CG1 4.19Å; V76-I80 HydrophobicContact CB-CD1 4.42Å; V76-I80 HydrophobicContact CG1-CD1 3Å; V76-I80 HydrophobicContact CG1-CG1 4.29Å; V76-R355 WeakPolarHBondContact O-CA 3.43Å; V76-I356 PolarHBondContact N-O 2.89Å; V76-I356 PolarHBondContact O-N 3.07Å; V76-A358 HydrophobicContact CG2-CB 4.08Å
77P81.9Confident71.3Confident31 Ų3181.7 Ų81.720%0.20143%0.429CS..EExtended strand (participates in β ladder)trans-54.7142.9172.4-23.630.3000112.5D79 I80P77-D79 WeakPolarHBondContact CB-OD1 3.46Å; P77-I80 HydrophobicContact CB-CD1 4.48Å; P77-I80 HydrophobicContact CB-CG1 4.16Å; P77-I80 WeakPolarHBondContact O-CD1 3.5Å; P77-I80 VanDerWaalsContact O-CG1 3.3Å; P77-I80 WeakPolarHBondContact O-CG1 3.47Å
78K81.5Confident73.2Confident39 Ų3979.8 Ų79.817%0.1743%0.425CS..THydrogen-bonded Turntrans-75.2-26.8-178.3-77-174.8174.5-1730113.4I80 M349 K350 E352 G354 I356K78-I80 PolarHBondContact O-N 3.44Å; K78-M349 HydrophobicContact CB-CG 4.06Å; K78-M349 HydrophobicContact CD-CG 4.32Å; K78-M349 HydrophobicContact CG-CG 3.99Å; K78-K350 WeakPolarHBondContact O-CA 3.37Å; K78-E352 VanDerWaalsContact CB-O 3.25Å; K78-E352 WeakPolarHBondContact CB-O 3.48Å; K78-E352 HydrophobicContact CD-CB 3.98Å; K78-E352 IonicContact NZ-OE2 3.01Å; K78-E352 PolarHBondContact NZ-OE2 3.44Å; K78-G354 WeakPolarHBondContact CG-O 3.4Å; K78-G354 PolarHBondContact N-O 3.26Å; K78-I356 HydrophobicContact CG-CB 4.01Å; K78-I356 HydrophobicContact CG-CG2 3.92Å
79D79.6Confident75.4Confident114 Ų11471.8 Ų71.861%0.6138%0.382SS*.THydrogen-bonded Turntrans-79.68.6-177.560.9-37.4000114.4P77P77-D79 WeakPolarHBondContact CB-OD1 3.46Å
80I82.1Confident77.4Confident15 Ų1572.7 Ų72.78%0.07737%0.37CS..  trans-64.1142.7179.8-70-179.6000111.3L51 A52 V76 P77 K78 L82 K350L51-I80 HydrophobicContact CB-CG2 3.5Å; L51-I80 HydrophobicContact CD1-CG2 4.34Å; L51-I80 HydrophobicContact CG-CG2 4.5Å; A52-I80 HydrophobicContact CB-CD1 3.51Å; V76-I80 HydrophobicContact CB-CD1 4.42Å; V76-I80 HydrophobicContact CG1-CD1 3Å; V76-I80 HydrophobicContact CG1-CG1 4.29Å; P77-I80 HydrophobicContact CB-CD1 4.48Å; P77-I80 HydrophobicContact CB-CG1 4.16Å; P77-I80 WeakPolarHBondContact O-CD1 3.5Å; P77-I80 VanDerWaalsContact O-CG1 3.3Å; P77-I80 WeakPolarHBondContact O-CG1 3.47Å; K78-I80 PolarHBondContact O-N 3.44Å; I80-L82 HydrophobicContact CG2-CB 4.47Å; I80-L82 PolarHBondContact O-N 3.31Å; I80-K350 WeakPolarHBondContact O-CE 3.27Å; I80-K350 WeakPolarHBondContact O-CG 3.37Å
81D79.4Confident79.1Confident104 Ų10470.3 Ų70.356%0.55636%0.361SS*.  trans-75.165.7173.5-162.225.1000113.2H83 K350D81-H83 IonicContact OD1-CD2 3.59Å; D81-H83 IonicContact OD1-NE2 3.3Å; D81-H83 PolarHBondContact OD1-NE2 3.13Å; D81-H83 IonicContact OD2-CD2 4Å; D81-H83 IonicContact OD2-NE2 3.88Å; D81-K350 IonicContact OD1-NZ 3.33Å; D81-K350 PolarHBondContact OD1-NZ 3.46Å
82L81.1Confident80.4Confident2 Ų271.3 Ų71.31%0.0136%0.363CS..  trans-81.1122.5176.1-17964.1000110.4P43 L48 L51 I80 L84 V346 K350 I361P43-L82 HydrophobicContact CB-CD1 3.92Å; P43-L82 HydrophobicContact CG-CD1 4.31Å; P43-L82 HydrophobicContact CG-CD2 4.2Å; L48-L82 HydrophobicContact CD2-CD1 3.93Å; L48-L82 HydrophobicContact CD2-CD2 4.02Å; L51-L82 HydrophobicContact CD1-CD1 4.02Å; I80-L82 HydrophobicContact CG2-CB 4.47Å; I80-L82 PolarHBondContact O-N 3.31Å; L82-L84 HydrophobicContact CD2-CD2 4.27Å; L82-L84 HydrophobicContact CG-CD2 4.43Å; L82-V346 HydrophobicContact CB-CG1 4.16Å; L82-V346 HydrophobicContact CD2-CG1 4.03Å; L82-V346 HydrophobicContact CD2-CG2 4.22Å; L82-V346 HydrophobicContact CG-CG1 4.22Å; L82-K350 WeakPolarHBondContact O-CE 3.22Å; L82-K350 PolarHBondContact O-NZ 2.88Å; L82-I361 HydrophobicContact CD2-CG2 4.06Å
83H82Confident81.5Confident119 Ų11964.7 Ų64.755%0.55134%0.336SS*.  trans-114.1117.7170-79.5-78000109.4D81 E85D81-H83 IonicContact OD1-CD2 3.59Å; D81-H83 IonicContact OD1-NE2 3.3Å; D81-H83 PolarHBondContact OD1-NE2 3.13Å; D81-H83 IonicContact OD2-CD2 4Å; D81-H83 IonicContact OD2-NE2 3.88Å; H83-E85 PolarHBondContact O-N 2.96Å
84L84.9Confident82.1Confident15 Ų1561.1 Ų61.18%0.07931%0.314CS..PPolyproline II helixtrans-75.6128.2-179.3-63.6176.4000110.8F40 L82 A342 V346 V365F40-L84 HydrophobicContact CB-CB 4.04Å; F40-L84 HydrophobicContact CB-CD1 3.95Å; F40-L84 HydrophobicContact CD1-CB 3.39Å; F40-L84 HydrophobicContact CD1-CD1 4.12Å; F40-L84 HydrophobicContact CD1-CG 4.43Å; F40-L84 HydrophobicContact CE1-CB 4.18Å; F40-L84 HydrophobicContact CG-CB 4.02Å; F40-L84 HydrophobicContact CG-CD1 4.04Å; L82-L84 HydrophobicContact CD2-CD2 4.27Å; L82-L84 HydrophobicContact CG-CD2 4.43Å; L84-A342 HydrophobicContact CD1-CB 4.25Å; L84-V346 HydrophobicContact CD1-CB 4.49Å; L84-V346 HydrophobicContact CD1-CG2 3.75Å; L84-V346 HydrophobicContact CD2-CG2 4.31Å; L84-V346 HydrophobicContact CG-CG2 4.07Å; L84-V365 HydrophobicContact CD1-CG2 4.15Å; L84-V365 HydrophobicContact CD2-CG2 4.21Å
85E84.8Confident82.6Confident106 Ų10663.2 Ų63.250%0.49532%0.324SS..PPolyproline II helixtrans-69.1132.8172.8-68.6-170171.600111.6F40 K41 H83F40-E85 WeakPolarHBondContact CA-O 3.5Å; K41-E85 HydrophobicContact CD-CB 4.33Å; K41-E85 PolarHBondContact N-O 3.39Å; K41-E85 IonicContact NZ-OE2 2.82Å; K41-E85 PolarHBondContact NZ-OE2 3.31Å; H83-E85 PolarHBondContact O-N 2.96Å
86K88.1Confident82.9Confident142 Ų14265.6 Ų65.662%0.61734%0.339SS*.EExtended strand (participates in β ladder)trans-85.2136.5172.3-66.8178.4-177.6176.20110.5R39 F40R39-K86 CarbonylContact O-C 3.52Å; R39-K86 WeakPolarHBondContact O-CA 3.46Å; F40-K86 HydrophobicContact CD1-CG 3.97Å; F40-K86 HydrophobicContact CE1-CD 4.24Å; F40-K86 HydrophobicContact CE1-CG 3.5Å; F40-K86 HydrophobicContact CZ-CD 4.45Å; F40-K86 HydrophobicContact CZ-CG 4.06Å
87A87.4Confident83.1Confident12 Ų1265.9 Ų65.910%0.09934%0.34CS..EExtended strand (participates in β ladder)trans-134.7143.3173.300000110.2F38 R39 K41F38-A87 CarbonylContact C-O 3.58Å; F38-A87 WeakPolarHBondContact CA-O 3.43Å; R39-A87 HydrophobicContact CG-CB 4.34Å; R39-A87 WeakPolarHBondContact CG-O 3.38Å; R39-A87 PolarHBondContact N-O 3.27Å; R39-A87 PolarHBondContact O-N 3.42Å; K41-A87 HydrophobicContact CG-CB 4.08Å
88P88.4Confident83.3Confident57 Ų5769.1 Ų69.137%0.3735%0.348SS..EExtended strand (participates in β ladder)trans-65.2148.4172.629-34.3000110.6N90P88-N90 PolarHBondContact O-N 2.99Å
89V87.5Confident83.6Confident0 Ų068.5 Ų68.50%035%0.346CS..  trans-76.1114.6175.1-178.40000109.8V32 L37 R39 L339 F369V32-V89 HydrophobicContact CG1-CG1 3.85Å; L37-V89 HydrophobicContact CB-CG2 4.02Å; L37-V89 PolarHBondContact O-N 2.74Å; R39-V89 HydrophobicContact CB-CG2 4.05Å; R39-V89 HydrophobicContact CG-CG2 4.32Å; V89-L339 HydrophobicContact CG2-CD1 4.42Å; V89-F369 HydrophobicContact CG1-CE2 4.12Å; V89-F369 HydrophobicContact CG1-CZ 4.34Å; V89-F369 HydrophobicContact CG2-CE2 4.09Å
90N84.9Confident84.1Confident88 Ų8863.5 Ų63.547%0.47132%0.319SS..  trans-96.2160.4-179.8-71.9-34.7000112.5P88 M92 D93 A94P88-N90 PolarHBondContact O-N 2.99Å; N90-M92 VanDerWaalsContact C-N 3.33Å; N90-M92 PolarHBondContact O-N 3.02Å; N90-D93 PolarHBondContact O-N 3.33Å; N90-A94 PolarHBondContact O-N 2.83Å; N90-A94 VanDerWaalsContact O-N 3.17Å
91M79.6Confident84.4Confident121 Ų12169 Ų6960%0.59635%0.347SS*.Hα-helixtrans-60.5-38.9178.6-64.1-176-173.700113.2C33 A94C33-M91 HydrophobicContact CB-CG 4.12Å; M91-A94 WeakPolarHBondContact O-CB 3.48Å; M91-A94 PolarHBondContact O-N 3.19Å
92M79.8Confident85Confident148 Ų14868.8 Ų68.873%0.72934%0.343SS*.Hα-helixtrans-68.9-35.9179.7-60.5-59.9-82.400111.9N90 A94 L95N90-M92 VanDerWaalsContact C-N 3.33Å; N90-M92 PolarHBondContact O-N 3.02Å; M92-A94 VanDerWaalsContact C-N 3.26Å; M92-A94 PolarHBondContact O-N 3.46Å; M92-L95 PolarHBondContact O-N 3.16Å
93D79.6Confident85.5Confident42 Ų4268.7 Ų68.723%0.22534%0.343CS..Hα-helixtrans-69.2-29177.1-65.4-23.9000111.5R39 N90 L95 V96 F369R39-D93 IonicContact CZ-OD2 3.96Å; R39-D93 VanDerWaalsContact CZ-OD2 3.28Å; R39-D93 IonicContact NE-OD2 3.28Å; R39-D93 PolarHBondContact NE-OD2 3.11Å; R39-D93 VanDerWaalsContact NH2-CG 3.26Å; R39-D93 IonicContact NH2-OD1 3.18Å; R39-D93 PolarHBondContact NH2-OD1 3.34Å; R39-D93 IonicContact NH2-OD2 3.35Å; R39-D93 PolarHBondContact NH2-OD2 3.25Å; N90-D93 PolarHBondContact O-N 3.33Å; D93-L95 VanDerWaalsContact C-N 3.28Å; D93-L95 PolarHBondContact O-N 2.82Å; D93-V96 PolarHBondContact O-N 3.1Å; D93-F369 HydrophobicContact CB-CE1 4.06Å; D93-F369 HydrophobicContact CB-CZ 3.85Å
94A79.9Confident86.1Confident1 Ų164.2 Ų64.21%0.00832%0.322CS..Hα-helixtrans-67.5-27.1-179.100000113.1N90 M91 M92 V96 L97 F100N90-A94 PolarHBondContact O-N 2.83Å; N90-A94 VanDerWaalsContact O-N 3.17Å; M91-A94 WeakPolarHBondContact O-CB 3.48Å; M91-A94 PolarHBondContact O-N 3.19Å; M92-A94 VanDerWaalsContact C-N 3.26Å; M92-A94 PolarHBondContact O-N 3.46Å; A94-V96 PolarHBondContact O-N 3.21Å; A94-L97 HydrophobicContact CB-CD1 4.11Å; A94-L97 WeakPolarHBondContact O-CB 3.15Å; A94-L97 VanDerWaalsContact O-CG 3.27Å; A94-L97 WeakPolarHBondContact O-CG 3.36Å; A94-L97 PolarHBondContact O-N 3.09Å; A94-L97 VanDerWaalsContact O-N 3.11Å; A94-F100 HydrophobicContact CB-CD2 4.18Å; A94-F100 HydrophobicContact CB-CE2 3.68Å; A94-F100 HydrophobicContact CB-CZ 4.13Å; A94-F100 VanDerWaalsContact O-CD2 3.27Å; A94-F100 WeakPolarHBondContact O-CD2 3.41Å; A94-F100 VanDerWaalsContact O-CG 3.3Å; A94-F100 WeakPolarHBondContact O-CG 3.48Å
95L80.6Confident86.4Confident113 Ų11369 Ų6959%0.59234%0.339SS*.THydrogen-bonded Turntrans-66.5-22.8177.9-64.8174.1000113.2M92 D93 L97 F100M92-L95 PolarHBondContact O-N 3.16Å; D93-L95 VanDerWaalsContact C-N 3.28Å; D93-L95 PolarHBondContact O-N 2.82Å; L95-L97 VanDerWaalsContact C-N 3.27Å; L95-F100 HydrophobicContact CD2-CD1 4.23Å; L95-F100 HydrophobicContact CD2-CE1 3.96Å
96V84.5Confident86.9Confident107 Ų10764.1 Ų64.165%0.64832%0.316SS*.THydrogen-bonded Turntrans-84.1-6.8178.4-171.40000111.4D93 A94D93-V96 PolarHBondContact O-N 3.1Å; A94-V96 PolarHBondContact O-N 3.21Å
97L87.5Confident87.2Confident7 Ų757.8 Ų57.84%0.03729%0.289CS..SBendtrans-73.5138.8-179.3-58.9176.5000111A94 L95 F100 F369 L372 T373A94-L97 HydrophobicContact CB-CD1 4.11Å; A94-L97 WeakPolarHBondContact O-CB 3.15Å; A94-L97 VanDerWaalsContact O-CG 3.27Å; A94-L97 WeakPolarHBondContact O-CG 3.36Å; A94-L97 PolarHBondContact O-N 3.09Å; A94-L97 VanDerWaalsContact O-N 3.11Å; L95-L97 VanDerWaalsContact C-N 3.27Å; L97-F100 HydrophobicContact CB-CB 4.22Å; L97-F100 WeakPolarHBondContact O-CB 3.24Å; L97-F100 PolarHBondContact O-N 3.37Å; L97-F369 HydrophobicContact CD2-CD1 4.13Å; L97-F369 HydrophobicContact CD2-CD2 4.32Å; L97-F369 HydrophobicContact CD2-CE1 3.87Å; L97-F369 HydrophobicContact CD2-CE2 4.06Å; L97-F369 HydrophobicContact CD2-CG 4.34Å; L97-F369 HydrophobicContact CD2-CZ 3.83Å; L97-F369 WeakPolarHBondContact CD2-O 3.5Å; L97-F369 HydrophobicContact CG-CZ 4.48Å; L97-L372 HydrophobicContact CD1-CB 4.5Å; L97-L372 HydrophobicContact CD1-CD2 4.37Å; L97-L372 HydrophobicContact CD2-CB 4.3Å; L97-T373 HydrophobicContact CB-CG2 3.69Å; L97-T373 HydrophobicContact CD1-CG2 3.68Å; L97-T373 HydrophobicContact CG-CG2 4.32Å
98R86.8Confident87.5Confident99 Ų9957.6 Ų57.637%0.37429%0.287SS..THydrogen-bonded Turntrans-70.4136.4-179.9-163.7-177.6176157-1109.8F100 H157 C370 Y371 T373R98-F100 PolarHBondContact O-N 3.15Å; R98-H157 PolarHBondContact NH2-CE1 3.05Å; R98-H157 PolarHBondContact NH2-ND1 3.35Å; R98-C370 PolarHBondContact N-O 3.41Å; R98-Y371 PolarHBondContact NH1-OH 3Å; R98-T373 WeakPolarHBondContact O-CB 3.41Å; R98-T373 PolarHBondContact O-OG1 3.22Å
99F88.1Confident87.8Confident26 Ų2655.4 Ų55.411%0.11427%0.271CS..THydrogen-bonded Turntrans63.421.8-175.3-65.1-80.2000115.4L101 E102 Y103 T153 L154 H157 V374 L377F99-L101 VanDerWaalsContact C-N 3.34Å; F99-L101 PolarHBondContact O-N 2.86Å; F99-E102 VanDerWaalsContact C-OE2 3.31Å; F99-E102 WeakPolarHBondContact CA-OE2 3.25Å; F99-E102 HydrophobicContact CD1-CB 4.35Å; F99-E102 HydrophobicContact CD1-CG 4.15Å; F99-Y103 WeakPolarHBondContact O-CB 3.15Å; F99-Y103 PolarHBondContact O-N 3.36Å; F99-T153 HydrophobicContact CD1-CG2 4.46Å; F99-T153 HydrophobicContact CE1-CG2 3.64Å; F99-T153 HydrophobicContact CZ-CG2 4.29Å; F99-L154 HydrophobicContact CD2-CD2 4.2Å; F99-L154 HydrophobicContact CE2-CD2 4.41Å; F99-L154 HydrophobicContact CG-CD2 4.42Å; F99-H157 AromaticContact CE2-CD2 3.93Å; F99-H157 AromaticContact CZ-CD2 3.27Å; F99-H157 WeakPolarHBondContact CZ-CD2 3.5Å; F99-H157 AromaticContact CZ-NE2 3.42Å; F99-H157 WeakPolarHBondContact CZ-NE2 3.48Å; F99-V374 HydrophobicContact CB-CG2 4.39Å; F99-V374 HydrophobicContact CD2-CG2 3.64Å; F99-V374 HydrophobicContact CE2-CG2 4.49Å; F99-V374 HydrophobicContact CG-CG2 4.41Å; F99-L377 HydrophobicContact CB-CD1 4.27Å
100F89Confident88.2Confident10 Ų1055.7 Ų55.74%0.04427%0.274CS..Hα-helixtrans-61.9-40.9-178.1179.5-101.7000112.7R29 A94 L95 L97 R98 Y103 Q104 T373R29-F100 HydrophobicContact CG-CE2 4.46Å; R29-F100 HydrophobicContact CG-CZ 3.74Å; A94-F100 HydrophobicContact CB-CD2 4.18Å; A94-F100 HydrophobicContact CB-CE2 3.68Å; A94-F100 HydrophobicContact CB-CZ 4.13Å; A94-F100 VanDerWaalsContact O-CD2 3.27Å; A94-F100 WeakPolarHBondContact O-CD2 3.41Å; A94-F100 VanDerWaalsContact O-CG 3.3Å; A94-F100 WeakPolarHBondContact O-CG 3.48Å; L95-F100 HydrophobicContact CD2-CD1 4.23Å; L95-F100 HydrophobicContact CD2-CE1 3.96Å; L97-F100 HydrophobicContact CB-CB 4.22Å; L97-F100 WeakPolarHBondContact O-CB 3.24Å; L97-F100 PolarHBondContact O-N 3.37Å; R98-F100 PolarHBondContact O-N 3.15Å; F100-Y103 HydrophobicContact CD2-CD1 4.34Å; F100-Y103 PolarHBondContact O-N 2.86Å; F100-Q104 VanDerWaalsContact CE1-OE1 3.23Å; F100-Q104 VanDerWaalsContact O-CB 3.27Å; F100-Q104 WeakPolarHBondContact O-CB 3.34Å; F100-Q104 PolarHBondContact O-N 3.37Å; F100-T373 HydrophobicContact CB-CG2 4.31Å; F100-T373 HydrophobicContact CD2-CG2 3.84Å
101L89.4Confident88.6Confident130 Ų13054.5 Ų54.568%0.68127%0.27SS*.Hα-helixtrans-67.8-44.4-179.2-67.9176000111.8F99 Q104 W105F99-L101 VanDerWaalsContact C-N 3.34Å; F99-L101 PolarHBondContact O-N 2.86Å; L101-Q104 PolarHBondContact O-N 2.73Å; L101-W105 VanDerWaalsContact O-CB 3.3Å; L101-W105 WeakPolarHBondContact O-CB 3.27Å; L101-W105 PolarHBondContact O-N 2.62Å
102E90.7Very high89.3Confident100 Ų10051.2 Ų51.247%0.46725%0.251SS..Hα-helixtrans-65.4-41177.5-61.888158.800111.2F99 L106F99-E102 VanDerWaalsContact C-OE2 3.31Å; F99-E102 WeakPolarHBondContact CA-OE2 3.25Å; F99-E102 HydrophobicContact CD1-CB 4.35Å; F99-E102 HydrophobicContact CD1-CG 4.15Å; E102-L106 WeakPolarHBondContact O-CB 3.04Å; E102-L106 PolarHBondContact O-N 3.06Å
103Y92.9Very high90Very high0 Ų044.2 Ų44.20%022%0.216CC..Hα-helixtrans-59.2-51.9172.1162.8-105.7000111.7A28 L31 V32 F99 F100 W105 L106 V107 T373 T376 L377 L380A28-Y103 HydrophobicContact CB-CD1 4.26Å; A28-Y103 HydrophobicContact CB-CE1 3.65Å; A28-Y103 PolarHBondContact O-OH 3.26Å; A28-Y103 VanDerWaalsContact O-OH 3.09Å; L31-Y103 WeakPolarHBondContact CD2-OH 3.35Å; V32-Y103 HydrophobicContact CG2-CE1 3.91Å; V32-Y103 WeakPolarHBondContact CG2-OH 3.48Å; F99-Y103 WeakPolarHBondContact O-CB 3.15Å; F99-Y103 PolarHBondContact O-N 3.36Å; F100-Y103 HydrophobicContact CD2-CD1 4.34Å; F100-Y103 PolarHBondContact O-N 2.86Å; Y103-W105 VanDerWaalsContact C-N 3.34Å; Y103-W105 PolarHBondContact O-N 3.21Å; Y103-L106 PolarHBondContact O-N 2.86Å; Y103-V107 HydrophobicContact CD2-CG2 3.91Å; Y103-V107 HydrophobicContact CE2-CB 4.46Å; Y103-V107 HydrophobicContact CE2-CG2 3.52Å; Y103-V107 WeakPolarHBondContact O-CG2 3.27Å; Y103-V107 PolarHBondContact O-N 3.4Å; Y103-V107 VanDerWaalsContact O-N 3.11Å; Y103-T373 HydrophobicContact CD1-CG2 3.9Å; Y103-T373 HydrophobicContact CG-CG2 4.19Å; Y103-T376 HydrophobicContact CD2-CG2 4.19Å; Y103-T376 HydrophobicContact CE2-CG2 3.39Å; Y103-L377 HydrophobicContact CD2-CD2 4.11Å; Y103-L377 HydrophobicContact CD2-CG 4.01Å; Y103-L380 HydrophobicContact CE2-CD1 4.08Å
104Q92.8Very high90.7Very high25 Ų2544.6 Ų44.612%0.11722%0.218CC..Hα-helixtrans-58.6-50-178.3179.5174-37.100110.6A22 S26 A28 F100 L101 D108A22-Q104 PolarHBondContact O-NE2 3.44Å; A22-Q104 VanDerWaalsContact O-NE2 3.11Å; S26-Q104 WeakPolarHBondContact OG-CG 3.3Å; A28-Q104 HydrophobicContact CB-CB 4.21Å; A28-Q104 HydrophobicContact CB-CG 4.13Å; F100-Q104 VanDerWaalsContact CE1-OE1 3.23Å; F100-Q104 VanDerWaalsContact O-CB 3.27Å; F100-Q104 WeakPolarHBondContact O-CB 3.34Å; F100-Q104 PolarHBondContact O-N 3.37Å; L101-Q104 PolarHBondContact O-N 2.73Å; Q104-D108 WeakPolarHBondContact CG-OD2 3.38Å; Q104-D108 VanDerWaalsContact O-CB 3.3Å; Q104-D108 WeakPolarHBondContact O-CB 3.22Å; Q104-D108 PolarHBondContact O-N 3.14Å
105W92.3Very high91.3Very high115 Ų11546.4 Ų46.444%0.43624%0.236SC..Hα-helixtrans-61.4-46.9-178.5-178.385.6000112.5L101 Y103 F109 F146L101-W105 VanDerWaalsContact O-CB 3.3Å; L101-W105 WeakPolarHBondContact O-CB 3.27Å; L101-W105 PolarHBondContact O-N 2.62Å; Y103-W105 VanDerWaalsContact C-N 3.34Å; Y103-W105 PolarHBondContact O-N 3.21Å; W105-F109 WeakPolarHBondContact O-CB 3.27Å; W105-F109 PolarHBondContact O-N 3.41Å; W105-F146 HydrophobicContact CH2-CB 4.34Å; W105-F146 AromaticContact CH2-CD1 3.81Å; W105-F146 HydrophobicContact CH2-CD1 3.81Å; W105-F146 AromaticContact CH2-CD2 3.38Å; W105-F146 HydrophobicContact CH2-CD2 3.38Å; W105-F146 AromaticContact CH2-CE1 3.87Å; W105-F146 HydrophobicContact CH2-CE1 3.87Å; W105-F146 AromaticContact CH2-CE2 3.44Å; W105-F146 HydrophobicContact CH2-CE2 3.44Å; W105-F146 VanDerWaalsContact CH2-CE2 3.44Å; W105-F146 AromaticContact CH2-CG 3.59Å; W105-F146 HydrophobicContact CH2-CG 3.59Å; W105-F146 AromaticContact CH2-CZ 3.69Å; W105-F146 HydrophobicContact CH2-CZ 3.69Å; W105-F146 HydrophobicContact CZ2-CD2 4.34Å; W105-F146 HydrophobicContact CZ2-CE2 4.07Å; W105-F146 HydrophobicContact CZ2-CZ 4.31Å; W105-F146 HydrophobicContact CZ3-CB 4.02Å; W105-F146 HydrophobicContact CZ3-CD1 4.19Å; W105-F146 AromaticContact CZ3-CD2 3.87Å; W105-F146 HydrophobicContact CZ3-CD2 3.87Å; W105-F146 HydrophobicContact CZ3-CE2 4.37Å; W105-F146 AromaticContact CZ3-CG 3.78Å; W105-F146 HydrophobicContact CZ3-CG 3.78Å
106L94.6Very high91.9Very high4 Ų441.3 Ų41.32%0.02121%0.21CC..Hα-helixtrans-65.6-43.8-177.6-179.364.8000112.4E102 Y103 A110 F146 A150 L377 V381E102-L106 WeakPolarHBondContact O-CB 3.04Å; E102-L106 PolarHBondContact O-N 3.06Å; Y103-L106 PolarHBondContact O-N 2.86Å; L106-A110 WeakPolarHBondContact O-CB 3.14Å; L106-A110 PolarHBondContact O-N 3.37Å; L106-F146 HydrophobicContact CD1-CB 3.7Å; L106-A150 HydrophobicContact CD2-CB 3.72Å; L106-L377 HydrophobicContact CD2-CD2 3.79Å; L106-V381 HydrophobicContact CD2-CG2 3.53Å
107V94.8Very high92.3Very high8 Ų836.4 Ų36.45%0.04818%0.18CC..Hα-helixtrans-69.2-43.4-179169.20000110.9F27 A28 Y103 A110 V111 L380F27-V107 HydrophobicContact CD1-CG1 3.7Å; F27-V107 HydrophobicContact CE1-CG1 4.37Å; A28-V107 HydrophobicContact CB-CB 3.77Å; A28-V107 HydrophobicContact CB-CG1 3.79Å; Y103-V107 HydrophobicContact CD2-CG2 3.91Å; Y103-V107 HydrophobicContact CE2-CB 4.46Å; Y103-V107 HydrophobicContact CE2-CG2 3.52Å; Y103-V107 WeakPolarHBondContact O-CG2 3.27Å; Y103-V107 PolarHBondContact O-N 3.4Å; Y103-V107 VanDerWaalsContact O-N 3.11Å; V107-A110 PolarHBondContact O-N 3.06Å; V107-V111 WeakPolarHBondContact O-CG2 3.35Å; V107-V111 PolarHBondContact O-N 2.96Å; V107-V111 VanDerWaalsContact O-N 3.11Å; V107-L380 HydrophobicContact CG2-CD1 3.74Å
108D93.5Very high92.5Very high9 Ų941 Ų415%0.04820%0.204CC..Hα-helixtrans-64.4-44.7176.7-68.9-22.2000110.4S26 F27 A28 Q104 A110 V111 Y112S26-D108 WeakPolarHBondContact CB-OD2 3.15Å; S26-D108 VanDerWaalsContact OG-CG 3.24Å; S26-D108 PolarHBondContact OG-OD1 3.4Å; S26-D108 VanDerWaalsContact OG-OD1 3.06Å; S26-D108 PolarHBondContact OG-OD2 3.47Å; F27-D108 PolarHBondContact N-OD1 3.46Å; A28-D108 PolarHBondContact N-OD1 3.42Å; Q104-D108 WeakPolarHBondContact CG-OD2 3.38Å; Q104-D108 VanDerWaalsContact O-CB 3.3Å; Q104-D108 WeakPolarHBondContact O-CB 3.22Å; Q104-D108 PolarHBondContact O-N 3.14Å; D108-A110 VanDerWaalsContact C-N 3.31Å; D108-A110 PolarHBondContact O-N 3.38Å; D108-V111 PolarHBondContact O-N 3.48Å; D108-V111 VanDerWaalsContact O-N 3.1Å; D108-Y112 HydrophobicContact CB-CE2 4.39Å; D108-Y112 WeakPolarHBondContact O-CD2 3.41Å; D108-Y112 PolarHBondContact O-N 3.25Å
109F94.4Very high92.6Very high10 Ų1040.2 Ų40.24%0.04420%0.203CC..Hα-helixtrans-55.8-44.8174.9-178.6-93000112M18 W105 V111 Y112 A113 W139 L142 T143 F146M18-F109 HydrophobicContact CE-CD2 4.21Å; M18-F109 HydrophobicContact SD-CB 4.26Å; M18-F109 HydrophobicContact SD-CD2 3.77Å; W105-F109 WeakPolarHBondContact O-CB 3.27Å; W105-F109 PolarHBondContact O-N 3.41Å; F109-V111 VanDerWaalsContact C-N 3.33Å; F109-V111 PolarHBondContact O-N 3.34Å; F109-Y112 PolarHBondContact O-N 2.91Å; F109-A113 HydrophobicContact CE1-CB 4.39Å; F109-A113 VanDerWaalsContact O-CB 3.3Å; F109-A113 WeakPolarHBondContact O-CB 3.35Å; F109-A113 PolarHBondContact O-N 3.44Å; F109-W139 HydrophobicContact CD2-CE3 4.39Å; F109-W139 AromaticContact CD2-CZ3 3.9Å; F109-W139 HydrophobicContact CD2-CZ3 3.9Å; F109-W139 HydrophobicContact CE1-CE3 4.32Å; F109-W139 AromaticContact CE2-CE3 3.64Å; F109-W139 HydrophobicContact CE2-CE3 3.64Å; F109-W139 HydrophobicContact CE2-CH2 4.24Å; F109-W139 AromaticContact CE2-CZ3 3.39Å; F109-W139 HydrophobicContact CE2-CZ3 3.39Å; F109-W139 HydrophobicContact CZ-CD2 4.44Å; F109-W139 AromaticContact CZ-CE3 3.59Å; F109-W139 HydrophobicContact CZ-CE3 3.59Å; F109-W139 AromaticContact CZ-CZ3 3.88Å; F109-W139 HydrophobicContact CZ-CZ3 3.88Å; F109-L142 HydrophobicContact CE1-CB 4.21Å; F109-L142 HydrophobicContact CZ-CB 3.96Å; F109-L142 HydrophobicContact CZ-CD1 4.47Å; F109-T143 VanDerWaalsContact CE1-OG1 3.28Å; F109-T143 WeakPolarHBondContact CE1-OG1 3.31Å; F109-F146 AromaticContact CD1-CD2 3.78Å; F109-F146 HydrophobicContact CD1-CD2 3.78Å; F109-F146 HydrophobicContact CD1-CE2 4.22Å; F109-F146 HydrophobicContact CD2-CE2 4.36Å; F109-F146 AromaticContact CE1-CD2 3.54Å; F109-F146 HydrophobicContact CE1-CD2 3.54Å; F109-F146 AromaticContact CE1-CE2 3.74Å; F109-F146 HydrophobicContact CE1-CE2 3.74Å; F109-F146 HydrophobicContact CE2-CD2 4.43Å; F109-F146 AromaticContact CE2-CE2 3.91Å; F109-F146 HydrophobicContact CE2-CE2 3.91Å; F109-F146 HydrophobicContact CG-CD2 4.32Å; F109-F146 AromaticContact CZ-CD2 3.92Å; F109-F146 HydrophobicContact CZ-CD2 3.92Å; F109-F146 AromaticContact CZ-CE2 3.58Å; F109-F146 HydrophobicContact CZ-CE2 3.58Å
110A95.8Very high92.6Very high6 Ų639.1 Ų39.15%0.0520%0.199CC..Hα-helixtrans-62.2-38.3177.400000112.5L106 V107 D108 A113 M114 T143 L384 F388L106-A110 WeakPolarHBondContact O-CB 3.14Å; L106-A110 PolarHBondContact O-N 3.37Å; V107-A110 PolarHBondContact O-N 3.06Å; D108-A110 VanDerWaalsContact C-N 3.31Å; D108-A110 PolarHBondContact O-N 3.38Å; A110-A113 PolarHBondContact O-N 3.2Å; A110-M114 WeakPolarHBondContact O-CB 3.47Å; A110-M114 PolarHBondContact O-N 3.31Å; A110-T143 HydrophobicContact CB-CG2 4.04Å; A110-L384 HydrophobicContact CB-CD1 4.02Å; A110-L384 HydrophobicContact CB-CD2 4Å; A110-F388 HydrophobicContact CB-CE2 3.95Å; A110-F388 HydrophobicContact CB-CZ 4.24Å; A110-F388 VanDerWaalsContact O-CZ 3.29Å; A110-F388 WeakPolarHBondContact O-CZ 3.35Å
111V94.7Very high92.6Very high64 Ų6440 Ų4039%0.38820%0.203SC..Hα-helixtrans-65.9-43.6175.9173.50000111.1F27 V107 D108 F109 M114 G115F27-V111 HydrophobicContact CB-CG2 4Å; F27-V111 HydrophobicContact CD1-CG2 3.63Å; F27-V111 HydrophobicContact CE1-CG2 4.22Å; F27-V111 HydrophobicContact CG-CG2 3.8Å; V107-V111 WeakPolarHBondContact O-CG2 3.35Å; V107-V111 PolarHBondContact O-N 2.96Å; V107-V111 VanDerWaalsContact O-N 3.11Å; D108-V111 PolarHBondContact O-N 3.48Å; D108-V111 VanDerWaalsContact O-N 3.1Å; F109-V111 VanDerWaalsContact C-N 3.33Å; F109-V111 PolarHBondContact O-N 3.34Å; V111-M114 PolarHBondContact O-N 2.86Å; V111-G115 PolarHBondContact O-N 3.07Å
112Y92.9Very high92.4Very high52 Ų5237.4 Ų37.420%0.20420%0.195CC..Hα-helixtrans-64.8-42.2174.9-71.8-70.5000111.9I17 M18 D108 F109 M114 G115 V116I17-Y112 HydrophobicContact CG2-CE1 3.83Å; M18-Y112 HydrophobicContact CB-CD2 3.84Å; M18-Y112 HydrophobicContact CB-CE2 3.87Å; M18-Y112 HydrophobicContact CB-CG 4.3Å; M18-Y112 HydrophobicContact CG-CD2 3.69Å; M18-Y112 HydrophobicContact CG-CE2 3.78Å; M18-Y112 HydrophobicContact SD-CD2 4.16Å; D108-Y112 HydrophobicContact CB-CE2 4.39Å; D108-Y112 WeakPolarHBondContact O-CD2 3.41Å; D108-Y112 PolarHBondContact O-N 3.25Å; F109-Y112 PolarHBondContact O-N 2.91Å; Y112-M114 VanDerWaalsContact C-N 3.3Å; Y112-M114 PolarHBondContact O-N 3.41Å; Y112-G115 PolarHBondContact O-N 3.39Å; Y112-G115 VanDerWaalsContact O-N 3.1Å; Y112-V116 WeakPolarHBondContact O-CG2 3.5Å; Y112-V116 PolarHBondContact O-N 2.77Å
113A94.8Very high92.2Very high0 Ų034.2 Ų34.20%018%0.179CC..Hα-helixtrans-58.6-42.1175.400000111.8F109 A110 V116 F117 W139 T143 F388F109-A113 HydrophobicContact CE1-CB 4.39Å; F109-A113 VanDerWaalsContact O-CB 3.3Å; F109-A113 WeakPolarHBondContact O-CB 3.35Å; F109-A113 PolarHBondContact O-N 3.44Å; A110-A113 PolarHBondContact O-N 3.2Å; A113-V116 PolarHBondContact O-N 3.01Å; A113-F117 WeakPolarHBondContact O-CB 3.39Å; A113-F117 PolarHBondContact O-N 3.01Å; A113-W139 HydrophobicContact CB-CB 4.08Å; A113-W139 HydrophobicContact CB-CE3 3.82Å; A113-T143 WeakPolarHBondContact CB-OG1 3.31Å; A113-F388 HydrophobicContact CB-CE1 3.73Å; A113-F388 HydrophobicContact CB-CZ 4.03Å
114M94.8Very high91.7Very high51 Ų5137.1 Ų37.125%0.25119%0.19SC..Hα-helixtrans-62.6-44.4173.7-176.364.769.800111.4A110 V111 Y112 F117 L118 L387 F388 L391A110-M114 WeakPolarHBondContact O-CB 3.47Å; A110-M114 PolarHBondContact O-N 3.31Å; V111-M114 PolarHBondContact O-N 2.86Å; Y112-M114 VanDerWaalsContact C-N 3.3Å; Y112-M114 PolarHBondContact O-N 3.41Å; M114-F117 PolarHBondContact O-N 2.99Å; M114-L118 HydrophobicContact CG-CD1 4.11Å; M114-L118 HydrophobicContact CG-CG 4.43Å; M114-L118 WeakPolarHBondContact O-CB 3.44Å; M114-L118 VanDerWaalsContact O-CG 3.3Å; M114-L118 WeakPolarHBondContact O-CG 3.46Å; M114-L118 PolarHBondContact O-N 3.36Å; M114-L118 HydrophobicContact SD-CD1 4.48Å; M114-L118 HydrophobicContact SD-CG 4.35Å; M114-L387 HydrophobicContact CE-CD1 4.37Å; M114-L387 HydrophobicContact CE-CD2 3.52Å; M114-L387 HydrophobicContact CE-CG 3.98Å; M114-F388 HydrophobicContact CB-CZ 4.27Å; M114-F388 HydrophobicContact CE-CZ 4.18Å; M114-L391 HydrophobicContact CE-CD1 3.77Å; M114-L391 HydrophobicContact SD-CD1 3.88Å
115G93.3Very high91.1Very high39 Ų3940.4 Ų40.440%0.40222%0.216SC..Hα-helixtrans-60.5-46176.500000112.8V111 Y112 F117 L118 F119V111-G115 PolarHBondContact O-N 3.07Å; Y112-G115 PolarHBondContact O-N 3.39Å; Y112-G115 VanDerWaalsContact O-N 3.1Å; G115-F117 VanDerWaalsContact C-N 3.34Å; G115-F117 PolarHBondContact O-N 3.49Å; G115-L118 PolarHBondContact O-N 3.36Å; G115-F119 WeakPolarHBondContact O-CB 3.19Å; G115-F119 PolarHBondContact O-N 3.1Å
116V92.4Very high90.7Very high6 Ų640.5 Ų40.54%0.03623%0.229CC..Hα-helixtrans-62.6-41.9176.2173.50000110.9A14 Y112 A113 F119 T120 W139A14-V116 HydrophobicContact CB-CG2 3.55Å; Y112-V116 WeakPolarHBondContact O-CG2 3.5Å; Y112-V116 PolarHBondContact O-N 2.77Å; A113-V116 PolarHBondContact O-N 3.01Å; V116-F119 PolarHBondContact O-N 3.24Å; V116-T120 WeakPolarHBondContact O-CB 3.47Å; V116-T120 PolarHBondContact O-N 3.48Å; V116-T120 PolarHBondContact O-OG1 3.41Å; V116-W139 HydrophobicContact CB-CD2 4.49Å; V116-W139 HydrophobicContact CB-CG 4.43Å; V116-W139 HydrophobicContact CG1-CG 4.15Å; V116-W139 HydrophobicContact CG2-CD2 4.36Å; V116-W139 HydrophobicContact CG2-CZ2 4.38Å
117F92Very high90Very high4 Ų443.1 Ų43.12%0.01825%0.245CC..Hα-helixtrans-60.9-51.8175.7178.5-89.5000111.7A113 M114 G115 F119 T120 E121 C140 L391 K394 V395 W401A113-F117 WeakPolarHBondContact O-CB 3.39Å; A113-F117 PolarHBondContact O-N 3.01Å; M114-F117 PolarHBondContact O-N 2.99Å; G115-F117 VanDerWaalsContact C-N 3.34Å; G115-F117 PolarHBondContact O-N 3.49Å; F117-F119 VanDerWaalsContact C-N 3.31Å; F117-F119 PolarHBondContact O-N 3.41Å; F117-T120 WeakPolarHBondContact O-CB 3.48Å; F117-T120 PolarHBondContact O-N 3.44Å; F117-T120 VanDerWaalsContact O-N 3.09Å; F117-E121 HydrophobicContact CD1-CG 4.02Å; F117-E121 HydrophobicContact CE1-CG 3.57Å; F117-E121 HydrophobicContact CE2-CG 4.43Å; F117-E121 HydrophobicContact CZ-CG 3.81Å; F117-E121 WeakPolarHBondContact O-CG 3.22Å; F117-E121 PolarHBondContact O-N 3.33Å; F117-C140 WeakPolarHBondContact CD2-SG 3.43Å; F117-L391 HydrophobicContact CD1-CD1 3.97Å; F117-L391 HydrophobicContact CD1-CD2 4.31Å; F117-L391 HydrophobicContact CD2-CB 4.15Å; F117-L391 HydrophobicContact CD2-CD1 4.4Å; F117-L391 HydrophobicContact CE1-CB 4.39Å; F117-L391 HydrophobicContact CE1-CD1 4.16Å; F117-L391 HydrophobicContact CE1-CD2 3.67Å; F117-L391 HydrophobicContact CE1-CG 4.26Å; F117-L391 HydrophobicContact CE2-CB 3.69Å; F117-L391 HydrophobicContact CE2-CD2 4.45Å; F117-L391 HydrophobicContact CE2-CG 4.42Å; F117-L391 HydrophobicContact CG-CD1 4.11Å; F117-L391 HydrophobicContact CZ-CB 3.85Å; F117-L391 HydrophobicContact CZ-CD1 4.43Å; F117-L391 HydrophobicContact CZ-CD2 3.75Å; F117-L391 HydrophobicContact CZ-CG 4.19Å; F117-K394 HydrophobicContact CZ-CD 4.47Å; F117-V395 HydrophobicContact CD2-CG2 4.37Å; F117-V395 HydrophobicContact CE2-CG2 3.43Å; F117-V395 VanDerWaalsContact CE2-CG2 3.43Å; F117-V395 HydrophobicContact CZ-CG2 4.04Å; F117-W401 HydrophobicContact CE1-CZ2 4.33Å; F117-W401 HydrophobicContact CZ-CZ2 4.34Å
118L92.1Very high88.7Confident103 Ų10349.6 Ų49.654%0.53928%0.279SS..Hα-helixtrans-61.4-39.5179.5-69.4174.5000112.1M114 G115 E121 C122M114-L118 HydrophobicContact CG-CD1 4.11Å; M114-L118 HydrophobicContact CG-CG 4.43Å; M114-L118 WeakPolarHBondContact O-CB 3.44Å; M114-L118 VanDerWaalsContact O-CG 3.3Å; M114-L118 WeakPolarHBondContact O-CG 3.46Å; M114-L118 PolarHBondContact O-N 3.36Å; M114-L118 HydrophobicContact SD-CD1 4.48Å; M114-L118 HydrophobicContact SD-CG 4.35Å; G115-L118 PolarHBondContact O-N 3.36Å; L118-E121 PolarHBondContact O-N 3.03Å; L118-C122 WeakPolarHBondContact O-CB 3.38Å; L118-C122 PolarHBondContact O-N 3.2Å
119F90.3Very high87.2Confident83 Ų8349.6 Ų49.636%0.36428%0.281SS..Hα-helixtrans-61.2-46.3173176.2-87.8000111.3V10 G115 V116 F117 E121 C122 Y123V10-F119 HydrophobicContact CB-CD1 4.28Å; V10-F119 HydrophobicContact CB-CE1 4.06Å; V10-F119 HydrophobicContact CG1-CD1 3.71Å; V10-F119 HydrophobicContact CG1-CE1 3.96Å; V10-F119 HydrophobicContact CG1-CG 4.1Å; V10-F119 HydrophobicContact CG2-CD1 4.23Å; V10-F119 HydrophobicContact CG2-CE1 3.58Å; V10-F119 HydrophobicContact CG2-CE2 4.41Å; V10-F119 HydrophobicContact CG2-CZ 3.68Å; G115-F119 WeakPolarHBondContact O-CB 3.19Å; G115-F119 PolarHBondContact O-N 3.1Å; V116-F119 PolarHBondContact O-N 3.24Å; F117-F119 VanDerWaalsContact C-N 3.31Å; F117-F119 PolarHBondContact O-N 3.41Å; F119-E121 VanDerWaalsContact C-N 3.3Å; F119-E121 PolarHBondContact O-N 2.97Å; F119-C122 PolarHBondContact O-N 3.15Å; F119-Y123 WeakPolarHBondContact O-CB 3.47Å; F119-Y123 PolarHBondContact O-N 3.36Å
120T88.2Confident85.5Confident2 Ų253.8 Ų53.81%0.01231%0.311CS..Hα-helixtrans-61.4-40.5180-57.80000111.1V116 F117 Y123 Y124V116-T120 WeakPolarHBondContact O-CB 3.47Å; V116-T120 PolarHBondContact O-N 3.48Å; V116-T120 PolarHBondContact O-OG1 3.41Å; F117-T120 WeakPolarHBondContact O-CB 3.48Å; F117-T120 PolarHBondContact O-N 3.44Å; F117-T120 VanDerWaalsContact O-N 3.09Å; T120-Y123 PolarHBondContact O-N 2.72Å; T120-Y124 HydrophobicContact CG2-CD2 3.76Å; T120-Y124 HydrophobicContact CG2-CE2 3.39Å; T120-Y124 WeakPolarHBondContact O-CD2 3.48Å; T120-Y124 PolarHBondContact O-N 2.8Å
121E87.1Confident83.8Confident28 Ų2863.3 Ų63.313%0.13135%0.351CS..Hα-helixtrans-65.9-42.9175.5-70.4-72.4122.600112.7F117 L118 F119 Y123 Y124 S125 K394 W401F117-E121 HydrophobicContact CD1-CG 4.02Å; F117-E121 HydrophobicContact CE1-CG 3.57Å; F117-E121 HydrophobicContact CE2-CG 4.43Å; F117-E121 HydrophobicContact CZ-CG 3.81Å; F117-E121 WeakPolarHBondContact O-CG 3.22Å; F117-E121 PolarHBondContact O-N 3.33Å; L118-E121 PolarHBondContact O-N 3.03Å; F119-E121 VanDerWaalsContact C-N 3.3Å; F119-E121 PolarHBondContact O-N 2.97Å; E121-Y123 VanDerWaalsContact C-N 3.32Å; E121-Y124 PolarHBondContact O-N 3.2Å; E121-S125 PolarHBondContact O-N 3.23Å; E121-K394 IonicContact OE1-NZ 2.75Å; E121-K394 PolarHBondContact OE1-NZ 3.45Å; E121-K394 VanDerWaalsContact OE2-CE 3.24Å; E121-K394 WeakPolarHBondContact OE2-CE 3.04Å; E121-K394 IonicContact OE2-NZ 3.44Å; E121-K394 PolarHBondContact OE2-NZ 3.27Å; E121-W401 PolarHBondContact OE2-NE1 3.13Å
122C87.1Confident82.6Confident76 Ų7663.4 Ų63.451%0.51435%0.347SS..Hα-helixtrans-65.5-36.7174.9-171.20000111.7L118 F119 S125 V126L118-C122 WeakPolarHBondContact O-CB 3.38Å; L118-C122 PolarHBondContact O-N 3.2Å; F119-C122 PolarHBondContact O-N 3.15Å; C122-S125 PolarHBondContact O-N 3.28Å; C122-S125 PolarHBondContact O-OG 3.49Å; C122-V126 WeakPolarHBondContact O-CG2 3.35Å; C122-V126 PolarHBondContact O-N 2.98Å
123Y85.3Confident81.6Confident33 Ų3364.5 Ų64.513%0.12936%0.36CS..Hα-helixtrans-64.7-46175.6176.9-109.6000111.2I6 Q7 F119 T120 E121 S125 V126 V127 A129I6-Y123 HydrophobicContact CB-CE2 4.48Å; I6-Y123 HydrophobicContact CD1-CE2 4.13Å; I6-Y123 HydrophobicContact CG2-CE2 4.32Å; Q7-Y123 HydrophobicContact CG-CD1 4.21Å; Q7-Y123 HydrophobicContact CG-CE1 4.17Å; F119-Y123 WeakPolarHBondContact O-CB 3.47Å; F119-Y123 PolarHBondContact O-N 3.36Å; T120-Y123 PolarHBondContact O-N 2.72Å; E121-Y123 VanDerWaalsContact C-N 3.32Å; Y123-S125 VanDerWaalsContact C-N 3.32Å; Y123-S125 PolarHBondContact O-N 3.47Å; Y123-V126 PolarHBondContact O-N 3.12Å; Y123-V127 HydrophobicContact CD2-CB 4.39Å; Y123-V127 HydrophobicContact CD2-CG2 4.18Å; Y123-V127 HydrophobicContact CE2-CB 4.04Å; Y123-V127 HydrophobicContact CE2-CG1 4.36Å; Y123-V127 HydrophobicContact CE2-CG2 3.88Å; Y123-V127 PolarHBondContact O-N 3.48Å; Y123-A129 HydrophobicContact CD1-CB 4.34Å; Y123-A129 HydrophobicContact CE1-CB 3.51Å
124Y82.1Confident80.9Confident62 Ų6266.1 Ų66.124%0.24337%0.368CS..Hα-helixtrans-68.3-26.4177.1-74.5-50.8000114.3Q7 T120 E121 V126 A129 N134Q7-Y124 PolarHBondContact NE2-OH 2.93Å; T120-Y124 HydrophobicContact CG2-CD2 3.76Å; T120-Y124 HydrophobicContact CG2-CE2 3.39Å; T120-Y124 WeakPolarHBondContact O-CD2 3.48Å; T120-Y124 PolarHBondContact O-N 2.8Å; E121-Y124 PolarHBondContact O-N 3.2Å; Y124-V126 VanDerWaalsContact C-N 3.28Å; Y124-A129 HydrophobicContact CD1-CB 3.96Å; Y124-A129 HydrophobicContact CE1-CB 3.71Å; Y124-A129 WeakPolarHBondContact CE1-O 3.06Å; Y124-N134 HydrophobicContact CE2-CB 4.37Å; Y124-N134 VanDerWaalsContact CE2-ND2 3.25Å; Y124-N134 WeakPolarHBondContact CE2-ND2 3.31Å
125S80.9Confident80.4Confident94 Ų9464.7 Ų64.766%0.65736%0.362SS*.Hα-helixtrans-74.1-20.917568.50000113.2E121 C122 Y123E121-S125 PolarHBondContact O-N 3.23Å; C122-S125 PolarHBondContact O-N 3.28Å; C122-S125 PolarHBondContact O-OG 3.49Å; Y123-S125 VanDerWaalsContact C-N 3.32Å; Y123-S125 PolarHBondContact O-N 3.47Å
126V83.3Confident80.1Confident117 Ų11762.9 Ų62.971%0.70934%0.342SS*.Hα-helixtrans-102.6-32.9-179.5178.90000112.1C122 Y123 Y124C122-V126 WeakPolarHBondContact O-CG2 3.35Å; C122-V126 PolarHBondContact O-N 2.98Å; Y123-V126 PolarHBondContact O-N 3.12Å; Y124-V126 VanDerWaalsContact C-N 3.28Å
127V80.3Confident79.9Confident59 Ų5962.9 Ų62.936%0.35834%0.343SS..SBendtrans-126.3125-174.6-175.20000109.8Y123 A129Y123-V127 HydrophobicContact CD2-CB 4.39Å; Y123-V127 HydrophobicContact CD2-CG2 4.18Å; Y123-V127 HydrophobicContact CE2-CB 4.04Å; Y123-V127 HydrophobicContact CE2-CG1 4.36Å; Y123-V127 HydrophobicContact CE2-CG2 3.88Å; Y123-V127 PolarHBondContact O-N 3.48Å; V127-A129 HydrophobicContact CG1-CB 4.29Å; V127-A129 PolarHBondContact O-N 3.42Å
128D66.8Low79.7Confident143 Ų14366.3 Ų66.377%0.76536%0.361SS*.  trans-73.778.3171.8-170.3-3.4000110.2S130D128-S130 VanDerWaalsContact C-N 3.31Å; D128-S130 PolarHBondContact O-N 3.17Å; D128-S130 WeakPolarHBondContact OD1-CB 3.31Å; D128-S130 PolarHBondContact OD1-OG 3Å; D128-S130 VanDerWaalsContact OD1-OG 3.11Å
129A62Low79.8Confident10 Ų1062 Ų628%0.08334%0.338CS..  trans-95.538.1-179.400000112.2Y123 Y124 V127 K131 E132Y123-A129 HydrophobicContact CD1-CB 4.34Å; Y123-A129 HydrophobicContact CE1-CB 3.51Å; Y124-A129 HydrophobicContact CD1-CB 3.96Å; Y124-A129 HydrophobicContact CE1-CB 3.71Å; Y124-A129 WeakPolarHBondContact CE1-O 3.06Å; V127-A129 HydrophobicContact CG1-CB 4.29Å; V127-A129 PolarHBondContact O-N 3.42Å; A129-K131 PolarHBondContact O-N 3.48Å; A129-E132 PolarHBondContact O-N 3.46Å
130S59.9Low80Confident97 Ų9758.1 Ų58.168%0.67832%0.32SS*.THydrogen-bonded Turntrans-56.2-11.5-178.848.10000115.5D128D128-S130 VanDerWaalsContact C-N 3.31Å; D128-S130 PolarHBondContact O-N 3.17Å; D128-S130 WeakPolarHBondContact OD1-CB 3.31Å; D128-S130 PolarHBondContact OD1-OG 3Å; D128-S130 VanDerWaalsContact OD1-OG 3.11Å
131K60.1Low80.2Confident207 Ų20760.4 Ų60.490%0.933%0.334SS*.THydrogen-bonded Turntrans-96.2-9.3178.4-62.2-176.3-178178.60114.9A129A129-K131 PolarHBondContact O-N 3.48Å
132E69.7Low80.5Confident65 Ų6562.2 Ų62.230%0.30434%0.344SS..SBendtrans-91.3147.7-178.6-65-172.2165.300112.6A129 N134A129-E132 PolarHBondContact O-N 3.46Å; E132-N134 PolarHBondContact O-N 3Å
133V71.1Confident81Confident76 Ų7658.6 Ų58.646%0.46132%0.32SS..  trans-67.7122.8172.7177.30000108.9Q7 I135 I138Q7-V133 PolarHBondContact OE1-O 2.94Å; V133-I135 WeakPolarHBondContact O-CG1 3.44Å; V133-I135 PolarHBondContact O-N 2.96Å; V133-I138 HydrophobicContact CG1-CD1 4.21Å
134N80.3Confident81.5Confident33 Ų3357.3 Ų57.318%0.17632%0.316CS..  trans-67.997.6178.9-170.4-42.2000111.1Y124 E132 G136 A137 V395Y124-N134 HydrophobicContact CE2-CB 4.37Å; Y124-N134 VanDerWaalsContact CE2-ND2 3.25Å; Y124-N134 WeakPolarHBondContact CE2-ND2 3.31Å; E132-N134 PolarHBondContact O-N 3Å; N134-G136 VanDerWaalsContact C-N 3.31Å; N134-G136 PolarHBondContact O-N 3.29Å; N134-G136 WeakPolarHBondContact OD1-CA 3.15Å; N134-G136 PolarHBondContact OD1-N 2.64Å; N134-G136 VanDerWaalsContact OD1-N 3.14Å; N134-A137 HydrophobicContact CB-CB 4.31Å; N134-A137 WeakPolarHBondContact O-CB 3.3Å; N134-A137 PolarHBondContact O-N 3.3Å; N134-A137 PolarHBondContact OD1-N 2.74Å; N134-V395 HydrophobicContact CB-CG1 4.09Å; N134-V395 VanDerWaalsContact CG-CG1 3.42Å; N134-V395 WeakPolarHBondContact ND2-CG1 3.18Å
135I85.3Confident82.2Confident22 Ų2258.1 Ų58.111%0.11333%0.327CS..Hα-helixtrans-70.7-30.9-177.8-57.3-172000111.2Q7 L8 V133 A137 I138 W139Q7-I135 VanDerWaalsContact C-CD1 3.45Å; Q7-I135 HydrophobicContact CB-CB 4.25Å; Q7-I135 HydrophobicContact CB-CD1 3.68Å; Q7-I135 HydrophobicContact CB-CG1 3.92Å; Q7-I135 VanDerWaalsContact OE1-N 3.17Å; L8-I135 HydrophobicContact CB-CD1 3.63Å; L8-I135 HydrophobicContact CD1-CD1 4.47Å; L8-I135 HydrophobicContact CG-CD1 4.2Å; L8-I135 VanDerWaalsContact N-CD1 3.27Å; V133-I135 WeakPolarHBondContact O-CG1 3.44Å; V133-I135 PolarHBondContact O-N 2.96Å; I135-A137 PolarHBondContact O-N 2.92Å; I135-I138 WeakPolarHBondContact O-CB 3.48Å; I135-I138 PolarHBondContact O-N 2.98Å; I135-W139 PolarHBondContact O-N 3.47Å; I135-W139 VanDerWaalsContact O-N 3.17Å
136G86.6Confident83Confident0 Ų056 Ų560%031%0.306CS..Hα-helixtrans-54.1-40.7172.700000112.6N134 I138 W139 C140N134-G136 VanDerWaalsContact C-N 3.31Å; N134-G136 PolarHBondContact O-N 3.29Å; N134-G136 WeakPolarHBondContact OD1-CA 3.15Å; N134-G136 PolarHBondContact OD1-N 2.64Å; N134-G136 VanDerWaalsContact OD1-N 3.14Å; G136-I138 VanDerWaalsContact C-N 3.33Å; G136-I138 PolarHBondContact O-N 3.4Å; G136-W139 PolarHBondContact O-N 2.95Å; G136-C140 PolarHBondContact O-N 3Å; G136-C140 PolarHBondContact O-SG 3.37Å
137A87.4Confident83.6Confident6 Ų650.4 Ų50.45%0.0527%0.272CS..Hα-helixtrans-58.4-44174.700000112.2N134 I135 W139 C140 V141 V395 L396N134-A137 HydrophobicContact CB-CB 4.31Å; N134-A137 WeakPolarHBondContact O-CB 3.3Å; N134-A137 PolarHBondContact O-N 3.3Å; N134-A137 PolarHBondContact OD1-N 2.74Å; I135-A137 PolarHBondContact O-N 2.92Å; A137-W139 VanDerWaalsContact C-N 3.35Å; A137-W139 PolarHBondContact O-N 3.32Å; A137-C140 WeakPolarHBondContact O-CB 3.39Å; A137-C140 PolarHBondContact O-N 3.05Å; A137-C140 VanDerWaalsContact O-N 3.16Å; A137-V141 WeakPolarHBondContact O-CG2 3.39Å; A137-V141 PolarHBondContact O-N 3.38Å; A137-V395 HydrophobicContact CB-CG1 3.66Å; A137-L396 HydrophobicContact CB-CD2 4.16Å; A137-L396 HydrophobicContact CB-CG 4.45Å
138I88.7Confident84.4Confident76 Ų7649.7 Ų49.739%0.3927%0.266SS..Hα-helixtrans-61.5-45.3-179.5-60.2174.3000110V133 I135 G136 C140 V141 L142V133-I138 HydrophobicContact CG1-CD1 4.21Å; I135-I138 WeakPolarHBondContact O-CB 3.48Å; I135-I138 PolarHBondContact O-N 2.98Å; G136-I138 VanDerWaalsContact C-N 3.33Å; G136-I138 PolarHBondContact O-N 3.4Å; I138-C140 VanDerWaalsContact C-N 3.31Å; I138-C140 PolarHBondContact O-N 3.28Å; I138-V141 PolarHBondContact O-N 3Å; I138-L142 HydrophobicContact CG2-CD1 3.97Å; I138-L142 HydrophobicContact CG2-CG 4.29Å; I138-L142 WeakPolarHBondContact O-CB 3.42Å; I138-L142 VanDerWaalsContact O-CG 3.3Å; I138-L142 WeakPolarHBondContact O-CG 3.25Å; I138-L142 PolarHBondContact O-N 2.96Å
139W93.3Very high85.8Confident14 Ų1449.2 Ų49.25%0.05326%0.257CS..Hα-helixtrans-61.9-37.9175.8-78.678.2000112.3S11 A14 F109 A113 V116 I135 G136 A137 T143S11-W139 PolarHBondContact OG-NE1 3.49Å; A14-W139 HydrophobicContact CB-CH2 4.29Å; A14-W139 HydrophobicContact CB-CZ2 4.28Å; F109-W139 HydrophobicContact CD2-CE3 4.39Å; F109-W139 AromaticContact CD2-CZ3 3.9Å; F109-W139 HydrophobicContact CD2-CZ3 3.9Å; F109-W139 HydrophobicContact CE1-CE3 4.32Å; F109-W139 AromaticContact CE2-CE3 3.64Å; F109-W139 HydrophobicContact CE2-CE3 3.64Å; F109-W139 HydrophobicContact CE2-CH2 4.24Å; F109-W139 AromaticContact CE2-CZ3 3.39Å; F109-W139 HydrophobicContact CE2-CZ3 3.39Å; F109-W139 HydrophobicContact CZ-CD2 4.44Å; F109-W139 AromaticContact CZ-CE3 3.59Å; F109-W139 HydrophobicContact CZ-CE3 3.59Å; F109-W139 AromaticContact CZ-CZ3 3.88Å; F109-W139 HydrophobicContact CZ-CZ3 3.88Å; A113-W139 HydrophobicContact CB-CB 4.08Å; A113-W139 HydrophobicContact CB-CE3 3.82Å; V116-W139 HydrophobicContact CB-CD2 4.49Å; V116-W139 HydrophobicContact CB-CG 4.43Å; V116-W139 HydrophobicContact CG1-CG 4.15Å; V116-W139 HydrophobicContact CG2-CD2 4.36Å; V116-W139 HydrophobicContact CG2-CZ2 4.38Å; I135-W139 PolarHBondContact O-N 3.47Å; I135-W139 VanDerWaalsContact O-N 3.17Å; G136-W139 PolarHBondContact O-N 2.95Å; A137-W139 VanDerWaalsContact C-N 3.35Å; A137-W139 PolarHBondContact O-N 3.32Å; W139-T143 WeakPolarHBondContact O-CB 3.48Å; W139-T143 PolarHBondContact O-N 3.11Å; W139-T143 PolarHBondContact O-OG1 3.33Å
140C94.2Very high87.4Confident0 Ų049.6 Ų49.60%026%0.26CS..Hα-helixtrans-62.8-49173.8-63.10000112.1F117 G136 A137 I138 L142 T143 V144 F388 A392F117-C140 WeakPolarHBondContact CD2-SG 3.43Å; G136-C140 PolarHBondContact O-N 3Å; G136-C140 PolarHBondContact O-SG 3.37Å; A137-C140 WeakPolarHBondContact O-CB 3.39Å; A137-C140 PolarHBondContact O-N 3.05Å; A137-C140 VanDerWaalsContact O-N 3.16Å; I138-C140 VanDerWaalsContact C-N 3.31Å; I138-C140 PolarHBondContact O-N 3.28Å; C140-L142 PolarHBondContact O-N 3.01Å; C140-T143 WeakPolarHBondContact O-CB 3.19Å; C140-T143 PolarHBondContact O-N 2.72Å; C140-V144 PolarHBondContact O-N 2.72Å; C140-F388 HydrophobicContact CB-CB 4.42Å; C140-F388 HydrophobicContact CB-CD1 4.02Å; C140-A392 HydrophobicContact CB-CB 4.02Å
141V92.9Very high89Confident50 Ų5045.1 Ų45.130%0.30323%0.229SC..Hα-helixtrans-62.3-43.6178.7178.40000111.2A137 I138 T143 V144 V145 A392 F469A137-V141 WeakPolarHBondContact O-CG2 3.39Å; A137-V141 PolarHBondContact O-N 3.38Å; I138-V141 PolarHBondContact O-N 3Å; V141-T143 VanDerWaalsContact C-N 3.3Å; V141-T143 PolarHBondContact O-N 2.87Å; V141-V144 WeakPolarHBondContact O-CB 3.43Å; V141-V144 PolarHBondContact O-N 3.48Å; V141-V145 HydrophobicContact CG1-CG2 4.48Å; V141-V145 WeakPolarHBondContact O-CG2 3.3Å; V141-V145 PolarHBondContact O-N 3Å; V141-A392 HydrophobicContact CG2-CB 4.47Å; V141-F469 HydrophobicContact CG2-CE1 4.4Å; V141-F469 HydrophobicContact CG2-CE2 4.26Å; V141-F469 HydrophobicContact CG2-CZ 3.61Å
142L94.3Very high90.7Very high66 Ų6639.2 Ų39.235%0.34620%0.204SC..Hα-helixtrans-59.2-41174.9-74.4174.4000111.8F109 I138 C140 V144 V145 F146F109-L142 HydrophobicContact CE1-CB 4.21Å; F109-L142 HydrophobicContact CZ-CB 3.96Å; F109-L142 HydrophobicContact CZ-CD1 4.47Å; I138-L142 HydrophobicContact CG2-CD1 3.97Å; I138-L142 HydrophobicContact CG2-CG 4.29Å; I138-L142 WeakPolarHBondContact O-CB 3.42Å; I138-L142 VanDerWaalsContact O-CG 3.3Å; I138-L142 WeakPolarHBondContact O-CG 3.25Å; I138-L142 PolarHBondContact O-N 2.96Å; C140-L142 PolarHBondContact O-N 3.01Å; L142-V144 VanDerWaalsContact C-N 3.33Å; L142-V144 PolarHBondContact O-N 3.35Å; L142-V145 PolarHBondContact O-N 3.34Å; L142-F146 HydrophobicContact CB-CD2 4.45Å; L142-F146 HydrophobicContact CB-CE2 4.08Å; L142-F146 HydrophobicContact CD2-CZ 4.28Å; L142-F146 WeakPolarHBondContact O-CB 3.32Å; L142-F146 VanDerWaalsContact O-CD2 3.24Å; L142-F146 WeakPolarHBondContact O-CD2 3.44Å; L142-F146 VanDerWaalsContact O-CG 3.23Å; L142-F146 WeakPolarHBondContact O-CG 3.26Å; L142-F146 PolarHBondContact O-N 3.21Å
143T96.5Very high91.8Very high1 Ų138.1 Ų38.11%0.00620%0.202CC..Hα-helixtrans-63.3-40.5177.6-52.70000111.6F109 A110 A113 W139 C140 V141 F146 G147 F388F109-T143 VanDerWaalsContact CE1-OG1 3.28Å; F109-T143 WeakPolarHBondContact CE1-OG1 3.31Å; A110-T143 HydrophobicContact CB-CG2 4.04Å; A113-T143 WeakPolarHBondContact CB-OG1 3.31Å; W139-T143 WeakPolarHBondContact O-CB 3.48Å; W139-T143 PolarHBondContact O-N 3.11Å; W139-T143 PolarHBondContact O-OG1 3.33Å; C140-T143 WeakPolarHBondContact O-CB 3.19Å; C140-T143 PolarHBondContact O-N 2.72Å; V141-T143 VanDerWaalsContact C-N 3.3Å; V141-T143 PolarHBondContact O-N 2.87Å; T143-F146 PolarHBondContact O-N 3.48Å; T143-G147 PolarHBondContact O-N 3.24Å; T143-F388 HydrophobicContact CG2-CB 4.42Å; T143-F388 HydrophobicContact CG2-CD1 4.24Å; T143-F388 HydrophobicContact CG2-CD2 3.35Å; T143-F388 HydrophobicContact CG2-CE1 4.38Å; T143-F388 HydrophobicContact CG2-CE2 3.57Å; T143-F388 HydrophobicContact CG2-CG 3.73Å; T143-F388 HydrophobicContact CG2-CZ 4.08Å
144V96.7Very high92.8Very high6 Ų634.9 Ų34.94%0.03618%0.182CC..Hα-helixtrans-62.2-46.7174.3172.50000111C140 V141 L142 G147 L148 I385 F388 S389 L472C140-V144 PolarHBondContact O-N 2.72Å; V141-V144 WeakPolarHBondContact O-CB 3.43Å; V141-V144 PolarHBondContact O-N 3.48Å; L142-V144 VanDerWaalsContact C-N 3.33Å; L142-V144 PolarHBondContact O-N 3.35Å; V144-G147 PolarHBondContact O-N 3.44Å; V144-L148 HydrophobicContact CG1-CD1 4.3Å; V144-L148 WeakPolarHBondContact O-CG 3.34Å; V144-L148 PolarHBondContact O-N 2.86Å; V144-I385 HydrophobicContact CG1-CG2 4.31Å; V144-F388 HydrophobicContact CG2-CB 3.85Å; V144-S389 WeakPolarHBondContact CG2-OG 3.4Å; V144-L472 HydrophobicContact CG1-CD2 3.89Å
145V96.4Very high93.3Very high78 Ų7833.8 Ų33.847%0.47318%0.176SC..Hα-helixtrans-62-45.5178.5172.10000111.3V141 L142 G147 L148 K149V141-V145 HydrophobicContact CG1-CG2 4.48Å; V141-V145 WeakPolarHBondContact O-CG2 3.3Å; V141-V145 PolarHBondContact O-N 3Å; L142-V145 PolarHBondContact O-N 3.34Å; V145-G147 VanDerWaalsContact C-N 3.32Å; V145-G147 PolarHBondContact O-N 2.81Å; V145-L148 PolarHBondContact O-N 2.83Å; V145-K149 WeakPolarHBondContact O-CB 3.37Å; V145-K149 PolarHBondContact O-N 3.34Å
146F96.6Very high93.5Very high49 Ų4935.2 Ų35.222%0.21519%0.188CC..Hα-helixtrans-66.2-33.9176.9-64.1-31.8000112.5W105 L106 F109 L142 T143 K149 A150W105-F146 HydrophobicContact CH2-CB 4.34Å; W105-F146 AromaticContact CH2-CD1 3.81Å; W105-F146 HydrophobicContact CH2-CD1 3.81Å; W105-F146 AromaticContact CH2-CD2 3.38Å; W105-F146 HydrophobicContact CH2-CD2 3.38Å; W105-F146 AromaticContact CH2-CE1 3.87Å; W105-F146 HydrophobicContact CH2-CE1 3.87Å; W105-F146 AromaticContact CH2-CE2 3.44Å; W105-F146 HydrophobicContact CH2-CE2 3.44Å; W105-F146 VanDerWaalsContact CH2-CE2 3.44Å; W105-F146 AromaticContact CH2-CG 3.59Å; W105-F146 HydrophobicContact CH2-CG 3.59Å; W105-F146 AromaticContact CH2-CZ 3.69Å; W105-F146 HydrophobicContact CH2-CZ 3.69Å; W105-F146 HydrophobicContact CZ2-CD2 4.34Å; W105-F146 HydrophobicContact CZ2-CE2 4.07Å; W105-F146 HydrophobicContact CZ2-CZ 4.31Å; W105-F146 HydrophobicContact CZ3-CB 4.02Å; W105-F146 HydrophobicContact CZ3-CD1 4.19Å; W105-F146 AromaticContact CZ3-CD2 3.87Å; W105-F146 HydrophobicContact CZ3-CD2 3.87Å; W105-F146 HydrophobicContact CZ3-CE2 4.37Å; W105-F146 AromaticContact CZ3-CG 3.78Å; W105-F146 HydrophobicContact CZ3-CG 3.78Å; L106-F146 HydrophobicContact CD1-CB 3.7Å; F109-F146 AromaticContact CD1-CD2 3.78Å; F109-F146 HydrophobicContact CD1-CD2 3.78Å; F109-F146 HydrophobicContact CD1-CE2 4.22Å; F109-F146 HydrophobicContact CD2-CE2 4.36Å; F109-F146 AromaticContact CE1-CD2 3.54Å; F109-F146 HydrophobicContact CE1-CD2 3.54Å; F109-F146 AromaticContact CE1-CE2 3.74Å; F109-F146 HydrophobicContact CE1-CE2 3.74Å; F109-F146 HydrophobicContact CE2-CD2 4.43Å; F109-F146 AromaticContact CE2-CE2 3.91Å; F109-F146 HydrophobicContact CE2-CE2 3.91Å; F109-F146 HydrophobicContact CG-CD2 4.32Å; F109-F146 AromaticContact CZ-CD2 3.92Å; F109-F146 HydrophobicContact CZ-CD2 3.92Å; F109-F146 AromaticContact CZ-CE2 3.58Å; F109-F146 HydrophobicContact CZ-CE2 3.58Å; L142-F146 HydrophobicContact CB-CD2 4.45Å; L142-F146 HydrophobicContact CB-CE2 4.08Å; L142-F146 HydrophobicContact CD2-CZ 4.28Å; L142-F146 WeakPolarHBondContact O-CB 3.32Å; L142-F146 VanDerWaalsContact O-CD2 3.24Å; L142-F146 WeakPolarHBondContact O-CD2 3.44Å; L142-F146 VanDerWaalsContact O-CG 3.23Å; L142-F146 WeakPolarHBondContact O-CG 3.26Å; L142-F146 PolarHBondContact O-N 3.21Å; T143-F146 PolarHBondContact O-N 3.48Å; F146-K149 PolarHBondContact O-N 3.46Å; F146-A150 WeakPolarHBondContact O-CB 3.39Å; F146-A150 PolarHBondContact O-N 3.11Å
147G96.9Very high93.5Very high1 Ų139 Ų391%0.0121%0.206CC..Hα-helixtrans-61.2-50170.100000112.3T143 V144 V145 K149 A150 L151 V381T143-G147 PolarHBondContact O-N 3.24Å; V144-G147 PolarHBondContact O-N 3.44Å; V145-G147 VanDerWaalsContact C-N 3.32Å; V145-G147 PolarHBondContact O-N 2.81Å; G147-K149 VanDerWaalsContact C-N 3.34Å; G147-K149 PolarHBondContact O-N 3.35Å; G147-A150 PolarHBondContact O-N 3.03Å; G147-L151 PolarHBondContact O-N 3.4Å; G147-V381 VanDerWaalsContact O-CG1 3.25Å; G147-V381 WeakPolarHBondContact O-CG1 3.37Å
148L96.5Very high93.2Very high43 Ų4339.6 Ų39.623%0.22521%0.207CC..Hα-helixtrans-61.6-41.2176.7-70.5172.5000112.1V144 V145 L151 H152 I239 L242 I385V144-L148 HydrophobicContact CG1-CD1 4.3Å; V144-L148 WeakPolarHBondContact O-CG 3.34Å; V144-L148 PolarHBondContact O-N 2.86Å; V145-L148 PolarHBondContact O-N 2.83Å; L148-L151 PolarHBondContact O-N 3.34Å; L148-H152 WeakPolarHBondContact O-CB 3.36Å; L148-H152 PolarHBondContact O-N 2.88Å; L148-I239 HydrophobicContact CD2-CG1 4.24Å; L148-L242 HydrophobicContact CD2-CD1 4.25Å; L148-I385 HydrophobicContact CD2-CD1 3.94Å; L148-I385 HydrophobicContact CG-CD1 4.21Å
149K96.1Very high92.8Very high133 Ų13339.3 Ų39.358%0.57820%0.203SC*.Hα-helixtrans-58.2-47.4172.9-179.6-159.9165.679.40111V145 F146 G147 L151 H152 T153V145-K149 WeakPolarHBondContact O-CB 3.37Å; V145-K149 PolarHBondContact O-N 3.34Å; F146-K149 PolarHBondContact O-N 3.46Å; G147-K149 VanDerWaalsContact C-N 3.34Å; G147-K149 PolarHBondContact O-N 3.35Å; K149-L151 PolarHBondContact O-N 2.84Å; K149-H152 WeakPolarHBondContact O-CB 3.48Å; K149-H152 PolarHBondContact O-N 3.07Å; K149-H152 VanDerWaalsContact O-N 3.17Å; K149-T153 PolarHBondContact O-N 2.87Å; K149-T153 PolarHBondContact O-OG1 2.98Å
150A95.1Very high92Very high18 Ų1843 Ų4315%0.14923%0.23CC..Hα-helixtrans-61.6-43.6179.800000111.7L106 F146 G147 H152 T153 L154 V381L106-A150 HydrophobicContact CD2-CB 3.72Å; F146-A150 WeakPolarHBondContact O-CB 3.39Å; F146-A150 PolarHBondContact O-N 3.11Å; G147-A150 PolarHBondContact O-N 3.03Å; A150-H152 VanDerWaalsContact C-N 3.33Å; A150-H152 PolarHBondContact O-N 2.53Å; A150-T153 PolarHBondContact O-N 3.43Å; A150-L154 WeakPolarHBondContact O-CG 3.34Å; A150-L154 PolarHBondContact O-N 3Å; A150-V381 HydrophobicContact CB-CG2 4.4Å
151L95.3Very high91.1Very high4 Ų444.7 Ų44.72%0.02124%0.241CC..Hα-helixtrans-62.8-39.9173.8-69.2175.8000112.1G147 L148 K149 L154 M155 L242 L243 P246 V381 I385G147-L151 PolarHBondContact O-N 3.4Å; L148-L151 PolarHBondContact O-N 3.34Å; K149-L151 PolarHBondContact O-N 2.84Å; L151-L154 PolarHBondContact O-N 3.16Å; L151-M155 VanDerWaalsContact O-CB 3.26Å; L151-M155 WeakPolarHBondContact O-CB 3.4Å; L151-M155 PolarHBondContact O-N 3.45Å; L151-L242 HydrophobicContact CB-CB 4.07Å; L151-L242 HydrophobicContact CB-CD1 4.2Å; L151-L242 HydrophobicContact CB-CD2 4.38Å; L151-L242 HydrophobicContact CB-CG 4.46Å; L151-L242 HydrophobicContact CD1-CB 4.39Å; L151-L243 HydrophobicContact CD1-CD2 3.77Å; L151-L243 HydrophobicContact CD1-CG 4.41Å; L151-P246 HydrophobicContact CD2-CG 3.89Å; L151-V381 HydrophobicContact CD1-CG1 3.9Å; L151-V381 HydrophobicContact CD2-CB 4.18Å; L151-V381 HydrophobicContact CD2-CG1 4.06Å; L151-V381 HydrophobicContact CG-CB 4.28Å; L151-V381 HydrophobicContact CG-CG1 3.61Å; L151-I385 HydrophobicContact CD1-CD1 3.82Å
152H94.8Very high89.7Confident83 Ų8351.7 Ų51.738%0.38427%0.271SS..Hα-helixtrans-62.1-44.9175.2175.872.3000112.2L148 K149 A150 L154 M155 S156 Y238 L242L148-H152 WeakPolarHBondContact O-CB 3.36Å; L148-H152 PolarHBondContact O-N 2.88Å; K149-H152 WeakPolarHBondContact O-CB 3.48Å; K149-H152 PolarHBondContact O-N 3.07Å; K149-H152 VanDerWaalsContact O-N 3.17Å; A150-H152 VanDerWaalsContact C-N 3.33Å; A150-H152 PolarHBondContact O-N 2.53Å; H152-L154 VanDerWaalsContact C-N 3.32Å; H152-L154 PolarHBondContact O-N 2.89Å; H152-M155 WeakPolarHBondContact O-CB 3.13Å; H152-M155 PolarHBondContact O-N 2.91Å; H152-S156 WeakPolarHBondContact O-CB 3.37Å; H152-S156 PolarHBondContact O-N 3.28Å; H152-Y238 WeakPolarHBondContact CB-OH 3.36Å; H152-Y238 VanDerWaalsContact CG-OH 3.23Å; H152-Y238 AromaticContact ND1-CZ 3.83Å; H152-Y238 PolarHBondContact ND1-OH 3.41Å; H152-L242 HydrophobicContact CB-CD2 4.18Å
153T93.5Very high88.7Confident42 Ų4255.5 Ų55.526%0.25829%0.287SS..Hα-helixtrans-60.5-42.9176.6-61.40000111.3F99 K149 A150 H157F99-T153 HydrophobicContact CD1-CG2 4.46Å; F99-T153 HydrophobicContact CE1-CG2 3.64Å; F99-T153 HydrophobicContact CZ-CG2 4.29Å; K149-T153 PolarHBondContact O-N 2.87Å; K149-T153 PolarHBondContact O-OG1 2.98Å; A150-T153 PolarHBondContact O-N 3.43Å; T153-H157 PolarHBondContact O-CD2 3.23Å; T153-H157 PolarHBondContact O-N 3.44Å
154L91.3Very high87.5Confident7 Ų757.8 Ų57.84%0.03731%0.311CS..Hα-helixtrans-63.2-45.1174.4-68.4179.3000111.6F99 A150 L151 H152 H157 Y158 V374 L377 Q378F99-L154 HydrophobicContact CD2-CD2 4.2Å; F99-L154 HydrophobicContact CE2-CD2 4.41Å; F99-L154 HydrophobicContact CG-CD2 4.42Å; A150-L154 WeakPolarHBondContact O-CG 3.34Å; A150-L154 PolarHBondContact O-N 3Å; L151-L154 PolarHBondContact O-N 3.16Å; H152-L154 VanDerWaalsContact C-N 3.32Å; H152-L154 PolarHBondContact O-N 2.89Å; L154-H157 PolarHBondContact O-N 3.47Å; L154-Y158 HydrophobicContact CB-CE2 4.47Å; L154-Y158 WeakPolarHBondContact O-CD2 3.38Å; L154-Y158 WeakPolarHBondContact O-CE2 3.46Å; L154-Y158 PolarHBondContact O-N 2.92Å; L154-V374 HydrophobicContact CD2-CB 4.48Å; L154-V374 HydrophobicContact CD2-CG1 3.84Å; L154-V374 HydrophobicContact CD2-CG2 4.24Å; L154-L377 HydrophobicContact CD1-CB 3.95Å; L154-L377 HydrophobicContact CD1-CD1 4.48Å; L154-Q378 HydrophobicContact CD1-CG 3.91Å
155M90.4Very high86.9Confident10 Ų1059.6 Ų59.65%0.04933%0.331CS..Hα-helixtrans-58.1-49.2177.5-178.257.175.200112.2L151 H152 H157 Y158 F159 C170 S241 L242L151-M155 VanDerWaalsContact O-CB 3.26Å; L151-M155 WeakPolarHBondContact O-CB 3.4Å; L151-M155 PolarHBondContact O-N 3.45Å; H152-M155 WeakPolarHBondContact O-CB 3.13Å; H152-M155 PolarHBondContact O-N 2.91Å; M155-H157 PolarHBondContact O-N 2.96Å; M155-Y158 WeakPolarHBondContact O-CB 3.41Å; M155-Y158 PolarHBondContact O-N 2.92Å; M155-F159 HydrophobicContact CG-CD2 3.76Å; M155-F159 HydrophobicContact CG-CE2 3.8Å; M155-F159 WeakPolarHBondContact O-CD2 3.39Å; M155-F159 PolarHBondContact O-N 3.05Å; M155-F159 HydrophobicContact SD-CD2 3.66Å; M155-F159 HydrophobicContact SD-CE2 3.47Å; M155-F159 WeakPolarHBondContact SD-CE2 3.35Å; M155-C170 HydrophobicContact CE-CB 4.19Å; M155-C170 VanDerWaalsContact CE-SG 3.57Å; M155-C170 HydrophobicContact SD-CB 3.79Å; M155-C170 PolarHBondContact SD-SG 3.39Å; M155-S241 WeakPolarHBondContact CE-O 3.36Å; M155-L242 HydrophobicContact CB-CD2 3.72Å; M155-L242 VanDerWaalsContact CE-CA 3.45Å; M155-L242 HydrophobicContact CE-CD2 4.49Å; M155-L242 HydrophobicContact CG-CD2 4.06Å
156S89.8Confident86.4Confident52 Ų5258.6 Ų58.636%0.36432%0.321SS..Hα-helixtrans-55-37.7179.2176.30000111.7H152 Y158 F159 C160H152-S156 WeakPolarHBondContact O-CB 3.37Å; H152-S156 PolarHBondContact O-N 3.28Å; S156-Y158 PolarHBondContact O-N 3.09Å; S156-F159 CarbonylContact O-C 3.54Å; S156-F159 WeakPolarHBondContact O-CB 3.3Å; S156-F159 PolarHBondContact O-N 3.08Å; S156-C160 PolarHBondContact O-N 3.42Å; S156-C160 PolarHBondContact O-SG 3.28Å; S156-C160 VanDerWaalsContact O-SG 3.39Å
157H86.3Confident86Confident81 Ų8160.7 Ų60.738%0.37533%0.328SS..Hα-helixtrans-65.7-37.1175.3-91.9-66.5000114.5R98 F99 T153 L154 M155 F159 C160 S161R98-H157 PolarHBondContact NH2-CE1 3.05Å; R98-H157 PolarHBondContact NH2-ND1 3.35Å; F99-H157 AromaticContact CE2-CD2 3.93Å; F99-H157 AromaticContact CZ-CD2 3.27Å; F99-H157 WeakPolarHBondContact CZ-CD2 3.5Å; F99-H157 AromaticContact CZ-NE2 3.42Å; F99-H157 WeakPolarHBondContact CZ-NE2 3.48Å; T153-H157 PolarHBondContact O-CD2 3.23Å; T153-H157 PolarHBondContact O-N 3.44Å; L154-H157 PolarHBondContact O-N 3.47Å; M155-H157 PolarHBondContact O-N 2.96Å; H157-F159 VanDerWaalsContact C-N 3.31Å; H157-C160 PolarHBondContact O-N 2.84Å; H157-S161 PolarHBondContact O-N 2.91Å
158Y81.1Confident85.7Confident18 Ų1863.9 Ų63.97%0.07135%0.349CS..Hα-helixtrans-67.3-36.1172.6-62.4-61.6000111.2L154 M155 S156 C160 S161 F245 Q378L154-Y158 HydrophobicContact CB-CE2 4.47Å; L154-Y158 WeakPolarHBondContact O-CD2 3.38Å; L154-Y158 WeakPolarHBondContact O-CE2 3.46Å; L154-Y158 PolarHBondContact O-N 2.92Å; M155-Y158 WeakPolarHBondContact O-CB 3.41Å; M155-Y158 PolarHBondContact O-N 2.92Å; S156-Y158 PolarHBondContact O-N 3.09Å; Y158-C160 VanDerWaalsContact C-N 3.29Å; Y158-C160 PolarHBondContact O-N 3.18Å; Y158-S161 VanDerWaalsContact O-CB 3.23Å; Y158-S161 WeakPolarHBondContact O-CB 3.4Å; Y158-S161 PolarHBondContact O-N 3.44Å; Y158-F245 HydrophobicContact CD1-CD2 4.29Å; Y158-F245 AromaticContact CD1-CE2 3.97Å; Y158-F245 HydrophobicContact CD1-CE2 3.97Å; Y158-F245 HydrophobicContact CD1-CZ 4.33Å; Y158-F245 AromaticContact CD2-CD2 3.4Å; Y158-F245 HydrophobicContact CD2-CD2 3.4Å; Y158-F245 AromaticContact CD2-CE2 3.67Å; Y158-F245 HydrophobicContact CD2-CE2 3.67Å; Y158-F245 HydrophobicContact CD2-CG 4.23Å; Y158-F245 HydrophobicContact CE2-CB 4.27Å; Y158-F245 AromaticContact CE2-CD2 3.76Å; Y158-F245 HydrophobicContact CE2-CD2 3.76Å; Y158-F245 HydrophobicContact CE2-CE2 4.36Å; Y158-F245 HydrophobicContact CE2-CG 4.16Å; Y158-F245 AromaticContact CG-CD2 3.71Å; Y158-F245 HydrophobicContact CG-CD2 3.71Å; Y158-F245 AromaticContact CG-CE2 3.46Å; Y158-F245 HydrophobicContact CG-CE2 3.46Å; Y158-F245 VanDerWaalsContact CG-CE2 3.46Å; Y158-F245 HydrophobicContact CG-CZ 4.23Å; Y158-Q378 PolarHBondContact OH-NE2 3.4Å
159F80Confident85.4Confident69 Ų6964.1 Ų64.130%0.30335%0.352SS..Hα-helixtrans-68.2-24.2173.4-89.3-89.9000114.2M155 S156 H157 R167 C170 L171M155-F159 HydrophobicContact CG-CD2 3.76Å; M155-F159 HydrophobicContact CG-CE2 3.8Å; M155-F159 WeakPolarHBondContact O-CD2 3.39Å; M155-F159 PolarHBondContact O-N 3.05Å; M155-F159 HydrophobicContact SD-CD2 3.66Å; M155-F159 HydrophobicContact SD-CE2 3.47Å; M155-F159 WeakPolarHBondContact SD-CE2 3.35Å; S156-F159 CarbonylContact O-C 3.54Å; S156-F159 WeakPolarHBondContact O-CB 3.3Å; S156-F159 PolarHBondContact O-N 3.08Å; H157-F159 VanDerWaalsContact C-N 3.31Å; F159-R167 HydrophobicContact CD1-CB 4.22Å; F159-R167 HydrophobicContact CD1-CG 4.49Å; F159-R167 HydrophobicContact CE1-CB 4.29Å; F159-R167 WeakPolarHBondContact O-CD 3.34Å; F159-R167 PolarHBondContact O-NE 3.19Å; F159-R167 PolarHBondContact O-NH2 3.15Å; F159-C170 HydrophobicContact CE2-CB 3.51Å; F159-C170 HydrophobicContact CZ-CB 3.76Å; F159-L171 HydrophobicContact CE1-CD2 4.2Å; F159-L171 HydrophobicContact CE1-CG 4.15Å; F159-L171 HydrophobicContact CZ-CD2 4.08Å; F159-L171 HydrophobicContact CZ-CG 4.09Å
160C77.6Confident85.2Confident92 Ų9257.8 Ų57.862%0.62233%0.325SS*.Hα-helixtrans-89-8.5174.3-68.20000113.6S156 H157 Y158 R167S156-C160 PolarHBondContact O-N 3.42Å; S156-C160 PolarHBondContact O-SG 3.28Å; S156-C160 VanDerWaalsContact O-SG 3.39Å; H157-C160 PolarHBondContact O-N 2.84Å; Y158-C160 VanDerWaalsContact C-N 3.29Å; Y158-C160 PolarHBondContact O-N 3.18Å; C160-R167 PolarHBondContact O-NH2 3.43Å
161S74.8Confident85.1Confident35 Ų3562.2 Ų62.225%0.24535%0.346CS..SBendtrans-62.6136.3179.1-168.30000111.4H157 Y158 E163 E166 R167H157-S161 PolarHBondContact O-N 2.91Å; Y158-S161 VanDerWaalsContact O-CB 3.23Å; Y158-S161 WeakPolarHBondContact O-CB 3.4Å; Y158-S161 PolarHBondContact O-N 3.44Å; S161-E163 PolarHBondContact O-N 3.05Å; S161-E166 WeakPolarHBondContact CB-OE2 3.46Å; S161-E166 PolarHBondContact OG-OE2 3.06Å; S161-R167 PolarHBondContact O-NE 3.49Å; S161-R167 PolarHBondContact O-NH2 3.36Å
162E64.7Low85Confident198 Ų19864.8 Ų64.893%0.92537%0.368SS*.SBendtrans-61.6-26.7179.7-106.2177.5151.600112.5G164E162-G164 PolarHBondContact O-N 2.95Å
163E72.8Confident85Confident145 Ų14561.6 Ų61.668%0.67835%0.353SS*.  trans-79.2107.1178.3-65.8178-171.300110.1S161 G165 E166S161-E163 PolarHBondContact O-N 3.05Å; E163-G165 PolarHBondContact O-N 3.44Å; E163-E166 PolarHBondContact O-N 2.91Å
164G71.6Confident85.1Confident49 Ų4960.1 Ų60.151%0.50535%0.346SS..Hα-helixtrans-61-15.6-177.200000115.5E162 R167 S168E162-G164 PolarHBondContact O-N 2.95Å; G164-R167 PolarHBondContact O-N 3.39Å; G164-S168 PolarHBondContact O-N 3.26Å
165G84.1Confident85.3Confident45 Ų4566 Ų6646%0.46437%0.371SS..Hα-helixtrans-65.7-35.8-179.800000114.1E163 R167 S168 V169E163-G165 PolarHBondContact O-N 3.44Å; G165-R167 VanDerWaalsContact C-N 3.31Å; G165-R167 PolarHBondContact O-N 3.07Å; G165-S168 PolarHBondContact O-N 3.23Å; G165-S168 PolarHBondContact O-OG 3.22Å; G165-V169 WeakPolarHBondContact O-CG2 3.33Å; G165-V169 PolarHBondContact O-N 3.34Å
166E85.3Confident85.6Confident56 Ų5668 Ų6826%0.26238%0.382SS..Hα-helixtrans-66.5-38.2178.9-68.9-173.8147.700111.3S161 E163 C170 F245S161-E166 WeakPolarHBondContact CB-OE2 3.46Å; S161-E166 PolarHBondContact OG-OE2 3.06Å; E163-E166 PolarHBondContact O-N 2.91Å; E166-C170 PolarHBondContact O-N 2.93Å; E166-C170 PolarHBondContact O-SG 3.24Å; E166-F245 HydrophobicContact CB-CE2 4.39Å; E166-F245 HydrophobicContact CB-CZ 3.73Å; E166-F245 HydrophobicContact CG-CZ 4.05Å
167R88.4Confident85.9Confident94 Ų9465.6 Ų65.636%0.35537%0.365SS..Hα-helixtrans-68.2-42.9-179.9-42.1-172.2-175.6-174.5-12111.5F159 C160 S161 G164 G165 C170 L171F159-R167 HydrophobicContact CD1-CB 4.22Å; F159-R167 HydrophobicContact CD1-CG 4.49Å; F159-R167 HydrophobicContact CE1-CB 4.29Å; F159-R167 WeakPolarHBondContact O-CD 3.34Å; F159-R167 PolarHBondContact O-NE 3.19Å; F159-R167 PolarHBondContact O-NH2 3.15Å; C160-R167 PolarHBondContact O-NH2 3.43Å; S161-R167 PolarHBondContact O-NE 3.49Å; S161-R167 PolarHBondContact O-NH2 3.36Å; G164-R167 PolarHBondContact O-N 3.39Å; G165-R167 VanDerWaalsContact C-N 3.31Å; G165-R167 PolarHBondContact O-N 3.07Å; R167-C170 PolarHBondContact O-N 3.35Å; R167-L171 WeakPolarHBondContact O-CG 3.38Å; R167-L171 PolarHBondContact O-N 3.31Å
168S89.6Confident86.4Confident67 Ų6764.2 Ų64.247%0.46936%0.36SS..Hα-helixtrans-66.3-37.9-179.464.40000111.9G164 G165 C170 L171 A172G164-S168 PolarHBondContact O-N 3.26Å; G165-S168 PolarHBondContact O-N 3.23Å; G165-S168 PolarHBondContact O-OG 3.22Å; S168-C170 PolarHBondContact O-N 3.02Å; S168-L171 PolarHBondContact O-N 3.41Å; S168-A172 VanDerWaalsContact O-CB 3.32Å; S168-A172 WeakPolarHBondContact O-CB 3.4Å; S168-A172 PolarHBondContact O-N 2.81Å
169V90.8Very high87.1Confident48 Ų4867.8 Ų67.829%0.29138%0.38SS..Hα-helixtrans-59.9-46.2174.2172.20000110.8G165 L171 A172 F173 L248G165-V169 WeakPolarHBondContact O-CG2 3.33Å; G165-V169 PolarHBondContact O-N 3.34Å; V169-L171 PolarHBondContact O-N 3.15Å; V169-A172 PolarHBondContact O-N 3.15Å; V169-F173 HydrophobicContact CG1-CD2 3.84Å; V169-F173 HydrophobicContact CG1-CE2 3.98Å; V169-F173 WeakPolarHBondContact O-CD2 3.44Å; V169-F173 PolarHBondContact O-N 3.38Å; V169-L248 HydrophobicContact CG1-CD1 3.91Å
170C91.7Very high87.8Confident0 Ų066.4 Ų66.40%038%0.377CS..Hα-helixtrans-63.4-42.1178.2-68.40000113.4M155 F159 E166 R167 S168 F173 G174 F245M155-C170 HydrophobicContact CE-CB 4.19Å; M155-C170 VanDerWaalsContact CE-SG 3.57Å; M155-C170 HydrophobicContact SD-CB 3.79Å; M155-C170 PolarHBondContact SD-SG 3.39Å; F159-C170 HydrophobicContact CE2-CB 3.51Å; F159-C170 HydrophobicContact CZ-CB 3.76Å; E166-C170 PolarHBondContact O-N 2.93Å; E166-C170 PolarHBondContact O-SG 3.24Å; R167-C170 PolarHBondContact O-N 3.35Å; S168-C170 PolarHBondContact O-N 3.02Å; C170-F173 PolarHBondContact O-N 2.92Å; C170-G174 PolarHBondContact O-N 2.97Å; C170-F245 VanDerWaalsContact SG-CD2 3.55Å; C170-F245 WeakPolarHBondContact SG-CE2 3.5Å
171L92.8Very high88.6Confident111 Ų11162 Ų6258%0.58135%0.348SS*.Hα-helixtrans-64.8-40.9175.9-69.8174.6000111.6F159 R167 S168 V169 G174 F175F159-L171 HydrophobicContact CE1-CD2 4.2Å; F159-L171 HydrophobicContact CE1-CG 4.15Å; F159-L171 HydrophobicContact CZ-CD2 4.08Å; F159-L171 HydrophobicContact CZ-CG 4.09Å; R167-L171 WeakPolarHBondContact O-CG 3.38Å; R167-L171 PolarHBondContact O-N 3.31Å; S168-L171 PolarHBondContact O-N 3.41Å; V169-L171 PolarHBondContact O-N 3.15Å; L171-G174 PolarHBondContact O-N 3.44Å; L171-F175 WeakPolarHBondContact O-CB 3.29Å; L171-F175 PolarHBondContact O-N 3.4Å
172A93.9Very high89.5Confident59 Ų5963.7 Ų63.749%0.48835%0.353SS..Hα-helixtrans-62.4-45.2176.600000111.7S168 V169 F175 L176S168-A172 VanDerWaalsContact O-CB 3.32Å; S168-A172 WeakPolarHBondContact O-CB 3.4Å; S168-A172 PolarHBondContact O-N 2.81Å; V169-A172 PolarHBondContact O-N 3.15Å; A172-F175 PolarHBondContact O-N 3.48Å; A172-L176 WeakPolarHBondContact O-CB 3.41Å; A172-L176 PolarHBondContact O-N 2.9Å
173F94.2Very high90.8Very high16 Ų1660.3 Ų60.37%0.0734%0.34CS..Hα-helixtrans-65.4-37.1174.4-90.2-79.4000112.7V169 C170 S177 A244 L248 I482 F486V169-F173 HydrophobicContact CG1-CD2 3.84Å; V169-F173 HydrophobicContact CG1-CE2 3.98Å; V169-F173 WeakPolarHBondContact O-CD2 3.44Å; V169-F173 PolarHBondContact O-N 3.38Å; C170-F173 PolarHBondContact O-N 2.92Å; F173-S177 WeakPolarHBondContact O-CB 3.37Å; F173-S177 PolarHBondContact O-N 2.88Å; F173-S177 PolarHBondContact O-OG 2.7Å; F173-A244 HydrophobicContact CB-CB 3.63Å; F173-A244 HydrophobicContact CD1-CB 4.29Å; F173-A244 HydrophobicContact CD2-CB 3.61Å; F173-A244 HydrophobicContact CE2-CB 4.34Å; F173-A244 HydrophobicContact CG-CB 3.57Å; F173-L248 HydrophobicContact CE2-CD1 4.23Å; F173-L248 HydrophobicContact CE2-CD2 4.39Å; F173-L248 HydrophobicContact CE2-CG 4.43Å; F173-L248 HydrophobicContact CZ-CD2 4.29Å; F173-I482 HydrophobicContact CE1-CG2 4.29Å; F173-F486 HydrophobicContact CE1-CB 4.39Å; F173-F486 HydrophobicContact CE1-CD2 4.11Å; F173-F486 HydrophobicContact CE1-CG 4.41Å; F173-F486 HydrophobicContact CZ-CB 3.76Å; F173-F486 HydrophobicContact CZ-CD2 4.16Å; F173-F486 HydrophobicContact CZ-CG 4Å
174G95.4Very high91.7Very high11 Ų1154.1 Ų54.111%0.11331%0.312CS..Hα-helixtrans-61.3-47.6173.600000111.9C170 L171 S177 L178 A237C170-G174 PolarHBondContact O-N 2.97Å; L171-G174 PolarHBondContact O-N 3.44Å; G174-S177 PolarHBondContact O-N 3.23Å; G174-L178 PolarHBondContact O-N 2.9Å; G174-A237 WeakPolarHBondContact CA-O 3.46Å; G174-A237 WeakPolarHBondContact O-CB 3.48Å
175F96.4Very high92.6Very high130 Ų13053 Ų5357%0.5729%0.294SS*.Hα-helixtrans-64.4-45176.7-179-102.7000112.6L171 A172 S177 L178 L179L171-F175 WeakPolarHBondContact O-CB 3.29Å; L171-F175 PolarHBondContact O-N 3.4Å; A172-F175 PolarHBondContact O-N 3.48Å; F175-S177 VanDerWaalsContact C-N 3.29Å; F175-S177 PolarHBondContact O-N 2.9Å; F175-L178 WeakPolarHBondContact O-CB 3.41Å; F175-L178 PolarHBondContact O-N 3.49Å; F175-L179 HydrophobicContact CD1-CD1 4.17Å; F175-L179 HydrophobicContact CE1-CD1 3.57Å; F175-L179 HydrophobicContact CE1-CG 4.14Å; F175-L179 HydrophobicContact CZ-CD1 3.96Å; F175-L179 HydrophobicContact CZ-CD2 4.22Å; F175-L179 HydrophobicContact CZ-CG 4.19Å; F175-L179 PolarHBondContact O-N 2.92Å
176L96Very high92.9Very high51 Ų5156.7 Ų56.727%0.26731%0.308SS..Hα-helixtrans-58.2-45.1174.4177.964.8000111A172 L178 L179 V180 I482 F486A172-L176 WeakPolarHBondContact O-CB 3.41Å; A172-L176 PolarHBondContact O-N 2.9Å; L176-L178 VanDerWaalsContact C-N 3.3Å; L176-L178 PolarHBondContact O-N 3.31Å; L176-L179 PolarHBondContact O-N 3.29Å; L176-V180 WeakPolarHBondContact O-CG2 3.39Å; L176-V180 PolarHBondContact O-N 3.36Å; L176-I482 HydrophobicContact CD2-CG2 3.72Å; L176-F486 HydrophobicContact CD2-CD2 4.45Å; L176-F486 HydrophobicContact CD2-CE2 3.67Å; L176-F486 HydrophobicContact CD2-CZ 4.23Å
177S96.2Very high93Very high2 Ų256.9 Ų56.91%0.01431%0.312CS..Hα-helixtrans-64.9-34.7178.5-62.10000111.8F173 G174 F175 A181 G240 W475F173-S177 WeakPolarHBondContact O-CB 3.37Å; F173-S177 PolarHBondContact O-N 2.88Å; F173-S177 PolarHBondContact O-OG 2.7Å; G174-S177 PolarHBondContact O-N 3.23Å; F175-S177 VanDerWaalsContact C-N 3.29Å; F175-S177 PolarHBondContact O-N 2.9Å; S177-A181 WeakPolarHBondContact O-CB 3.34Å; S177-A181 PolarHBondContact O-N 2.94Å; S177-G240 WeakPolarHBondContact OG-CA 3.32Å; S177-W475 WeakPolarHBondContact O-CH2 3.43Å; S177-W475 WeakPolarHBondContact O-CZ2 3.46Å
178L96.7Very high92.9Very high52 Ų5259.7 Ų59.727%0.27232%0.323SS..Hα-helixtrans-61.1-49172.1-173.870.6000111.1G174 F175 L176 V180 A181 M182 A233 A237G174-L178 PolarHBondContact O-N 2.9Å; F175-L178 WeakPolarHBondContact O-CB 3.41Å; F175-L178 PolarHBondContact O-N 3.49Å; L176-L178 VanDerWaalsContact C-N 3.3Å; L176-L178 PolarHBondContact O-N 3.31Å; L178-V180 PolarHBondContact O-N 3.47Å; L178-A181 PolarHBondContact O-N 3.4Å; L178-M182 HydrophobicContact CD1-CE 3.99Å; L178-M182 HydrophobicContact CG-CE 4.43Å; L178-M182 VanDerWaalsContact O-CG 3.31Å; L178-M182 WeakPolarHBondContact O-CG 3.48Å; L178-M182 PolarHBondContact O-N 2.93Å; L178-A233 HydrophobicContact CD1-CB 4.15Å; L178-A237 HydrophobicContact CB-CB 3.71Å; L178-A237 HydrophobicContact CD1-CB 3.87Å; L178-A237 HydrophobicContact CG-CB 4.38Å
179L95.7Very high92.6Very high94 Ų9459.4 Ų59.449%0.49231%0.314SS..Hα-helixtrans-61.6-44.7179.4-65.9179.9000111.9F175 L176 A181 M182 L183F175-L179 HydrophobicContact CD1-CD1 4.17Å; F175-L179 HydrophobicContact CE1-CD1 3.57Å; F175-L179 HydrophobicContact CE1-CG 4.14Å; F175-L179 HydrophobicContact CZ-CD1 3.96Å; F175-L179 HydrophobicContact CZ-CD2 4.22Å; F175-L179 HydrophobicContact CZ-CG 4.19Å; F175-L179 PolarHBondContact O-N 2.92Å; L176-L179 PolarHBondContact O-N 3.29Å; L179-A181 VanDerWaalsContact C-N 3.34Å; L179-M182 PolarHBondContact O-N 3.42Å; L179-L183 PolarHBondContact O-N 3.1Å; L179-L183 VanDerWaalsContact O-N 3.1Å
180V95.6Very high92.2Very high40 Ų4061.8 Ų61.824%0.24233%0.326CS..Hα-helixtrans-64.2-40.8176.3175.40000110.7L176 L178 M182 L183 V184 W475 I482L176-V180 WeakPolarHBondContact O-CG2 3.39Å; L176-V180 PolarHBondContact O-N 3.36Å; L178-V180 PolarHBondContact O-N 3.47Å; V180-M182 PolarHBondContact O-N 2.87Å; V180-L183 WeakPolarHBondContact O-CB 3.38Å; V180-L183 PolarHBondContact O-N 3.1Å; V180-V184 HydrophobicContact CG1-CG2 4.19Å; V180-V184 VanDerWaalsContact O-CG2 3.29Å; V180-V184 WeakPolarHBondContact O-CG2 3.3Å; V180-V184 PolarHBondContact O-N 2.89Å; V180-W475 HydrophobicContact CB-CH2 4.15Å; V180-W475 HydrophobicContact CG1-CH2 3.95Å; V180-W475 HydrophobicContact CG1-CZ3 4.05Å; V180-I482 HydrophobicContact CG1-CD1 4.27Å; V180-I482 HydrophobicContact CG2-CD1 4.31Å
181A95.1Very high92Very high0 Ų067.6 Ų67.60%035%0.348CS..Hα-helixtrans-62.9-43.5177.700000111.5S177 L178 L179 L183 V184 L185 A233 C236 W475S177-A181 WeakPolarHBondContact O-CB 3.34Å; S177-A181 PolarHBondContact O-N 2.94Å; L178-A181 PolarHBondContact O-N 3.4Å; L179-A181 VanDerWaalsContact C-N 3.34Å; A181-L183 VanDerWaalsContact C-N 3.3Å; A181-L183 PolarHBondContact O-N 3.44Å; A181-V184 PolarHBondContact O-N 3.31Å; A181-L185 WeakPolarHBondContact O-CB 3.49Å; A181-L185 VanDerWaalsContact O-CG 3.22Å; A181-L185 WeakPolarHBondContact O-CG 3.34Å; A181-L185 PolarHBondContact O-N 2.99Å; A181-A233 HydrophobicContact CB-CB 4.32Å; A181-C236 HydrophobicContact CB-CB 3.45Å; A181-C236 VanDerWaalsContact CB-CB 3.45Å; A181-W475 HydrophobicContact CB-CH2 3.59Å; A181-W475 HydrophobicContact CB-CZ2 3.98Å; A181-W475 HydrophobicContact CB-CZ3 4.12Å
182M92.4Very high91.8Very high70 Ų7063.3 Ų63.335%0.34533%0.326SS..Hα-helixtrans-60-40.9175.6-68.9-60.8-178.900111.7L178 L179 V180 V186 L230 A233L178-M182 HydrophobicContact CD1-CE 3.99Å; L178-M182 HydrophobicContact CG-CE 4.43Å; L178-M182 VanDerWaalsContact O-CG 3.31Å; L178-M182 WeakPolarHBondContact O-CG 3.48Å; L178-M182 PolarHBondContact O-N 2.93Å; L179-M182 PolarHBondContact O-N 3.42Å; V180-M182 PolarHBondContact O-N 2.87Å; M182-V186 VanDerWaalsContact O-CG2 3.23Å; M182-V186 WeakPolarHBondContact O-CG2 3.36Å; M182-V186 PolarHBondContact O-N 3.04Å; M182-L230 HydrophobicContact CE-CD1 3.54Å; M182-A233 HydrophobicContact CE-CB 3.5Å; M182-A233 HydrophobicContact SD-CB 3.71Å
183L92.2Very high91.5Very high127 Ų12762.8 Ų62.867%0.66531%0.313SS*.Hα-helixtrans-63.7-50.9175.7-172.877.5000111L179 V180 A181 L185 V186 V187L179-L183 PolarHBondContact O-N 3.1Å; L179-L183 VanDerWaalsContact O-N 3.1Å; V180-L183 WeakPolarHBondContact O-CB 3.38Å; V180-L183 PolarHBondContact O-N 3.1Å; A181-L183 VanDerWaalsContact C-N 3.3Å; A181-L183 PolarHBondContact O-N 3.44Å; L183-L185 PolarHBondContact O-N 3.26Å; L183-V186 PolarHBondContact O-N 3.48Å; L183-V187 WeakPolarHBondContact O-CG2 3.36Å; L183-V187 PolarHBondContact O-N 3.37Å
184V92.4Very high91.2Very high14 Ų1462.7 Ų62.79%0.08531%0.313CS..Hα-helixtrans-64-41.5-176.2171.40000111.9V180 A181 V186 V187 L192 F194 F471 W474 W475V180-V184 HydrophobicContact CG1-CG2 4.19Å; V180-V184 VanDerWaalsContact O-CG2 3.29Å; V180-V184 WeakPolarHBondContact O-CG2 3.3Å; V180-V184 PolarHBondContact O-N 2.89Å; A181-V184 PolarHBondContact O-N 3.31Å; V184-V186 PolarHBondContact O-N 3.3Å; V184-V187 WeakPolarHBondContact O-CB 3.28Å; V184-V187 PolarHBondContact O-N 3.25Å; V184-V187 VanDerWaalsContact O-N 3.08Å; V184-L192 HydrophobicContact CG1-CD1 4.08Å; V184-F194 HydrophobicContact CG1-CE2 3.84Å; V184-F194 HydrophobicContact CG1-CZ 4.26Å; V184-F471 HydrophobicContact CG1-CE2 4.14Å; V184-W474 HydrophobicContact CB-CH2 4.47Å; V184-W474 HydrophobicContact CB-CZ3 4.42Å; V184-W474 HydrophobicContact CG1-CH2 3.89Å; V184-W474 HydrophobicContact CG1-CZ3 3.69Å; V184-W474 HydrophobicContact CG2-CH2 3.69Å; V184-W474 HydrophobicContact CG2-CZ3 3.98Å; V184-W475 HydrophobicContact CG2-CZ3 4.5Å
185L90.1Very high90.7Very high25 Ų2563.1 Ų63.113%0.13132%0.317CS..Hα-helixtrans-70.1-12.4179.9-68.4172.9000113.6A181 L183 L196 L232 A233 F471A181-L185 WeakPolarHBondContact O-CB 3.49Å; A181-L185 VanDerWaalsContact O-CG 3.22Å; A181-L185 WeakPolarHBondContact O-CG 3.34Å; A181-L185 PolarHBondContact O-N 2.99Å; L183-L185 PolarHBondContact O-N 3.26Å; L185-L196 HydrophobicContact CD2-CD1 4.11Å; L185-L232 HydrophobicContact CD1-CB 4.38Å; L185-L232 HydrophobicContact CD1-CD2 4.39Å; L185-L232 HydrophobicContact CD1-CG 4.27Å; L185-L232 HydrophobicContact CD2-CD2 3.63Å; L185-L232 HydrophobicContact CD2-CG 4.31Å; L185-A233 HydrophobicContact CD1-CB 3.91Å; L185-F471 HydrophobicContact CD2-CE2 4.08Å; L185-F471 HydrophobicContact CD2-CZ 3.94Å
186V89.3Confident90.2Very high124 Ų12457.6 Ų57.675%0.75229%0.293SS*.Hα-helixtrans-91.1-20172.5171.70000111.8M182 L183 V184 R188M182-V186 VanDerWaalsContact O-CG2 3.23Å; M182-V186 WeakPolarHBondContact O-CG2 3.36Å; M182-V186 PolarHBondContact O-N 3.04Å; L183-V186 PolarHBondContact O-N 3.48Å; V184-V186 PolarHBondContact O-N 3.3Å; V186-R188 PolarHBondContact O-N 3.35Å
187V88.4Confident89.8Confident59 Ų5959.1 Ų59.136%0.35830%0.299SS..SBendtrans-65135.6179.41780000110.4L183 V184 Y191 L192L183-V187 WeakPolarHBondContact O-CG2 3.36Å; L183-V187 PolarHBondContact O-N 3.37Å; V184-V187 WeakPolarHBondContact O-CB 3.28Å; V184-V187 PolarHBondContact O-N 3.25Å; V184-V187 VanDerWaalsContact O-N 3.08Å; V187-Y191 HydrophobicContact CG1-CD2 4.47Å; V187-L192 HydrophobicContact CB-CD1 4Å; V187-L192 HydrophobicContact CG1-CB 4.37Å; V187-L192 HydrophobicContact CG1-CD1 3.8Å; V187-L192 HydrophobicContact CG1-CG 3.97Å; V187-L192 HydrophobicContact CG2-CD1 4.33Å
188R85.3Confident89.3Confident153 Ų15361.3 Ų61.358%0.57731%0.313SS*.  trans-67.2146.6176.9-62.8-173.9-67.7-176.30.7111.4V186 D190 Y191 L192V186-R188 PolarHBondContact O-N 3.35Å; R188-D190 PolarHBondContact O-N 2.82Å; R188-D190 VanDerWaalsContact O-N 3.1Å; R188-Y191 HydrophobicContact CB-CD2 4.35Å; R188-Y191 PolarHBondContact O-N 3.09Å; R188-L192 PolarHBondContact O-N 3.3Å
189E83.4Confident88.8Confident62 Ų6258.8 Ų58.829%0.2930%0.3SS..THydrogen-bonded Turntrans-62.7-18.5177.8-58.3-155.4143.300113.9Y191 L192 G195 L196 E197 P198E189-Y191 PolarHBondContact O-N 3.32Å; E189-L192 WeakPolarHBondContact CA-O 3.16Å; E189-L192 CarbonylContact O-C 3.58Å; E189-G195 WeakPolarHBondContact OE1-CA 3.32Å; E189-G195 PolarHBondContact OE1-N 3.31Å; E189-L196 PolarHBondContact OE1-N 2.8Å; E189-E197 HydrophobicContact CG-CB 4.12Å; E189-E197 WeakPolarHBondContact OE1-CB 3.36Å; E189-E197 PolarHBondContact OE1-N 2.97Å; E189-P198 WeakPolarHBondContact OE1-CD 3.27Å; E189-P198 WeakPolarHBondContact OE2-CD 3.27Å
190D82.1Confident88.4Confident98 Ų9854.8 Ų54.852%0.52428%0.279SS..THydrogen-bonded Turntrans-60.7-24.9172.4-61.7-40.2000112.9R188 K287R188-D190 PolarHBondContact O-N 2.82Å; R188-D190 VanDerWaalsContact O-N 3.1Å; D190-K287 WeakPolarHBondContact O-CD 3.37Å
191Y87.5Confident88Confident122 Ų12255 Ų5548%0.47828%0.282SS..THydrogen-bonded Turntrans-101.8-42.4176.1-62.6-79.9000112.4V187 R188 E189 V286 K287 P288V187-Y191 HydrophobicContact CG1-CD2 4.47Å; R188-Y191 HydrophobicContact CB-CD2 4.35Å; R188-Y191 PolarHBondContact O-N 3.09Å; E189-Y191 PolarHBondContact O-N 3.32Å; Y191-V286 WeakPolarHBondContact O-CA 3.43Å; Y191-K287 PolarHBondContact O-N 3.36Å; Y191-P288 HydrophobicContact CD1-CG 4.45Å
192L88.6Confident87.6Confident21 Ų2156.1 Ų56.111%0.1129%0.29CS..BIsolated β-bridgetrans-118.1107.1-178.4-69175.5000110.6V184 V187 R188 E189 F194 V286 W474V184-L192 HydrophobicContact CG1-CD1 4.08Å; V187-L192 HydrophobicContact CB-CD1 4Å; V187-L192 HydrophobicContact CG1-CB 4.37Å; V187-L192 HydrophobicContact CG1-CD1 3.8Å; V187-L192 HydrophobicContact CG1-CG 3.97Å; V187-L192 HydrophobicContact CG2-CD1 4.33Å; R188-L192 PolarHBondContact O-N 3.3Å; E189-L192 WeakPolarHBondContact CA-O 3.16Å; E189-L192 CarbonylContact O-C 3.58Å; L192-F194 VanDerWaalsContact C-N 3.29Å; L192-F194 HydrophobicContact CB-CD2 3.97Å; L192-F194 HydrophobicContact CB-CE2 3.51Å; L192-F194 HydrophobicContact CB-CZ 3.81Å; L192-F194 HydrophobicContact CD1-CE2 3.68Å; L192-F194 HydrophobicContact CD1-CZ 3.85Å; L192-F194 HydrophobicContact CD2-CZ 4.14Å; L192-F194 HydrophobicContact CG-CE2 4.11Å; L192-F194 HydrophobicContact CG-CZ 4.15Å; L192-F194 PolarHBondContact O-N 2.88Å; L192-V286 HydrophobicContact CD2-CG2 3.92Å; L192-W474 HydrophobicContact CD2-CZ2 4.44Å
193E87.8Confident87.3Confident48 Ų4853.7 Ų53.722%0.22428%0.278CS..  trans-86.465.4-171-164.4-172.8-148.400111.8W285 K287 R291E193-W285 PolarHBondContact N-O 3.38Å; E193-W285 VanDerWaalsContact O-CD1 3.3Å; E193-K287 HydrophobicContact CB-CB 4.47Å; E193-R291 VanDerWaalsContact CD-NE 3.25Å; E193-R291 IonicContact OE1-CZ 2.72Å; E193-R291 IonicContact OE1-NE 3.51Å; E193-R291 PolarHBondContact OE1-NE 3.27Å; E193-R291 IonicContact OE1-NH2 2.76Å; E193-R291 PolarHBondContact OE1-NH2 3.02Å; E193-R291 IonicContact OE2-CZ 2.65Å; E193-R291 IonicContact OE2-NE 2.77Å; E193-R291 PolarHBondContact OE2-NE 3.26Å; E193-R291 IonicContact OE2-NH2 3.85Å; E193-R291 PolarHBondContact OE2-NH2 3.37Å
194F87.8Confident86.9Confident14 Ų1448.3 Ų48.36%0.06125%0.249CC..  trans-81.4-35.3176.4-56.3-50.5000112.8V184 L192 L196 W285 G467 F471 W474V184-F194 HydrophobicContact CG1-CE2 3.84Å; V184-F194 HydrophobicContact CG1-CZ 4.26Å; L192-F194 VanDerWaalsContact C-N 3.29Å; L192-F194 HydrophobicContact CB-CD2 3.97Å; L192-F194 HydrophobicContact CB-CE2 3.51Å; L192-F194 HydrophobicContact CB-CZ 3.81Å; L192-F194 HydrophobicContact CD1-CE2 3.68Å; L192-F194 HydrophobicContact CD1-CZ 3.85Å; L192-F194 HydrophobicContact CD2-CZ 4.14Å; L192-F194 HydrophobicContact CG-CE2 4.11Å; L192-F194 HydrophobicContact CG-CZ 4.15Å; L192-F194 PolarHBondContact O-N 2.88Å; F194-L196 HydrophobicContact CB-CB 4.46Å; F194-L196 HydrophobicContact CB-CD1 4.1Å; F194-L196 HydrophobicContact CB-CG 3.87Å; F194-L196 HydrophobicContact CD2-CD1 4.18Å; F194-L196 HydrophobicContact CG-CD1 4.43Å; F194-W285 AromaticContact CD1-CD1 3.61Å; F194-W285 HydrophobicContact CD1-CG 4.29Å; F194-W285 HydrophobicContact CE1-CB 4.08Å; F194-W285 AromaticContact CE1-CD1 3.96Å; F194-W285 HydrophobicContact CE1-CG 4.19Å; F194-G467 WeakPolarHBondContact O-CA 3.47Å; F194-F471 HydrophobicContact CD1-CD2 4.4Å; F194-F471 HydrophobicContact CD2-CD2 4.03Å; F194-F471 HydrophobicContact CE2-CD2 4.1Å; F194-F471 HydrophobicContact CE2-CE2 4.42Å; F194-F471 HydrophobicContact CG-CD2 4.18Å; F194-F471 HydrophobicContact CZ-CD2 4.36Å; F194-W474 HydrophobicContact CD1-CB 4.45Å; F194-W474 HydrophobicContact CD1-CG 4.49Å; F194-W474 HydrophobicContact CE1-CB 3.77Å; F194-W474 AromaticContact CE1-CD1 3.78Å; F194-W474 AromaticContact CE1-CD2 3.55Å; F194-W474 HydrophobicContact CE1-CD2 3.55Å; F194-W474 AromaticContact CE1-CE2 3.99Å; F194-W474 HydrophobicContact CE1-CE3 4.06Å; F194-W474 AromaticContact CE1-CG 3.42Å; F194-W474 HydrophobicContact CE1-CG 3.42Å; F194-W474 VanDerWaalsContact CE1-CG 3.42Å; F194-W474 AromaticContact CZ-CD2 3.51Å; F194-W474 HydrophobicContact CZ-CD2 3.51Å; F194-W474 AromaticContact CZ-CE2 3.74Å; F194-W474 AromaticContact CZ-CE3 3.7Å; F194-W474 HydrophobicContact CZ-CE3 3.7Å; F194-W474 AromaticContact CZ-CG 3.92Å; F194-W474 HydrophobicContact CZ-CG 3.92Å; F194-W474 HydrophobicContact CZ-CH2 4.35Å; F194-W474 HydrophobicContact CZ-CZ2 4.16Å; F194-W474 HydrophobicContact CZ-CZ3 4.13Å
195G84.8Confident86.6Confident19 Ų1952 Ų5220%0.19627%0.269CS..  trans73.632.2-17000000112.8E189 G199E189-G195 WeakPolarHBondContact OE1-CA 3.32Å; E189-G195 PolarHBondContact OE1-N 3.31Å; G195-G199 PolarHBondContact O-N 2.88Å
196L86.6Confident86.3Confident15 Ų1553.4 Ų53.48%0.07928%0.276CS..Hα-helixtrans-79-42.6178.5-79.9174.2000111.9L185 E189 F194 G199 F200 L232 F471L185-L196 HydrophobicContact CD2-CD1 4.11Å; E189-L196 PolarHBondContact OE1-N 2.8Å; F194-L196 HydrophobicContact CB-CB 4.46Å; F194-L196 HydrophobicContact CB-CD1 4.1Å; F194-L196 HydrophobicContact CB-CG 3.87Å; F194-L196 HydrophobicContact CD2-CD1 4.18Å; F194-L196 HydrophobicContact CG-CD1 4.43Å; L196-G199 PolarHBondContact O-N 2.86Å; L196-F200 HydrophobicContact CB-CD2 4.2Å; L196-F200 HydrophobicContact CB-CE2 3.98Å; L196-F200 HydrophobicContact CD2-CE2 4.18Å; L196-F200 HydrophobicContact CD2-CZ 4.24Å; L196-F200 VanDerWaalsContact O-CB 3.31Å; L196-F200 WeakPolarHBondContact O-CB 3.35Å; L196-F200 WeakPolarHBondContact O-CD2 3.34Å; L196-F200 VanDerWaalsContact O-CG 3.26Å; L196-F200 WeakPolarHBondContact O-CG 3.22Å; L196-F200 PolarHBondContact O-N 3.2Å; L196-L232 HydrophobicContact CD1-CD2 4.46Å; L196-F471 HydrophobicContact CD1-CB 3.96Å; L196-F471 HydrophobicContact CD1-CD1 4.45Å; L196-F471 HydrophobicContact CD1-CD2 3.6Å; L196-F471 HydrophobicContact CD1-CE2 4.18Å; L196-F471 HydrophobicContact CD1-CG 3.74Å; L196-F471 HydrophobicContact CD2-CB 4Å; L196-F471 HydrophobicContact CD2-CG 4.39Å; L196-F471 HydrophobicContact CG-CB 4.14Å; L196-F471 HydrophobicContact CG-CG 4.44Å
197E87.4Confident85.9Confident83 Ų8349.7 Ų49.739%0.38825%0.252SS..Hα-helixtrans-62.1-48.7-179.9-161.867.4-147.200112.2E189 G199 F200 S201 K229E189-E197 HydrophobicContact CG-CB 4.12Å; E189-E197 WeakPolarHBondContact OE1-CB 3.36Å; E189-E197 PolarHBondContact OE1-N 2.97Å; E197-G199 VanDerWaalsContact C-N 3.32Å; E197-G199 PolarHBondContact O-N 2.88Å; E197-F200 PolarHBondContact O-N 3.16Å; E197-S201 PolarHBondContact O-N 3.39Å; E197-S201 PolarHBondContact O-OG 2.75Å; E197-K229 IonicContact OE2-NZ 2.66Å; E197-K229 PolarHBondContact OE2-NZ 2.97Å
198P86.8Confident85.6Confident47 Ų4749.1 Ų49.131%0.30525%0.245SC..Hα-helixtrans-68.1-31.2174.227.5-35.5000112.6E189 S201 S202 L463E189-P198 WeakPolarHBondContact OE1-CD 3.27Å; E189-P198 WeakPolarHBondContact OE2-CD 3.27Å; P198-S201 WeakPolarHBondContact CA-OG 3.42Å; P198-S201 PolarHBondContact O-OG 3.33Å; P198-S202 WeakPolarHBondContact O-CB 3.32Å; P198-S202 PolarHBondContact O-N 3.26Å; P198-S202 VanDerWaalsContact O-N 3.14Å; P198-L463 HydrophobicContact CB-CD2 4.18Å; P198-L463 WeakPolarHBondContact O-CD2 3.5Å
199G85.6Confident85.5Confident0 Ų045.5 Ų45.50%024%0.24CC..Hα-helixtrans-65.5-44.1173.800000112.1G195 L196 E197 L203G195-G199 PolarHBondContact O-N 2.88Å; L196-G199 PolarHBondContact O-N 2.86Å; E197-G199 VanDerWaalsContact C-N 3.32Å; E197-G199 PolarHBondContact O-N 2.88Å; G199-L203 PolarHBondContact O-N 3.47Å
200F87.3Confident85.3Confident10 Ų1046.2 Ų46.24%0.04424%0.242CC..Hα-helixtrans-67.6-43176.6-76-43.2000112L196 E197 S202 L203 F204 V228 L232 F464L196-F200 HydrophobicContact CB-CD2 4.2Å; L196-F200 HydrophobicContact CB-CE2 3.98Å; L196-F200 HydrophobicContact CD2-CE2 4.18Å; L196-F200 HydrophobicContact CD2-CZ 4.24Å; L196-F200 VanDerWaalsContact O-CB 3.31Å; L196-F200 WeakPolarHBondContact O-CB 3.35Å; L196-F200 WeakPolarHBondContact O-CD2 3.34Å; L196-F200 VanDerWaalsContact O-CG 3.26Å; L196-F200 WeakPolarHBondContact O-CG 3.22Å; L196-F200 PolarHBondContact O-N 3.2Å; E197-F200 PolarHBondContact O-N 3.16Å; F200-S202 VanDerWaalsContact C-N 3.31Å; F200-S202 PolarHBondContact O-N 2.89Å; F200-L203 PolarHBondContact O-N 3.3Å; F200-F204 HydrophobicContact CB-CD2 4.19Å; F200-F204 HydrophobicContact CB-CE2 3.83Å; F200-F204 HydrophobicContact CG-CE2 4.4Å; F200-F204 WeakPolarHBondContact O-CD2 3.25Å; F200-F204 WeakPolarHBondContact O-CG 3.43Å; F200-F204 PolarHBondContact O-N 2.88Å; F200-V228 HydrophobicContact CD1-CG1 3.85Å; F200-V228 HydrophobicContact CE1-CG1 3.37Å; F200-V228 HydrophobicContact CZ-CG1 4.01Å; F200-L232 HydrophobicContact CE2-CD2 4.4Å; F200-L232 HydrophobicContact CZ-CD2 3.8Å; F200-F464 HydrophobicContact CD1-CD2 4.28Å; F200-F464 AromaticContact CD1-CE2 3.83Å; F200-F464 HydrophobicContact CD1-CE2 3.83Å; F200-F464 AromaticContact CE1-CE2 3.73Å; F200-F464 HydrophobicContact CE1-CE2 3.73Å
201S86.9Confident85.1Confident44 Ų4442 Ų4231%0.30822%0.221SC..Hα-helixtrans-58.2-47176.664.50000110.9E197 P198 L203 F204 D205E197-S201 PolarHBondContact O-N 3.39Å; E197-S201 PolarHBondContact O-OG 2.75Å; P198-S201 WeakPolarHBondContact CA-OG 3.42Å; P198-S201 PolarHBondContact O-OG 3.33Å; S201-L203 VanDerWaalsContact C-N 3.32Å; S201-L203 PolarHBondContact O-N 3.45Å; S201-F204 PolarHBondContact O-N 3.38Å; S201-D205 PolarHBondContact O-N 3.42Å
202S87.1Confident84.8Confident23 Ų2344.1 Ų44.116%0.16123%0.228CC..Hα-helixtrans-59.6-40.7175.8174.10000112.9P198 F200 N206 T461P198-S202 WeakPolarHBondContact O-CB 3.32Å; P198-S202 PolarHBondContact O-N 3.26Å; P198-S202 VanDerWaalsContact O-N 3.14Å; F200-S202 VanDerWaalsContact C-N 3.31Å; F200-S202 PolarHBondContact O-N 2.89Å; S202-N206 WeakPolarHBondContact O-CB 3.48Å; S202-N206 VanDerWaalsContact O-CG 3.28Å; S202-N206 PolarHBondContact O-N 3.27Å; S202-N206 PolarHBondContact O-ND2 3.36Å; S202-T461 VanDerWaalsContact OG-CG2 3.24Å; S202-T461 WeakPolarHBondContact OG-CG2 3.33Å; S202-T461 PolarHBondContact OG-OG1 3.39Å
203L85.7Confident84.3Confident19 Ų1950.7 Ų50.710%0.09926%0.258CS..Hα-helixtrans-65.8-42.1177.1-179.1140.6000111.7G199 F200 S201 L207 V459 L460 F464G199-L203 PolarHBondContact O-N 3.47Å; F200-L203 PolarHBondContact O-N 3.3Å; S201-L203 VanDerWaalsContact C-N 3.32Å; S201-L203 PolarHBondContact O-N 3.45Å; L203-L207 VanDerWaalsContact O-CB 3.22Å; L203-L207 WeakPolarHBondContact O-CB 3.45Å; L203-L207 PolarHBondContact O-N 3.07Å; L203-V459 HydrophobicContact CG-CG1 4.3Å; L203-L460 HydrophobicContact CD1-CD2 4.29Å; L203-F464 HydrophobicContact CB-CD2 4.18Å; L203-F464 HydrophobicContact CB-CG 4.42Å; L203-F464 HydrophobicContact CD1-CD1 3.85Å; L203-F464 HydrophobicContact CD1-CD2 3.79Å; L203-F464 HydrophobicContact CD1-CE1 3.81Å; L203-F464 HydrophobicContact CD1-CE2 3.76Å; L203-F464 HydrophobicContact CD1-CG 3.84Å; L203-F464 HydrophobicContact CD1-CZ 3.76Å
204F85Confident83.9Confident14 Ų1454.1 Ų54.16%0.06127%0.274CS..Hα-helixtrans-68.7-40.8179.2-69.4-55.9000112.5F200 S201 N206 L207 E208 K225 V228F200-F204 HydrophobicContact CB-CD2 4.19Å; F200-F204 HydrophobicContact CB-CE2 3.83Å; F200-F204 HydrophobicContact CG-CE2 4.4Å; F200-F204 WeakPolarHBondContact O-CD2 3.25Å; F200-F204 WeakPolarHBondContact O-CG 3.43Å; F200-F204 PolarHBondContact O-N 2.88Å; S201-F204 PolarHBondContact O-N 3.38Å; F204-N206 VanDerWaalsContact C-N 3.32Å; F204-N206 PolarHBondContact O-N 3.23Å; F204-L207 PolarHBondContact O-N 3.39Å; F204-E208 WeakPolarHBondContact O-CB 3.34Å; F204-E208 PolarHBondContact O-N 3.4Å; F204-K225 HydrophobicContact CD2-CD 4.46Å; F204-K225 HydrophobicContact CD2-CG 3.72Å; F204-K225 HydrophobicContact CE1-CG 4.48Å; F204-K225 HydrophobicContact CE2-CB 4.23Å; F204-K225 HydrophobicContact CE2-CD 4.48Å; F204-K225 HydrophobicContact CE2-CG 3.43Å; F204-K225 VanDerWaalsContact CE2-CG 3.43Å; F204-K225 HydrophobicContact CG-CG 4.41Å; F204-K225 HydrophobicContact CZ-CB 4.32Å; F204-K225 HydrophobicContact CZ-CG 3.86Å; F204-V228 HydrophobicContact CE1-CB 4.45Å; F204-V228 HydrophobicContact CE1-CG2 3.78Å; F204-V228 HydrophobicContact CZ-CB 3.85Å; F204-V228 HydrophobicContact CZ-CG1 4.29Å; F204-V228 HydrophobicContact CZ-CG2 3.68Å
205D84.5Confident83.2Confident93 Ų9356.5 Ų56.550%0.49730%0.303SS..Hα-helixtrans-62.5-41.7177.8-63.1-18.3000111S201 T209S201-D205 PolarHBondContact O-N 3.42Å; D205-T209 PolarHBondContact O-N 2.88Å; D205-T209 VanDerWaalsContact O-N 3.09Å; D205-T209 PolarHBondContact O-OG1 2.93Å
206N83.9Confident82.6Confident54 Ų5463 Ų6329%0.28932%0.322SS..Hα-helixtrans-70.6-39.5176.2-70.5-18.2000112.4S202 F204 E208 T209 F210 S458 T461S202-N206 WeakPolarHBondContact O-CB 3.48Å; S202-N206 VanDerWaalsContact O-CG 3.28Å; S202-N206 PolarHBondContact O-N 3.27Å; S202-N206 PolarHBondContact O-ND2 3.36Å; F204-N206 VanDerWaalsContact C-N 3.32Å; F204-N206 PolarHBondContact O-N 3.23Å; N206-E208 VanDerWaalsContact C-N 3.33Å; N206-T209 PolarHBondContact O-N 3.43Å; N206-F210 WeakPolarHBondContact O-CB 3.2Å; N206-F210 PolarHBondContact O-N 3.34Å; N206-S458 PolarHBondContact ND2-O 3.1Å; N206-T461 WeakPolarHBondContact ND2-CG2 3.41Å
207L82.2Confident81.3Confident46 Ų4666.5 Ų66.524%0.24135%0.353CS..Hα-helixtrans-66.4-37.4177.1-170.270.4000111.4L203 F204 F210 A211 W219 V459L203-L207 VanDerWaalsContact O-CB 3.22Å; L203-L207 WeakPolarHBondContact O-CB 3.45Å; L203-L207 PolarHBondContact O-N 3.07Å; F204-L207 PolarHBondContact O-N 3.39Å; L207-F210 PolarHBondContact O-N 3.23Å; L207-A211 VanDerWaalsContact O-CB 3.23Å; L207-A211 WeakPolarHBondContact O-CB 3.48Å; L207-A211 PolarHBondContact O-N 2.9Å; L207-W219 HydrophobicContact CD2-CZ2 3.78Å; L207-V459 HydrophobicContact CD1-CG1 4.42Å
208E82Confident80.2Confident46 Ų4670.3 Ų70.322%0.21538%0.377CS..Hα-helixtrans-63.3-45.6173.9-177.8176.9-178.300110.8F204 N206 F210 A211 R212F204-E208 WeakPolarHBondContact O-CB 3.34Å; F204-E208 PolarHBondContact O-N 3.4Å; N206-E208 VanDerWaalsContact C-N 3.33Å; E208-F210 VanDerWaalsContact C-N 3.31Å; E208-F210 PolarHBondContact O-N 3.07Å; E208-A211 PolarHBondContact O-N 2.87Å; E208-R212 WeakPolarHBondContact O-CB 3.33Å; E208-R212 VanDerWaalsContact O-CG 3.3Å; E208-R212 WeakPolarHBondContact O-CG 3.36Å; E208-R212 PolarHBondContact O-N 3.35Å; E208-R212 IonicContact OE1-CZ 2.77Å; E208-R212 IonicContact OE1-NE 3.79Å; E208-R212 PolarHBondContact OE1-NE 3.08Å; E208-R212 IonicContact OE1-NH2 3.94Å; E208-R212 PolarHBondContact OE1-NH2 3.27Å
209T81.6Confident79.3Confident77 Ų7773.3 Ų73.347%0.47238%0.382SS..Hα-helixtrans-57.9-46.6175.4-53.80000110.6D205 N206 R212 H213D205-T209 PolarHBondContact O-N 2.88Å; D205-T209 VanDerWaalsContact O-N 3.09Å; D205-T209 PolarHBondContact O-OG1 2.93Å; N206-T209 PolarHBondContact O-N 3.43Å; T209-R212 PolarHBondContact O-N 3.28Å; T209-H213 PolarHBondContact O-CD2 3.42Å; T209-H213 PolarHBondContact O-N 3.37Å
210F79.8Confident78.4Confident77 Ų7776.2 Ų76.234%0.33840%0.402SS..Hα-helixtrans-64.8-43177.3-175.6-97.1000113.2N206 L207 E208 R212 H213 Q214 A455N206-F210 WeakPolarHBondContact O-CB 3.2Å; N206-F210 PolarHBondContact O-N 3.34Å; L207-F210 PolarHBondContact O-N 3.23Å; E208-F210 VanDerWaalsContact C-N 3.31Å; E208-F210 PolarHBondContact O-N 3.07Å; F210-R212 VanDerWaalsContact C-N 3.34Å; F210-R212 PolarHBondContact O-N 3.49Å; F210-H213 WeakPolarHBondContact O-CB 3.46Å; F210-H213 PolarHBondContact O-N 2.82Å; F210-Q214 HydrophobicContact CE1-CG 4.17Å; F210-Q214 HydrophobicContact CZ-CG 4.4Å; F210-Q214 PolarHBondContact O-N 3.43Å; F210-Q214 VanDerWaalsContact O-N 3.14Å; F210-A455 HydrophobicContact CE2-CB 4.16Å
211A78.8Confident77.4Confident9 Ų978.5 Ų78.57%0.07441%0.414CS..Hα-helixtrans-65.1-38179.200000112L207 E208 H213 Q214 G215 Y216L207-A211 VanDerWaalsContact O-CB 3.23Å; L207-A211 WeakPolarHBondContact O-CB 3.48Å; L207-A211 PolarHBondContact O-N 2.9Å; E208-A211 PolarHBondContact O-N 2.87Å; A211-H213 VanDerWaalsContact C-N 3.34Å; A211-Q214 CarbonylContact O-C 3.58Å; A211-Q214 PolarHBondContact O-N 2.88Å; A211-Q214 VanDerWaalsContact O-N 3.12Å; A211-G215 PolarHBondContact O-N 2.88Å; A211-Y216 PolarHBondContact O-N 3.27Å
212R80.1Confident76.6Confident168 Ų16881.3 Ų81.363%0.63443%0.431SS*.Hα-helixtrans-62-40.8172.2-73.7178.4-177.1-164.13.5111.7E208 T209 F210 Q214 G215E208-R212 WeakPolarHBondContact O-CB 3.33Å; E208-R212 VanDerWaalsContact O-CG 3.3Å; E208-R212 WeakPolarHBondContact O-CG 3.36Å; E208-R212 PolarHBondContact O-N 3.35Å; E208-R212 IonicContact OE1-CZ 2.77Å; E208-R212 IonicContact OE1-NE 3.79Å; E208-R212 PolarHBondContact OE1-NE 3.08Å; E208-R212 IonicContact OE1-NH2 3.94Å; E208-R212 PolarHBondContact OE1-NH2 3.27Å; T209-R212 PolarHBondContact O-N 3.28Å; F210-R212 VanDerWaalsContact C-N 3.34Å; F210-R212 PolarHBondContact O-N 3.49Å; R212-Q214 PolarHBondContact O-N 2.89Å; R212-G215 PolarHBondContact O-N 3.46Å
213H79.7Confident75.8Confident158 Ų15884.3 Ų84.373%0.73145%0.448SS*.Hα-helixtrans-63-28.5173.9-78.2-65.9000113.2T209 F210 A211T209-H213 PolarHBondContact O-CD2 3.42Å; T209-H213 PolarHBondContact O-N 3.37Å; F210-H213 WeakPolarHBondContact O-CB 3.46Å; F210-H213 PolarHBondContact O-N 2.82Å; A211-H213 VanDerWaalsContact C-N 3.34Å
214Q77.4Confident75.4Confident121 Ų12184.3 Ų84.357%0.56545%0.449SS*.THydrogen-bonded Turntrans-926.4177.1-61.9-140.14.100114.6F210 A211 R212 Y216F210-Q214 HydrophobicContact CE1-CG 4.17Å; F210-Q214 HydrophobicContact CZ-CG 4.4Å; F210-Q214 PolarHBondContact O-N 3.43Å; F210-Q214 VanDerWaalsContact O-N 3.14Å; A211-Q214 CarbonylContact O-C 3.58Å; A211-Q214 PolarHBondContact O-N 2.88Å; A211-Q214 VanDerWaalsContact O-N 3.12Å; R212-Q214 PolarHBondContact O-N 2.89Å; Q214-Y216 HydrophobicContact CB-CD2 4.11Å; Q214-Y216 HydrophobicContact CB-CE2 4.4Å
215G73.9Confident75.2Confident64 Ų6487.4 Ų87.466%0.6646%0.463SS*.THydrogen-bonded Turntrans84.98.6174.900000115.7A211 R212 A217A211-G215 PolarHBondContact O-N 2.88Å; R212-G215 PolarHBondContact O-N 3.46Å; G215-A217 PolarHBondContact O-N 3.43Å
216Y71.8Confident75.2Confident155 Ų15588.9 Ų88.961%0.60847%0.47SS*.  trans-89.587.5174.8-67-79.4000110.4A211 Q214A211-Y216 PolarHBondContact O-N 3.27Å; Q214-Y216 HydrophobicContact CB-CD2 4.11Å; Q214-Y216 HydrophobicContact CB-CE2 4.4Å
217A60.4Low75.3Confident88 Ų8890.3 Ų90.373%0.72748%0.481SS*.  trans-77.4-28.7-17700000114.3G215 W219G215-A217 PolarHBondContact O-N 3.43Å; A217-W219 PolarHBondContact O-N 3.03Å
218D64.5Low75.5Confident164 Ų16490.4 Ų90.488%0.87748%0.483SS*.  trans-95.136.4-173.9-64.5-35.6000113.7S220D218-S220 PolarHBondContact O-N 3.41Å; D218-S220 VanDerWaalsContact O-N 3.15Å
219W67.4Low75.8Confident110 Ų11091.2 Ų91.242%0.41749%0.486SS..  trans-72.5107.4-179.7-170.7-94.6000111.6L207 A217 I221 T224L207-W219 HydrophobicContact CD2-CZ2 3.78Å; A217-W219 PolarHBondContact O-N 3.03Å; W219-I221 PolarHBondContact O-N 2.98Å; W219-I221 VanDerWaalsContact O-N 3.16Å; W219-T224 HydrophobicContact CD2-CG2 4.29Å; W219-T224 HydrophobicContact CH2-CG2 4.3Å; W219-T224 HydrophobicContact CZ2-CG2 3.4Å
220S66.2Low76.2Confident61 Ų6192.4 Ų92.443%0.42749%0.489SS..  trans-77.3100.8180610000112.7D218 P222 V223 T224D218-S220 PolarHBondContact O-N 3.41Å; D218-S220 VanDerWaalsContact O-N 3.15Å; S220-P222 VanDerWaalsContact C-CD 3.48Å; S220-V223 PolarHBondContact O-N 3.38Å; S220-V223 WeakPolarHBondContact OG-CG2 3.15Å; S220-T224 WeakPolarHBondContact O-CG2 3.44Å; S220-T224 PolarHBondContact O-N 3.09Å; S220-T224 PolarHBondContact O-OG1 3.46Å
221I66.6Low76.8Confident58 Ų5890.5 Ų90.530%0.29749%0.491SS..Hα-helixtrans-55.6-39.9-179.5-61156.3000113.9W219 V223 T224 K225W219-I221 PolarHBondContact O-N 2.98Å; W219-I221 VanDerWaalsContact O-N 3.16Å; I221-V223 PolarHBondContact O-N 2.91Å; I221-T224 WeakPolarHBondContact CA-OG1 3.35Å; I221-T224 PolarHBondContact O-N 3.44Å; I221-T224 PolarHBondContact O-OG1 3.04Å; I221-K225 HydrophobicContact CG2-CD 4.28Å; I221-K225 WeakPolarHBondContact O-CG 3.35Å; I221-K225 PolarHBondContact O-N 3.48Å; I221-K225 VanDerWaalsContact O-N 3.09Å
222P70.4Confident77.4Confident102 Ų10291.1 Ų91.166%0.66249%0.493SS*.Hα-helixtrans-66.6-38.8-179.5-23.235.2000113.7S220 T224 L226S220-P222 VanDerWaalsContact C-CD 3.48Å; P222-T224 VanDerWaalsContact C-N 3.31Å; P222-T224 PolarHBondContact O-N 2.89Å; P222-L226 PolarHBondContact O-N 3.28Å
223V71Confident78.2Confident86 Ų8683.1 Ų83.152%0.52146%0.463SS..Hα-helixtrans-67.8-37-179.9178.30000110.2S220 I221 T227S220-V223 PolarHBondContact O-N 3.38Å; S220-V223 WeakPolarHBondContact OG-CG2 3.15Å; I221-V223 PolarHBondContact O-N 2.91Å; V223-T227 WeakPolarHBondContact O-CB 3.42Å; V223-T227 PolarHBondContact O-N 3.45Å; V223-T227 PolarHBondContact O-OG1 2.87Å
224T77.3Confident78.9Confident20 Ų2078.1 Ų78.112%0.12345%0.449CS..Hα-helixtrans-74.3-37.3-17953.60000112W219 S220 I221 P222 T227 V228W219-T224 HydrophobicContact CD2-CG2 4.29Å; W219-T224 HydrophobicContact CH2-CG2 4.3Å; W219-T224 HydrophobicContact CZ2-CG2 3.4Å; S220-T224 WeakPolarHBondContact O-CG2 3.44Å; S220-T224 PolarHBondContact O-N 3.09Å; S220-T224 PolarHBondContact O-OG1 3.46Å; I221-T224 WeakPolarHBondContact CA-OG1 3.35Å; I221-T224 PolarHBondContact O-N 3.44Å; I221-T224 PolarHBondContact O-OG1 3.04Å; P222-T224 VanDerWaalsContact C-N 3.31Å; P222-T224 PolarHBondContact O-N 2.89Å; T224-T227 PolarHBondContact O-N 3.36Å; T224-V228 WeakPolarHBondContact O-CG2 3.37Å; T224-V228 PolarHBondContact O-N 3.27Å
225K80.3Confident79.8Confident79 Ų7976 Ų7634%0.34344%0.444SS..Hα-helixtrans-56.4-50.5169.4-77.3-178.4179-168.80112.6F204 I221 T227 V228 K229F204-K225 HydrophobicContact CD2-CD 4.46Å; F204-K225 HydrophobicContact CD2-CG 3.72Å; F204-K225 HydrophobicContact CE1-CG 4.48Å; F204-K225 HydrophobicContact CE2-CB 4.23Å; F204-K225 HydrophobicContact CE2-CD 4.48Å; F204-K225 HydrophobicContact CE2-CG 3.43Å; F204-K225 VanDerWaalsContact CE2-CG 3.43Å; F204-K225 HydrophobicContact CG-CG 4.41Å; F204-K225 HydrophobicContact CZ-CB 4.32Å; F204-K225 HydrophobicContact CZ-CG 3.86Å; I221-K225 HydrophobicContact CG2-CD 4.28Å; I221-K225 WeakPolarHBondContact O-CG 3.35Å; I221-K225 PolarHBondContact O-N 3.48Å; I221-K225 VanDerWaalsContact O-N 3.09Å; K225-T227 VanDerWaalsContact C-N 3.33Å; K225-T227 PolarHBondContact O-N 2.79Å; K225-V228 PolarHBondContact O-N 3.24Å; K225-K229 WeakPolarHBondContact O-CG 3.45Å; K225-K229 PolarHBondContact O-N 2.95Å; K225-K229 VanDerWaalsContact O-N 3.09Å
226L83.6Confident80.9Confident123 Ų12373 Ų7364%0.64441%0.413SS*.Hα-helixtrans-62.3-42.7177.5-17963.3000111.4P222 V228 K229 L230P222-L226 PolarHBondContact O-N 3.28Å; L226-V228 PolarHBondContact O-N 2.84Å; L226-K229 PolarHBondContact O-N 3.45Å; L226-L230 WeakPolarHBondContact O-CB 3.15Å; L226-L230 PolarHBondContact O-N 2.91Å
227T86.3Confident82.1Confident84 Ų8466.2 Ų66.252%0.51539%0.389SS..Hα-helixtrans-62.2-43.8-179.4-59.50000111.9V223 T224 K225 L230 G231V223-T227 WeakPolarHBondContact O-CB 3.42Å; V223-T227 PolarHBondContact O-N 3.45Å; V223-T227 PolarHBondContact O-OG1 2.87Å; T224-T227 PolarHBondContact O-N 3.36Å; K225-T227 VanDerWaalsContact C-N 3.33Å; K225-T227 PolarHBondContact O-N 2.79Å; T227-L230 PolarHBondContact O-N 3.33Å; T227-G231 PolarHBondContact O-N 2.98Å
228V85.9Confident83.9Confident49 Ų4966.9 Ų66.930%0.29737%0.373SS..Hα-helixtrans-66.5-42.1176.8171.60000111.4F200 F204 T224 K225 L226 G231 L232F200-V228 HydrophobicContact CD1-CG1 3.85Å; F200-V228 HydrophobicContact CE1-CG1 3.37Å; F200-V228 HydrophobicContact CZ-CG1 4.01Å; F204-V228 HydrophobicContact CE1-CB 4.45Å; F204-V228 HydrophobicContact CE1-CG2 3.78Å; F204-V228 HydrophobicContact CZ-CB 3.85Å; F204-V228 HydrophobicContact CZ-CG1 4.29Å; F204-V228 HydrophobicContact CZ-CG2 3.68Å; T224-V228 WeakPolarHBondContact O-CG2 3.37Å; T224-V228 PolarHBondContact O-N 3.27Å; K225-V228 PolarHBondContact O-N 3.24Å; L226-V228 PolarHBondContact O-N 2.84Å; V228-G231 PolarHBondContact O-N 2.87Å; V228-L232 WeakPolarHBondContact O-CB 3.44Å; V228-L232 PolarHBondContact O-N 2.94Å
229K87.9Confident85.4Confident62 Ų6259.5 Ų59.527%0.2733%0.334SS..Hα-helixtrans-63.5-41.8175.9-71.9-172.5178.8-169.50111.6E197 K225 L226 L232 A233E197-K229 IonicContact OE2-NZ 2.66Å; E197-K229 PolarHBondContact OE2-NZ 2.97Å; K225-K229 WeakPolarHBondContact O-CG 3.45Å; K225-K229 PolarHBondContact O-N 2.95Å; K225-K229 VanDerWaalsContact O-N 3.09Å; L226-K229 PolarHBondContact O-N 3.45Å; K229-L232 PolarHBondContact O-N 3.36Å; K229-A233 WeakPolarHBondContact O-CB 3.23Å; K229-A233 PolarHBondContact O-N 3.2Å
230L90.4Very high86.8Confident102 Ų10254.4 Ų54.453%0.53432%0.315SS..Hα-helixtrans-64.4-42.9174.9-170.377.9000111.8M182 L226 T227 A233 A234M182-L230 HydrophobicContact CE-CD1 3.54Å; L226-L230 WeakPolarHBondContact O-CB 3.15Å; L226-L230 PolarHBondContact O-N 2.91Å; T227-L230 PolarHBondContact O-N 3.33Å; L230-A233 WeakPolarHBondContact O-CB 3.25Å; L230-A233 PolarHBondContact O-N 3.48Å; L230-A234 PolarHBondContact O-N 2.92Å
231G92Very high88.2Confident37 Ų3752.2 Ų52.238%0.38130%0.3SS..Hα-helixtrans-61.1-44174.800000112.1T227 V228 A233 A234 V235T227-G231 PolarHBondContact O-N 2.98Å; V228-G231 PolarHBondContact O-N 2.87Å; G231-A233 VanDerWaalsContact C-N 3.35Å; G231-A233 PolarHBondContact O-N 2.9Å; G231-A234 WeakPolarHBondContact O-CB 3.32Å; G231-A234 PolarHBondContact O-N 3.25Å; G231-V235 WeakPolarHBondContact O-CG2 3.48Å; G231-V235 PolarHBondContact O-N 3.31Å
232L92.9Very high89.6Confident22 Ų2249.5 Ų49.512%0.11529%0.286CS..Hα-helixtrans-62.6-41.6174.8-177.259.1000111.4L185 L196 F200 V228 K229 A234 V235 C236 F471L185-L232 HydrophobicContact CD1-CB 4.38Å; L185-L232 HydrophobicContact CD1-CD2 4.39Å; L185-L232 HydrophobicContact CD1-CG 4.27Å; L185-L232 HydrophobicContact CD2-CD2 3.63Å; L185-L232 HydrophobicContact CD2-CG 4.31Å; L196-L232 HydrophobicContact CD1-CD2 4.46Å; F200-L232 HydrophobicContact CE2-CD2 4.4Å; F200-L232 HydrophobicContact CZ-CD2 3.8Å; V228-L232 WeakPolarHBondContact O-CB 3.44Å; V228-L232 PolarHBondContact O-N 2.94Å; K229-L232 PolarHBondContact O-N 3.36Å; L232-A234 VanDerWaalsContact C-N 3.32Å; L232-A234 PolarHBondContact O-N 3.38Å; L232-V235 PolarHBondContact O-N 3.33Å; L232-C236 WeakPolarHBondContact O-CB 3.35Å; L232-C236 PolarHBondContact O-N 2.85Å; L232-C236 PolarHBondContact O-SG 3.01Å; L232-F471 HydrophobicContact CD1-CD1 4.24Å; L232-F471 HydrophobicContact CD1-CE1 3.89Å; L232-F471 HydrophobicContact CD2-CD1 4.22Å; L232-F471 HydrophobicContact CD2-CE1 3.94Å; L232-F471 HydrophobicContact CD2-CZ 4.47Å; L232-F471 HydrophobicContact CG-CE1 4Å
233A95.5Very high90.8Very high0 Ų044.8 Ų44.80%026%0.255CS..Hα-helixtrans-61.9-38.5174.700000112.4L178 A181 M182 L185 K229 L230 G231 C236 A237L178-A233 HydrophobicContact CD1-CB 4.15Å; A181-A233 HydrophobicContact CB-CB 4.32Å; M182-A233 HydrophobicContact CE-CB 3.5Å; M182-A233 HydrophobicContact SD-CB 3.71Å; L185-A233 HydrophobicContact CD1-CB 3.91Å; K229-A233 WeakPolarHBondContact O-CB 3.23Å; K229-A233 PolarHBondContact O-N 3.2Å; L230-A233 WeakPolarHBondContact O-CB 3.25Å; L230-A233 PolarHBondContact O-N 3.48Å; G231-A233 VanDerWaalsContact C-N 3.35Å; G231-A233 PolarHBondContact O-N 2.9Å; A233-C236 WeakPolarHBondContact O-CB 3.48Å; A233-C236 PolarHBondContact O-N 3.17Å; A233-A237 PolarHBondContact O-N 3.27Å
234A96.3Very high91.8Very high54 Ų5440.7 Ų40.745%0.44623%0.23SC..Hα-helixtrans-65.7-41.7174.500000112L230 G231 L232 C236 A237 Y238L230-A234 PolarHBondContact O-N 2.92Å; G231-A234 WeakPolarHBondContact O-CB 3.32Å; G231-A234 PolarHBondContact O-N 3.25Å; L232-A234 VanDerWaalsContact C-N 3.32Å; L232-A234 PolarHBondContact O-N 3.38Å; A234-C236 VanDerWaalsContact C-N 3.29Å; A234-C236 PolarHBondContact O-N 3.46Å; A234-A237 WeakPolarHBondContact O-CB 3.26Å; A234-A237 PolarHBondContact O-N 2.72Å; A234-Y238 WeakPolarHBondContact O-CB 3.49Å; A234-Y238 PolarHBondContact O-N 2.95Å
235V96.1Very high92.5Very high75 Ų7540.9 Ų40.946%0.45523%0.23SC..Hα-helixtrans-61.2-40.1172.2172.60000110.9G231 L232 Y238 I239G231-V235 WeakPolarHBondContact O-CG2 3.48Å; G231-V235 PolarHBondContact O-N 3.31Å; L232-V235 PolarHBondContact O-N 3.33Å; V235-Y238 WeakPolarHBondContact O-CB 3.29Å; V235-Y238 PolarHBondContact O-N 3.39Å; V235-I239 HydrophobicContact CG1-CD1 3.85Å; V235-I239 HydrophobicContact CG1-CG1 4.39Å; V235-I239 WeakPolarHBondContact O-CG1 3.46Å; V235-I239 PolarHBondContact O-N 3.16Å
236C96.6Very high93.1Very high1 Ų137.5 Ų37.51%0.00722%0.216CC..Hα-helixtrans-62.2-45.2176-71.60000112.3A181 L232 A233 A234 Y238 I239 G240 F471 W475A181-C236 HydrophobicContact CB-CB 3.45Å; A181-C236 VanDerWaalsContact CB-CB 3.45Å; L232-C236 WeakPolarHBondContact O-CB 3.35Å; L232-C236 PolarHBondContact O-N 2.85Å; L232-C236 PolarHBondContact O-SG 3.01Å; A233-C236 WeakPolarHBondContact O-CB 3.48Å; A233-C236 PolarHBondContact O-N 3.17Å; A234-C236 VanDerWaalsContact C-N 3.29Å; A234-C236 PolarHBondContact O-N 3.46Å; C236-Y238 VanDerWaalsContact C-N 3.31Å; C236-Y238 PolarHBondContact O-N 3.41Å; C236-I239 PolarHBondContact O-N 3.05Å; C236-G240 PolarHBondContact O-N 3.45Å; C236-F471 WeakPolarHBondContact SG-CE1 3.43Å; C236-F471 VanDerWaalsContact SG-CZ 3.54Å; C236-W475 VanDerWaalsContact CA-NE1 3.3Å; C236-W475 HydrophobicContact CB-CD2 4.11Å; C236-W475 VanDerWaalsContact CB-CE2 3.41Å; C236-W475 HydrophobicContact CB-CH2 4.26Å; C236-W475 HydrophobicContact CB-CZ2 3.51Å; C236-W475 PolarHBondContact O-NE1 3.49Å
237A97.3Very high93.6Very high14 Ų1431.7 Ų31.712%0.11619%0.186CC..Hα-helixtrans-59.8-43.3174.800000111.4G174 L178 A233 A234 G240 S241G174-A237 WeakPolarHBondContact CA-O 3.46Å; G174-A237 WeakPolarHBondContact O-CB 3.48Å; L178-A237 HydrophobicContact CB-CB 3.71Å; L178-A237 HydrophobicContact CD1-CB 3.87Å; L178-A237 HydrophobicContact CG-CB 4.38Å; A233-A237 PolarHBondContact O-N 3.27Å; A234-A237 WeakPolarHBondContact O-CB 3.26Å; A234-A237 PolarHBondContact O-N 2.72Å; A237-G240 PolarHBondContact O-N 3.19Å; A237-S241 PolarHBondContact O-N 3.49Å
238Y96.6Very high93.9Very high101 Ų10129.1 Ų29.140%0.39617%0.169SC..Hα-helixtrans-62.7-50.9176.4178-110.2000112H152 A234 V235 C236 G240 S241 L242H152-Y238 WeakPolarHBondContact CB-OH 3.36Å; H152-Y238 VanDerWaalsContact CG-OH 3.23Å; H152-Y238 AromaticContact ND1-CZ 3.83Å; H152-Y238 PolarHBondContact ND1-OH 3.41Å; A234-Y238 WeakPolarHBondContact O-CB 3.49Å; A234-Y238 PolarHBondContact O-N 2.95Å; V235-Y238 WeakPolarHBondContact O-CB 3.29Å; V235-Y238 PolarHBondContact O-N 3.39Å; C236-Y238 VanDerWaalsContact C-N 3.31Å; C236-Y238 PolarHBondContact O-N 3.41Å; Y238-G240 VanDerWaalsContact C-N 3.28Å; Y238-G240 PolarHBondContact O-N 3.07Å; Y238-S241 WeakPolarHBondContact O-CB 3.43Å; Y238-S241 PolarHBondContact O-N 2.89Å; Y238-S241 VanDerWaalsContact O-N 3.12Å; Y238-S241 PolarHBondContact O-OG 3.18Å; Y238-L242 HydrophobicContact CD1-CD1 4.14Å; Y238-L242 HydrophobicContact CE1-CD1 3.65Å; Y238-L242 HydrophobicContact CE1-CG 4.22Å; Y238-L242 HydrophobicContact CE2-CD2 4.28Å; Y238-L242 HydrophobicContact CE2-CG 4.46Å; Y238-L242 WeakPolarHBondContact O-CG 3.47Å; Y238-L242 PolarHBondContact O-N 3.25Å
239I96.9Very high94.1Very high10 Ų1029.3 Ų29.35%0.05116%0.164CC..Hα-helixtrans-59.4-40.3175.6-67.7169.5000111.2L148 V235 C236 S241 L242 L243 L472 V476L148-I239 HydrophobicContact CD2-CG1 4.24Å; V235-I239 HydrophobicContact CG1-CD1 3.85Å; V235-I239 HydrophobicContact CG1-CG1 4.39Å; V235-I239 WeakPolarHBondContact O-CG1 3.46Å; V235-I239 PolarHBondContact O-N 3.16Å; C236-I239 PolarHBondContact O-N 3.05Å; I239-S241 VanDerWaalsContact C-N 3.33Å; I239-S241 PolarHBondContact O-N 3.28Å; I239-L242 WeakPolarHBondContact O-CB 3.26Å; I239-L242 PolarHBondContact O-N 2.86Å; I239-L242 VanDerWaalsContact O-N 3.17Å; I239-L243 HydrophobicContact CG2-CD1 3.78Å; I239-L243 HydrophobicContact CG2-CG 4.5Å; I239-L243 WeakPolarHBondContact O-CG 3.4Å; I239-L243 PolarHBondContact O-N 3.46Å; I239-L472 HydrophobicContact CD1-CD1 3.71Å; I239-V476 HydrophobicContact CG2-CG2 4.17Å
240G96.2Very high94.3Very high2 Ų226.9 Ų26.92%0.02115%0.154CC..Hα-helixtrans-62.2-39.9176.100000112.9S177 C236 A237 Y238 L243 A244 C479S177-G240 WeakPolarHBondContact OG-CA 3.32Å; C236-G240 PolarHBondContact O-N 3.45Å; A237-G240 PolarHBondContact O-N 3.19Å; Y238-G240 VanDerWaalsContact C-N 3.28Å; Y238-G240 PolarHBondContact O-N 3.07Å; G240-L243 PolarHBondContact O-N 2.83Å; G240-A244 PolarHBondContact O-N 3.29Å; G240-C479 VanDerWaalsContact CA-SG 3.55Å
241S95.4Very high94.5Very high15 Ų1522 Ų2211%0.10513%0.128CC..Hα-helixtrans-60.8-50.6170.379.10000110.4M155 A237 Y238 I239 L243 A244M155-S241 WeakPolarHBondContact CE-O 3.36Å; A237-S241 PolarHBondContact O-N 3.49Å; Y238-S241 WeakPolarHBondContact O-CB 3.43Å; Y238-S241 PolarHBondContact O-N 2.89Å; Y238-S241 VanDerWaalsContact O-N 3.12Å; Y238-S241 PolarHBondContact O-OG 3.18Å; I239-S241 VanDerWaalsContact C-N 3.33Å; I239-S241 PolarHBondContact O-N 3.28Å; S241-L243 PolarHBondContact O-N 2.87Å; S241-L243 VanDerWaalsContact O-N 3.1Å; S241-A244 WeakPolarHBondContact O-CB 3.39Å; S241-A244 PolarHBondContact O-N 3.26Å
242L95.8Very high94.4Very high2 Ų221.8 Ų21.81%0.0112%0.117CC..Hα-helixtrans-53.3-35.4-178.8-68.5-175.6000113.1L148 L151 H152 M155 Y238 I239 P246L148-L242 HydrophobicContact CD2-CD1 4.25Å; L151-L242 HydrophobicContact CB-CB 4.07Å; L151-L242 HydrophobicContact CB-CD1 4.2Å; L151-L242 HydrophobicContact CB-CD2 4.38Å; L151-L242 HydrophobicContact CB-CG 4.46Å; L151-L242 HydrophobicContact CD1-CB 4.39Å; H152-L242 HydrophobicContact CB-CD2 4.18Å; M155-L242 HydrophobicContact CB-CD2 3.72Å; M155-L242 VanDerWaalsContact CE-CA 3.45Å; M155-L242 HydrophobicContact CE-CD2 4.49Å; M155-L242 HydrophobicContact CG-CD2 4.06Å; Y238-L242 HydrophobicContact CD1-CD1 4.14Å; Y238-L242 HydrophobicContact CE1-CD1 3.65Å; Y238-L242 HydrophobicContact CE1-CG 4.22Å; Y238-L242 HydrophobicContact CE2-CD2 4.28Å; Y238-L242 HydrophobicContact CE2-CG 4.46Å; Y238-L242 WeakPolarHBondContact O-CG 3.47Å; Y238-L242 PolarHBondContact O-N 3.25Å; I239-L242 WeakPolarHBondContact O-CB 3.26Å; I239-L242 PolarHBondContact O-N 2.86Å; I239-L242 VanDerWaalsContact O-N 3.17Å; L242-P246 WeakPolarHBondContact O-CD 3.38Å; L242-P246 WeakPolarHBondContact O-CG 3.25Å
243L95.5Very high94.4Very high2 Ų220.9 Ų20.91%0.0111%0.113CC..Hα-helixtrans-91.4-3.6-176.5-68.5170000114.5L151 I239 G240 S241 P246 G247 P382 V476 C479L151-L243 HydrophobicContact CD1-CD2 3.77Å; L151-L243 HydrophobicContact CD1-CG 4.41Å; I239-L243 HydrophobicContact CG2-CD1 3.78Å; I239-L243 HydrophobicContact CG2-CG 4.5Å; I239-L243 WeakPolarHBondContact O-CG 3.4Å; I239-L243 PolarHBondContact O-N 3.46Å; G240-L243 PolarHBondContact O-N 2.83Å; S241-L243 PolarHBondContact O-N 2.87Å; S241-L243 VanDerWaalsContact O-N 3.1Å; L243-P246 HydrophobicContact CD2-CB 4.46Å; L243-P246 WeakPolarHBondContact O-CD 3.3Å; L243-G247 PolarHBondContact O-N 3.48Å; L243-P382 HydrophobicContact CD2-CB 3.97Å; L243-P382 HydrophobicContact CD2-CG 3.59Å; L243-V476 HydrophobicContact CD1-CB 4.29Å; L243-V476 HydrophobicContact CD1-CG1 3.89Å; L243-V476 HydrophobicContact CD1-CG2 4.34Å; L243-C479 HydrophobicContact CB-CB 4.06Å; L243-C479 HydrophobicContact CD1-CB 3.56Å; L243-C479 HydrophobicContact CG-CB 4.46Å
244A93.3Very high94.3Very high0 Ų021.2 Ų21.20%012%0.115CC..Hα-helixtrans-55.8-61.4-179.800000112.5F173 G240 S241 G247 L248F173-A244 HydrophobicContact CB-CB 3.63Å; F173-A244 HydrophobicContact CD1-CB 4.29Å; F173-A244 HydrophobicContact CD2-CB 3.61Å; F173-A244 HydrophobicContact CE2-CB 4.34Å; F173-A244 HydrophobicContact CG-CB 3.57Å; G240-A244 PolarHBondContact O-N 3.29Å; S241-A244 WeakPolarHBondContact O-CB 3.39Å; S241-A244 PolarHBondContact O-N 3.26Å; A244-G247 PolarHBondContact O-N 3Å; A244-L248 WeakPolarHBondContact O-CG 3.5Å; A244-L248 PolarHBondContact O-N 3.36Å
245F91.5Very high94.2Very high25 Ų2521.2 Ų21.211%0.1111%0.106CC..Hα-helixtrans-64.4-43.8178.8-75.2-61.5000113.9Y158 E166 C170 G247 L248 R249Y158-F245 HydrophobicContact CD1-CD2 4.29Å; Y158-F245 AromaticContact CD1-CE2 3.97Å; Y158-F245 HydrophobicContact CD1-CE2 3.97Å; Y158-F245 HydrophobicContact CD1-CZ 4.33Å; Y158-F245 AromaticContact CD2-CD2 3.4Å; Y158-F245 HydrophobicContact CD2-CD2 3.4Å; Y158-F245 AromaticContact CD2-CE2 3.67Å; Y158-F245 HydrophobicContact CD2-CE2 3.67Å; Y158-F245 HydrophobicContact CD2-CG 4.23Å; Y158-F245 HydrophobicContact CE2-CB 4.27Å; Y158-F245 AromaticContact CE2-CD2 3.76Å; Y158-F245 HydrophobicContact CE2-CD2 3.76Å; Y158-F245 HydrophobicContact CE2-CE2 4.36Å; Y158-F245 HydrophobicContact CE2-CG 4.16Å; Y158-F245 AromaticContact CG-CD2 3.71Å; Y158-F245 HydrophobicContact CG-CD2 3.71Å; Y158-F245 AromaticContact CG-CE2 3.46Å; Y158-F245 HydrophobicContact CG-CE2 3.46Å; Y158-F245 VanDerWaalsContact CG-CE2 3.46Å; Y158-F245 HydrophobicContact CG-CZ 4.23Å; E166-F245 HydrophobicContact CB-CE2 4.39Å; E166-F245 HydrophobicContact CB-CZ 3.73Å; E166-F245 HydrophobicContact CG-CZ 4.05Å; C170-F245 VanDerWaalsContact SG-CD2 3.55Å; C170-F245 WeakPolarHBondContact SG-CE2 3.5Å; F245-G247 VanDerWaalsContact C-N 3.28Å; F245-G247 PolarHBondContact O-N 3.19Å; F245-L248 HydrophobicContact CD1-CD1 4.4Å; F245-L248 PolarHBondContact O-N 2.9Å; F245-R249 WeakPolarHBondContact O-CB 3.24Å; F245-R249 PolarHBondContact O-N 3.02Å
246P93.9Very high94Very high8 Ų818.7 Ų18.75%0.0529%0.09CC..Hα-helixtrans-48.5-46.9169.9-32.336000114L151 L242 L243 L250 Q378 P382L151-P246 HydrophobicContact CD2-CG 3.89Å; L242-P246 WeakPolarHBondContact O-CD 3.38Å; L242-P246 WeakPolarHBondContact O-CG 3.25Å; L243-P246 HydrophobicContact CD2-CB 4.46Å; L243-P246 WeakPolarHBondContact O-CD 3.3Å; P246-L250 VanDerWaalsContact O-CB 3.26Å; P246-L250 WeakPolarHBondContact O-CB 3.23Å; P246-L250 PolarHBondContact O-N 3.44Å; P246-Q378 HydrophobicContact CB-CB 4.29Å; P246-Q378 HydrophobicContact CG-CB 4.27Å; P246-Q378 HydrophobicContact CG-CG 4.13Å; P246-P382 HydrophobicContact CB-CG 4.26Å
247G92.8Very high93.8Very high1 Ų118.6 Ų18.61%0.019%0.09CC..Hα-helixtrans-72.1-42.8-179.700000114.3L243 A244 F245 R249 L250 A251 S483L243-G247 PolarHBondContact O-N 3.48Å; A244-G247 PolarHBondContact O-N 3Å; F245-G247 VanDerWaalsContact C-N 3.28Å; F245-G247 PolarHBondContact O-N 3.19Å; G247-R249 VanDerWaalsContact C-N 3.26Å; G247-R249 PolarHBondContact O-N 3.43Å; G247-L250 WeakPolarHBondContact O-CB 3.44Å; G247-L250 PolarHBondContact O-N 3.48Å; G247-A251 PolarHBondContact O-N 3.17Å; G247-S483 WeakPolarHBondContact CA-OG 3.23Å
248L92.3Very high93.6Very high30 Ų3019 Ų1916%0.1579%0.091CC..Hα-helixtrans-58.3-42.1175.2-69.3174.9000111.2V169 F173 A244 F245 A251 Q252 F486V169-L248 HydrophobicContact CG1-CD1 3.91Å; F173-L248 HydrophobicContact CE2-CD1 4.23Å; F173-L248 HydrophobicContact CE2-CD2 4.39Å; F173-L248 HydrophobicContact CE2-CG 4.43Å; F173-L248 HydrophobicContact CZ-CD2 4.29Å; A244-L248 WeakPolarHBondContact O-CG 3.5Å; A244-L248 PolarHBondContact O-N 3.36Å; F245-L248 HydrophobicContact CD1-CD1 4.4Å; F245-L248 PolarHBondContact O-N 2.9Å; L248-A251 PolarHBondContact O-N 2.9Å; L248-Q252 PolarHBondContact O-N 3.47Å; L248-F486 HydrophobicContact CD2-CB 4.38Å
249R91.1Very high93.4Very high53 Ų5320.1 Ų20.120%0.210%0.1CC..Hα-helixtrans-74.5-34.5178.8-171157.6-66.5158-3.7112.9F245 G247 A251 Q252 T253 V375F245-R249 WeakPolarHBondContact O-CB 3.24Å; F245-R249 PolarHBondContact O-N 3.02Å; G247-R249 VanDerWaalsContact C-N 3.26Å; G247-R249 PolarHBondContact O-N 3.43Å; R249-A251 VanDerWaalsContact C-N 3.28Å; R249-A251 PolarHBondContact O-N 2.83Å; R249-Q252 PolarHBondContact O-N 3.37Å; R249-T253 HydrophobicContact CG-CG2 4.18Å; R249-T253 WeakPolarHBondContact O-CG2 3.43Å; R249-T253 PolarHBondContact O-N 3.33Å; R249-T253 PolarHBondContact O-OG1 3.17Å; R249-V375 HydrophobicContact CG-CG1 4.29Å
250L92.8Very high93.1Very high10 Ų1022.7 Ų22.75%0.05211%0.113CC..Hα-helixtrans-58.3-43.8172.2176.864.2000110.8P246 G247 T253 H254 R327 Y379P246-L250 VanDerWaalsContact O-CB 3.26Å; P246-L250 WeakPolarHBondContact O-CB 3.23Å; P246-L250 PolarHBondContact O-N 3.44Å; G247-L250 WeakPolarHBondContact O-CB 3.44Å; G247-L250 PolarHBondContact O-N 3.48Å; L250-T253 PolarHBondContact O-OG1 2.88Å; L250-H254 WeakPolarHBondContact O-CB 3.43Å; L250-H254 PolarHBondContact O-N 3.2Å; L250-R327 VanDerWaalsContact CD2-NH2 3.32Å; L250-Y379 HydrophobicContact CD1-CD2 3.65Å; L250-Y379 HydrophobicContact CD1-CE2 3.41Å; L250-Y379 VanDerWaalsContact CD1-CE2 3.41Å
251A93Very high92.9Very high0 Ų023 Ų230%011%0.114CC..Hα-helixtrans-60.5-48.7176.800000112.3G247 L248 R249 H254 L255 S484 I488G247-A251 PolarHBondContact O-N 3.17Å; L248-A251 PolarHBondContact O-N 2.9Å; R249-A251 VanDerWaalsContact C-N 3.28Å; R249-A251 PolarHBondContact O-N 2.83Å; A251-H254 PolarHBondContact O-N 3.26Å; A251-L255 WeakPolarHBondContact O-CG 3.04Å; A251-L255 PolarHBondContact O-N 2.81Å; A251-L255 VanDerWaalsContact O-N 3.08Å; A251-S484 WeakPolarHBondContact CB-O 3.44Å; A251-I488 HydrophobicContact CB-CG1 3.96Å
252Q91.6Very high92.6Very high32 Ų3225.6 Ų25.615%0.1513%0.132CC..Hα-helixtrans-57.1-56.2177.2-173.4-177.25.800111.7L248 R249 H254 L255 D256 H491L248-Q252 PolarHBondContact O-N 3.47Å; R249-Q252 PolarHBondContact O-N 3.37Å; Q252-H254 PolarHBondContact O-N 3.4Å; Q252-L255 PolarHBondContact O-N 3.2Å; Q252-D256 PolarHBondContact O-N 3.34Å; Q252-H491 WeakPolarHBondContact CB-NE2 3.4Å; Q252-H491 WeakPolarHBondContact CG-NE2 3.26Å
253T92.7Very high92.4Very high4 Ų432.8 Ų32.83%0.02517%0.17CC..Hα-helixtrans-66.6-26.9-176.656.70000112.5R249 L250 A257 Y338R249-T253 HydrophobicContact CG-CG2 4.18Å; R249-T253 WeakPolarHBondContact O-CG2 3.43Å; R249-T253 PolarHBondContact O-N 3.33Å; R249-T253 PolarHBondContact O-OG1 3.17Å; L250-T253 PolarHBondContact O-OG1 2.88Å; T253-A257 WeakPolarHBondContact O-CB 3.11Å; T253-A257 PolarHBondContact O-N 3.39Å; T253-Y338 HydrophobicContact CG2-CD2 4.39Å
254H93.7Very high92.4Very high7 Ų739.7 Ų39.73%0.03220%0.196CC..Hα-helixtrans-67.5-51.9172.7176.464.1000111.8L250 A251 Q252 D256 A257 V258 L271 H272 F275L250-H254 WeakPolarHBondContact O-CB 3.43Å; L250-H254 PolarHBondContact O-N 3.2Å; A251-H254 PolarHBondContact O-N 3.26Å; Q252-H254 PolarHBondContact O-N 3.4Å; H254-D256 VanDerWaalsContact C-N 3.26Å; H254-D256 PolarHBondContact O-N 2.99Å; H254-A257 PolarHBondContact O-N 2.94Å; H254-A257 VanDerWaalsContact O-N 3.15Å; H254-V258 WeakPolarHBondContact O-CG2 3.44Å; H254-V258 PolarHBondContact O-N 3.49Å; H254-L271 PolarHBondContact CE1-O 2.88Å; H254-L271 VanDerWaalsContact CE1-O 3.27Å; H254-H272 AromaticContact CE1-ND1 3.73Å; H254-H272 AromaticContact NE2-ND1 3.54Å; H254-F275 HydrophobicContact CB-CD2 3.89Å; H254-F275 HydrophobicContact CB-CE2 4.33Å; H254-F275 AromaticContact CD2-CD2 3.6Å; H254-F275 AromaticContact CD2-CG 3.64Å; H254-F275 AromaticContact CG-CD2 3.58Å; H254-F275 AromaticContact CG-CG 3.9Å; H254-F275 AromaticContact NE2-CG 3.72Å
255L92.8Very high92.3Very high53 Ų5343.7 Ų43.728%0.27722%0.222SC..Hα-helixtrans-57.5-43.7177.5-68.5174.2000111A251 Q252 V258 Q259 H491 Q492A251-L255 WeakPolarHBondContact O-CG 3.04Å; A251-L255 PolarHBondContact O-N 2.81Å; A251-L255 VanDerWaalsContact O-N 3.08Å; Q252-L255 PolarHBondContact O-N 3.2Å; L255-V258 PolarHBondContact O-N 3Å; L255-Q259 WeakPolarHBondContact O-CB 3.12Å; L255-Q259 PolarHBondContact O-N 2.98Å; L255-H491 HydrophobicContact CD1-CB 4.24Å; L255-Q492 HydrophobicContact CD1-CG 4.24Å
256D92Very high92.4Very high22 Ų2248.9 Ų48.912%0.11825%0.25CS..Hα-helixtrans-65-40.3177.4-69.6-25.9000112.5Q252 H254 Q259 M260 A337 K344Q252-D256 PolarHBondContact O-N 3.34Å; H254-D256 VanDerWaalsContact C-N 3.26Å; H254-D256 PolarHBondContact O-N 2.99Å; D256-Q259 PolarHBondContact O-N 3.25Å; D256-M260 WeakPolarHBondContact O-CB 3.4Å; D256-M260 PolarHBondContact O-N 3.23Å; D256-A337 HydrophobicContact CB-CB 3.89Å; D256-K344 IonicContact OD1-NZ 2.74Å; D256-K344 PolarHBondContact OD1-NZ 3.17Å
257A93.1Very high92.4Very high0 Ų049.6 Ų49.60%025%0.254CS..Hα-helixtrans-68.1-38.8178.300000112.3T253 H254 M260 N261 L271 A337T253-A257 WeakPolarHBondContact O-CB 3.11Å; T253-A257 PolarHBondContact O-N 3.39Å; H254-A257 PolarHBondContact O-N 2.94Å; H254-A257 VanDerWaalsContact O-N 3.15Å; A257-M260 PolarHBondContact O-N 3.18Å; A257-N261 PolarHBondContact O-N 3.3Å; A257-N261 PolarHBondContact O-ND2 3.27Å; A257-L271 HydrophobicContact CB-CD1 4.05Å; A257-L271 HydrophobicContact CB-CD2 4.25Å; A257-A337 HydrophobicContact CB-CB 3.8Å
258V93.9Very high92.5Very high23 Ų2351.7 Ų51.714%0.13926%0.263CS..Hα-helixtrans-65.2-44.5176.21720000110.4H254 L255 M260 N261 S262 Q268 L271H254-V258 WeakPolarHBondContact O-CG2 3.44Å; H254-V258 PolarHBondContact O-N 3.49Å; L255-V258 PolarHBondContact O-N 3Å; V258-M260 PolarHBondContact O-N 3.42Å; V258-N261 CarbonylContact O-C 3.57Å; V258-N261 PolarHBondContact O-N 3Å; V258-S262 PolarHBondContact O-N 3.29Å; V258-Q268 HydrophobicContact CG1-CG 4.47Å; V258-Q268 PolarHBondContact O-NE2 2.96Å; V258-Q268 VanDerWaalsContact O-NE2 3.15Å; V258-L271 HydrophobicContact CG2-CB 4.17Å; V258-L271 HydrophobicContact CG2-CD1 4.24Å
259Q91.4Very high92.7Very high124 Ų12455.1 Ų55.158%0.57928%0.28SS*.Hα-helixtrans-62.1-43.5177.3-170.9-178.321.200111.7L255 D256 N261 S262L255-Q259 WeakPolarHBondContact O-CB 3.12Å; L255-Q259 PolarHBondContact O-N 2.98Å; D256-Q259 PolarHBondContact O-N 3.25Å; Q259-N261 PolarHBondContact O-N 2.7Å; Q259-S262 PolarHBondContact O-N 3.17Å; Q259-S262 PolarHBondContact O-OG 3.5Å
260M90.9Very high92.9Very high64 Ų6456.3 Ų56.332%0.31529%0.29SS..Hα-helixtrans-63.1-27.2178.5-177-178.569.700113.1D256 A257 V258 Q336 N340D256-M260 WeakPolarHBondContact O-CB 3.4Å; D256-M260 PolarHBondContact O-N 3.23Å; A257-M260 PolarHBondContact O-N 3.18Å; V258-M260 PolarHBondContact O-N 3.42Å; M260-Q336 HydrophobicContact CE-CB 4.22Å; M260-Q336 HydrophobicContact CE-CG 4.19Å; M260-Q336 HydrophobicContact SD-CG 3.97Å; M260-N340 PolarHBondContact SD-ND2 3.49Å
261N90.8Very high93Very high9 Ų955.9 Ų55.95%0.04829%0.288CS..THydrogen-bonded Turntrans-107.628.6-178.2-65.9-82.4000112.5A257 V258 Q259 D263 R264 I267 Q268A257-N261 PolarHBondContact O-N 3.3Å; A257-N261 PolarHBondContact O-ND2 3.27Å; V258-N261 CarbonylContact O-C 3.57Å; V258-N261 PolarHBondContact O-N 3Å; Q259-N261 PolarHBondContact O-N 2.7Å; N261-D263 PolarHBondContact O-N 3.3Å; N261-D263 VanDerWaalsContact O-N 3.15Å; N261-R264 PolarHBondContact O-N 2.81Å; N261-I267 HydrophobicContact CB-CB 4.46Å; N261-I267 HydrophobicContact CB-CG2 4.14Å; N261-Q268 HydrophobicContact CB-CG 4.49Å; N261-Q268 WeakPolarHBondContact O-CG 3.48Å
262S90.1Very high93.1Very high69 Ų6960.2 Ų60.248%0.48331%0.308SS..THydrogen-bonded Turntrans-55.2-31179.3-620000113.8V258 Q259 R264V258-S262 PolarHBondContact O-N 3.29Å; Q259-S262 PolarHBondContact O-N 3.17Å; Q259-S262 PolarHBondContact O-OG 3.5Å; S262-R264 VanDerWaalsContact C-N 3.29Å; S262-R264 PolarHBondContact O-N 2.82Å
263D92.3Very high93.3Very high153 Ų15363 Ų6382%0.81832%0.322SS*.THydrogen-bonded Turntrans-82.7-3.4-179.7-49.7-51.9000113.6N261N261-D263 PolarHBondContact O-N 3.3Å; N261-D263 VanDerWaalsContact O-N 3.15Å
264R93.6Very high93.3Very high147 Ų14762.9 Ų62.956%0.55532%0.322SS*.  trans-127.484.6-170.9-63.3-176.7-177.8-178.50.1111.2N261 S262 L266 I267 Q268N261-R264 PolarHBondContact O-N 2.81Å; S262-R264 VanDerWaalsContact C-N 3.29Å; S262-R264 PolarHBondContact O-N 2.82Å; R264-L266 VanDerWaalsContact C-N 3.32Å; R264-L266 PolarHBondContact O-N 3.32Å; R264-I267 HydrophobicContact CB-CB 4.26Å; R264-I267 HydrophobicContact CB-CD1 4.03Å; R264-I267 HydrophobicContact CB-CG1 4.22Å; R264-I267 HydrophobicContact CG-CD1 4.45Å; R264-I267 PolarHBondContact O-N 2.79Å; R264-I267 VanDerWaalsContact O-N 3.1Å; R264-Q268 PolarHBondContact O-N 3.44Å
265P92Very high93.4Very high84 Ų8464.2 Ų64.255%0.54533%0.327SS..Hα-helixtrans-62.4-36.1-170.623.9-34.2000113.1I267 Q268 I269P265-I267 VanDerWaalsContact C-N 3.33Å; P265-I267 PolarHBondContact O-N 3.49Å; P265-Q268 PolarHBondContact O-N 2.7Å; P265-I269 WeakPolarHBondContact O-CG1 3.46Å; P265-I269 PolarHBondContact O-N 3.09Å
266L94.6Very high93.5Very high133 Ų13365.9 Ų65.970%0.69634%0.336SS*.Hα-helixtrans-61-41.2177.6-65.7179.6000112.3R264 I269 L270R264-L266 VanDerWaalsContact C-N 3.32Å; R264-L266 PolarHBondContact O-N 3.32Å; L266-I269 PolarHBondContact O-N 2.94Å; L266-L270 WeakPolarHBondContact O-CG 3.32Å; L266-L270 PolarHBondContact O-N 3.46Å; L266-L270 VanDerWaalsContact O-N 3.08Å
267I93.7Very high93.6Very high24 Ų2465 Ų6512%0.12333%0.332CS..Hα-helixtrans-69.4-38.3178.8-60.5179.3000110N261 R264 P265 L270 L271 Y333N261-I267 HydrophobicContact CB-CB 4.46Å; N261-I267 HydrophobicContact CB-CG2 4.14Å; R264-I267 HydrophobicContact CB-CB 4.26Å; R264-I267 HydrophobicContact CB-CD1 4.03Å; R264-I267 HydrophobicContact CB-CG1 4.22Å; R264-I267 HydrophobicContact CG-CD1 4.45Å; R264-I267 PolarHBondContact O-N 2.79Å; R264-I267 VanDerWaalsContact O-N 3.1Å; P265-I267 VanDerWaalsContact C-N 3.33Å; P265-I267 PolarHBondContact O-N 3.49Å; I267-L270 PolarHBondContact O-N 3.38Å; I267-L271 HydrophobicContact CG2-CD1 3.98Å; I267-L271 HydrophobicContact CG2-CG 4.23Å; I267-L271 WeakPolarHBondContact O-CB 3.21Å; I267-L271 VanDerWaalsContact O-CG 3.26Å; I267-L271 WeakPolarHBondContact O-CG 3.45Å; I267-L271 PolarHBondContact O-N 3.04Å; I267-Y333 HydrophobicContact CD1-CE1 3.91Å; I267-Y333 HydrophobicContact CG2-CD1 4.21Å; I267-Y333 HydrophobicContact CG2-CE1 4.04Å
268Q94.5Very high93.7Very high44 Ų4465.2 Ų65.221%0.20633%0.333CS..Hα-helixtrans-61.5-44.9175.1-67.2-171.9-41.100112.2V258 N261 R264 P265 L270 L271 H272V258-Q268 HydrophobicContact CG1-CG 4.47Å; V258-Q268 PolarHBondContact O-NE2 2.96Å; V258-Q268 VanDerWaalsContact O-NE2 3.15Å; N261-Q268 HydrophobicContact CB-CG 4.49Å; N261-Q268 WeakPolarHBondContact O-CG 3.48Å; R264-Q268 PolarHBondContact O-N 3.44Å; P265-Q268 PolarHBondContact O-N 2.7Å; Q268-L270 VanDerWaalsContact C-N 3.31Å; Q268-L270 PolarHBondContact O-N 3.47Å; Q268-L271 PolarHBondContact O-N 3.43Å; Q268-H272 PolarHBondContact O-CD2 3.49Å; Q268-H272 PolarHBondContact O-N 2.84Å
269I95.4Very high93.8Very high102 Ų10266.7 Ų66.752%0.52334%0.342SS..Hα-helixtrans-58.3-46.5175.6-67166.4000110.1P265 L266 L271 H272 M273P265-I269 WeakPolarHBondContact O-CG1 3.46Å; P265-I269 PolarHBondContact O-N 3.09Å; L266-I269 PolarHBondContact O-N 2.94Å; I269-L271 PolarHBondContact O-N 3.12Å; I269-H272 PolarHBondContact O-N 3.4Å; I269-M273 HydrophobicContact CG2-CG 4.41Å; I269-M273 WeakPolarHBondContact O-CB 3.23Å; I269-M273 VanDerWaalsContact O-CG 3.32Å; I269-M273 WeakPolarHBondContact O-CG 3.36Å; I269-M273 PolarHBondContact O-N 2.9Å
270L95.9Very high94Very high79 Ų7963 Ų6341%0.41433%0.328SS..Hα-helixtrans-62.3-40.4177-68.1175.1000112.5L266 I267 Q268 M273 S274 L326 L330L266-L270 WeakPolarHBondContact O-CG 3.32Å; L266-L270 PolarHBondContact O-N 3.46Å; L266-L270 VanDerWaalsContact O-N 3.08Å; I267-L270 PolarHBondContact O-N 3.38Å; Q268-L270 VanDerWaalsContact C-N 3.31Å; Q268-L270 PolarHBondContact O-N 3.47Å; L270-M273 PolarHBondContact O-N 2.89Å; L270-S274 VanDerWaalsContact O-CB 3.25Å; L270-S274 WeakPolarHBondContact O-CB 3.38Å; L270-S274 PolarHBondContact O-N 3.4Å; L270-L326 HydrophobicContact CB-CD1 4.46Å; L270-L326 HydrophobicContact CD2-CD1 3.95Å; L270-L330 HydrophobicContact CB-CD1 4.19Å; L270-L330 HydrophobicContact CB-CD2 4.27Å; L270-L330 VanDerWaalsContact O-CD1 3.32Å; L270-L330 WeakPolarHBondContact O-CD1 3.33Å
271L95Very high94.3Very high0 Ų060.1 Ų60.10%031%0.314CS..Hα-helixtrans-63.9-41.9176.1-73.8169.9000111.7H254 A257 V258 I267 Q268 I269 S274 F275 L330H254-L271 PolarHBondContact CE1-O 2.88Å; H254-L271 VanDerWaalsContact CE1-O 3.27Å; A257-L271 HydrophobicContact CB-CD1 4.05Å; A257-L271 HydrophobicContact CB-CD2 4.25Å; V258-L271 HydrophobicContact CG2-CB 4.17Å; V258-L271 HydrophobicContact CG2-CD1 4.24Å; I267-L271 HydrophobicContact CG2-CD1 3.98Å; I267-L271 HydrophobicContact CG2-CG 4.23Å; I267-L271 WeakPolarHBondContact O-CB 3.21Å; I267-L271 VanDerWaalsContact O-CG 3.26Å; I267-L271 WeakPolarHBondContact O-CG 3.45Å; I267-L271 PolarHBondContact O-N 3.04Å; Q268-L271 PolarHBondContact O-N 3.43Å; I269-L271 PolarHBondContact O-N 3.12Å; L271-S274 WeakPolarHBondContact O-CB 3.4Å; L271-S274 PolarHBondContact O-N 3.21Å; L271-F275 WeakPolarHBondContact O-CB 3.36Å; L271-F275 PolarHBondContact O-N 3.18Å; L271-L330 HydrophobicContact CD2-CD2 4.26Å
272H95.3Very high94.5Very high92 Ų9261.1 Ų61.143%0.42632%0.319SS..Hα-helixtrans-66.9-43.2175.6-69.1-50.3000111.8H254 Q268 I269 S274 F275 L276H254-H272 AromaticContact CE1-ND1 3.73Å; H254-H272 AromaticContact NE2-ND1 3.54Å; Q268-H272 PolarHBondContact O-CD2 3.49Å; Q268-H272 PolarHBondContact O-N 2.84Å; I269-H272 PolarHBondContact O-N 3.4Å; H272-S274 VanDerWaalsContact C-N 3.28Å; H272-S274 PolarHBondContact O-N 3.36Å; H272-F275 PolarHBondContact O-N 3Å; H272-L276 WeakPolarHBondContact O-CB 3.3Å; H272-L276 PolarHBondContact O-N 3.26Å
273M94.8Very high94.7Very high91 Ų9160.6 Ų60.645%0.44831%0.313SS..Hα-helixtrans-59.4-40.8173.8-75-62.1-64.200111.8I269 L270 L276 S277 L326I269-M273 HydrophobicContact CG2-CG 4.41Å; I269-M273 WeakPolarHBondContact O-CB 3.23Å; I269-M273 VanDerWaalsContact O-CG 3.32Å; I269-M273 WeakPolarHBondContact O-CG 3.36Å; I269-M273 PolarHBondContact O-N 2.9Å; L270-M273 PolarHBondContact O-N 2.89Å; M273-L276 PolarHBondContact O-N 3.5Å; M273-S277 PolarHBondContact O-N 3.13Å; M273-L326 HydrophobicContact CB-CD2 3.98Å
274S94.3Very high94.7Very high1 Ų154 Ų541%0.00728%0.277CS..Hα-helixtrans-65.3-39.4175166.70000113L270 L271 H272 S277 R327L270-S274 VanDerWaalsContact O-CB 3.25Å; L270-S274 WeakPolarHBondContact O-CB 3.38Å; L270-S274 PolarHBondContact O-N 3.4Å; L271-S274 WeakPolarHBondContact O-CB 3.4Å; L271-S274 PolarHBondContact O-N 3.21Å; H272-S274 VanDerWaalsContact C-N 3.28Å; H272-S274 PolarHBondContact O-N 3.36Å; S274-S277 WeakPolarHBondContact O-CB 3.11Å; S274-S277 PolarHBondContact O-N 3.08Å; S274-R327 WeakPolarHBondContact OG-CG 3.39Å
275F94.4Very high94.7Very high34 Ų3447 Ų4715%0.14925%0.251CS..Hα-helixtrans-69.6-37.2176.3-173.4-99.5000112.2H254 L271 H272 S277 P278 I488H254-F275 HydrophobicContact CB-CD2 3.89Å; H254-F275 HydrophobicContact CB-CE2 4.33Å; H254-F275 AromaticContact CD2-CD2 3.6Å; H254-F275 AromaticContact CD2-CG 3.64Å; H254-F275 AromaticContact CG-CD2 3.58Å; H254-F275 AromaticContact CG-CG 3.9Å; H254-F275 AromaticContact NE2-CG 3.72Å; L271-F275 WeakPolarHBondContact O-CB 3.36Å; L271-F275 PolarHBondContact O-N 3.18Å; H272-F275 PolarHBondContact O-N 3Å; F275-S277 VanDerWaalsContact C-N 3.28Å; F275-S277 PolarHBondContact O-N 2.94Å; F275-P278 VanDerWaalsContact O-CD 3.27Å; F275-P278 WeakPolarHBondContact O-CD 3.47Å; F275-I488 HydrophobicContact CE1-CD1 3.53Å; F275-I488 HydrophobicContact CE2-CD1 4.34Å; F275-I488 HydrophobicContact CZ-CD1 3.34Å; F275-I488 HydrophobicContact CZ-CG1 4.1Å
276L95Very high94.7Very high88 Ų8844.6 Ų44.646%0.46124%0.235SC..Hα-helixtrans-78.2-11178-161.867.8000113.2H272 M273 P278 V279 V280H272-L276 WeakPolarHBondContact O-CB 3.3Å; H272-L276 PolarHBondContact O-N 3.26Å; M273-L276 PolarHBondContact O-N 3.5Å; L276-P278 VanDerWaalsContact C-CD 3.46Å; L276-P278 VanDerWaalsContact C-N 3.35Å; L276-V279 HydrophobicContact CD1-CB 3.97Å; L276-V279 HydrophobicContact CD1-CG1 4.36Å; L276-V279 HydrophobicContact CD1-CG2 3.91Å; L276-V279 HydrophobicContact CG-CB 4.27Å; L276-V279 WeakPolarHBondContact O-CA 3.4Å; L276-V279 WeakPolarHBondContact O-CB 3.37Å; L276-V279 PolarHBondContact O-N 3.46Å; L276-V280 PolarHBondContact O-N 3.19Å
277S94.9Very high94.4Very high5 Ų541 Ų414%0.03521%0.213CC..Hα-helixtrans-50.4-44.7-176.2107.80000114M273 S274 F275 V279 V280 V281 R327M273-S277 PolarHBondContact O-N 3.13Å; S274-S277 WeakPolarHBondContact O-CB 3.11Å; S274-S277 PolarHBondContact O-N 3.08Å; F275-S277 VanDerWaalsContact C-N 3.28Å; F275-S277 PolarHBondContact O-N 2.94Å; S277-V279 VanDerWaalsContact C-N 3.27Å; S277-V279 PolarHBondContact O-N 3.11Å; S277-V280 PolarHBondContact O-N 2.83Å; S277-V281 WeakPolarHBondContact O-CG2 3.48Å; S277-V281 PolarHBondContact O-N 2.65Å; S277-V281 VanDerWaalsContact O-N 3.08Å; S277-R327 WeakPolarHBondContact OG-CD 3.48Å; S277-R327 PolarHBondContact OG-NH1 2.76Å
278P95.1Very high94Very high3 Ų342.8 Ų42.82%0.01923%0.226CC..Hα-helixtrans-63.8-33.3178.9-25.439.1000112.5F275 L276 V281 L282 A477 Q480 V481F275-P278 VanDerWaalsContact O-CD 3.27Å; F275-P278 WeakPolarHBondContact O-CD 3.47Å; L276-P278 VanDerWaalsContact C-CD 3.46Å; L276-P278 VanDerWaalsContact C-N 3.35Å; P278-V281 WeakPolarHBondContact O-CB 3.46Å; P278-V281 PolarHBondContact O-N 2.71Å; P278-L282 WeakPolarHBondContact O-CG 3.24Å; P278-L282 PolarHBondContact O-N 2.95Å; P278-A477 HydrophobicContact CB-CB 4.16Å; P278-Q480 HydrophobicContact CB-CB 4.24Å; P278-Q480 HydrophobicContact CG-CB 4.19Å; P278-V481 HydrophobicContact CB-CG2 3.63Å
279V96.2Very high93.6Very high54 Ų5445.4 Ų45.433%0.32724%0.241SC..Hα-helixtrans-65.7-42.2176.4-178.20000110.5L276 S277 V281 L282 V283 V481L276-V279 HydrophobicContact CD1-CB 3.97Å; L276-V279 HydrophobicContact CD1-CG1 4.36Å; L276-V279 HydrophobicContact CD1-CG2 3.91Å; L276-V279 HydrophobicContact CG-CB 4.27Å; L276-V279 WeakPolarHBondContact O-CA 3.4Å; L276-V279 WeakPolarHBondContact O-CB 3.37Å; L276-V279 PolarHBondContact O-N 3.46Å; S277-V279 VanDerWaalsContact C-N 3.27Å; S277-V279 PolarHBondContact O-N 3.11Å; V279-V281 VanDerWaalsContact C-N 3.3Å; V279-V281 PolarHBondContact O-N 3.09Å; V279-L282 WeakPolarHBondContact O-CB 3.27Å; V279-L282 PolarHBondContact O-N 2.68Å; V279-L282 VanDerWaalsContact O-N 3.11Å; V279-V283 WeakPolarHBondContact O-CG2 3.33Å; V279-V283 PolarHBondContact O-N 2.92Å; V279-V481 HydrophobicContact CG2-CG1 4.25Å; V279-V481 HydrophobicContact CG2-CG2 3.69Å
280V95.9Very high93.2Very high48 Ų4840.9 Ų40.929%0.29122%0.219SC..Hα-helixtrans-60-43.5174.8-178.70000110.5L276 S277 L282 V283 L284 I319 L323L276-V280 PolarHBondContact O-N 3.19Å; S277-V280 PolarHBondContact O-N 2.83Å; V280-L282 VanDerWaalsContact C-N 3.32Å; V280-L282 PolarHBondContact O-N 3.09Å; V280-V283 PolarHBondContact O-N 2.91Å; V280-L284 HydrophobicContact CG1-CD1 4.41Å; V280-L284 WeakPolarHBondContact O-CG 3.49Å; V280-L284 PolarHBondContact O-N 3.34Å; V280-L284 VanDerWaalsContact O-N 3.12Å; V280-I319 HydrophobicContact CG1-CG2 4.21Å; V280-L323 HydrophobicContact CB-CD1 3.88Å; V280-L323 HydrophobicContact CG1-CD1 3.86Å
281V95.7Very high92.6Very high2 Ų238.1 Ų38.11%0.01220%0.203CC..Hα-helixtrans-58.5-43173.9176.50000111.1S277 P278 V279 V283 L284 W285 I320 L323 T473 A477S277-V281 WeakPolarHBondContact O-CG2 3.48Å; S277-V281 PolarHBondContact O-N 2.65Å; S277-V281 VanDerWaalsContact O-N 3.08Å; P278-V281 WeakPolarHBondContact O-CB 3.46Å; P278-V281 PolarHBondContact O-N 2.71Å; V279-V281 VanDerWaalsContact C-N 3.3Å; V279-V281 PolarHBondContact O-N 3.09Å; V281-V283 PolarHBondContact O-N 3.46Å; V281-L284 PolarHBondContact O-N 3.31Å; V281-W285 HydrophobicContact CG1-CE3 4.42Å; V281-W285 HydrophobicContact CG1-CH2 4.43Å; V281-W285 HydrophobicContact CG1-CZ3 3.77Å; V281-W285 WeakPolarHBondContact O-CZ3 3.49Å; V281-I320 HydrophobicContact CG2-CG1 4.3Å; V281-L323 HydrophobicContact CG2-CD1 4.19Å; V281-T473 HydrophobicContact CG1-CG2 4.39Å; V281-A477 HydrophobicContact CB-CB 3.96Å; V281-A477 HydrophobicContact CG1-CB 3.72Å
282L95.3Very high92.1Very high31 Ų3141 Ų4116%0.16222%0.218CC..Hα-helixtrans-61.7-45.6177.6-65.4179.5000112.8P278 V279 V280 L284 W285 W474 A477 A478 V481P278-L282 WeakPolarHBondContact O-CG 3.24Å; P278-L282 PolarHBondContact O-N 2.95Å; V279-L282 WeakPolarHBondContact O-CB 3.27Å; V279-L282 PolarHBondContact O-N 2.68Å; V279-L282 VanDerWaalsContact O-N 3.11Å; V280-L282 VanDerWaalsContact C-N 3.32Å; V280-L282 PolarHBondContact O-N 3.09Å; L282-L284 VanDerWaalsContact C-N 3.3Å; L282-L284 PolarHBondContact O-N 2.87Å; L282-W285 PolarHBondContact O-N 3.15Å; L282-W474 HydrophobicContact CD2-CD2 3.81Å; L282-W474 VanDerWaalsContact CD2-CE2 3.45Å; L282-W474 HydrophobicContact CD2-CG 3.98Å; L282-W474 HydrophobicContact CD2-CZ2 3.91Å; L282-W474 WeakPolarHBondContact CD2-O 3.4Å; L282-W474 PolarHBondContact O-NE1 3.32Å; L282-A477 HydrophobicContact CD2-CB 4.18Å; L282-A477 HydrophobicContact CG-CB 4.49Å; L282-A478 HydrophobicContact CD2-CB 3.72Å; L282-V481 HydrophobicContact CD1-CB 4.21Å; L282-V481 HydrophobicContact CD1-CG2 3.75Å
283V94.4Very high91.5Very high57 Ų5742.5 Ų42.535%0.34522%0.224SC..Hα-helixtrans-63.4-36.4-177.4171.60000111.5V279 V280 V281 W285 V286 I289 A290V279-V283 WeakPolarHBondContact O-CG2 3.33Å; V279-V283 PolarHBondContact O-N 2.92Å; V280-V283 PolarHBondContact O-N 2.91Å; V281-V283 PolarHBondContact O-N 3.46Å; V283-W285 PolarHBondContact O-N 3.45Å; V283-W285 VanDerWaalsContact O-N 3.08Å; V283-V286 PolarHBondContact O-N 2.93Å; V283-I289 HydrophobicContact CG1-CB 4.35Å; V283-I289 HydrophobicContact CG1-CG2 3.57Å; V283-A290 WeakPolarHBondContact O-CB 3.45Å
284L92.9Very high90.8Very high15 Ų1540 Ų408%0.07921%0.212CC..THydrogen-bonded Turntrans-60.2-19.5-179.8-74.7170.4000114.6V280 V281 L282 R316 I319 I320V280-L284 HydrophobicContact CG1-CD1 4.41Å; V280-L284 WeakPolarHBondContact O-CG 3.49Å; V280-L284 PolarHBondContact O-N 3.34Å; V280-L284 VanDerWaalsContact O-N 3.12Å; V281-L284 PolarHBondContact O-N 3.31Å; L282-L284 VanDerWaalsContact C-N 3.3Å; L282-L284 PolarHBondContact O-N 2.87Å; L284-R316 HydrophobicContact CB-CG 4.17Å; L284-R316 HydrophobicContact CD1-CG 4.24Å; L284-I319 HydrophobicContact CD1-CB 4.17Å; L284-I319 HydrophobicContact CD1-CG2 3.81Å; L284-I319 HydrophobicContact CD2-CD1 4.1Å; L284-I320 HydrophobicContact CD1-CG1 4.31Å
285W93.3Very high90Very high1 Ų141.3 Ų41.30%0.00422%0.223CC..THydrogen-bonded Turntrans-101.4-6.1175.9-86-100.2000113.9E193 F194 V281 L282 V283 K287 R316 I320 L393 T473 W474E193-W285 PolarHBondContact N-O 3.38Å; E193-W285 VanDerWaalsContact O-CD1 3.3Å; F194-W285 AromaticContact CD1-CD1 3.61Å; F194-W285 HydrophobicContact CD1-CG 4.29Å; F194-W285 HydrophobicContact CE1-CB 4.08Å; F194-W285 AromaticContact CE1-CD1 3.96Å; F194-W285 HydrophobicContact CE1-CG 4.19Å; V281-W285 HydrophobicContact CG1-CE3 4.42Å; V281-W285 HydrophobicContact CG1-CH2 4.43Å; V281-W285 HydrophobicContact CG1-CZ3 3.77Å; V281-W285 WeakPolarHBondContact O-CZ3 3.49Å; L282-W285 PolarHBondContact O-N 3.15Å; V283-W285 PolarHBondContact O-N 3.45Å; V283-W285 VanDerWaalsContact O-N 3.08Å; W285-K287 PolarHBondContact O-N 3.46Å; W285-R316 HydrophobicContact CH2-CG 4.25Å; W285-R316 HydrophobicContact CZ3-CG 4.13Å; W285-I320 HydrophobicContact CH2-CD1 3.31Å; W285-I320 HydrophobicContact CH2-CG1 4.35Å; W285-I320 HydrophobicContact CZ2-CD1 4.43Å; W285-I320 HydrophobicContact CZ3-CD1 3.66Å; W285-I320 HydrophobicContact CZ3-CG1 4.31Å; W285-L393 HydrophobicContact CZ2-CD2 4.38Å; W285-T473 HydrophobicContact CH2-CG2 4Å; W285-W474 AromaticContact CG-CD1 3.99Å
286V92.5Very high88.9Confident33 Ų3343.9 Ų43.920%0.224%0.238CC..BIsolated β-bridgetrans-81.198.7172.5-175.20000108Y191 L192 V283 P288 I289 A290Y191-V286 WeakPolarHBondContact O-CA 3.43Å; L192-V286 HydrophobicContact CD2-CG2 3.92Å; V283-V286 PolarHBondContact O-N 2.93Å; V286-P288 HydrophobicContact CG1-CG 3.91Å; V286-I289 HydrophobicContact CB-CB 4.22Å; V286-I289 HydrophobicContact CB-CD1 4.17Å; V286-I289 HydrophobicContact CB-CG1 4.32Å; V286-I289 HydrophobicContact CG1-CB 4.08Å; V286-I289 HydrophobicContact CG1-CD1 3.63Å; V286-I289 HydrophobicContact CG1-CG1 3.69Å; V286-I289 PolarHBondContact O-N 3.38Å; V286-A290 PolarHBondContact O-N 3.02Å
287K87.7Confident87.5Confident58 Ų5840.5 Ų40.525%0.25222%0.223SC..THydrogen-bonded Turntrans-49.7-49.1-174.3-165.6-178.8-1791800114D190 Y191 E193 W285 I289 R291 D292D190-K287 WeakPolarHBondContact O-CD 3.37Å; Y191-K287 PolarHBondContact O-N 3.36Å; E193-K287 HydrophobicContact CB-CB 4.47Å; W285-K287 PolarHBondContact O-N 3.46Å; K287-I289 VanDerWaalsContact C-N 3.27Å; K287-I289 PolarHBondContact O-N 2.88Å; K287-R291 HydrophobicContact CG-CB 4.26Å; K287-R291 PolarHBondContact O-N 2.92Å; K287-R291 VanDerWaalsContact O-N 3.11Å; K287-D292 PolarHBondContact O-N 2.94Å
288P85.1Confident85.8Confident60 Ų6045 Ų4539%0.3925%0.252SS..THydrogen-bonded Turntrans-67.1-25.6-179.524.7-34.7000114Y191 V286 D292Y191-P288 HydrophobicContact CD1-CG 4.45Å; V286-P288 HydrophobicContact CG1-CG 3.91Å; P288-D292 WeakPolarHBondContact CA-OD2 3.24Å
289I85.8Confident83.9Confident99 Ų9951.9 Ų51.951%0.50829%0.286SS..THydrogen-bonded Turntrans-90.4-39.1-177.1-58.5177.3000111.2V283 V286 K287 F293V283-I289 HydrophobicContact CG1-CB 4.35Å; V283-I289 HydrophobicContact CG1-CG2 3.57Å; V286-I289 HydrophobicContact CB-CB 4.22Å; V286-I289 HydrophobicContact CB-CD1 4.17Å; V286-I289 HydrophobicContact CB-CG1 4.32Å; V286-I289 HydrophobicContact CG1-CB 4.08Å; V286-I289 HydrophobicContact CG1-CD1 3.63Å; V286-I289 HydrophobicContact CG1-CG1 3.69Å; V286-I289 PolarHBondContact O-N 3.38Å; K287-I289 VanDerWaalsContact C-N 3.27Å; K287-I289 PolarHBondContact O-N 2.88Å; I289-F293 WeakPolarHBondContact O-CB 3.18Å
290A87.3Confident82.4Confident8 Ų852.9 Ų52.97%0.06631%0.307CS..THydrogen-bonded Turntrans-98.8-68.2-17500000112.1V283 V286 L294 F312V283-A290 WeakPolarHBondContact O-CB 3.45Å; V286-A290 PolarHBondContact O-N 3.02Å; A290-L294 WeakPolarHBondContact O-CB 3.47Å; A290-L294 WeakPolarHBondContact O-CG 3.44Å; A290-L294 PolarHBondContact O-N 3.04Å; A290-F312 HydrophobicContact CB-CE2 4Å; A290-F312 HydrophobicContact CB-CZ 3.79Å
291R84.6Confident80.6Confident20 Ų2060.9 Ų60.98%0.07534%0.338CS..Hα-helixtrans-69-52.2-172.3-173-177.6-68.4-93.80.8111.6E193 K287 F293 L294 A295 S309 F312 D313E193-R291 VanDerWaalsContact CD-NE 3.25Å; E193-R291 IonicContact OE1-CZ 2.72Å; E193-R291 IonicContact OE1-NE 3.51Å; E193-R291 PolarHBondContact OE1-NE 3.27Å; E193-R291 IonicContact OE1-NH2 2.76Å; E193-R291 PolarHBondContact OE1-NH2 3.02Å; E193-R291 IonicContact OE2-CZ 2.65Å; E193-R291 IonicContact OE2-NE 2.77Å; E193-R291 PolarHBondContact OE2-NE 3.26Å; E193-R291 IonicContact OE2-NH2 3.85Å; E193-R291 PolarHBondContact OE2-NH2 3.37Å; K287-R291 HydrophobicContact CG-CB 4.26Å; K287-R291 PolarHBondContact O-N 2.92Å; K287-R291 VanDerWaalsContact O-N 3.11Å; R291-F293 VanDerWaalsContact C-N 3.3Å; R291-F293 PolarHBondContact O-N 3Å; R291-L294 PolarHBondContact O-N 3.44Å; R291-A295 WeakPolarHBondContact O-CB 3.5Å; R291-A295 PolarHBondContact O-N 2.9Å; R291-S309 PolarHBondContact NH1-O 3.3Å; R291-S309 PolarHBondContact NH1-OG 3.48Å; R291-F312 HydrophobicContact CB-CD1 4.39Å; R291-F312 HydrophobicContact CB-CE1 4.03Å; R291-F312 HydrophobicContact CB-CE2 4.32Å; R291-F312 HydrophobicContact CB-CZ 4Å; R291-F312 HydrophobicContact CG-CD1 4.28Å; R291-F312 HydrophobicContact CG-CE1 4.4Å; R291-F312 HydrophobicContact CG-CG 4.47Å; R291-F312 VanDerWaalsContact CZ-CD1 3.5Å; R291-D313 IonicContact CZ-OD1 2.85Å; R291-D313 IonicContact NH1-OD1 2.64Å; R291-D313 IonicContact NH2-OD1 3.37Å; R291-D313 PolarHBondContact NH2-OD1 2.98Å; R291-D313 IonicContact NH2-OD2 2.74Å
292D83.5Confident78.6Confident61 Ų6165.3 Ų65.333%0.32637%0.365SS..Hα-helixtrans-69-32.8-174.2-61.8-23.1000111.6K287 P288 N296K287-D292 PolarHBondContact O-N 2.94Å; P288-D292 WeakPolarHBondContact CA-OD2 3.24Å; D292-N296 WeakPolarHBondContact O-CA 3.31Å; D292-N296 WeakPolarHBondContact O-CB 3.35Å; D292-N296 PolarHBondContact O-N 3.46Å
293F83.1Confident77.1Confident123 Ų12367.7 Ų67.754%0.53939%0.385SS..Hα-helixtrans-65.9-44.2175.1-177.9-99.8000112.4I289 R291 N296 A297I289-F293 WeakPolarHBondContact O-CB 3.18Å; R291-F293 VanDerWaalsContact C-N 3.3Å; R291-F293 PolarHBondContact O-N 3Å; F293-N296 CarbonylContact O-C 3.52Å; F293-A297 VanDerWaalsContact O-CA 3.27Å; F293-A297 WeakPolarHBondContact O-CA 3.39Å; F293-A297 PolarHBondContact O-N 3.05Å; F293-A297 VanDerWaalsContact O-N 3.12Å
294L80.8Confident75.9Confident40 Ų4068.4 Ų68.421%0.20939%0.389CS..Hα-helixtrans-77.1-30.3178.7-72.9167.1000112.7A290 R291 L306 V307 F312 M315A290-L294 WeakPolarHBondContact O-CB 3.47Å; A290-L294 WeakPolarHBondContact O-CG 3.44Å; A290-L294 PolarHBondContact O-N 3.04Å; R291-L294 PolarHBondContact O-N 3.44Å; L294-L306 WeakPolarHBondContact O-CB 3.45Å; L294-L306 PolarHBondContact O-N 2.6Å; L294-V307 HydrophobicContact CB-CG2 4.41Å; L294-V307 PolarHBondContact O-N 3.28Å; L294-F312 HydrophobicContact CD1-CD2 3.88Å; L294-F312 HydrophobicContact CD1-CE2 3.86Å; L294-M315 HydrophobicContact CD1-CE 3.61Å; L294-M315 HydrophobicContact CD1-SD 4.36Å
295A76.6Confident74.9Confident28 Ų2873 Ų7323%0.23142%0.418CS..Hα-helixtrans-77.2-30.8175.700000112.5R291 T305R291-A295 WeakPolarHBondContact O-CB 3.5Å; R291-A295 PolarHBondContact O-N 2.9Å; A295-T305 VanDerWaalsContact O-CA 3.27Å; A295-T305 WeakPolarHBondContact O-CA 3.45Å; A295-T305 WeakPolarHBondContact O-CG2 3.16Å
296N70.4Confident73.9Confident88 Ų8878.4 Ų78.447%0.47145%0.446SS..SBendtrans-130.649.9-176-58.4-57000111.6D292 F293 P298D292-N296 WeakPolarHBondContact O-CA 3.31Å; D292-N296 WeakPolarHBondContact O-CB 3.35Å; D292-N296 PolarHBondContact O-N 3.46Å; F293-N296 CarbonylContact O-C 3.52Å; N296-P298 VanDerWaalsContact O-CD 3.31Å; N296-P298 WeakPolarHBondContact O-CD 3.37Å; N296-P298 VanDerWaalsContact O-N 3.16Å
297A66.8Low73.1Confident17 Ų1778.4 Ų78.414%0.1445%0.446CS..EExtended strand (participates in β ladder)trans-60119.8-178.800000110.1F293 M299 V304 L306F293-A297 VanDerWaalsContact O-CA 3.27Å; F293-A297 WeakPolarHBondContact O-CA 3.39Å; F293-A297 PolarHBondContact O-N 3.05Å; F293-A297 VanDerWaalsContact O-N 3.12Å; A297-M299 PolarHBondContact O-N 3.14Å; A297-V304 PolarHBondContact N-O 3.06Å; A297-V304 PolarHBondContact O-N 2.93Å; A297-L306 HydrophobicContact CB-CD1 4.22Å
298P59.8Low72.8Confident99 Ų9978.8 Ų78.864%0.64346%0.456SS*.EExtended strand (participates in β ladder)trans-76.797.7-175.328.5-32.5000110.4N296 G300N296-P298 VanDerWaalsContact O-CD 3.31Å; N296-P298 WeakPolarHBondContact O-CD 3.37Å; N296-P298 VanDerWaalsContact O-N 3.16Å; P298-G300 PolarHBondContact O-N 2.97Å
299M53.5Low72.5Confident147 Ų14779.8 Ų79.872%0.72447%0.465SS*.EExtended strand (participates in β ladder)trans-93.875.6164.6-83.2-14589.700110.1A297 K301 T302A297-M299 PolarHBondContact O-N 3.14Å; M299-K301 PolarHBondContact O-N 2.89Å; M299-T302 CarbonylContact C-O 3.55Å; M299-T302 PolarHBondContact N-O 2.64Å
300G65.8Low72.3Confident76 Ų7678.2 Ų78.278%0.78447%0.466SS*.THydrogen-bonded Turntrans73.9-116.5175.700000113.1P298P298-G300 PolarHBondContact O-N 2.97Å
301K58.8Low72.1Confident215 Ų21578.3 Ų78.394%0.93547%0.467SS*.THydrogen-bonded Turntrans-90.4-2.5-177.1-66.5-175.9-1791790114.1M299M299-K301 PolarHBondContact O-N 2.89Å
302T52.8Low72.3Confident95 Ų9577.6 Ų77.658%0.58346%0.464SS*.EExtended strand (participates in β ladder)trans-131130.2-178.147.30000110M299M299-T302 CarbonylContact C-O 3.55Å; M299-T302 PolarHBondContact N-O 2.64Å
303S64.6Low72.5Confident82 Ų8275.4 Ų75.457%0.57345%0.453SS*.EExtended strand (participates in β ladder)trans-83.1125.8169.749.30000109.5
304V67.8Low72.8Confident71 Ų7169.8 Ų69.843%0.4343%0.429SS..EExtended strand (participates in β ladder)trans-102.7128.9173.6-178.70000108.4A297 L306A297-V304 PolarHBondContact N-O 3.06Å; A297-V304 PolarHBondContact O-N 2.93Å; V304-L306 PolarHBondContact O-N 2.96Å; V304-L306 VanDerWaalsContact O-N 3.13Å
305T73.1Confident73.2Confident112 Ų11269.8 Ų69.869%0.68743%0.428SS*.  trans-73.198.7172.8530000109.9A295A295-T305 VanDerWaalsContact O-CA 3.27Å; A295-T305 WeakPolarHBondContact O-CA 3.45Å; A295-T305 WeakPolarHBondContact O-CG2 3.16Å
306L70.9Confident74Confident115 Ų11568.8 Ų68.860%0.60242%0.418SS*.  trans-76.5-34.8-175.4-134.291.9000112L294 A297 V304L294-L306 WeakPolarHBondContact O-CB 3.45Å; L294-L306 PolarHBondContact O-N 2.6Å; A297-L306 HydrophobicContact CB-CD1 4.22Å; V304-L306 PolarHBondContact O-N 2.96Å; V304-L306 VanDerWaalsContact O-N 3.13Å
307V75.9Confident75.1Confident33 Ų3364.6 Ų64.620%0.240%0.396CS..SBendtrans-140.1132.8-176.2-173.80000109.9L294 A311 F312L294-V307 HydrophobicContact CB-CG2 4.41Å; L294-V307 PolarHBondContact O-N 3.28Å; V307-A311 HydrophobicContact CG1-CB 3.59Å; V307-F312 HydrophobicContact CG1-CB 4.02Å
308S81.5Confident76.4Confident66 Ų6669 Ų6946%0.46241%0.409SS..  trans-71160.2173.873.50000111.5A310 A311 F312S308-A310 VanDerWaalsContact C-N 3.29Å; S308-A310 PolarHBondContact O-N 2.93Å; S308-A311 PolarHBondContact O-N 3.46Å; S308-A311 VanDerWaalsContact OG-CB 3.26Å; S308-A311 WeakPolarHBondContact OG-CB 3.33Å; S308-A311 PolarHBondContact OG-N 3.34Å; S308-F312 PolarHBondContact O-N 3Å
309S80.1Confident78.1Confident81 Ų8166.7 Ų66.757%0.56639%0.391SS*.Hα-helixtrans-56.8-42-178.9-169.90000112.9R291 F312 D313R291-S309 PolarHBondContact NH1-O 3.3Å; R291-S309 PolarHBondContact NH1-OG 3.48Å; S309-F312 PolarHBondContact O-N 2.94Å; S309-D313 PolarHBondContact O-N 2.96Å
310A80.6Confident80.1Confident66 Ų6659.7 Ų59.755%0.54536%0.356SS..Hα-helixtrans-69.1-42.9177.500000112.1S308 F312 D313 S314S308-A310 VanDerWaalsContact C-N 3.29Å; S308-A310 PolarHBondContact O-N 2.93Å; A310-F312 VanDerWaalsContact C-N 3.28Å; A310-F312 PolarHBondContact O-N 3.02Å; A310-D313 PolarHBondContact O-N 3.32Å; A310-S314 PolarHBondContact O-N 3.1Å; A310-S314 VanDerWaalsContact O-N 3.12Å; A310-S314 PolarHBondContact O-OG 3.49Å
311A84.1Confident81.6Confident10 Ų1057.6 Ų57.68%0.08333%0.328CS..Hα-helixtrans-63.5-34.4177.800000112.1V307 S308 M315 F403V307-A311 HydrophobicContact CG1-CB 3.59Å; S308-A311 PolarHBondContact O-N 3.46Å; S308-A311 VanDerWaalsContact OG-CB 3.26Å; S308-A311 WeakPolarHBondContact OG-CB 3.33Å; S308-A311 PolarHBondContact OG-N 3.34Å; A311-M315 WeakPolarHBondContact O-CB 3.47Å; A311-M315 PolarHBondContact O-N 3.32Å; A311-F403 WeakPolarHBondContact CB-O 3.32Å
312F88Confident83.4Confident4 Ų450.1 Ų50.12%0.01831%0.307CS..Hα-helixtrans-65.3-42.8174.7176.9-91.4000111.8A290 R291 L294 V307 S308 S309 A310 S314 M315 R316A290-F312 HydrophobicContact CB-CE2 4Å; A290-F312 HydrophobicContact CB-CZ 3.79Å; R291-F312 HydrophobicContact CB-CD1 4.39Å; R291-F312 HydrophobicContact CB-CE1 4.03Å; R291-F312 HydrophobicContact CB-CE2 4.32Å; R291-F312 HydrophobicContact CB-CZ 4Å; R291-F312 HydrophobicContact CG-CD1 4.28Å; R291-F312 HydrophobicContact CG-CE1 4.4Å; R291-F312 HydrophobicContact CG-CG 4.47Å; R291-F312 VanDerWaalsContact CZ-CD1 3.5Å; L294-F312 HydrophobicContact CD1-CD2 3.88Å; L294-F312 HydrophobicContact CD1-CE2 3.86Å; V307-F312 HydrophobicContact CG1-CB 4.02Å; S308-F312 PolarHBondContact O-N 3Å; S309-F312 PolarHBondContact O-N 2.94Å; A310-F312 VanDerWaalsContact C-N 3.28Å; A310-F312 PolarHBondContact O-N 3.02Å; F312-S314 PolarHBondContact O-N 3.05Å; F312-M315 HydrophobicContact CD2-CE 3.7Å; F312-M315 HydrophobicContact CE2-CE 3.86Å; F312-M315 PolarHBondContact O-N 3.22Å; F312-R316 WeakPolarHBondContact O-CB 3.45Å; F312-R316 PolarHBondContact O-N 3.07Å
313D87.3Confident85.6Confident16 Ų1646.4 Ų46.49%0.08628%0.283CS..Hα-helixtrans-62.6-43.6178.2-74.6-35.7000111.5R291 S309 A310 R316 L317 F399R291-D313 IonicContact CZ-OD1 2.85Å; R291-D313 IonicContact NH1-OD1 2.64Å; R291-D313 IonicContact NH2-OD1 3.37Å; R291-D313 PolarHBondContact NH2-OD1 2.98Å; R291-D313 IonicContact NH2-OD2 2.74Å; S309-D313 PolarHBondContact O-N 2.96Å; A310-D313 PolarHBondContact O-N 3.32Å; D313-R316 PolarHBondContact O-N 3.45Å; D313-R316 IonicContact OD1-CZ 3.04Å; D313-R316 IonicContact OD1-NH1 3.33Å; D313-R316 IonicContact OD1-NH2 3.81Å; D313-R316 PolarHBondContact OD1-NH2 3.42Å; D313-L317 WeakPolarHBondContact O-CG 3.25Å; D313-L317 PolarHBondContact O-N 2.94Å; D313-F399 HydrophobicContact CB-CD1 3.62Å; D313-F399 HydrophobicContact CB-CE1 3.61Å
314S89.4Confident87.1Confident4 Ų442.8 Ų42.83%0.02826%0.258CS..Hα-helixtrans-64.7-43.4173.9-56.30000112.4A310 F312 R316 L317 W318 S400 G402A310-S314 PolarHBondContact O-N 3.1Å; A310-S314 VanDerWaalsContact O-N 3.12Å; A310-S314 PolarHBondContact O-OG 3.49Å; F312-S314 PolarHBondContact O-N 3.05Å; S314-R316 VanDerWaalsContact C-N 3.34Å; S314-R316 PolarHBondContact O-N 3.41Å; S314-L317 PolarHBondContact O-N 3.22Å; S314-W318 VanDerWaalsContact O-CD1 3.32Å; S314-W318 PolarHBondContact O-N 3.46Å; S314-S400 WeakPolarHBondContact CB-O 3.35Å; S314-S400 PolarHBondContact OG-O 3.32Å; S314-G402 PolarHBondContact OG-O 3.48Å
315M90.4Very high88.5Confident40 Ų4041.7 Ų41.720%0.19726%0.256CS..Hα-helixtrans-58.8-45.8176.5-175.3-163.670.500111.3L294 A311 F312 L317 W318 I319 F403L294-M315 HydrophobicContact CD1-CE 3.61Å; L294-M315 HydrophobicContact CD1-SD 4.36Å; A311-M315 WeakPolarHBondContact O-CB 3.47Å; A311-M315 PolarHBondContact O-N 3.32Å; F312-M315 HydrophobicContact CD2-CE 3.7Å; F312-M315 HydrophobicContact CE2-CE 3.86Å; F312-M315 PolarHBondContact O-N 3.22Å; M315-L317 VanDerWaalsContact C-N 3.34Å; M315-L317 PolarHBondContact O-N 3.49Å; M315-W318 PolarHBondContact O-N 3.22Å; M315-I319 HydrophobicContact CE-CD1 3.94Å; M315-I319 HydrophobicContact CG-CD1 3.74Å; M315-I319 HydrophobicContact CG-CG1 4.31Å; M315-I319 VanDerWaalsContact O-CG1 3.27Å; M315-I319 WeakPolarHBondContact O-CG1 3.47Å; M315-I319 PolarHBondContact O-N 3.43Å; M315-I319 HydrophobicContact SD-CD1 4.14Å; M315-F403 HydrophobicContact CB-CE1 4.04Å
316R92.8Very high89.6Confident7 Ų738.2 Ų38.23%0.02623%0.233CC..Hα-helixtrans-55.8-48.6177.3177.4177.463.9-160.8-11.8111L284 W285 F312 D313 S314 I319 I320L284-R316 HydrophobicContact CB-CG 4.17Å; L284-R316 HydrophobicContact CD1-CG 4.24Å; W285-R316 HydrophobicContact CH2-CG 4.25Å; W285-R316 HydrophobicContact CZ3-CG 4.13Å; F312-R316 WeakPolarHBondContact O-CB 3.45Å; F312-R316 PolarHBondContact O-N 3.07Å; D313-R316 PolarHBondContact O-N 3.45Å; D313-R316 IonicContact OD1-CZ 3.04Å; D313-R316 IonicContact OD1-NH1 3.33Å; D313-R316 IonicContact OD1-NH2 3.81Å; D313-R316 PolarHBondContact OD1-NH2 3.42Å; S314-R316 VanDerWaalsContact C-N 3.34Å; S314-R316 PolarHBondContact O-N 3.41Å; R316-I319 PolarHBondContact O-N 2.78Å; R316-I320 HydrophobicContact CG-CD1 3.94Å; R316-I320 VanDerWaalsContact O-CD1 3.22Å; R316-I320 WeakPolarHBondContact O-CD1 3.1Å; R316-I320 VanDerWaalsContact O-CG1 3.24Å; R316-I320 WeakPolarHBondContact O-CG1 3.5Å; R316-I320 PolarHBondContact O-N 2.9Å; R316-I320 VanDerWaalsContact O-N 3.13Å
317L93.1Very high90.8Very high0 Ų032.9 Ų32.90%021%0.205CC..Hα-helixtrans-61.1-47.1178.7-63.6175.8000111.7D313 S314 M315 I319 I320 V321 T390 L393 K394 F399 W401D313-L317 WeakPolarHBondContact O-CG 3.25Å; D313-L317 PolarHBondContact O-N 2.94Å; S314-L317 PolarHBondContact O-N 3.22Å; M315-L317 VanDerWaalsContact C-N 3.34Å; M315-L317 PolarHBondContact O-N 3.49Å; L317-I319 PolarHBondContact O-N 3.31Å; L317-I320 PolarHBondContact O-N 3.03Å; L317-V321 WeakPolarHBondContact O-CG2 3.23Å; L317-V321 PolarHBondContact O-N 2.72Å; L317-T390 HydrophobicContact CB-CG2 4.43Å; L317-T390 HydrophobicContact CD2-CG2 3.54Å; L317-L393 HydrophobicContact CD2-CD2 4.15Å; L317-K394 HydrophobicContact CD1-CB 3.92Å; L317-K394 HydrophobicContact CD1-CG 4Å; L317-F399 HydrophobicContact CD1-CB 3.59Å; L317-F399 HydrophobicContact CD1-CD2 4.28Å; L317-F399 HydrophobicContact CD1-CG 4.04Å; L317-W401 HydrophobicContact CB-CZ3 3.96Å
318W94.1Very high91.8Very high109 Ų10934.2 Ų34.241%0.41321%0.21SC..Hα-helixtrans-61.3-42.2178-85.2116.6000113.1S314 M315 I320 V321 A322 W401 F403S314-W318 VanDerWaalsContact O-CD1 3.32Å; S314-W318 PolarHBondContact O-N 3.46Å; M315-W318 PolarHBondContact O-N 3.22Å; W318-I320 VanDerWaalsContact C-N 3.34Å; W318-I320 PolarHBondContact O-N 2.84Å; W318-V321 PolarHBondContact O-N 2.8Å; W318-A322 WeakPolarHBondContact O-CB 3.37Å; W318-A322 PolarHBondContact O-N 3.37Å; W318-W401 AromaticContact CD1-CE3 4Å; W318-W401 AromaticContact CD2-CE3 3.95Å; W318-W401 HydrophobicContact CD2-CE3 3.95Å; W318-W401 HydrophobicContact CD2-CZ3 4.05Å; W318-W401 AromaticContact CE2-CE3 3.47Å; W318-W401 VanDerWaalsContact CE2-CE3 3.47Å; W318-W401 HydrophobicContact CE3-CZ3 4.43Å; W318-W401 HydrophobicContact CG-CE3 4.27Å; W318-W401 HydrophobicContact CG-CZ3 4.35Å; W318-W401 HydrophobicContact CH2-CE3 4.45Å; W318-W401 HydrophobicContact CZ2-CB 4.34Å; W318-W401 HydrophobicContact CZ2-CD2 4.2Å; W318-W401 AromaticContact CZ2-CE3 3.77Å; W318-W401 HydrophobicContact CZ2-CE3 3.77Å; W318-W401 HydrophobicContact CZ2-CG 4.47Å; W318-W401 HydrophobicContact CZ2-CZ3 4.42Å; W318-W401 AromaticContact NE1-CE3 3.54Å; W318-W401 PolarHBondContact NE1-O 2.83Å; W318-W401 VanDerWaalsContact NE1-O 3.12Å; W318-F403 HydrophobicContact CB-CZ 4.34Å; W318-F403 AromaticContact CD1-CE2 3.66Å; W318-F403 AromaticContact CD1-CZ 3.31Å; W318-F403 HydrophobicContact CG-CE2 4.46Å; W318-F403 AromaticContact CG-CZ 3.96Å; W318-F403 HydrophobicContact CG-CZ 3.96Å; W318-F403 AromaticContact NE1-CE2 3.75Å; W318-F403 AromaticContact NE1-CZ 3.91Å
319I95.5Very high92.4Very high52 Ų5236.2 Ų36.227%0.26722%0.22SC..Hα-helixtrans-59.8-46.5176.6-68.9166.7000110V280 L284 M315 R316 L317 V321 A322 L323V280-I319 HydrophobicContact CG1-CG2 4.21Å; L284-I319 HydrophobicContact CD1-CB 4.17Å; L284-I319 HydrophobicContact CD1-CG2 3.81Å; L284-I319 HydrophobicContact CD2-CD1 4.1Å; M315-I319 HydrophobicContact CE-CD1 3.94Å; M315-I319 HydrophobicContact CG-CD1 3.74Å; M315-I319 HydrophobicContact CG-CG1 4.31Å; M315-I319 VanDerWaalsContact O-CG1 3.27Å; M315-I319 WeakPolarHBondContact O-CG1 3.47Å; M315-I319 PolarHBondContact O-N 3.43Å; M315-I319 HydrophobicContact SD-CD1 4.14Å; R316-I319 PolarHBondContact O-N 2.78Å; L317-I319 PolarHBondContact O-N 3.31Å; I319-V321 PolarHBondContact O-N 2.76Å; I319-A322 PolarHBondContact O-N 3.44Å; I319-L323 HydrophobicContact CG2-CD1 3.87Å; I319-L323 HydrophobicContact CG2-CG 4.22Å; I319-L323 WeakPolarHBondContact O-CB 3.03Å; I319-L323 VanDerWaalsContact O-CG 3.24Å; I319-L323 WeakPolarHBondContact O-CG 3.24Å; I319-L323 PolarHBondContact O-N 3.34Å
320I96.6Very high93.1Very high0 Ų032.6 Ų32.60%019%0.194CC..Hα-helixtrans-63.9-44.6-179.5-60.3152.5000111.1V281 L284 W285 R316 L317 W318 A322 L323 C324 I386 T390V281-I320 HydrophobicContact CG2-CG1 4.3Å; L284-I320 HydrophobicContact CD1-CG1 4.31Å; W285-I320 HydrophobicContact CH2-CD1 3.31Å; W285-I320 HydrophobicContact CH2-CG1 4.35Å; W285-I320 HydrophobicContact CZ2-CD1 4.43Å; W285-I320 HydrophobicContact CZ3-CD1 3.66Å; W285-I320 HydrophobicContact CZ3-CG1 4.31Å; R316-I320 HydrophobicContact CG-CD1 3.94Å; R316-I320 VanDerWaalsContact O-CD1 3.22Å; R316-I320 WeakPolarHBondContact O-CD1 3.1Å; R316-I320 VanDerWaalsContact O-CG1 3.24Å; R316-I320 WeakPolarHBondContact O-CG1 3.5Å; R316-I320 PolarHBondContact O-N 2.9Å; R316-I320 VanDerWaalsContact O-N 3.13Å; L317-I320 PolarHBondContact O-N 3.03Å; W318-I320 VanDerWaalsContact C-N 3.34Å; W318-I320 PolarHBondContact O-N 2.84Å; I320-A322 VanDerWaalsContact C-N 3.32Å; I320-A322 PolarHBondContact O-N 3.41Å; I320-L323 PolarHBondContact O-N 2.65Å; I320-C324 WeakPolarHBondContact O-CB 3.43Å; I320-C324 PolarHBondContact O-N 3.46Å; I320-C324 PolarHBondContact O-SG 2.92Å; I320-I386 HydrophobicContact CG2-CG2 3.67Å; I320-T390 HydrophobicContact CB-CG2 4.12Å; I320-T390 HydrophobicContact CD1-CG2 4.06Å; I320-T390 HydrophobicContact CG2-CG2 4.08Å; I320-T390 VanDerWaalsContact CG2-OG1 3.31Å; I320-T390 WeakPolarHBondContact CG2-OG1 3.44Å
321V96.6Very high93.7Very high32 Ų3229.4 Ų29.419%0.19417%0.168CC..Hα-helixtrans-59.6-44.3176.4172.50000110.8L317 W318 I319 C324 A325 L387 L391 W401L317-V321 WeakPolarHBondContact O-CG2 3.23Å; L317-V321 PolarHBondContact O-N 2.72Å; W318-V321 PolarHBondContact O-N 2.8Å; I319-V321 PolarHBondContact O-N 2.76Å; V321-C324 PolarHBondContact O-N 3.41Å; V321-A325 WeakPolarHBondContact O-CB 3.34Å; V321-A325 PolarHBondContact O-N 2.86Å; V321-L387 HydrophobicContact CG1-CD1 4.47Å; V321-L387 HydrophobicContact CG2-CD1 4.17Å; V321-L391 HydrophobicContact CG2-CD2 4.4Å; V321-W401 HydrophobicContact CG2-CH2 4.01Å; V321-W401 HydrophobicContact CG2-CZ3 4.39Å
322A97.1Very high94.1Very high58 Ų5831.5 Ų31.548%0.47917%0.173SC..Hα-helixtrans-63.4-41.9177.400000112.4W318 I319 I320 A325 L326W318-A322 WeakPolarHBondContact O-CB 3.37Å; W318-A322 PolarHBondContact O-N 3.37Å; I319-A322 PolarHBondContact O-N 3.44Å; I320-A322 VanDerWaalsContact C-N 3.32Å; I320-A322 PolarHBondContact O-N 3.41Å; A322-A325 PolarHBondContact O-N 3.46Å; A322-L326 WeakPolarHBondContact O-CB 3.34Å; A322-L326 PolarHBondContact O-N 3.27Å
323L97.3Very high94.4Very high17 Ų1734.9 Ų34.99%0.08919%0.187CC..Hα-helixtrans-65-41.6175.7-69.6176.4000111.8V280 V281 I319 I320 L326 R327V280-L323 HydrophobicContact CB-CD1 3.88Å; V280-L323 HydrophobicContact CG1-CD1 3.86Å; V281-L323 HydrophobicContact CG2-CD1 4.19Å; I319-L323 HydrophobicContact CG2-CD1 3.87Å; I319-L323 HydrophobicContact CG2-CG 4.22Å; I319-L323 WeakPolarHBondContact O-CB 3.03Å; I319-L323 VanDerWaalsContact O-CG 3.24Å; I319-L323 WeakPolarHBondContact O-CG 3.24Å; I319-L323 PolarHBondContact O-N 3.34Å; I320-L323 PolarHBondContact O-N 2.65Å; L323-L326 PolarHBondContact O-N 2.88Å; L323-R327 WeakPolarHBondContact O-CG 3.33Å; L323-R327 PolarHBondContact O-N 3.02Å; L323-R327 VanDerWaalsContact O-N 3.07Å
324C97.6Very high94.7Very high6 Ų634.3 Ų34.34%0.04118%0.184CC..Hα-helixtrans-62.3-44.7173.3-76.90000111.4I320 V321 L326 R327 L328 I383 L387I320-C324 WeakPolarHBondContact O-CB 3.43Å; I320-C324 PolarHBondContact O-N 3.46Å; I320-C324 PolarHBondContact O-SG 2.92Å; V321-C324 PolarHBondContact O-N 3.41Å; C324-L326 PolarHBondContact O-N 3.32Å; C324-R327 PolarHBondContact O-N 3.25Å; C324-L328 WeakPolarHBondContact O-CG 3.48Å; C324-L328 PolarHBondContact O-N 2.96Å; C324-I383 HydrophobicContact CB-CG2 3.96Å; C324-L387 HydrophobicContact CB-CB 4.16Å; C324-L387 HydrophobicContact CB-CD1 4.03Å; C324-L387 HydrophobicContact CB-CD2 4.49Å; C324-L387 HydrophobicContact CB-CG 4.46Å
325A97.1Very high94.9Very high48 Ų4834.2 Ų34.240%0.39718%0.183SC..Hα-helixtrans-60.9-44.5176.700000112V321 A322 R327 L328 V329V321-A325 WeakPolarHBondContact O-CB 3.34Å; V321-A325 PolarHBondContact O-N 2.86Å; A322-A325 PolarHBondContact O-N 3.46Å; A325-R327 VanDerWaalsContact C-N 3.32Å; A325-R327 PolarHBondContact O-N 3.41Å; A325-L328 PolarHBondContact O-N 3.44Å; A325-V329 WeakPolarHBondContact O-CG2 2.78Å; A325-V329 PolarHBondContact O-N 3.43Å
326L96.5Very high95.1Very high38 Ų3833.5 Ų33.520%0.19918%0.179CC..Hα-helixtrans-54.7-47.8174.1174.263.6000111.2L270 M273 A322 L323 C324 V329 L330L270-L326 HydrophobicContact CB-CD1 4.46Å; L270-L326 HydrophobicContact CD2-CD1 3.95Å; M273-L326 HydrophobicContact CB-CD2 3.98Å; A322-L326 WeakPolarHBondContact O-CB 3.34Å; A322-L326 PolarHBondContact O-N 3.27Å; L323-L326 PolarHBondContact O-N 2.88Å; C324-L326 PolarHBondContact O-N 3.32Å; L326-V329 PolarHBondContact O-N 3.27Å; L326-L330 HydrophobicContact CD1-CD1 3.74Å; L326-L330 HydrophobicContact CD1-CG 4.34Å; L326-L330 HydrophobicContact CG-CD1 3.99Å; L326-L330 WeakPolarHBondContact O-CG 3.35Å; L326-L330 PolarHBondContact O-N 3.29Å
327R95.9Very high95.1Very high4 Ų433.2 Ų33.22%0.01518%0.178CC..Hα-helixtrans-65.1-41.4178.6-68.2-174.567.1162.70.9112.4L250 S274 S277 L323 C324 A325 V329 L330 T331 Y379 I383L250-R327 VanDerWaalsContact CD2-NH2 3.32Å; S274-R327 WeakPolarHBondContact OG-CG 3.39Å; S277-R327 WeakPolarHBondContact OG-CD 3.48Å; S277-R327 PolarHBondContact OG-NH1 2.76Å; L323-R327 WeakPolarHBondContact O-CG 3.33Å; L323-R327 PolarHBondContact O-N 3.02Å; L323-R327 VanDerWaalsContact O-N 3.07Å; C324-R327 PolarHBondContact O-N 3.25Å; A325-R327 VanDerWaalsContact C-N 3.32Å; A325-R327 PolarHBondContact O-N 3.41Å; R327-V329 VanDerWaalsContact C-N 3.33Å; R327-V329 PolarHBondContact O-N 3.12Å; R327-L330 PolarHBondContact O-N 3.01Å; R327-T331 PolarHBondContact O-N 3.12Å; R327-T331 VanDerWaalsContact O-N 3.07Å; R327-T331 PolarHBondContact O-OG1 3.42Å; R327-Y379 WeakPolarHBondContact O-CE1 3.39Å; R327-Y379 PolarHBondContact O-OH 3.11Å; R327-I383 HydrophobicContact CB-CD1 3.59Å; R327-I383 HydrophobicContact CB-CG1 4.1Å; R327-I383 HydrophobicContact CB-CG2 4.44Å
328L95.6Very high95.2Very high60 Ų6034 Ų3431%0.31418%0.181SC..Hα-helixtrans-59.9-43.8175.9-70.4174.4000111.5C324 A325 L330 T331 L380 I383 L387C324-L328 WeakPolarHBondContact O-CG 3.48Å; C324-L328 PolarHBondContact O-N 2.96Å; A325-L328 PolarHBondContact O-N 3.44Å; L328-L330 VanDerWaalsContact C-N 3.31Å; L328-L330 PolarHBondContact O-N 3.11Å; L328-T331 WeakPolarHBondContact CA-OG1 3.49Å; L328-T331 VanDerWaalsContact O-CB 3.31Å; L328-T331 WeakPolarHBondContact O-CB 3.5Å; L328-T331 PolarHBondContact O-N 2.86Å; L328-T331 PolarHBondContact O-OG1 3.47Å; L328-L380 HydrophobicContact CD2-CD2 3.67Å; L328-I383 HydrophobicContact CD2-CG2 4.04Å; L328-I383 HydrophobicContact CG-CG2 4.01Å; L328-L387 HydrophobicContact CD1-CD2 4.33Å
329V94.5Very high95.1Very high109 Ų10929 Ų2966%0.66116%0.162SC*.Hα-helixtrans-62-39176.3171.10000111.5A325 L326 R327 T331A325-V329 WeakPolarHBondContact O-CG2 2.78Å; A325-V329 PolarHBondContact O-N 3.43Å; L326-V329 PolarHBondContact O-N 3.27Å; R327-V329 VanDerWaalsContact C-N 3.33Å; R327-V329 PolarHBondContact O-N 3.12Å; V329-T331 VanDerWaalsContact C-N 3.32Å; V329-T331 PolarHBondContact O-N 3.29Å
330L94.7Very high95Very high4 Ų427.9 Ų27.92%0.02116%0.157CC..Hα-helixtrans-81.3-7.1-178-68.4168.7000114.7L270 L271 L326 R327 L328 R332 Y333 H334L270-L330 HydrophobicContact CB-CD1 4.19Å; L270-L330 HydrophobicContact CB-CD2 4.27Å; L270-L330 VanDerWaalsContact O-CD1 3.32Å; L270-L330 WeakPolarHBondContact O-CD1 3.33Å; L271-L330 HydrophobicContact CD2-CD2 4.26Å; L326-L330 HydrophobicContact CD1-CD1 3.74Å; L326-L330 HydrophobicContact CD1-CG 4.34Å; L326-L330 HydrophobicContact CG-CD1 3.99Å; L326-L330 WeakPolarHBondContact O-CG 3.35Å; L326-L330 PolarHBondContact O-N 3.29Å; R327-L330 PolarHBondContact O-N 3.01Å; L328-L330 VanDerWaalsContact C-N 3.31Å; L328-L330 PolarHBondContact O-N 3.11Å; L330-R332 PolarHBondContact O-N 3.29Å; L330-R332 VanDerWaalsContact O-N 3.12Å; L330-Y333 HydrophobicContact CD2-CD2 3.79Å; L330-Y333 HydrophobicContact CD2-CE2 4.14Å; L330-Y333 WeakPolarHBondContact O-CB 3.21Å; L330-Y333 PolarHBondContact O-N 3.44Å; L330-H334 PolarHBondContact O-CD2 3.31Å; L330-H334 PolarHBondContact O-N 3.5Å
331T94.1Very high94.7Very high0 Ų030 Ų300%017%0.168CC..Hα-helixtrans-46.6-46.8179.8-54.30000112.4L31 R327 L328 V329 Y333 H334 L335 Y379 L380L31-T331 HydrophobicContact CD2-CG2 4.31Å; R327-T331 PolarHBondContact O-N 3.12Å; R327-T331 VanDerWaalsContact O-N 3.07Å; R327-T331 PolarHBondContact O-OG1 3.42Å; L328-T331 WeakPolarHBondContact CA-OG1 3.49Å; L328-T331 VanDerWaalsContact O-CB 3.31Å; L328-T331 WeakPolarHBondContact O-CB 3.5Å; L328-T331 PolarHBondContact O-N 2.86Å; L328-T331 PolarHBondContact O-OG1 3.47Å; V329-T331 VanDerWaalsContact C-N 3.32Å; V329-T331 PolarHBondContact O-N 3.29Å; T331-Y333 VanDerWaalsContact C-N 3.31Å; T331-Y333 PolarHBondContact O-N 3.47Å; T331-H334 PolarHBondContact O-N 2.84Å; T331-H334 VanDerWaalsContact O-N 3.17Å; T331-L335 HydrophobicContact CG2-CD1 4.03Å; T331-L335 HydrophobicContact CG2-CG 4.14Å; T331-L335 WeakPolarHBondContact O-CG 3.46Å; T331-L335 PolarHBondContact O-N 3.47Å; T331-Y379 HydrophobicContact CG2-CD1 3.82Å; T331-Y379 HydrophobicContact CG2-CE1 4.14Å; T331-Y379 WeakPolarHBondContact OG1-CE1 3.26Å; T331-L380 HydrophobicContact CG2-CD2 3.91Å; T331-L380 HydrophobicContact CG2-CG 4.34Å
332R92.4Very high94.3Very high53 Ų5328.6 Ų28.620%0.216%0.16CC..Hα-helixtrans-63.1-34-176.5-67.8-175.5176.6176.55.7113.3W30 L31 N34 S36 L330 L335 Q336W30-R332 VanDerWaalsContact CZ3-NH2 3.27Å; W30-R332 PolarHBondContact O-NH2 3.29Å; L31-R332 HydrophobicContact CD1-CG 4.37Å; N34-R332 PolarHBondContact ND2-NH1 2.95Å; S36-R332 PolarHBondContact OG-NH1 3.31Å; L330-R332 PolarHBondContact O-N 3.29Å; L330-R332 VanDerWaalsContact O-N 3.12Å; R332-L335 PolarHBondContact O-N 2.95Å; R332-Q336 WeakPolarHBondContact O-CB 3.43Å; R332-Q336 PolarHBondContact O-N 3.19Å
333Y93.8Very high94Very high76 Ų7627.3 Ų27.330%0.29814%0.144SC..Hα-helixtrans-66.6-41.2176.7-69.1-81.9000111.4I267 L330 T331 Q336 A337I267-Y333 HydrophobicContact CD1-CE1 3.91Å; I267-Y333 HydrophobicContact CG2-CD1 4.21Å; I267-Y333 HydrophobicContact CG2-CE1 4.04Å; L330-Y333 HydrophobicContact CD2-CD2 3.79Å; L330-Y333 HydrophobicContact CD2-CE2 4.14Å; L330-Y333 WeakPolarHBondContact O-CB 3.21Å; L330-Y333 PolarHBondContact O-N 3.44Å; T331-Y333 VanDerWaalsContact C-N 3.31Å; T331-Y333 PolarHBondContact O-N 3.47Å; Y333-Q336 PolarHBondContact O-N 3.09Å; Y333-A337 WeakPolarHBondContact O-CB 3.42Å; Y333-A337 PolarHBondContact O-N 3.28Å
334H93.8Very high93.6Very high4 Ų429.4 Ų29.42%0.01915%0.152CC..Hα-helixtrans-66.6-40.1174.7-72.1-81.5000112.3L330 T331 A337 Y338 Y379L330-H334 PolarHBondContact O-CD2 3.31Å; L330-H334 PolarHBondContact O-N 3.5Å; T331-H334 PolarHBondContact O-N 2.84Å; T331-H334 VanDerWaalsContact O-N 3.17Å; H334-A337 PolarHBondContact O-N 3.12Å; H334-Y338 PolarHBondContact O-N 3.2Å; H334-Y379 HydrophobicContact CB-CD2 4.24Å; H334-Y379 HydrophobicContact CB-CE2 4.03Å; H334-Y379 AromaticContact CD2-CE2 3.34Å; H334-Y379 WeakPolarHBondContact CD2-CE2 3.47Å; H334-Y379 AromaticContact CD2-CZ 3.42Å; H334-Y379 VanDerWaalsContact CD2-CZ 3.42Å; H334-Y379 PolarHBondContact CD2-OH 2.94Å; H334-Y379 AromaticContact CG-CE2 3.55Å; H334-Y379 AromaticContact ND1-CE2 4Å; H334-Y379 AromaticContact NE2-CE2 3.68Å; H334-Y379 AromaticContact NE2-CZ 3.88Å; H334-Y379 PolarHBondContact NE2-OH 3.23Å
335L93.8Very high93.2Very high2 Ų232.1 Ų32.11%0.0116%0.162CC..Hα-helixtrans-64.7-41.5175.9-65.4-176.4000112.2L37 T331 R332 Y338 L339 L372 T376L37-L335 HydrophobicContact CD1-CB 4.17Å; L37-L335 HydrophobicContact CD1-CD1 4.05Å; L37-L335 HydrophobicContact CD2-CB 4.05Å; T331-L335 HydrophobicContact CG2-CD1 4.03Å; T331-L335 HydrophobicContact CG2-CG 4.14Å; T331-L335 WeakPolarHBondContact O-CG 3.46Å; T331-L335 PolarHBondContact O-N 3.47Å; R332-L335 PolarHBondContact O-N 2.95Å; L335-Y338 WeakPolarHBondContact O-CB 3.42Å; L335-Y338 PolarHBondContact O-N 3.45Å; L335-L339 WeakPolarHBondContact O-CG 3.43Å; L335-L339 PolarHBondContact O-N 2.93Å; L335-L372 HydrophobicContact CB-CD1 4.38Å; L335-L372 HydrophobicContact CD2-CD1 4.22Å; L335-T376 HydrophobicContact CD1-CG2 4.03Å; L335-T376 HydrophobicContact CD2-CG2 4.28Å; L335-T376 WeakPolarHBondContact CD2-OG1 3.36Å
336Q94.8Very high92.8Very high25 Ų2529.8 Ų29.812%0.11714%0.143CC..Hα-helixtrans-66-40.4176.3-172.759.649.200111.6L37 F38 M260 R332 Y333 Y338 L339 N340L37-Q336 HydrophobicContact CD2-CB 3.99Å; F38-Q336 PolarHBondContact O-NE2 3.08Å; M260-Q336 HydrophobicContact CE-CB 4.22Å; M260-Q336 HydrophobicContact CE-CG 4.19Å; M260-Q336 HydrophobicContact SD-CG 3.97Å; R332-Q336 WeakPolarHBondContact O-CB 3.43Å; R332-Q336 PolarHBondContact O-N 3.19Å; Y333-Q336 PolarHBondContact O-N 3.09Å; Q336-Y338 VanDerWaalsContact C-N 3.28Å; Q336-Y338 PolarHBondContact O-N 3.37Å; Q336-L339 PolarHBondContact O-N 3.09Å; Q336-N340 PolarHBondContact NE2-OD1 3.32Å; Q336-N340 VanDerWaalsContact O-CG 3.24Å; Q336-N340 PolarHBondContact O-N 2.81Å; Q336-N340 PolarHBondContact O-ND2 2.96Å; Q336-N340 PolarHBondContact O-OD1 3.33Å
337A93Very high92.4Very high1 Ų132.3 Ų32.31%0.00815%0.154CC..Hα-helixtrans-58.9-41.4174.300000111.6D256 A257 Y333 H334 N340D256-A337 HydrophobicContact CB-CB 3.89Å; A257-A337 HydrophobicContact CB-CB 3.8Å; Y333-A337 WeakPolarHBondContact O-CB 3.42Å; Y333-A337 PolarHBondContact O-N 3.28Å; H334-A337 PolarHBondContact O-N 3.12Å; A337-N340 PolarHBondContact O-N 2.69Å
338Y93.6Very high92Very high16 Ų1636.8 Ų36.86%0.06318%0.175CC..Hα-helixtrans-63.6-44.6174178.1-106.2000113T253 H334 L335 Q336 N340 L341 V368 Y371 L372 V375T253-Y338 HydrophobicContact CG2-CD2 4.39Å; H334-Y338 PolarHBondContact O-N 3.2Å; L335-Y338 WeakPolarHBondContact O-CB 3.42Å; L335-Y338 PolarHBondContact O-N 3.45Å; Q336-Y338 VanDerWaalsContact C-N 3.28Å; Q336-Y338 PolarHBondContact O-N 3.37Å; Y338-N340 PolarHBondContact O-N 2.96Å; Y338-L341 HydrophobicContact CD2-CD2 4.46Å; Y338-L341 HydrophobicContact CE2-CD2 4.22Å; Y338-L341 WeakPolarHBondContact O-CB 3.36Å; Y338-L341 PolarHBondContact O-N 3.37Å; Y338-V368 HydrophobicContact CE1-CG1 4.13Å; Y338-V368 WeakPolarHBondContact CE1-O 3.31Å; Y338-Y371 WeakPolarHBondContact OH-CB 3.44Å; Y338-L372 HydrophobicContact CD1-CD1 4.3Å; Y338-V375 HydrophobicContact CD1-CB 4.18Å; Y338-V375 HydrophobicContact CD1-CG1 4.24Å; Y338-V375 HydrophobicContact CD1-CG2 3.98Å; Y338-V375 HydrophobicContact CD2-CG1 4.2Å; Y338-V375 HydrophobicContact CD2-CG2 4Å; Y338-V375 HydrophobicContact CE1-CB 4.2Å; Y338-V375 HydrophobicContact CE1-CG2 3.59Å; Y338-V375 HydrophobicContact CE2-CG2 3.63Å; Y338-V375 HydrophobicContact CG-CB 4.38Å; Y338-V375 HydrophobicContact CG-CG1 3.98Å; Y338-V375 HydrophobicContact CG-CG2 4.17Å; Y338-V375 VanDerWaalsContact CZ-CG2 3.41Å
339L92.9Very high91.6Very high3 Ų334.2 Ų34.22%0.01616%0.161CC..Hα-helixtrans-61.7-32.7177.4-72172.1000112.2L37 F38 R39 F40 V89 L335 Q336 L341 A342 F369 L372L37-L339 HydrophobicContact CB-CD1 4.15Å; F38-L339 WeakPolarHBondContact O-CD1 3.22Å; R39-L339 HydrophobicContact CB-CD2 4.45Å; F40-L339 WeakPolarHBondContact CD2-O 3.49Å; F40-L339 WeakPolarHBondContact CE2-O 3.29Å; V89-L339 HydrophobicContact CG2-CD1 4.42Å; L335-L339 WeakPolarHBondContact O-CG 3.43Å; L335-L339 PolarHBondContact O-N 2.93Å; Q336-L339 PolarHBondContact O-N 3.09Å; L339-L341 PolarHBondContact O-N 3.4Å; L339-A342 PolarHBondContact O-N 2.85Å; L339-F369 HydrophobicContact CD2-CD2 4.19Å; L339-L372 HydrophobicContact CD1-CD1 4.24Å; L339-L372 HydrophobicContact CD1-CD2 4.4Å; L339-L372 HydrophobicContact CD2-CD1 3.98Å; L339-L372 HydrophobicContact CD2-CD2 4.25Å; L339-L372 HydrophobicContact CG-CD1 3.99Å
340N92.8Very high91.2Very high30 Ų3031.4 Ų31.416%0.1614%0.14CC..THydrogen-bonded Turntrans-69.6-10.3175.1-66.8-12.5000114F40 M260 Q336 A337 Y338 A342 Q343 K344F40-N340 WeakPolarHBondContact CE2-OD1 3.36Å; M260-N340 PolarHBondContact SD-ND2 3.49Å; Q336-N340 PolarHBondContact NE2-OD1 3.32Å; Q336-N340 VanDerWaalsContact O-CG 3.24Å; Q336-N340 PolarHBondContact O-N 2.81Å; Q336-N340 PolarHBondContact O-ND2 2.96Å; Q336-N340 PolarHBondContact O-OD1 3.33Å; A337-N340 PolarHBondContact O-N 2.69Å; Y338-N340 PolarHBondContact O-N 2.96Å; N340-A342 PolarHBondContact O-N 3.45Å; N340-Q343 PolarHBondContact O-N 2.88Å; N340-Q343 VanDerWaalsContact O-N 3.11Å; N340-K344 PolarHBondContact O-N 3.46Å
341L90.2Very high90.8Very high44 Ų4438.9 Ų38.923%0.2317%0.172CC..Hα-helixtrans-60.2-31.6174.2-171.362.8000112.2Y338 L339 Q343 K344 W345 V368Y338-L341 HydrophobicContact CD2-CD2 4.46Å; Y338-L341 HydrophobicContact CE2-CD2 4.22Å; Y338-L341 WeakPolarHBondContact O-CB 3.36Å; Y338-L341 PolarHBondContact O-N 3.37Å; L339-L341 PolarHBondContact O-N 3.4Å; L341-Q343 VanDerWaalsContact C-N 3.34Å; L341-Q343 PolarHBondContact O-N 3.42Å; L341-K344 PolarHBondContact O-N 3.35Å; L341-W345 WeakPolarHBondContact O-CB 3.41Å; L341-W345 PolarHBondContact O-N 3.47Å; L341-V368 HydrophobicContact CB-CG1 4.48Å
342A89.6Confident90.4Very high3 Ų343.1 Ų43.13%0.02519%0.192CC..Hα-helixtrans-60.9-44175.100000111.7F40 L84 L339 N340 W345 V346 V365 V368F40-A342 HydrophobicContact CB-CB 4.42Å; F40-A342 HydrophobicContact CD2-CB 4.14Å; L84-A342 HydrophobicContact CD1-CB 4.25Å; L339-A342 PolarHBondContact O-N 2.85Å; N340-A342 PolarHBondContact O-N 3.45Å; A342-W345 PolarHBondContact O-N 2.89Å; A342-V346 PolarHBondContact O-N 2.97Å; A342-V346 VanDerWaalsContact O-N 3.15Å; A342-V365 HydrophobicContact CB-CG1 4.33Å; A342-V368 HydrophobicContact CB-CB 4.29Å; A342-V368 HydrophobicContact CB-CG1 4.29Å; A342-V368 HydrophobicContact CB-CG2 4.31Å
343Q90.1Very high89.8Confident30 Ų3045.5 Ų45.514%0.1422%0.223CC..Hα-helixtrans-68.1-45.7178.1-179.262.328.200111.6F40 N340 L341 W345 V346 E347F40-Q343 HydrophobicContact CE1-CB 4.04Å; F40-Q343 HydrophobicContact CE1-CG 4.42Å; F40-Q343 HydrophobicContact CE2-CB 4.04Å; F40-Q343 HydrophobicContact CZ-CB 3.69Å; F40-Q343 HydrophobicContact CZ-CG 4.3Å; N340-Q343 PolarHBondContact O-N 2.88Å; N340-Q343 VanDerWaalsContact O-N 3.11Å; L341-Q343 VanDerWaalsContact C-N 3.34Å; L341-Q343 PolarHBondContact O-N 3.42Å; Q343-W345 VanDerWaalsContact C-N 3.26Å; Q343-W345 PolarHBondContact O-N 3.02Å; Q343-V346 PolarHBondContact O-N 2.96Å; Q343-V346 VanDerWaalsContact O-N 3.13Å; Q343-E347 WeakPolarHBondContact CG-OE1 3.22Å; Q343-E347 PolarHBondContact NE2-OE1 2.64Å; Q343-E347 WeakPolarHBondContact O-CG 3.24Å; Q343-E347 PolarHBondContact O-N 2.85Å
344K88.6Confident89.4Confident61 Ų6143.9 Ų43.927%0.26523%0.229SC..Hα-helixtrans-57.8-40175.9-67.8-168.6-177.1-163.70112D256 N340 L341 E347 Q348D256-K344 IonicContact OD1-NZ 2.74Å; D256-K344 PolarHBondContact OD1-NZ 3.17Å; N340-K344 PolarHBondContact O-N 3.46Å; L341-K344 PolarHBondContact O-N 3.35Å; K344-E347 PolarHBondContact O-N 2.87Å; K344-Q348 WeakPolarHBondContact O-CB 3.31Å; K344-Q348 PolarHBondContact O-N 3.37Å
345W89.6Confident88.9Confident63 Ų6351.4 Ų51.424%0.23926%0.258CS..Hα-helixtrans-65.2-41.6176.917778.7000112.2L341 A342 Q343 Q348 M349 I356 I361 K364L341-W345 WeakPolarHBondContact O-CB 3.41Å; L341-W345 PolarHBondContact O-N 3.47Å; A342-W345 PolarHBondContact O-N 2.89Å; Q343-W345 VanDerWaalsContact C-N 3.26Å; Q343-W345 PolarHBondContact O-N 3.02Å; W345-Q348 PolarHBondContact O-N 2.9Å; W345-M349 HydrophobicContact CH2-SD 3.72Å; W345-M349 HydrophobicContact CZ2-SD 4.29Å; W345-M349 HydrophobicContact CZ3-SD 4.1Å; W345-M349 WeakPolarHBondContact O-CB 3.48Å; W345-M349 PolarHBondContact O-N 3.12Å; W345-I356 HydrophobicContact CH2-CD1 4.06Å; W345-I356 HydrophobicContact CZ2-CD1 4.02Å; W345-I361 HydrophobicContact CH2-CB 4.3Å; W345-I361 HydrophobicContact CH2-CG1 4.05Å; W345-I361 HydrophobicContact CH2-CG2 4.5Å; W345-I361 HydrophobicContact CZ3-CB 4.41Å; W345-I361 HydrophobicContact CZ3-CG1 4.46Å; W345-I361 HydrophobicContact CZ3-CG2 4.12Å; W345-K364 HydrophobicContact CD2-CB 4.39Å; W345-K364 HydrophobicContact CD2-CG 3.67Å; W345-K364 HydrophobicContact CE3-CB 4.25Å; W345-K364 HydrophobicContact CE3-CG 3.96Å; W345-K364 HydrophobicContact CG-CG 4.12Å; W345-K364 HydrophobicContact CH2-CB 4.1Å; W345-K364 HydrophobicContact CH2-CG 4.35Å; W345-K364 HydrophobicContact CZ2-CB 4.22Å; W345-K364 HydrophobicContact CZ2-CG 4.09Å; W345-K364 HydrophobicContact CZ3-CB 4.11Å; W345-K364 HydrophobicContact CZ3-CG 4.29Å
346V88.6Confident88.5Confident0 Ų052.6 Ų52.60%026%0.264CS..Hα-helixtrans-62.6-43.4174.6169.90000111L82 L84 A342 Q343 Q348 M349 K350L82-V346 HydrophobicContact CB-CG1 4.16Å; L82-V346 HydrophobicContact CD2-CG1 4.03Å; L82-V346 HydrophobicContact CD2-CG2 4.22Å; L82-V346 HydrophobicContact CG-CG1 4.22Å; L84-V346 HydrophobicContact CD1-CB 4.49Å; L84-V346 HydrophobicContact CD1-CG2 3.75Å; L84-V346 HydrophobicContact CD2-CG2 4.31Å; L84-V346 HydrophobicContact CG-CG2 4.07Å; A342-V346 PolarHBondContact O-N 2.97Å; A342-V346 VanDerWaalsContact O-N 3.15Å; Q343-V346 PolarHBondContact O-N 2.96Å; Q343-V346 VanDerWaalsContact O-N 3.13Å; V346-Q348 VanDerWaalsContact C-N 3.31Å; V346-Q348 PolarHBondContact O-N 3.46Å; V346-M349 HydrophobicContact CG1-CE 4.26Å; V346-M349 WeakPolarHBondContact O-CB 3.46Å; V346-M349 PolarHBondContact O-N 3.31Å; V346-K350 WeakPolarHBondContact O-CG 3.3Å; V346-K350 PolarHBondContact O-N 3.48Å
347E88.2Confident88.1Confident91 Ų9151.8 Ų51.843%0.42526%0.261SS..Hα-helixtrans-62.9-36.7177-72.6167.2-167.400112.7Q343 K344Q343-E347 WeakPolarHBondContact CG-OE1 3.22Å; Q343-E347 PolarHBondContact NE2-OE1 2.64Å; Q343-E347 WeakPolarHBondContact O-CG 3.24Å; Q343-E347 PolarHBondContact O-N 2.85Å; K344-E347 PolarHBondContact O-N 2.87Å
348Q86.8Confident87.7Confident98 Ų9851.7 Ų51.746%0.45826%0.26SS..Hα-helixtrans-70.7-42.5174.4-171.165.37.200111.6K344 W345 V346 K350 K351 E352K344-Q348 WeakPolarHBondContact O-CB 3.31Å; K344-Q348 PolarHBondContact O-N 3.37Å; W345-Q348 PolarHBondContact O-N 2.9Å; V346-Q348 VanDerWaalsContact C-N 3.31Å; V346-Q348 PolarHBondContact O-N 3.46Å; Q348-K350 VanDerWaalsContact C-N 3.27Å; Q348-K350 PolarHBondContact O-N 3.27Å; Q348-K351 WeakPolarHBondContact O-CB 3.34Å; Q348-K351 PolarHBondContact O-N 3.37Å; Q348-E352 PolarHBondContact O-N 2.84Å
349M87.6Confident87.3Confident6 Ų654.5 Ų54.53%0.0328%0.276CS..Hα-helixtrans-56.8-40.8175.4178.7-166.468.500111.4K78 W345 V346 K351 E352 I356 I361K78-M349 HydrophobicContact CB-CG 4.06Å; K78-M349 HydrophobicContact CD-CG 4.32Å; K78-M349 HydrophobicContact CG-CG 3.99Å; W345-M349 HydrophobicContact CH2-SD 3.72Å; W345-M349 HydrophobicContact CZ2-SD 4.29Å; W345-M349 HydrophobicContact CZ3-SD 4.1Å; W345-M349 WeakPolarHBondContact O-CB 3.48Å; W345-M349 PolarHBondContact O-N 3.12Å; V346-M349 HydrophobicContact CG1-CE 4.26Å; V346-M349 WeakPolarHBondContact O-CB 3.46Å; V346-M349 PolarHBondContact O-N 3.31Å; M349-K351 PolarHBondContact O-N 3.27Å; M349-K351 VanDerWaalsContact O-N 3.16Å; M349-E352 PolarHBondContact O-N 2.87Å; M349-I356 HydrophobicContact SD-CD1 4.23Å; M349-I356 HydrophobicContact SD-CG2 4.06Å; M349-I361 HydrophobicContact CE-CD1 4.32Å; M349-I361 HydrophobicContact SD-CD1 4.06Å; M349-I361 HydrophobicContact SD-CG1 3.97Å
350K86.4Confident87Confident49 Ų4957.7 Ų57.721%0.21329%0.293CS..THydrogen-bonded Turntrans-58.3-26.1176.5-73-174-173.8-172.20113.7K78 I80 D81 L82 V346 Q348K78-K350 WeakPolarHBondContact O-CA 3.37Å; I80-K350 WeakPolarHBondContact O-CE 3.27Å; I80-K350 WeakPolarHBondContact O-CG 3.37Å; D81-K350 IonicContact OD1-NZ 3.33Å; D81-K350 PolarHBondContact OD1-NZ 3.46Å; L82-K350 WeakPolarHBondContact O-CE 3.22Å; L82-K350 PolarHBondContact O-NZ 2.88Å; V346-K350 WeakPolarHBondContact O-CG 3.3Å; V346-K350 PolarHBondContact O-N 3.48Å; Q348-K350 VanDerWaalsContact C-N 3.27Å; Q348-K350 PolarHBondContact O-N 3.27Å
351K86.4Confident86.7Confident162 Ų16256.4 Ų56.470%0.70429%0.286SS*.THydrogen-bonded Turntrans-84.7-18.3179.4-61.2173.8-172.9171.20112.9Q348 M349Q348-K351 WeakPolarHBondContact O-CB 3.34Å; Q348-K351 PolarHBondContact O-N 3.37Å; M349-K351 PolarHBondContact O-N 3.27Å; M349-K351 VanDerWaalsContact O-N 3.16Å
352E86.1Confident86.5Confident89 Ų8955.9 Ų55.942%0.41628%0.282SS..SBendtrans-88.3129.8-180-67.8176.9-166.600110.9K78 Q348 M349K78-E352 VanDerWaalsContact CB-O 3.25Å; K78-E352 WeakPolarHBondContact CB-O 3.48Å; K78-E352 HydrophobicContact CD-CB 3.98Å; K78-E352 IonicContact NZ-OE2 3.01Å; K78-E352 PolarHBondContact NZ-OE2 3.44Å; Q348-E352 PolarHBondContact O-N 2.84Å; M349-E352 PolarHBondContact O-N 2.87Å
353A79.3Confident86.5Confident103 Ų10362.2 Ų62.285%0.85131%0.306SS*.  trans-72.1138.9170.500000110.7
354G85Confident86.4Confident41 Ų4164.9 Ų64.942%0.42332%0.317SS..SBendtrans143.5-174.1171.500000113.7K78K78-G354 WeakPolarHBondContact CG-O 3.4Å; K78-G354 PolarHBondContact N-O 3.26Å
355R83.9Confident86.4Confident163 Ų16362.1 Ų62.162%0.61531%0.305SS*.EExtended strand (participates in β ladder)trans-114.2142.1173-73.5-174.2163.1174.8-0.6109.6V76V76-R355 WeakPolarHBondContact O-CA 3.43Å
356I85.6Confident86.4Confident27 Ų2761.8 Ų61.814%0.13831%0.31CS..EExtended strand (participates in β ladder)trans-126149.5176.1-170165.2000108.8T75 V76 K78 W345 M349 D360 I361T75-I356 WeakPolarHBondContact CA-O 3.41Å; V76-I356 PolarHBondContact N-O 2.89Å; V76-I356 PolarHBondContact O-N 3.07Å; K78-I356 HydrophobicContact CG-CB 4.01Å; K78-I356 HydrophobicContact CG-CG2 3.92Å; W345-I356 HydrophobicContact CH2-CD1 4.06Å; W345-I356 HydrophobicContact CZ2-CD1 4.02Å; M349-I356 HydrophobicContact SD-CD1 4.23Å; M349-I356 HydrophobicContact SD-CG2 4.06Å; I356-D360 HydrophobicContact CD1-CB 4.34Å; I356-D360 HydrophobicContact CG1-CB 4.1Å; I356-I361 HydrophobicContact CD1-CG1 4.22Å; I356-I361 HydrophobicContact CG1-CG1 4.42Å; I356-I361 HydrophobicContact CG2-CD1 3.65Å; I356-I361 HydrophobicContact CG2-CG1 3.85Å
357A86.5Confident86.4Confident7 Ų767.9 Ų67.96%0.05833%0.333CS..EExtended strand (participates in β ladder)trans-71.1137.9172.700000110.2P73 L74 I359 D360 I361P73-A357 HydrophobicContact CB-CB 3.89Å; P73-A357 HydrophobicContact CG-CB 4.15Å; L74-A357 WeakPolarHBondContact O-CA 3.22Å; A357-I359 HydrophobicContact CB-CG2 4Å; A357-I359 PolarHBondContact O-N 3.16Å; A357-D360 HydrophobicContact CB-CB 4.44Å; A357-D360 WeakPolarHBondContact CB-OD2 3.24Å; A357-D360 WeakPolarHBondContact O-CB 3.47Å; A357-D360 PolarHBondContact O-N 3.48Å; A357-I361 PolarHBondContact O-N 2.89Å
358A84.3Confident86.6Confident0 Ų064.2 Ų64.20%032%0.316CS..Hα-helixtrans-55.8-37.3176.600000111.9L48 L74 V76 D360 I361 Q362L48-A358 HydrophobicContact CD1-CB 3.71Å; L74-A358 PolarHBondContact O-N 2.71Å; V76-A358 HydrophobicContact CG2-CB 4.08Å; A358-D360 VanDerWaalsContact C-N 3.28Å; A358-D360 PolarHBondContact O-N 3.41Å; A358-I361 WeakPolarHBondContact O-CB 3.47Å; A358-I361 PolarHBondContact O-N 3.44Å; A358-Q362 WeakPolarHBondContact O-CG 3.38Å; A358-Q362 PolarHBondContact O-N 2.7Å; A358-Q362 VanDerWaalsContact O-N 3.1Å
359I85Confident86.7Confident75 Ų7560.5 Ų60.539%0.38530%0.299SS..Hα-helixtrans-64.8-30.1178-159.2166000112.8P73 A357 R363P73-I359 HydrophobicContact CB-CG2 4.42Å; A357-I359 HydrophobicContact CB-CG2 4Å; A357-I359 PolarHBondContact O-N 3.16Å; I359-R363 WeakPolarHBondContact O-CB 3.45Å; I359-R363 PolarHBondContact O-N 3.24Å
360D86.6Confident86.9Confident69 Ų6961.6 Ų61.637%0.36931%0.307SS..Hα-helixtrans-74.3-37.7179-68-30.9000111I356 A357 A358 R363 K364I356-D360 HydrophobicContact CD1-CB 4.34Å; I356-D360 HydrophobicContact CG1-CB 4.1Å; A357-D360 HydrophobicContact CB-CB 4.44Å; A357-D360 WeakPolarHBondContact CB-OD2 3.24Å; A357-D360 WeakPolarHBondContact O-CB 3.47Å; A357-D360 PolarHBondContact O-N 3.48Å; A358-D360 VanDerWaalsContact C-N 3.28Å; A358-D360 PolarHBondContact O-N 3.41Å; D360-R363 PolarHBondContact O-N 3.45Å; D360-R363 IonicContact OD1-NH1 2.78Å; D360-K364 WeakPolarHBondContact O-CB 3.4Å; D360-K364 PolarHBondContact O-N 3.48Å
361I85.8Confident87.1Confident3 Ų362.3 Ų62.32%0.01531%0.309CS..Hα-helixtrans-58.6-53.4171-61174.2000109.6P43 L48 L82 W345 M349 I356 A357 A358 R363 K364 V365P43-I361 HydrophobicContact CG-CG2 3.93Å; L48-I361 HydrophobicContact CD1-CD1 4.44Å; L48-I361 HydrophobicContact CD2-CD1 4.18Å; L82-I361 HydrophobicContact CD2-CG2 4.06Å; W345-I361 HydrophobicContact CH2-CB 4.3Å; W345-I361 HydrophobicContact CH2-CG1 4.05Å; W345-I361 HydrophobicContact CH2-CG2 4.5Å; W345-I361 HydrophobicContact CZ3-CB 4.41Å; W345-I361 HydrophobicContact CZ3-CG1 4.46Å; W345-I361 HydrophobicContact CZ3-CG2 4.12Å; M349-I361 HydrophobicContact CE-CD1 4.32Å; M349-I361 HydrophobicContact SD-CD1 4.06Å; M349-I361 HydrophobicContact SD-CG1 3.97Å; I356-I361 HydrophobicContact CD1-CG1 4.22Å; I356-I361 HydrophobicContact CG1-CG1 4.42Å; I356-I361 HydrophobicContact CG2-CD1 3.65Å; I356-I361 HydrophobicContact CG2-CG1 3.85Å; A357-I361 PolarHBondContact O-N 2.89Å; A358-I361 WeakPolarHBondContact O-CB 3.47Å; A358-I361 PolarHBondContact O-N 3.44Å; I361-R363 VanDerWaalsContact C-N 3.34Å; I361-R363 PolarHBondContact O-N 3.04Å; I361-K364 PolarHBondContact O-N 3Å; I361-V365 WeakPolarHBondContact O-CG2 3.22Å; I361-V365 PolarHBondContact O-N 2.94Å; I361-V365 VanDerWaalsContact O-N 3.07Å
362Q87Confident87.4Confident34 Ų3454.6 Ų54.616%0.15928%0.275CS..Hα-helixtrans-59.6-44.5179.8-71.2175.6-11.200111.9H42 P43 A358 K364 T366H42-Q362 HydrophobicContact CB-CB 4.41Å; H42-Q362 HydrophobicContact CB-CG 4.41Å; P43-Q362 WeakPolarHBondContact O-CG 3.5Å; P43-Q362 PolarHBondContact O-NE2 3.17Å; A358-Q362 WeakPolarHBondContact O-CG 3.38Å; A358-Q362 PolarHBondContact O-N 2.7Å; A358-Q362 VanDerWaalsContact O-N 3.1Å; Q362-K364 VanDerWaalsContact C-N 3.35Å; Q362-K364 PolarHBondContact O-N 2.92Å; Q362-T366 WeakPolarHBondContact O-CB 3.19Å; Q362-T366 PolarHBondContact O-N 2.85Å; Q362-T366 PolarHBondContact O-OG1 3.2Å
363R88.9Confident87.7Confident136 Ų13650.4 Ų50.451%0.51326%0.255SS..Hα-helixtrans-62.9-40.7179-174.5-177.4-70.2165.6-6.4111.3I359 D360 I361 R367I359-R363 WeakPolarHBondContact O-CB 3.45Å; I359-R363 PolarHBondContact O-N 3.24Å; D360-R363 PolarHBondContact O-N 3.45Å; D360-R363 IonicContact OD1-NH1 2.78Å; I361-R363 VanDerWaalsContact C-N 3.34Å; I361-R363 PolarHBondContact O-N 3.04Å; R363-R367 WeakPolarHBondContact O-CB 3.34Å; R363-R367 PolarHBondContact O-N 3.36Å
364K87.7Confident88.4Confident86 Ų8645.6 Ų45.637%0.37422%0.216SC..Hα-helixtrans-66.9-48.2179.3-166.572.6171-169.30111.7W345 D360 I361 Q362 R367 V368W345-K364 HydrophobicContact CD2-CB 4.39Å; W345-K364 HydrophobicContact CD2-CG 3.67Å; W345-K364 HydrophobicContact CE3-CB 4.25Å; W345-K364 HydrophobicContact CE3-CG 3.96Å; W345-K364 HydrophobicContact CG-CG 4.12Å; W345-K364 HydrophobicContact CH2-CB 4.1Å; W345-K364 HydrophobicContact CH2-CG 4.35Å; W345-K364 HydrophobicContact CZ2-CB 4.22Å; W345-K364 HydrophobicContact CZ2-CG 4.09Å; W345-K364 HydrophobicContact CZ3-CB 4.11Å; W345-K364 HydrophobicContact CZ3-CG 4.29Å; D360-K364 WeakPolarHBondContact O-CB 3.4Å; D360-K364 PolarHBondContact O-N 3.48Å; I361-K364 PolarHBondContact O-N 3Å; Q362-K364 VanDerWaalsContact C-N 3.35Å; Q362-K364 PolarHBondContact O-N 2.92Å; K364-R367 PolarHBondContact O-N 3.28Å; K364-V368 PolarHBondContact O-N 3.28Å
365V89.2Confident88.8Confident3 Ų343.9 Ų43.92%0.01820%0.197CC..Hα-helixtrans-62.1-45.1177.5176.70000110.8F40 H42 L84 A342 I361 R367 V368 F369F40-V365 HydrophobicContact CB-CG1 4.28Å; H42-V365 HydrophobicContact CB-CG1 4.5Å; L84-V365 HydrophobicContact CD1-CG2 4.15Å; L84-V365 HydrophobicContact CD2-CG2 4.21Å; A342-V365 HydrophobicContact CB-CG1 4.33Å; I361-V365 WeakPolarHBondContact O-CG2 3.22Å; I361-V365 PolarHBondContact O-N 2.94Å; I361-V365 VanDerWaalsContact O-N 3.07Å; V365-R367 PolarHBondContact O-N 3.27Å; V365-V368 PolarHBondContact O-N 3.5Å; V365-F369 PolarHBondContact O-N 2.94Å
366T89.3Confident89.3Confident55 Ų5536.1 Ų36.134%0.33717%0.168SC..Hα-helixtrans-64.7-40.3178.3-57.20000111.8Q362 V368 F369 C370Q362-T366 WeakPolarHBondContact O-CB 3.19Å; Q362-T366 PolarHBondContact O-N 2.85Å; Q362-T366 PolarHBondContact O-OG1 3.2Å; T366-V368 VanDerWaalsContact C-N 3.33Å; T366-V368 PolarHBondContact O-N 3.18Å; T366-F369 PolarHBondContact O-N 3.5Å; T366-F369 VanDerWaalsContact O-N 3.14Å; T366-C370 PolarHBondContact O-N 3.08Å; T366-C370 PolarHBondContact O-SG 3.12Å
367R90Very high89.7Confident128 Ų12835 Ų3548%0.48316%0.162SC..Hα-helixtrans-60.2-42.5178.1-173.8-176.4-63.5177.4-1111.6R363 K364 V365 F369 C370 Y371R363-R367 WeakPolarHBondContact O-CB 3.34Å; R363-R367 PolarHBondContact O-N 3.36Å; K364-R367 PolarHBondContact O-N 3.28Å; V365-R367 PolarHBondContact O-N 3.27Å; R367-F369 VanDerWaalsContact C-N 3.27Å; R367-F369 PolarHBondContact O-N 2.88Å; R367-C370 PolarHBondContact O-N 3.31Å; R367-Y371 HydrophobicContact CG-CD2 3.71Å; R367-Y371 HydrophobicContact CG-CE2 3.72Å; R367-Y371 VanDerWaalsContact O-CD2 3.25Å; R367-Y371 WeakPolarHBondContact O-CD2 3.43Å; R367-Y371 PolarHBondContact O-N 2.98Å; R367-Y371 VanDerWaalsContact O-N 3.16Å
368V90.6Very high90.1Very high14 Ų1435 Ų359%0.08516%0.161CC..Hα-helixtrans-57.2-45.1176.2174.40000110.3Y338 L341 A342 K364 V365 T366Y338-V368 HydrophobicContact CE1-CG1 4.13Å; Y338-V368 WeakPolarHBondContact CE1-O 3.31Å; L341-V368 HydrophobicContact CB-CG1 4.48Å; A342-V368 HydrophobicContact CB-CB 4.29Å; A342-V368 HydrophobicContact CB-CG1 4.29Å; A342-V368 HydrophobicContact CB-CG2 4.31Å; K364-V368 PolarHBondContact O-N 3.28Å; V365-V368 PolarHBondContact O-N 3.5Å; T366-V368 VanDerWaalsContact C-N 3.33Å; T366-V368 PolarHBondContact O-N 3.18Å
369F90.3Very high90.6Very high20 Ų2035.5 Ų35.59%0.08816%0.163CC..Hα-helixtrans-67.6-50.2178-178.2-118.8000112.6R39 V89 D93 L97 L339 V365 T366 R367 Y371 L372R39-F369 HydrophobicContact CB-CD2 3.73Å; R39-F369 HydrophobicContact CB-CE2 4Å; R39-F369 HydrophobicContact CB-CG 4.45Å; R39-F369 VanDerWaalsContact CD-CZ 3.41Å; R39-F369 HydrophobicContact CG-CD2 4.32Å; R39-F369 HydrophobicContact CG-CE2 4.26Å; V89-F369 HydrophobicContact CG1-CE2 4.12Å; V89-F369 HydrophobicContact CG1-CZ 4.34Å; V89-F369 HydrophobicContact CG2-CE2 4.09Å; D93-F369 HydrophobicContact CB-CE1 4.06Å; D93-F369 HydrophobicContact CB-CZ 3.85Å; L97-F369 HydrophobicContact CD2-CD1 4.13Å; L97-F369 HydrophobicContact CD2-CD2 4.32Å; L97-F369 HydrophobicContact CD2-CE1 3.87Å; L97-F369 HydrophobicContact CD2-CE2 4.06Å; L97-F369 HydrophobicContact CD2-CG 4.34Å; L97-F369 HydrophobicContact CD2-CZ 3.83Å; L97-F369 WeakPolarHBondContact CD2-O 3.5Å; L97-F369 HydrophobicContact CG-CZ 4.48Å; L339-F369 HydrophobicContact CD2-CD2 4.19Å; V365-F369 PolarHBondContact O-N 2.94Å; T366-F369 PolarHBondContact O-N 3.5Å; T366-F369 VanDerWaalsContact O-N 3.14Å; R367-F369 VanDerWaalsContact C-N 3.27Å; R367-F369 PolarHBondContact O-N 2.88Å; F369-Y371 PolarHBondContact O-N 2.77Å; F369-L372 HydrophobicContact CD2-CD2 4.46Å; F369-L372 HydrophobicContact CE2-CD2 4.17Å; F369-L372 WeakPolarHBondContact O-CB 3.25Å; F369-L372 PolarHBondContact O-N 2.77Å
370C90.3Very high91.2Very high30 Ų3032.2 Ų32.220%0.20315%0.146CC..Hα-helixtrans-59.4-23.5-177.4-73.60000114.4R98 T366 R367R98-C370 PolarHBondContact N-O 3.41Å; T366-C370 PolarHBondContact O-N 3.08Å; T366-C370 PolarHBondContact O-SG 3.12Å; R367-C370 PolarHBondContact O-N 3.31Å
371Y91.3Very high91.7Very high64 Ų6429 Ų2925%0.25113%0.128SC..THydrogen-bonded Turntrans-92.62.1177.8-83.4-101.4000114R98 Y338 R367 F369 T373 V374 V375R98-Y371 PolarHBondContact NH1-OH 3Å; Y338-Y371 WeakPolarHBondContact OH-CB 3.44Å; R367-Y371 HydrophobicContact CG-CD2 3.71Å; R367-Y371 HydrophobicContact CG-CE2 3.72Å; R367-Y371 VanDerWaalsContact O-CD2 3.25Å; R367-Y371 WeakPolarHBondContact O-CD2 3.43Å; R367-Y371 PolarHBondContact O-N 2.98Å; R367-Y371 VanDerWaalsContact O-N 3.16Å; F369-Y371 PolarHBondContact O-N 2.77Å; Y371-T373 VanDerWaalsContact C-N 3.34Å; Y371-T373 PolarHBondContact O-N 2.87Å; Y371-V374 HydrophobicContact CD1-CB 4.2Å; Y371-V374 HydrophobicContact CD1-CG1 4.34Å; Y371-V374 HydrophobicContact CD1-CG2 4.23Å; Y371-V374 WeakPolarHBondContact O-CB 3.44Å; Y371-V374 PolarHBondContact O-N 3.46Å; Y371-V375 WeakPolarHBondContact O-CG2 3.32Å; Y371-V375 PolarHBondContact O-N 3.29Å
372L93Very high92.2Very high0 Ų028.8 Ų28.80%013%0.128CC..Hα-helixtrans-53-46.5-177.5177.462000113.4V32 L97 L335 Y338 L339 F369 V375 T376V32-L372 HydrophobicContact CG1-CD2 3.83Å; L97-L372 HydrophobicContact CD1-CB 4.5Å; L97-L372 HydrophobicContact CD1-CD2 4.37Å; L97-L372 HydrophobicContact CD2-CB 4.3Å; L335-L372 HydrophobicContact CB-CD1 4.38Å; L335-L372 HydrophobicContact CD2-CD1 4.22Å; Y338-L372 HydrophobicContact CD1-CD1 4.3Å; L339-L372 HydrophobicContact CD1-CD1 4.24Å; L339-L372 HydrophobicContact CD1-CD2 4.4Å; L339-L372 HydrophobicContact CD2-CD1 3.98Å; L339-L372 HydrophobicContact CD2-CD2 4.25Å; L339-L372 HydrophobicContact CG-CD1 3.99Å; F369-L372 HydrophobicContact CD2-CD2 4.46Å; F369-L372 HydrophobicContact CE2-CD2 4.17Å; F369-L372 WeakPolarHBondContact O-CB 3.25Å; F369-L372 PolarHBondContact O-N 2.77Å; L372-V375 PolarHBondContact O-N 3.42Å; L372-T376 WeakPolarHBondContact O-CB 3.33Å; L372-T376 PolarHBondContact O-N 3.4Å; L372-T376 PolarHBondContact O-OG1 2.81Å
373T92.7Very high92.7Very high0 Ų027.2 Ų27.20%012%0.12CC..Hα-helixtrans-63.6-39.7176.735.70000112.8L97 R98 F100 Y103 Y371 V375 T376 L377L97-T373 HydrophobicContact CB-CG2 3.69Å; L97-T373 HydrophobicContact CD1-CG2 3.68Å; L97-T373 HydrophobicContact CG-CG2 4.32Å; R98-T373 WeakPolarHBondContact O-CB 3.41Å; R98-T373 PolarHBondContact O-OG1 3.22Å; F100-T373 HydrophobicContact CB-CG2 4.31Å; F100-T373 HydrophobicContact CD2-CG2 3.84Å; Y103-T373 HydrophobicContact CD1-CG2 3.9Å; Y103-T373 HydrophobicContact CG-CG2 4.19Å; Y371-T373 VanDerWaalsContact C-N 3.34Å; Y371-T373 PolarHBondContact O-N 2.87Å; T373-V375 VanDerWaalsContact C-N 3.35Å; T373-T376 WeakPolarHBondContact O-CB 3.28Å; T373-T376 PolarHBondContact O-N 3.35Å; T373-L377 PolarHBondContact O-N 3.15Å
374V93.3Very high93.1Very high3 Ų321.4 Ų21.42%0.01810%0.099CC..Hα-helixtrans-61.3-45.9174.7173.10000110.4F99 L154 Y371 T376 L377 Q378F99-V374 HydrophobicContact CB-CG2 4.39Å; F99-V374 HydrophobicContact CD2-CG2 3.64Å; F99-V374 HydrophobicContact CE2-CG2 4.49Å; F99-V374 HydrophobicContact CG-CG2 4.41Å; L154-V374 HydrophobicContact CD2-CB 4.48Å; L154-V374 HydrophobicContact CD2-CG1 3.84Å; L154-V374 HydrophobicContact CD2-CG2 4.24Å; Y371-V374 HydrophobicContact CD1-CB 4.2Å; Y371-V374 HydrophobicContact CD1-CG1 4.34Å; Y371-V374 HydrophobicContact CD1-CG2 4.23Å; Y371-V374 WeakPolarHBondContact O-CB 3.44Å; Y371-V374 PolarHBondContact O-N 3.46Å; V374-T376 VanDerWaalsContact C-N 3.31Å; V374-T376 PolarHBondContact O-N 2.92Å; V374-L377 PolarHBondContact O-N 2.94Å; V374-Q378 VanDerWaalsContact O-CG 3.32Å; V374-Q378 WeakPolarHBondContact O-CG 3.44Å; V374-Q378 PolarHBondContact O-N 3.46Å
375V93.2Very high93.6Very high5 Ų517.4 Ų17.43%0.038%0.082CC..Hα-helixtrans-65.4-38176.7178.50000111.5R249 Y338 Y371 L372 T373 Q378 Y379R249-V375 HydrophobicContact CG-CG1 4.29Å; Y338-V375 HydrophobicContact CD1-CB 4.18Å; Y338-V375 HydrophobicContact CD1-CG1 4.24Å; Y338-V375 HydrophobicContact CD1-CG2 3.98Å; Y338-V375 HydrophobicContact CD2-CG1 4.2Å; Y338-V375 HydrophobicContact CD2-CG2 4Å; Y338-V375 HydrophobicContact CE1-CB 4.2Å; Y338-V375 HydrophobicContact CE1-CG2 3.59Å; Y338-V375 HydrophobicContact CE2-CG2 3.63Å; Y338-V375 HydrophobicContact CG-CB 4.38Å; Y338-V375 HydrophobicContact CG-CG1 3.98Å; Y338-V375 HydrophobicContact CG-CG2 4.17Å; Y338-V375 VanDerWaalsContact CZ-CG2 3.41Å; Y371-V375 WeakPolarHBondContact O-CG2 3.32Å; Y371-V375 PolarHBondContact O-N 3.29Å; L372-V375 PolarHBondContact O-N 3.42Å; T373-V375 VanDerWaalsContact C-N 3.35Å; V375-Q378 PolarHBondContact O-N 3.03Å; V375-Y379 PolarHBondContact O-N 2.75Å
376T94.8Very high94Very high0 Ų017.5 Ų17.50%08%0.082CC..Hα-helixtrans-61.6-45175.8-51.90000111.2L31 Y103 L335 L372 T373 V374 Y379 L380L31-T376 HydrophobicContact CD2-CG2 4.31Å; Y103-T376 HydrophobicContact CD2-CG2 4.19Å; Y103-T376 HydrophobicContact CE2-CG2 3.39Å; L335-T376 HydrophobicContact CD1-CG2 4.03Å; L335-T376 HydrophobicContact CD2-CG2 4.28Å; L335-T376 WeakPolarHBondContact CD2-OG1 3.36Å; L372-T376 WeakPolarHBondContact O-CB 3.33Å; L372-T376 PolarHBondContact O-N 3.4Å; L372-T376 PolarHBondContact O-OG1 2.81Å; T373-T376 WeakPolarHBondContact O-CB 3.28Å; T373-T376 PolarHBondContact O-N 3.35Å; V374-T376 VanDerWaalsContact C-N 3.31Å; V374-T376 PolarHBondContact O-N 2.92Å; T376-Y379 PolarHBondContact O-N 3.21Å; T376-L380 HydrophobicContact CG2-CD1 3.67Å; T376-L380 HydrophobicContact CG2-CG 4.17Å; T376-L380 WeakPolarHBondContact O-CB 3.36Å; T376-L380 WeakPolarHBondContact O-CG 3.39Å; T376-L380 PolarHBondContact O-N 3.01Å
377L95.3Very high94.4Very high4 Ų415.2 Ų15.22%0.0217%0.068CC..Hα-helixtrans-60.4-46173.5-79.7170.7000111.8F99 Y103 L106 L154 T373 V374 Y379 L380 V381F99-L377 HydrophobicContact CB-CD1 4.27Å; Y103-L377 HydrophobicContact CD2-CD2 4.11Å; Y103-L377 HydrophobicContact CD2-CG 4.01Å; L106-L377 HydrophobicContact CD2-CD2 3.79Å; L154-L377 HydrophobicContact CD1-CB 3.95Å; L154-L377 HydrophobicContact CD1-CD1 4.48Å; T373-L377 PolarHBondContact O-N 3.15Å; V374-L377 PolarHBondContact O-N 2.94Å; L377-Y379 PolarHBondContact O-N 3.07Å; L377-L380 PolarHBondContact O-N 2.9Å; L377-V381 HydrophobicContact CB-CG2 4.35Å; L377-V381 HydrophobicContact CD2-CG2 3.83Å; L377-V381 VanDerWaalsContact O-CB 3.27Å; L377-V381 WeakPolarHBondContact O-CB 3.28Å; L377-V381 WeakPolarHBondContact O-CG2 3.48Å; L377-V381 PolarHBondContact O-N 3Å
378Q94.8Very high94.8Very high6 Ų69.2 Ų9.23%0.0285%0.046CC..Hα-helixtrans-61-31.9178.9-74177.7-27.100113L154 Y158 P246 V374 V375 P382L154-Q378 HydrophobicContact CD1-CG 3.91Å; Y158-Q378 PolarHBondContact OH-NE2 3.4Å; P246-Q378 HydrophobicContact CB-CB 4.29Å; P246-Q378 HydrophobicContact CG-CB 4.27Å; P246-Q378 HydrophobicContact CG-CG 4.13Å; V374-Q378 VanDerWaalsContact O-CG 3.32Å; V374-Q378 WeakPolarHBondContact O-CG 3.44Å; V374-Q378 PolarHBondContact O-N 3.46Å; V375-Q378 PolarHBondContact O-N 3.03Å; Q378-P382 VanDerWaalsContact O-CD 3.26Å; Q378-P382 WeakPolarHBondContact O-CD 3.46Å; Q378-P382 WeakPolarHBondContact O-CG 3.32Å
379Y94.9Very high95Very high11 Ų118.6 Ų8.64%0.0434%0.042CC..Hα-helixtrans-78.6-48.1174.6-171.9-91.9000112.4L250 R327 T331 H334 V375 T376 L377 I383L250-Y379 HydrophobicContact CD1-CD2 3.65Å; L250-Y379 HydrophobicContact CD1-CE2 3.41Å; L250-Y379 VanDerWaalsContact CD1-CE2 3.41Å; R327-Y379 WeakPolarHBondContact O-CE1 3.39Å; R327-Y379 PolarHBondContact O-OH 3.11Å; T331-Y379 HydrophobicContact CG2-CD1 3.82Å; T331-Y379 HydrophobicContact CG2-CE1 4.14Å; T331-Y379 WeakPolarHBondContact OG1-CE1 3.26Å; H334-Y379 HydrophobicContact CB-CD2 4.24Å; H334-Y379 HydrophobicContact CB-CE2 4.03Å; H334-Y379 AromaticContact CD2-CE2 3.34Å; H334-Y379 WeakPolarHBondContact CD2-CE2 3.47Å; H334-Y379 AromaticContact CD2-CZ 3.42Å; H334-Y379 VanDerWaalsContact CD2-CZ 3.42Å; H334-Y379 PolarHBondContact CD2-OH 2.94Å; H334-Y379 AromaticContact CG-CE2 3.55Å; H334-Y379 AromaticContact ND1-CE2 4Å; H334-Y379 AromaticContact NE2-CE2 3.68Å; H334-Y379 AromaticContact NE2-CZ 3.88Å; H334-Y379 PolarHBondContact NE2-OH 3.23Å; V375-Y379 PolarHBondContact O-N 2.75Å; T376-Y379 PolarHBondContact O-N 3.21Å; L377-Y379 PolarHBondContact O-N 3.07Å; Y379-I383 HydrophobicContact CD1-CD1 3.73Å; Y379-I383 HydrophobicContact CE1-CD1 3.46Å; Y379-I383 VanDerWaalsContact CE1-CD1 3.46Å; Y379-I383 VanDerWaalsContact O-CD1 3.25Å; Y379-I383 WeakPolarHBondContact O-CD1 3.15Å; Y379-I383 WeakPolarHBondContact O-CG1 3.43Å
380L96.6Very high95.2Very high6 Ų67.6 Ų7.63%0.0314%0.037CC..Hα-helixtrans-74.9-43.8-172.6-70.9179.5000113.4L31 Y103 V107 L328 T331 T376 L377 I383 L384L31-L380 HydrophobicContact CD2-CD1 3.72Å; Y103-L380 HydrophobicContact CE2-CD1 4.08Å; V107-L380 HydrophobicContact CG2-CD1 3.74Å; L328-L380 HydrophobicContact CD2-CD2 3.67Å; T331-L380 HydrophobicContact CG2-CD2 3.91Å; T331-L380 HydrophobicContact CG2-CG 4.34Å; T376-L380 HydrophobicContact CG2-CD1 3.67Å; T376-L380 HydrophobicContact CG2-CG 4.17Å; T376-L380 WeakPolarHBondContact O-CB 3.36Å; T376-L380 WeakPolarHBondContact O-CG 3.39Å; T376-L380 PolarHBondContact O-N 3.01Å; L377-L380 PolarHBondContact O-N 2.9Å; L380-I383 WeakPolarHBondContact O-CA 3.48Å; L380-I383 WeakPolarHBondContact O-CB 3.45Å; L380-I383 PolarHBondContact O-N 3.1Å; L380-L384 WeakPolarHBondContact O-CG 3.44Å; L380-L384 PolarHBondContact O-N 2.87Å
381V97.2Very high95.4Very high0 Ų06.5 Ų6.50%03%0.029CC..Hα-helixtrans-59.5-44.6-169.3176.20000113.2L106 G147 A150 L151 L377 I383 L384 I385L106-V381 HydrophobicContact CD2-CG2 3.53Å; G147-V381 VanDerWaalsContact O-CG1 3.25Å; G147-V381 WeakPolarHBondContact O-CG1 3.37Å; A150-V381 HydrophobicContact CB-CG2 4.4Å; L151-V381 HydrophobicContact CD1-CG1 3.9Å; L151-V381 HydrophobicContact CD2-CB 4.18Å; L151-V381 HydrophobicContact CD2-CG1 4.06Å; L151-V381 HydrophobicContact CG-CB 4.28Å; L151-V381 HydrophobicContact CG-CG1 3.61Å; L377-V381 HydrophobicContact CB-CG2 4.35Å; L377-V381 HydrophobicContact CD2-CG2 3.83Å; L377-V381 VanDerWaalsContact O-CB 3.27Å; L377-V381 WeakPolarHBondContact O-CB 3.28Å; L377-V381 WeakPolarHBondContact O-CG2 3.48Å; L377-V381 PolarHBondContact O-N 3Å; V381-I383 VanDerWaalsContact C-N 3.27Å; V381-I383 PolarHBondContact O-N 3.47Å; V381-L384 PolarHBondContact O-N 3.18Å; V381-I385 HydrophobicContact CG1-CD1 3.83Å; V381-I385 HydrophobicContact CG1-CG1 4.26Å; V381-I385 WeakPolarHBondContact O-CG1 3.33Å; V381-I385 PolarHBondContact O-N 3.33Å
382P96.9Very high95.4Very high0 Ų03.4 Ų3.40%02%0.017CC..Hα-helixtrans-60.7-35.7174.4-24.635.7000113.3L243 P246 Q378 I385 I386 Q480L243-P382 HydrophobicContact CD2-CB 3.97Å; L243-P382 HydrophobicContact CD2-CG 3.59Å; P246-P382 HydrophobicContact CB-CG 4.26Å; Q378-P382 VanDerWaalsContact O-CD 3.26Å; Q378-P382 WeakPolarHBondContact O-CD 3.46Å; Q378-P382 WeakPolarHBondContact O-CG 3.32Å; P382-I385 PolarHBondContact O-N 3.4Å; P382-I386 WeakPolarHBondContact O-CG1 3.42Å; P382-I386 PolarHBondContact O-N 2.87Å; P382-Q480 HydrophobicContact CB-CG 4.34Å
383I97.2Very high95.3Very high1 Ų13.5 Ų3.51%0.0052%0.018CC..Hα-helixtrans-66.1-43.8176.7-57.6164.1000109.8C324 R327 L328 Y379 L380 V381 I386 L387C324-I383 HydrophobicContact CB-CG2 3.96Å; R327-I383 HydrophobicContact CB-CD1 3.59Å; R327-I383 HydrophobicContact CB-CG1 4.1Å; R327-I383 HydrophobicContact CB-CG2 4.44Å; L328-I383 HydrophobicContact CD2-CG2 4.04Å; L328-I383 HydrophobicContact CG-CG2 4.01Å; Y379-I383 HydrophobicContact CD1-CD1 3.73Å; Y379-I383 HydrophobicContact CE1-CD1 3.46Å; Y379-I383 VanDerWaalsContact CE1-CD1 3.46Å; Y379-I383 VanDerWaalsContact O-CD1 3.25Å; Y379-I383 WeakPolarHBondContact O-CD1 3.15Å; Y379-I383 WeakPolarHBondContact O-CG1 3.43Å; L380-I383 WeakPolarHBondContact O-CA 3.48Å; L380-I383 WeakPolarHBondContact O-CB 3.45Å; L380-I383 PolarHBondContact O-N 3.1Å; V381-I383 VanDerWaalsContact C-N 3.27Å; V381-I383 PolarHBondContact O-N 3.47Å; I383-I386 PolarHBondContact O-N 3.41Å; I383-L387 VanDerWaalsContact O-CB 3.23Å; I383-L387 WeakPolarHBondContact O-CB 3.41Å; I383-L387 PolarHBondContact O-N 3.44Å
384L97.6Very high95.2Very high14 Ų144.8 Ų4.87%0.0732%0.023CC..Hα-helixtrans-63.2-44.2176.5-62.7178.4000111.1A110 L380 V381 I386 L387 F388A110-L384 HydrophobicContact CB-CD1 4.02Å; A110-L384 HydrophobicContact CB-CD2 4Å; L380-L384 WeakPolarHBondContact O-CG 3.44Å; L380-L384 PolarHBondContact O-N 2.87Å; V381-L384 PolarHBondContact O-N 3.18Å; L384-I386 PolarHBondContact O-N 2.68Å; L384-L387 PolarHBondContact O-N 3.23Å; L384-F388 HydrophobicContact CB-CD2 4.31Å; L384-F388 HydrophobicContact CD2-CE2 4.07Å; L384-F388 WeakPolarHBondContact O-CB 3.14Å; L384-F388 VanDerWaalsContact O-CD2 3.29Å; L384-F388 WeakPolarHBondContact O-CD2 3.26Å; L384-F388 PolarHBondContact O-N 2.84Å
385I97.9Very high94.8Very high1 Ų15.5 Ų5.51%0.0053%0.027CC..Hα-helixtrans-59.9-47.3177.8-68.1167.5000110.6V144 L148 L151 V381 P382 S389 V476V144-I385 HydrophobicContact CG1-CG2 4.31Å; L148-I385 HydrophobicContact CD2-CD1 3.94Å; L148-I385 HydrophobicContact CG-CD1 4.21Å; L151-I385 HydrophobicContact CD1-CD1 3.82Å; V381-I385 HydrophobicContact CG1-CD1 3.83Å; V381-I385 HydrophobicContact CG1-CG1 4.26Å; V381-I385 WeakPolarHBondContact O-CG1 3.33Å; V381-I385 PolarHBondContact O-N 3.33Å; P382-I385 PolarHBondContact O-N 3.4Å; I385-S389 WeakPolarHBondContact O-CB 3.46Å; I385-S389 PolarHBondContact O-N 3.05Å; I385-S389 PolarHBondContact O-OG 3.14Å; I385-V476 HydrophobicContact CG2-CG1 4.37Å; I385-V476 HydrophobicContact CG2-CG2 3.79Å
386I97.6Very high94.2Very high5 Ų57.2 Ų7.23%0.0264%0.036CC..Hα-helixtrans-62.1-48177.1-70172.7000110.7I320 P382 I383 L384 T390 T473 V476 A477I320-I386 HydrophobicContact CG2-CG2 3.67Å; P382-I386 WeakPolarHBondContact O-CG1 3.42Å; P382-I386 PolarHBondContact O-N 2.87Å; I383-I386 PolarHBondContact O-N 3.41Å; L384-I386 PolarHBondContact O-N 2.68Å; I386-T390 WeakPolarHBondContact O-CB 3.4Å; I386-T390 PolarHBondContact O-N 2.99Å; I386-T390 PolarHBondContact O-OG1 3.44Å; I386-T473 HydrophobicContact CG2-CG2 3.96Å; I386-V476 HydrophobicContact CD1-CG1 3.99Å; I386-V476 HydrophobicContact CG1-CB 4.13Å; I386-V476 HydrophobicContact CG1-CG1 3.7Å; I386-A477 HydrophobicContact CD1-CB 4.31Å
387L97.8Very high93.1Very high8 Ų87.5 Ų7.54%0.0424%0.039CC..Hα-helixtrans-61.2-55-177.7-179.358.5000111.3M114 V321 C324 L328 I383 L384 S389 T390 L391M114-L387 HydrophobicContact CE-CD1 4.37Å; M114-L387 HydrophobicContact CE-CD2 3.52Å; M114-L387 HydrophobicContact CE-CG 3.98Å; V321-L387 HydrophobicContact CG1-CD1 4.47Å; V321-L387 HydrophobicContact CG2-CD1 4.17Å; C324-L387 HydrophobicContact CB-CB 4.16Å; C324-L387 HydrophobicContact CB-CD1 4.03Å; C324-L387 HydrophobicContact CB-CD2 4.49Å; C324-L387 HydrophobicContact CB-CG 4.46Å; L328-L387 HydrophobicContact CD1-CD2 4.33Å; I383-L387 VanDerWaalsContact O-CB 3.23Å; I383-L387 WeakPolarHBondContact O-CB 3.41Å; I383-L387 PolarHBondContact O-N 3.44Å; L384-L387 PolarHBondContact O-N 3.23Å; L387-S389 PolarHBondContact O-N 2.87Å; L387-T390 WeakPolarHBondContact O-CA 3.38Å; L387-T390 WeakPolarHBondContact O-CB 3.23Å; L387-T390 PolarHBondContact O-N 3.38Å; L387-T390 VanDerWaalsContact O-N 3.09Å; L387-L391 WeakPolarHBondContact O-CG 3.19Å; L387-L391 PolarHBondContact O-N 2.85Å
388F97Very high92.1Very high2 Ų214.1 Ų14.11%0.0098%0.075CC..Hα-helixtrans-71.8-27.9-177.6-75.8-79.4000113.2A110 A113 M114 C140 T143 V144 L384 T390 L391 A392A110-F388 HydrophobicContact CB-CE2 3.95Å; A110-F388 HydrophobicContact CB-CZ 4.24Å; A110-F388 VanDerWaalsContact O-CZ 3.29Å; A110-F388 WeakPolarHBondContact O-CZ 3.35Å; A113-F388 HydrophobicContact CB-CE1 3.73Å; A113-F388 HydrophobicContact CB-CZ 4.03Å; M114-F388 HydrophobicContact CB-CZ 4.27Å; M114-F388 HydrophobicContact CE-CZ 4.18Å; C140-F388 HydrophobicContact CB-CB 4.42Å; C140-F388 HydrophobicContact CB-CD1 4.02Å; T143-F388 HydrophobicContact CG2-CB 4.42Å; T143-F388 HydrophobicContact CG2-CD1 4.24Å; T143-F388 HydrophobicContact CG2-CD2 3.35Å; T143-F388 HydrophobicContact CG2-CE1 4.38Å; T143-F388 HydrophobicContact CG2-CE2 3.57Å; T143-F388 HydrophobicContact CG2-CG 3.73Å; T143-F388 HydrophobicContact CG2-CZ 4.08Å; V144-F388 HydrophobicContact CG2-CB 3.85Å; L384-F388 HydrophobicContact CB-CD2 4.31Å; L384-F388 HydrophobicContact CD2-CE2 4.07Å; L384-F388 WeakPolarHBondContact O-CB 3.14Å; L384-F388 VanDerWaalsContact O-CD2 3.29Å; L384-F388 WeakPolarHBondContact O-CD2 3.26Å; L384-F388 PolarHBondContact O-N 2.84Å; F388-T390 VanDerWaalsContact C-N 3.32Å; F388-L391 HydrophobicContact CD1-CD1 4.16Å; F388-L391 HydrophobicContact CE1-CD1 4.26Å; F388-A392 VanDerWaalsContact O-CB 3.24Å; F388-A392 WeakPolarHBondContact O-CB 3.2Å; F388-A392 PolarHBondContact O-N 3.25Å
389S95.4Very high91.4Very high0 Ų014.7 Ų14.70%08%0.077CC..Hα-helixtrans-66.4-36.3168.4-59.50000111.4V144 I385 L387 L393 T473V144-S389 WeakPolarHBondContact CG2-OG 3.4Å; I385-S389 WeakPolarHBondContact O-CB 3.46Å; I385-S389 PolarHBondContact O-N 3.05Å; I385-S389 PolarHBondContact O-OG 3.14Å; L387-S389 PolarHBondContact O-N 2.87Å; S389-L393 WeakPolarHBondContact O-CB 3.23Å; S389-L393 PolarHBondContact O-N 3.29Å; S389-T473 VanDerWaalsContact CB-OG1 3.23Å; S389-T473 WeakPolarHBondContact CB-OG1 3.48Å
390T95.3Very high90.6Very high0 Ų016.7 Ų16.70%09%0.093CC..Hα-helixtrans-69.4-41.1175.9-56.30000111.7L317 I320 I386 L387 F388 L393 K394L317-T390 HydrophobicContact CB-CG2 4.43Å; L317-T390 HydrophobicContact CD2-CG2 3.54Å; I320-T390 HydrophobicContact CB-CG2 4.12Å; I320-T390 HydrophobicContact CD1-CG2 4.06Å; I320-T390 HydrophobicContact CG2-CG2 4.08Å; I320-T390 VanDerWaalsContact CG2-OG1 3.31Å; I320-T390 WeakPolarHBondContact CG2-OG1 3.44Å; I386-T390 WeakPolarHBondContact O-CB 3.4Å; I386-T390 PolarHBondContact O-N 2.99Å; I386-T390 PolarHBondContact O-OG1 3.44Å; L387-T390 WeakPolarHBondContact O-CA 3.38Å; L387-T390 WeakPolarHBondContact O-CB 3.23Å; L387-T390 PolarHBondContact O-N 3.38Å; L387-T390 VanDerWaalsContact O-N 3.09Å; F388-T390 VanDerWaalsContact C-N 3.32Å; T390-L393 WeakPolarHBondContact O-CB 3.29Å; T390-L393 PolarHBondContact O-N 2.94Å; T390-K394 PolarHBondContact O-N 2.85Å
391L94.3Very high89.8Confident6 Ų619 Ų193%0.03110%0.101CC..Hα-helixtrans-66-42.1174.7-63.2-174.8000111.8M114 F117 V321 L387 F388 L393 K394 V395 W401M114-L391 HydrophobicContact CE-CD1 3.77Å; M114-L391 HydrophobicContact SD-CD1 3.88Å; F117-L391 HydrophobicContact CD1-CD1 3.97Å; F117-L391 HydrophobicContact CD1-CD2 4.31Å; F117-L391 HydrophobicContact CD2-CB 4.15Å; F117-L391 HydrophobicContact CD2-CD1 4.4Å; F117-L391 HydrophobicContact CE1-CB 4.39Å; F117-L391 HydrophobicContact CE1-CD1 4.16Å; F117-L391 HydrophobicContact CE1-CD2 3.67Å; F117-L391 HydrophobicContact CE1-CG 4.26Å; F117-L391 HydrophobicContact CE2-CB 3.69Å; F117-L391 HydrophobicContact CE2-CD2 4.45Å; F117-L391 HydrophobicContact CE2-CG 4.42Å; F117-L391 HydrophobicContact CG-CD1 4.11Å; F117-L391 HydrophobicContact CZ-CB 3.85Å; F117-L391 HydrophobicContact CZ-CD1 4.43Å; F117-L391 HydrophobicContact CZ-CD2 3.75Å; F117-L391 HydrophobicContact CZ-CG 4.19Å; V321-L391 HydrophobicContact CG2-CD2 4.4Å; L387-L391 WeakPolarHBondContact O-CG 3.19Å; L387-L391 PolarHBondContact O-N 2.85Å; F388-L391 HydrophobicContact CD1-CD1 4.16Å; F388-L391 HydrophobicContact CE1-CD1 4.26Å; L391-L393 VanDerWaalsContact C-N 3.34Å; L391-K394 WeakPolarHBondContact O-CB 3.47Å; L391-K394 PolarHBondContact O-N 3.31Å; L391-V395 PolarHBondContact O-N 2.96Å; L391-V395 VanDerWaalsContact O-N 3.12Å; L391-W401 HydrophobicContact CD2-CH2 4.15Å; L391-W401 HydrophobicContact CD2-CZ2 4.08Å
392A91.4Very high88.6Confident0 Ų020.5 Ų20.50%012%0.116CC..Hα-helixtrans-63.1-41.2172.800000111.4C140 V141 F388 K394 V395 L396 F469C140-A392 HydrophobicContact CB-CB 4.02Å; V141-A392 HydrophobicContact CG2-CB 4.47Å; F388-A392 VanDerWaalsContact O-CB 3.24Å; F388-A392 WeakPolarHBondContact O-CB 3.2Å; F388-A392 PolarHBondContact O-N 3.25Å; A392-K394 VanDerWaalsContact C-N 3.34Å; A392-K394 PolarHBondContact O-N 2.9Å; A392-V395 PolarHBondContact O-N 2.87Å; A392-L396 HydrophobicContact CB-CD1 4.38Å; A392-L396 VanDerWaalsContact O-CB 3.28Å; A392-L396 WeakPolarHBondContact O-CB 3.41Å; A392-L396 WeakPolarHBondContact O-CG 3.26Å; A392-L396 PolarHBondContact O-N 3.36Å; A392-F469 HydrophobicContact CB-CD1 4.1Å; A392-F469 HydrophobicContact CB-CD2 4.21Å; A392-F469 HydrophobicContact CB-CE1 4.06Å; A392-F469 HydrophobicContact CB-CE2 4.2Å; A392-F469 HydrophobicContact CB-CG 4.2Å; A392-F469 HydrophobicContact CB-CZ 4.14Å
393L90.6Very high86.6Confident1 Ų125.3 Ų25.31%0.00514%0.137CC..Hα-helixtrans-60-43.5174.9179.363.5000111.4W285 L317 S389 T390 L391 V395 G397 F399 R466 F469 A470W285-L393 HydrophobicContact CZ2-CD2 4.38Å; L317-L393 HydrophobicContact CD2-CD2 4.15Å; S389-L393 WeakPolarHBondContact O-CB 3.23Å; S389-L393 PolarHBondContact O-N 3.29Å; T390-L393 WeakPolarHBondContact O-CB 3.29Å; T390-L393 PolarHBondContact O-N 2.94Å; L391-L393 VanDerWaalsContact C-N 3.34Å; L393-V395 PolarHBondContact O-N 3.49Å; L393-G397 VanDerWaalsContact O-CA 3.22Å; L393-G397 WeakPolarHBondContact O-CA 3.36Å; L393-G397 PolarHBondContact O-N 2.94Å; L393-F399 HydrophobicContact CD1-CE2 3.92Å; L393-F399 HydrophobicContact CG-CD2 4.31Å; L393-F399 HydrophobicContact CG-CE2 3.88Å; L393-F399 WeakPolarHBondContact O-CD2 3.5Å; L393-R466 HydrophobicContact CD1-CB 4.33Å; L393-R466 HydrophobicContact CD1-CG 3.86Å; L393-R466 WeakPolarHBondContact CD1-O 3.31Å; L393-F469 HydrophobicContact CB-CB 4.04Å; L393-F469 HydrophobicContact CD1-CB 4.29Å; L393-A470 HydrophobicContact CD1-CB 4.1Å; L393-A470 HydrophobicContact CD2-CB 4.12Å
394K90.3Very high84.1Confident28 Ų2832.1 Ų32.112%0.12217%0.174CC..Hα-helixtrans-56.6-52.3175.9-177.5-90.2172.8-170.30110.9F117 E121 L317 T390 L391 A392 N398 F399 W401F117-K394 HydrophobicContact CZ-CD 4.47Å; E121-K394 IonicContact OE1-NZ 2.75Å; E121-K394 PolarHBondContact OE1-NZ 3.45Å; E121-K394 VanDerWaalsContact OE2-CE 3.24Å; E121-K394 WeakPolarHBondContact OE2-CE 3.04Å; E121-K394 IonicContact OE2-NZ 3.44Å; E121-K394 PolarHBondContact OE2-NZ 3.27Å; L317-K394 HydrophobicContact CD1-CB 3.92Å; L317-K394 HydrophobicContact CD1-CG 4Å; T390-K394 PolarHBondContact O-N 2.85Å; L391-K394 WeakPolarHBondContact O-CB 3.47Å; L391-K394 PolarHBondContact O-N 3.31Å; A392-K394 VanDerWaalsContact C-N 3.34Å; A392-K394 PolarHBondContact O-N 2.9Å; K394-N398 PolarHBondContact O-N 3.33Å; K394-F399 WeakPolarHBondContact CE-O 3.41Å; K394-F399 HydrophobicContact CG-CB 4.45Å; K394-F399 PolarHBondContact O-N 2.84Å; K394-F399 VanDerWaalsContact O-N 3.11Å; K394-W401 HydrophobicContact CB-CZ2 4.42Å; K394-W401 HydrophobicContact CD-CZ2 4.27Å; K394-W401 VanDerWaalsContact CE-NE1 3.3Å; K394-W401 HydrophobicContact CG-CD2 4.49Å; K394-W401 HydrophobicContact CG-CZ2 3.92Å
395V85.9Confident81.3Confident17 Ų1737.9 Ų37.910%0.10320%0.203CC..Hα-helixtrans-72.9-44.5-172164.30000112.6F117 N134 A137 L391 A392 L393F117-V395 HydrophobicContact CD2-CG2 4.37Å; F117-V395 HydrophobicContact CE2-CG2 3.43Å; F117-V395 VanDerWaalsContact CE2-CG2 3.43Å; F117-V395 HydrophobicContact CZ-CG2 4.04Å; N134-V395 HydrophobicContact CB-CG1 4.09Å; N134-V395 VanDerWaalsContact CG-CG1 3.42Å; N134-V395 WeakPolarHBondContact ND2-CG1 3.18Å; A137-V395 HydrophobicContact CB-CG1 3.66Å; L391-V395 PolarHBondContact O-N 2.96Å; L391-V395 VanDerWaalsContact O-N 3.12Å; A392-V395 PolarHBondContact O-N 2.87Å; L393-V395 PolarHBondContact O-N 3.49Å
396L79.9Confident78.4Confident41 Ų4146.9 Ų46.922%0.21525%0.245CC..Hα-helixtrans-83.1-22.8-177.3-61.2169.9000112.2A137 A392 L465 F469A137-L396 HydrophobicContact CB-CD2 4.16Å; A137-L396 HydrophobicContact CB-CG 4.45Å; A392-L396 HydrophobicContact CB-CD1 4.38Å; A392-L396 VanDerWaalsContact O-CB 3.28Å; A392-L396 WeakPolarHBondContact O-CB 3.41Å; A392-L396 WeakPolarHBondContact O-CG 3.26Å; A392-L396 PolarHBondContact O-N 3.36Å; L396-L465 HydrophobicContact CB-CB 4.44Å; L396-L465 HydrophobicContact CD1-CB 4.3Å; L396-L465 HydrophobicContact CD1-CD1 4.2Å; L396-L465 HydrophobicContact CD2-CD1 4.44Å; L396-F469 HydrophobicContact CD1-CD2 3.93Å; L396-F469 HydrophobicContact CD1-CE2 3.5Å; L396-F469 HydrophobicContact CD1-CZ 4.46Å
397G72.2Confident75.4Confident6 Ų654.4 Ų54.46%0.06228%0.281CS..THydrogen-bonded Turntrans-91.64.6179.900000115L393 F399L393-G397 VanDerWaalsContact O-CA 3.22Å; L393-G397 WeakPolarHBondContact O-CA 3.36Å; L393-G397 PolarHBondContact O-N 2.94Å; G397-F399 PolarHBondContact O-N 2.63Å
398N74.4Confident72.1Confident144 Ų14459.9 Ų59.977%0.7731%0.314SS*.THydrogen-bonded Turntrans52.636.6-176.6-63.3-23.3000113.6K394K394-N398 PolarHBondContact O-N 3.33Å
399F79.3Confident69.2Low18 Ų1866.3 Ų66.38%0.07936%0.356CS..  trans-83.1144.9175-64-71.7000110.6D313 L317 L393 K394 G397 R466D313-F399 HydrophobicContact CB-CD1 3.62Å; D313-F399 HydrophobicContact CB-CE1 3.61Å; L317-F399 HydrophobicContact CD1-CB 3.59Å; L317-F399 HydrophobicContact CD1-CD2 4.28Å; L317-F399 HydrophobicContact CD1-CG 4.04Å; L393-F399 HydrophobicContact CD1-CE2 3.92Å; L393-F399 HydrophobicContact CG-CD2 4.31Å; L393-F399 HydrophobicContact CG-CE2 3.88Å; L393-F399 WeakPolarHBondContact O-CD2 3.5Å; K394-F399 WeakPolarHBondContact CE-O 3.41Å; K394-F399 HydrophobicContact CG-CB 4.45Å; K394-F399 PolarHBondContact O-N 2.84Å; K394-F399 VanDerWaalsContact O-N 3.11Å; G397-F399 PolarHBondContact O-N 2.63Å; F399-R466 HydrophobicContact CE2-CG 4.24Å; F399-R466 HydrophobicContact CZ-CG 4.45Å
400S78.2Confident66.2Low53 Ų5369.2 Ų69.237%0.37139%0.386SS..  trans-94.1150.7173.2-1760000111.4S314 G402S314-S400 WeakPolarHBondContact CB-O 3.35Å; S314-S400 PolarHBondContact OG-O 3.32Å; S400-G402 VanDerWaalsContact C-N 3.31Å; S400-G402 PolarHBondContact OG-N 3.22Å; S400-G402 VanDerWaalsContact OG-N 3.09Å
401W80.6Confident63Low55 Ų5575.8 Ų75.821%0.20843%0.426CS..SBendtrans-78.8-17.1167.3-68.7117.7000112.8F117 E121 L317 W318 V321 L391 K394F117-W401 HydrophobicContact CE1-CZ2 4.33Å; F117-W401 HydrophobicContact CZ-CZ2 4.34Å; E121-W401 PolarHBondContact OE2-NE1 3.13Å; L317-W401 HydrophobicContact CB-CZ3 3.96Å; W318-W401 AromaticContact CD1-CE3 4Å; W318-W401 AromaticContact CD2-CE3 3.95Å; W318-W401 HydrophobicContact CD2-CE3 3.95Å; W318-W401 HydrophobicContact CD2-CZ3 4.05Å; W318-W401 AromaticContact CE2-CE3 3.47Å; W318-W401 VanDerWaalsContact CE2-CE3 3.47Å; W318-W401 HydrophobicContact CE3-CZ3 4.43Å; W318-W401 HydrophobicContact CG-CE3 4.27Å; W318-W401 HydrophobicContact CG-CZ3 4.35Å; W318-W401 HydrophobicContact CH2-CE3 4.45Å; W318-W401 HydrophobicContact CZ2-CB 4.34Å; W318-W401 HydrophobicContact CZ2-CD2 4.2Å; W318-W401 AromaticContact CZ2-CE3 3.77Å; W318-W401 HydrophobicContact CZ2-CE3 3.77Å; W318-W401 HydrophobicContact CZ2-CG 4.47Å; W318-W401 HydrophobicContact CZ2-CZ3 4.42Å; W318-W401 AromaticContact NE1-CE3 3.54Å; W318-W401 PolarHBondContact NE1-O 2.83Å; W318-W401 VanDerWaalsContact NE1-O 3.12Å; V321-W401 HydrophobicContact CG2-CH2 4.01Å; V321-W401 HydrophobicContact CG2-CZ3 4.39Å; L391-W401 HydrophobicContact CD2-CH2 4.15Å; L391-W401 HydrophobicContact CD2-CZ2 4.08Å; K394-W401 HydrophobicContact CB-CZ2 4.42Å; K394-W401 HydrophobicContact CD-CZ2 4.27Å; K394-W401 VanDerWaalsContact CE-NE1 3.3Å; K394-W401 HydrophobicContact CG-CD2 4.49Å; K394-W401 HydrophobicContact CG-CZ2 3.92Å
402G71.6Confident60Low31 Ų3181.3 Ų81.332%0.3246%0.46SS..  trans-76.3129.1-176.700000112S314 S400 N404S314-G402 PolarHBondContact OG-O 3.48Å; S400-G402 VanDerWaalsContact C-N 3.31Å; S400-G402 PolarHBondContact OG-N 3.22Å; S400-G402 VanDerWaalsContact OG-N 3.09Å; G402-N404 VanDerWaalsContact C-N 3.27Å; G402-N404 PolarHBondContact O-N 3.12Å
403F54.8Low57.2Low100 Ų10087.2 Ų87.244%0.43950%0.499SS..SBendtrans-73-18.2177.3-69.7-81.6000113.5A311 M315 W318A311-F403 WeakPolarHBondContact CB-O 3.32Å; M315-F403 HydrophobicContact CB-CE1 4.04Å; W318-F403 HydrophobicContact CB-CZ 4.34Å; W318-F403 AromaticContact CD1-CE2 3.66Å; W318-F403 AromaticContact CD1-CZ 3.31Å; W318-F403 HydrophobicContact CG-CE2 4.46Å; W318-F403 AromaticContact CG-CZ 3.96Å; W318-F403 HydrophobicContact CG-CZ 3.96Å; W318-F403 AromaticContact NE1-CE2 3.75Å; W318-F403 AromaticContact NE1-CZ 3.91Å
404N45.2Very low54.3Low145 Ų14591.6 Ų91.678%0.77554%0.535SS*.  trans-156.883.8179.8-74.7-55.4000110.9G402G402-N404 VanDerWaalsContact C-N 3.27Å; G402-N404 PolarHBondContact O-N 3.12Å
405I37.8Very low51.6Low135 Ų13598.3 Ų98.369%0.69257%0.571SS**  trans-127.2105.1150.7-57.1179.3000105.1E407I405-E407 VanDerWaalsContact C-N 3.29Å; I405-E407 PolarHBondContact O-N 2.85Å
406E36.8Very low49Very low189 Ų189104.1 Ų104.188%0.88361%0.606SS**  trans-56.499.1162.8-164.2168.6-164.100106.3T408E406-T408 PolarHBondContact O-N 2.84Å
407E33.9Very low46.8Very low164 Ų164109 Ų10977%0.76663%0.632SS**  trans-64.6104.8167.9-72.9-171.3176.800106.5I405I405-E407 VanDerWaalsContact C-N 3.29Å; I405-E407 PolarHBondContact O-N 2.85Å
408T28.3Very low45Very low122 Ų122114.4 Ų114.475%0.74867%0.666SS**  trans-45132.1162.526.60000109.2E406 G410E406-T408 PolarHBondContact O-N 2.84Å; T408-G410 PolarHBondContact O-N 3.32Å
409P37.8Very low42.8Very low138 Ų138114.1 Ų114.190%0.89667%0.67SS**  trans-68.5100.3-177.527.4-31.6000108.5
410G31Very low40.6Very low61 Ų61117.5 Ų117.563%0.62970%0.701SS**  trans-150.294.9-169.500000112T408T408-G410 PolarHBondContact O-N 3.32Å
411V28.5Very low38.5Very low137 Ų137119.2 Ų119.283%0.8372%0.718SS**  trans85.696156-161.70000115.7
412T31.3Very low36.2Very low123 Ų123122.4 Ų122.476%0.75575%0.746SS**  trans-17.1123.9145.8-6.30000113.1A414T412-A414 PolarHBondContact O-N 3.4Å
413P33.1Very low34.4Very low124 Ų124127 Ų12781%0.80577%0.768SS**  trans-63114.2168.725-29.4000107.7L415P413-L415 PolarHBondContact O-N 3.21Å; P413-L415 VanDerWaalsContact O-N 3.14Å
414A28.7Very low33.6Very low93 Ų93128.1 Ų128.177%0.76979%0.785SS**  trans-57.4120.1177.700000109.3T412 V416T412-A414 PolarHBondContact O-N 3.4Å; A414-V416 PolarHBondContact O-N 2.88Å
415L33.5Very low33Very low169 Ų169127.7 Ų127.789%0.88579%0.788SS**  trans-46.5120.1163.1-89.2138.9000109P413 L417P413-L415 PolarHBondContact O-N 3.21Å; P413-L415 VanDerWaalsContact O-N 3.14Å; L415-L417 PolarHBondContact O-N 2.92Å
416V32.7Very low32.9Very low138 Ų138125.3 Ų125.384%0.83680%0.796SS**  trans-68.3101167.4177.80000106.8A414A414-V416 PolarHBondContact O-N 2.88Å
417L32.3Very low32.6Very low144 Ų144120.1 Ų120.175%0.75479%0.794SS**  trans-66.3136.6163.2-15084.7000107.7L415 T419L415-L417 PolarHBondContact O-N 2.92Å; L417-T419 PolarHBondContact O-N 3.11Å
418P34.4Very low32.9Very low119 Ų119120 Ų12077%0.77380%0.797SS**  trans-65.3113.8176.7-12.926.9000108.9A420P418-A420 PolarHBondContact O-N 3.29Å
419T29.2Very low33.2Very low138 Ų138120.5 Ų120.585%0.84780%0.796SS**PPolyproline II helixtrans-76.7119.7166.9-61.50000107.1L417L417-T419 PolarHBondContact O-N 3.11Å
420A32.8Very low33.4Very low90 Ų90122 Ų12274%0.74479%0.791SS**PPolyproline II helixtrans-56.1136.4175.500000110.8P418P418-A420 PolarHBondContact O-N 3.29Å
421A33.1Very low34Very low88 Ų88125.8 Ų125.873%0.72780%0.797SS**PPolyproline II helixtrans-63146177.900000111.5
422P33Very low34.9Very low122 Ų122125.8 Ų125.879%0.79279%0.788SS**PPolyproline II helixtrans-73.3135.6174.230.2-30.6000110.2
423V33.4Very low35.7Very low129 Ų129126.7 Ų126.778%0.78279%0.788SS**PPolyproline II helixtrans-65126.8172.5177.90000109.4
424P37.7Very low36.5Very low122 Ų122123.5 Ų123.579%0.79278%0.778SS**PPolyproline II helixtrans-81.6117.7165.7-2.420.8000109.1
425T32.7Very low37.4Very low136 Ų136124.6 Ų124.683%0.83477%0.768SS**PPolyproline II helixtrans-68.7134.5162.239.80000109.7
426G36.8Very low38.3Very low85 Ų85121.6 Ų121.688%0.87675%0.75SS**PPolyproline II helixtrans-65.1160.1-172.900000116.1
427G30.1Very low39.5Very low81 Ų81120.1 Ų120.184%0.83574%0.737SS**  trans-151.4129.316400000107.3
428L39.7Very low40.6Very low160 Ų160118.8 Ų118.884%0.83873%0.729SS**  trans-79.7160.2-172.8-72.8147.6000112.7
429D35.4Very low41.9Very low133 Ų133118.9 Ų118.971%0.71172%0.719SS**  trans111110.3145.5-58.8-32000119.1
430E42Very low43.9Very low170 Ų170118.5 Ų118.579%0.79471%0.707SS**  trans90.5105.2130.2-67.4177.9175.300121.3
431D44.5Very low45.7Very low140 Ų140119.6 Ų119.675%0.74970%0.701SS**  trans59.679.6138.3-64-15.1000120.5
432E46.3Very low47.6Very low138 Ų138120 Ų12065%0.64569%0.69SS**  trans-146.157.3152.6-84.5-159.7145.400113.1G434 M435E432-G434 PolarHBondContact O-N 2.9Å; E432-M435 PolarHBondContact O-N 3.03Å
433D47.5Very low49.6Very low141 Ų141120.7 Ų120.775%0.75468%0.682SS**THydrogen-bonded Turntrans-6224.9-178.1-80.5-26000117
434G51.1Low51.6Low58 Ų58116.9 Ų116.960%0.59866%0.664SS**THydrogen-bonded Turntrans-137.4-17.8177.400000115.6E432E432-G434 PolarHBondContact O-N 2.9Å
435M47.1Very low53.2Low115 Ų115114.9 Ų114.957%0.56765%0.65SS**THydrogen-bonded Turntrans-101.9-30.5177.4-150.879.2-176.400111.2E432 M438 E439E432-M435 PolarHBondContact O-N 3.03Å; M435-M438 PolarHBondContact O-N 3.33Å; M435-E439 PolarHBondContact O-N 3.01Å; M435-E439 VanDerWaalsContact O-N 3.16Å
436E52.4Low55.2Low107 Ų107112.5 Ų112.550%0.564%0.635SS.*Hα-helixtrans-65.4-42.9179.2-65.9-174.3164.500112.4M438 E439 E440E436-M438 VanDerWaalsContact C-N 3.27Å; E436-M438 PolarHBondContact O-N 2.78Å; E436-E439 PolarHBondContact O-N 2.74Å; E436-E440 WeakPolarHBondContact O-CB 3.45Å; E436-E440 WeakPolarHBondContact O-CG 3.19Å; E436-E440 PolarHBondContact O-N 3.2Å
437D58.3Low57Low106 Ų106110.8 Ų110.857%0.56761%0.613SS**Hα-helixtrans-58.7-37.1177-80.1-18000112.6D441D437-D441 VanDerWaalsContact O-CB 3.3Å; D437-D441 WeakPolarHBondContact O-CB 3.14Å; D437-D441 PolarHBondContact O-N 2.91Å
438M56.3Low59Low117 Ų117115.9 Ų115.958%0.57661%0.607SS**Hα-helixtrans-75.9-38.2179.3-168.2179.8-54.600111.7M435 E436 I442M435-M438 PolarHBondContact O-N 3.33Å; E436-M438 VanDerWaalsContact C-N 3.27Å; E436-M438 PolarHBondContact O-N 2.78Å; M438-I442 HydrophobicContact CG-CD1 4.05Å; M438-I442 WeakPolarHBondContact O-CB 3.35Å; M438-I442 WeakPolarHBondContact O-CD1 3.37Å; M438-I442 WeakPolarHBondContact O-CG1 3.42Å; M438-I442 PolarHBondContact O-N 3.47Å
439E61.2Low60.4Low120 Ų120113.4 Ų113.456%0.56159%0.594SS**Hα-helixtrans-70.4-37.3175.1-75.4-167164.100112.2M435 E436 I442 Q443M435-E439 PolarHBondContact O-N 3.01Å; M435-E439 VanDerWaalsContact O-N 3.16Å; E436-E439 PolarHBondContact O-N 2.74Å; E439-I442 PolarHBondContact O-N 2.96Å; E439-Q443 WeakPolarHBondContact O-CB 3.43Å; E439-Q443 WeakPolarHBondContact O-CG 3.37Å; E439-Q443 PolarHBondContact O-N 2.79Å
440E70.6Confident62.2Low130 Ų130110.4 Ų110.461%0.60758%0.583SS**Hα-helixtrans-65.1-43.6172-77.7-162.4156.600111.5E436 I442 Q443 A444E436-E440 WeakPolarHBondContact O-CB 3.45Å; E436-E440 WeakPolarHBondContact O-CG 3.19Å; E436-E440 PolarHBondContact O-N 3.2Å; E440-I442 PolarHBondContact O-N 3.14Å; E440-Q443 PolarHBondContact O-N 3.29Å; E440-A444 VanDerWaalsContact O-CB 3.22Å; E440-A444 WeakPolarHBondContact O-CB 3.49Å; E440-A444 PolarHBondContact O-N 2.92Å
441D71.4Confident63.9Low114 Ų114109 Ų10961%0.6158%0.577SS**Hα-helixtrans-64.8-39175-97-10.9000112.1D437 T445D437-D441 VanDerWaalsContact O-CB 3.3Å; D437-D441 WeakPolarHBondContact O-CB 3.14Å; D437-D441 PolarHBondContact O-N 2.91Å; D441-T445 VanDerWaalsContact O-CB 3.24Å; D441-T445 WeakPolarHBondContact O-CB 3.36Å; D441-T445 PolarHBondContact O-N 3.5Å; D441-T445 PolarHBondContact O-OG1 3.06Å
442I72.4Confident65.1Low96 Ų96106.6 Ų106.649%0.49257%0.567SS.*Hα-helixtrans-65.9-45.3174.2-70.8165.1000109.9M438 E439 E440 T445 V446M438-I442 HydrophobicContact CG-CD1 4.05Å; M438-I442 WeakPolarHBondContact O-CB 3.35Å; M438-I442 WeakPolarHBondContact O-CD1 3.37Å; M438-I442 WeakPolarHBondContact O-CG1 3.42Å; M438-I442 PolarHBondContact O-N 3.47Å; E439-I442 PolarHBondContact O-N 2.96Å; E440-I442 PolarHBondContact O-N 3.14Å; I442-T445 PolarHBondContact O-N 3.19Å; I442-V446 HydrophobicContact CG2-CG2 4.34Å; I442-V446 WeakPolarHBondContact O-CB 3.26Å; I442-V446 WeakPolarHBondContact O-CG2 3.27Å; I442-V446 PolarHBondContact O-N 3.43Å
443Q74.6Confident66.2Low137 Ų137105.9 Ų105.964%0.6456%0.562SS**Hα-helixtrans-64.8-41.2177.7-82.3-1753.700112.2E439 E440 T445 V446 A447E439-Q443 WeakPolarHBondContact O-CB 3.43Å; E439-Q443 WeakPolarHBondContact O-CG 3.37Å; E439-Q443 PolarHBondContact O-N 2.79Å; E440-Q443 PolarHBondContact O-N 3.29Å; Q443-T445 VanDerWaalsContact C-N 3.34Å; Q443-V446 PolarHBondContact O-N 3.29Å; Q443-A447 VanDerWaalsContact O-CB 3.3Å; Q443-A447 WeakPolarHBondContact O-CB 3.47Å; Q443-A447 PolarHBondContact O-N 3.39Å
444A75.2Confident67.3Low49 Ų49102 Ų10241%0.40555%0.549SS..Hα-helixtrans-64.7-39.4175.300000111.4E440 A447 R448E440-A444 VanDerWaalsContact O-CB 3.22Å; E440-A444 WeakPolarHBondContact O-CB 3.49Å; E440-A444 PolarHBondContact O-N 2.92Å; A444-A447 PolarHBondContact O-N 2.92Å; A444-R448 WeakPolarHBondContact O-CB 3.31Å; A444-R448 WeakPolarHBondContact O-CG 3.22Å; A444-R448 PolarHBondContact O-N 3.24Å
445T71.7Confident68.2Low79 Ų79100.6 Ų100.649%0.48553%0.532SS..Hα-helixtrans-65.6-43.3174.2-59.40000111.2D441 I442 Q443 R448 L449D441-T445 VanDerWaalsContact O-CB 3.24Å; D441-T445 WeakPolarHBondContact O-CB 3.36Å; D441-T445 PolarHBondContact O-N 3.5Å; D441-T445 PolarHBondContact O-OG1 3.06Å; I442-T445 PolarHBondContact O-N 3.19Å; Q443-T445 VanDerWaalsContact C-N 3.34Å; T445-R448 PolarHBondContact O-N 3.01Å; T445-L449 HydrophobicContact CG2-CD1 4.11Å; T445-L449 HydrophobicContact CG2-CG 4.5Å; T445-L449 WeakPolarHBondContact O-CB 3.18Å; T445-L449 VanDerWaalsContact O-CG 3.29Å; T445-L449 WeakPolarHBondContact O-CG 3.49Å; T445-L449 PolarHBondContact O-N 3.06Å
446V74.5Confident69.3Low86 Ų8699.6 Ų99.652%0.52153%0.529SS..Hα-helixtrans-64.5-41.1175.7169.20000111I442 Q443 L449 S450I442-V446 HydrophobicContact CG2-CG2 4.34Å; I442-V446 WeakPolarHBondContact O-CB 3.26Å; I442-V446 WeakPolarHBondContact O-CG2 3.27Å; I442-V446 PolarHBondContact O-N 3.43Å; Q443-V446 PolarHBondContact O-N 3.29Å; V446-L449 PolarHBondContact O-N 2.94Å; V446-S450 VanDerWaalsContact O-CB 3.31Å; V446-S450 WeakPolarHBondContact O-CB 3.27Å; V446-S450 PolarHBondContact O-N 3.05Å
447A75.3Confident70.2Confident50 Ų50102.1 Ų102.141%0.41353%0.534SS..Hα-helixtrans-62.1-48.3175.800000110.9Q443 A444 L449 S450 E451Q443-A447 VanDerWaalsContact O-CB 3.3Å; Q443-A447 WeakPolarHBondContact O-CB 3.47Å; Q443-A447 PolarHBondContact O-N 3.39Å; A444-A447 PolarHBondContact O-N 2.92Å; A447-L449 PolarHBondContact O-N 3.24Å; A447-S450 PolarHBondContact O-N 3.48Å; A447-S450 VanDerWaalsContact O-N 3.16Å; A447-S450 PolarHBondContact O-OG 3.26Å; A447-E451 WeakPolarHBondContact O-CB 3.36Å; A447-E451 PolarHBondContact O-N 3.03Å
448R71.6Confident70.8Confident188 Ų188100.1 Ų100.171%0.70953%0.528SS*.Hα-helixtrans-61.7-41175.2-77.3-173.9175.4175.42.9113A444 T445 S450 E451 T452A444-R448 WeakPolarHBondContact O-CB 3.31Å; A444-R448 WeakPolarHBondContact O-CG 3.22Å; A444-R448 PolarHBondContact O-N 3.24Å; T445-R448 PolarHBondContact O-N 3.01Å; R448-S450 VanDerWaalsContact C-N 3.34Å; R448-E451 PolarHBondContact O-N 3.32Å; R448-T452 WeakPolarHBondContact O-CB 3.48Å; R448-T452 WeakPolarHBondContact O-CG2 3.4Å; R448-T452 PolarHBondContact O-N 3.14Å; R448-T452 PolarHBondContact O-OG1 3.39Å
449L69.2Low71.7Confident108 Ų10895.5 Ų95.557%0.56551%0.507SS*.Hα-helixtrans-64.7-39.4174.4-76.4172.7000111.4T445 V446 A447 T452 F453T445-L449 HydrophobicContact CG2-CD1 4.11Å; T445-L449 HydrophobicContact CG2-CG 4.5Å; T445-L449 WeakPolarHBondContact O-CB 3.18Å; T445-L449 VanDerWaalsContact O-CG 3.29Å; T445-L449 WeakPolarHBondContact O-CG 3.49Å; T445-L449 PolarHBondContact O-N 3.06Å; V446-L449 PolarHBondContact O-N 2.94Å; A447-L449 PolarHBondContact O-N 3.24Å; L449-T452 VanDerWaalsContact CA-OG1 3.31Å; L449-T452 WeakPolarHBondContact CA-OG1 3.16Å; L449-T452 PolarHBondContact O-OG1 2.84Å; L449-T452 VanDerWaalsContact O-OG1 3.04Å; L449-F453 WeakPolarHBondContact O-CB 3.29Å; L449-F453 PolarHBondContact O-N 3.21Å
450S73.9Confident72.5Confident70 Ų7092.5 Ų92.549%0.4949%0.494SS..Hα-helixtrans-67.3-40.2177.879.50000112V446 A447 R448 F453 A454V446-S450 VanDerWaalsContact O-CB 3.31Å; V446-S450 WeakPolarHBondContact O-CB 3.27Å; V446-S450 PolarHBondContact O-N 3.05Å; A447-S450 PolarHBondContact O-N 3.48Å; A447-S450 VanDerWaalsContact O-N 3.16Å; A447-S450 PolarHBondContact O-OG 3.26Å; R448-S450 VanDerWaalsContact C-N 3.34Å; S450-F453 PolarHBondContact O-N 3.2Å; S450-A454 VanDerWaalsContact O-CB 3.31Å; S450-A454 WeakPolarHBondContact O-CB 3.39Å; S450-A454 PolarHBondContact O-N 2.93Å
451E75.9Confident73Confident141 Ų14187.2 Ų87.266%0.65947%0.471SS*.Hα-helixtrans-70.8-44.5179.3-170.2177.6-167.800111.1A447 R448 F453 A454 A455A447-E451 WeakPolarHBondContact O-CB 3.36Å; A447-E451 PolarHBondContact O-N 3.03Å; R448-E451 PolarHBondContact O-N 3.32Å; E451-F453 VanDerWaalsContact C-N 3.32Å; E451-F453 PolarHBondContact O-N 3.48Å; E451-A454 PolarHBondContact O-N 2.93Å; E451-A455 WeakPolarHBondContact O-CB 3.48Å; E451-A455 PolarHBondContact O-N 3.26Å
452T71.6Confident73.5Confident89 Ų8985.6 Ų85.655%0.54647%0.466SS..Hα-helixtrans-63.4-3717346.40000112.1R448 L449 L456R448-T452 WeakPolarHBondContact O-CB 3.48Å; R448-T452 WeakPolarHBondContact O-CG2 3.4Å; R448-T452 PolarHBondContact O-N 3.14Å; R448-T452 PolarHBondContact O-OG1 3.39Å; L449-T452 VanDerWaalsContact CA-OG1 3.31Å; L449-T452 WeakPolarHBondContact CA-OG1 3.16Å; L449-T452 PolarHBondContact O-OG1 2.84Å; L449-T452 VanDerWaalsContact O-OG1 3.04Å; T452-L456 VanDerWaalsContact O-CB 3.22Å; T452-L456 WeakPolarHBondContact O-CB 3.24Å; T452-L456 PolarHBondContact O-N 3.37Å
453F68.4Low74Confident122 Ų12284.9 Ų84.954%0.53546%0.463SS..Hα-helixtrans-69.2-38.4175-165.3-98.7000112.2L449 S450 E451 L456 R457L449-F453 WeakPolarHBondContact O-CB 3.29Å; L449-F453 PolarHBondContact O-N 3.21Å; S450-F453 PolarHBondContact O-N 3.2Å; E451-F453 VanDerWaalsContact C-N 3.32Å; E451-F453 PolarHBondContact O-N 3.48Å; F453-L456 PolarHBondContact O-N 3.33Å; F453-R457 VanDerWaalsContact O-CB 3.26Å; F453-R457 WeakPolarHBondContact O-CB 2.99Å; F453-R457 PolarHBondContact O-N 2.84Å
454A70.3Confident74.5Confident59 Ų5979.5 Ų79.549%0.48844%0.438SS..Hα-helixtrans-65.5-44.2174.200000111.6S450 E451 R457 S458S450-A454 VanDerWaalsContact O-CB 3.31Å; S450-A454 WeakPolarHBondContact O-CB 3.39Å; S450-A454 PolarHBondContact O-N 2.93Å; E451-A454 PolarHBondContact O-N 2.93Å; A454-R457 PolarHBondContact O-N 3.44Å; A454-S458 PolarHBondContact O-N 3.01Å
455A70.3Confident75Confident29 Ų2978.9 Ų78.924%0.2443%0.427CS..Hα-helixtrans-61.6-46.6173.400000111F210 E451 R457 S458 V459F210-A455 HydrophobicContact CE2-CB 4.16Å; E451-A455 WeakPolarHBondContact O-CB 3.48Å; E451-A455 PolarHBondContact O-N 3.26Å; A455-R457 VanDerWaalsContact C-N 3.31Å; A455-R457 PolarHBondContact O-N 3.05Å; A455-S458 PolarHBondContact O-N 3.23Å; A455-S458 VanDerWaalsContact O-N 3.14Å; A455-S458 PolarHBondContact O-OG 3.38Å; A455-V459 PolarHBondContact O-N 3.35Å
456L69.7Low75.8Confident94 Ų9479.2 Ų79.249%0.49242%0.42SS..Hα-helixtrans-61.7-39.4177.2-172.766.2000112.1T452 F453 S458 V459 L460T452-L456 VanDerWaalsContact O-CB 3.22Å; T452-L456 WeakPolarHBondContact O-CB 3.24Å; T452-L456 PolarHBondContact O-N 3.37Å; F453-L456 PolarHBondContact O-N 3.33Å; L456-S458 VanDerWaalsContact C-N 3.35Å; L456-V459 PolarHBondContact O-N 3.46Å; L456-L460 HydrophobicContact CD1-CD1 3.89Å; L456-L460 HydrophobicContact CD1-CG 4.16Å; L456-L460 HydrophobicContact CD2-CD1 4.27Å; L456-L460 HydrophobicContact CG-CD1 3.78Å; L456-L460 HydrophobicContact CG-CG 4.28Å; L456-L460 WeakPolarHBondContact O-CB 3.22Å; L456-L460 WeakPolarHBondContact O-CG 3.33Å; L456-L460 PolarHBondContact O-N 3.29Å
457R71.7Confident76.6Confident160 Ų16075.1 Ų75.160%0.60440%0.395SS*.Hα-helixtrans-67.2-33.2175.8-175.1175.3179.2146.9-0.2112.8F453 A454 A455 V459F453-R457 VanDerWaalsContact O-CB 3.26Å; F453-R457 WeakPolarHBondContact O-CB 2.99Å; F453-R457 PolarHBondContact O-N 2.84Å; A454-R457 PolarHBondContact O-N 3.44Å; A455-R457 VanDerWaalsContact C-N 3.31Å; A455-R457 PolarHBondContact O-N 3.05Å; R457-V459 VanDerWaalsContact C-N 3.29Å
458S71.1Confident77.3Confident64 Ų6475.4 Ų75.445%0.44839%0.389SS..Hα-helixtrans-67.2-30.5173.971.20000112.6N206 A454 A455 L456N206-S458 PolarHBondContact ND2-O 3.1Å; A454-S458 PolarHBondContact O-N 3.01Å; A455-S458 PolarHBondContact O-N 3.23Å; A455-S458 VanDerWaalsContact O-N 3.14Å; A455-S458 PolarHBondContact O-OG 3.38Å; L456-S458 VanDerWaalsContact C-N 3.35Å
459V75.4Confident78.3Confident21 Ų2167 Ų6713%0.12736%0.358CS..Hα-helixtrans-84.4-42.7177.3178.20000111.6L203 L207 A455 L456 R457 T461L203-V459 HydrophobicContact CG-CG1 4.3Å; L207-V459 HydrophobicContact CD1-CG1 4.42Å; A455-V459 PolarHBondContact O-N 3.35Å; L456-V459 PolarHBondContact O-N 3.46Å; R457-V459 VanDerWaalsContact C-N 3.29Å; V459-T461 PolarHBondContact O-N 2.75Å; V459-T461 VanDerWaalsContact O-N 3.14Å
460L78.2Confident79.5Confident56 Ų5662.1 Ų62.129%0.29333%0.333SS..SBendtrans-84.981.2179.5-62.7-178.4000111.2L203 L456 F464L203-L460 HydrophobicContact CD1-CD2 4.29Å; L456-L460 HydrophobicContact CD1-CD1 3.89Å; L456-L460 HydrophobicContact CD1-CG 4.16Å; L456-L460 HydrophobicContact CD2-CD1 4.27Å; L456-L460 HydrophobicContact CG-CD1 3.78Å; L456-L460 HydrophobicContact CG-CG 4.28Å; L456-L460 WeakPolarHBondContact O-CB 3.22Å; L456-L460 WeakPolarHBondContact O-CG 3.33Å; L456-L460 PolarHBondContact O-N 3.29Å; L460-F464 HydrophobicContact CD2-CD1 3.76Å; L460-F464 HydrophobicContact CD2-CE1 3.67Å
461T81.4Confident80.5Confident20 Ų2059 Ų5912%0.12331%0.311CS..  trans-67.6153.4178.561.60000112.4S202 N206 V459 L463 F464 L465S202-T461 VanDerWaalsContact OG-CG2 3.24Å; S202-T461 WeakPolarHBondContact OG-CG2 3.33Å; S202-T461 PolarHBondContact OG-OG1 3.39Å; N206-T461 WeakPolarHBondContact ND2-CG2 3.41Å; V459-T461 PolarHBondContact O-N 2.75Å; V459-T461 VanDerWaalsContact O-N 3.14Å; T461-L463 PolarHBondContact O-N 3.48Å; T461-F464 WeakPolarHBondContact O-CB 3.31Å; T461-F464 PolarHBondContact O-N 3.08Å; T461-F464 PolarHBondContact OG1-N 2.87Å; T461-L465 PolarHBondContact O-N 3.23Å
462P80.6Confident81.4Confident80 Ų8053.4 Ų53.452%0.51929%0.285SS..Hα-helixtrans-54.2-34171.5-2634.5000112.7L465 R466P462-L465 PolarHBondContact O-N 3.22Å; P462-R466 VanDerWaalsContact O-CB 3.29Å; P462-R466 WeakPolarHBondContact O-CB 3.49Å; P462-R466 PolarHBondContact O-N 3.47Å
463L82.9Confident82.5Confident80 Ų8049.2 Ų49.242%0.41926%0.259SS..Hα-helixtrans-64.4-43.6177-16470.5000111.8P198 T461 G467P198-L463 HydrophobicContact CB-CD2 4.18Å; P198-L463 WeakPolarHBondContact O-CD2 3.5Å; T461-L463 PolarHBondContact O-N 3.48Å; L463-G467 PolarHBondContact O-N 3.46Å; L463-G467 VanDerWaalsContact O-N 3.15Å
464F86.4Confident83.9Confident25 Ų2544.4 Ų44.411%0.1124%0.238CC..Hα-helixtrans-63.8-47.4174.1175-105.6000111.9F200 L203 L460 T461 R466 G467 L468F200-F464 HydrophobicContact CD1-CD2 4.28Å; F200-F464 AromaticContact CD1-CE2 3.83Å; F200-F464 HydrophobicContact CD1-CE2 3.83Å; F200-F464 AromaticContact CE1-CE2 3.73Å; F200-F464 HydrophobicContact CE1-CE2 3.73Å; L203-F464 HydrophobicContact CB-CD2 4.18Å; L203-F464 HydrophobicContact CB-CG 4.42Å; L203-F464 HydrophobicContact CD1-CD1 3.85Å; L203-F464 HydrophobicContact CD1-CD2 3.79Å; L203-F464 HydrophobicContact CD1-CE1 3.81Å; L203-F464 HydrophobicContact CD1-CE2 3.76Å; L203-F464 HydrophobicContact CD1-CG 3.84Å; L203-F464 HydrophobicContact CD1-CZ 3.76Å; L460-F464 HydrophobicContact CD2-CD1 3.76Å; L460-F464 HydrophobicContact CD2-CE1 3.67Å; T461-F464 WeakPolarHBondContact O-CB 3.31Å; T461-F464 PolarHBondContact O-N 3.08Å; T461-F464 PolarHBondContact OG1-N 2.87Å; F464-R466 VanDerWaalsContact C-N 3.31Å; F464-R466 PolarHBondContact O-N 3.14Å; F464-G467 PolarHBondContact O-N 2.91Å; F464-L468 HydrophobicContact CE1-CD2 4.15Å; F464-L468 HydrophobicContact CZ-CD2 4.38Å; F464-L468 WeakPolarHBondContact O-CB 3.48Å; F464-L468 PolarHBondContact O-N 3.35Å
465L85.3Confident85.2Confident36 Ų3641.7 Ų41.719%0.18822%0.215CC..Hα-helixtrans-62.7-38.3179.3-67.1174000111.9L396 T461 P462 L468 F469L396-L465 HydrophobicContact CB-CB 4.44Å; L396-L465 HydrophobicContact CD1-CB 4.3Å; L396-L465 HydrophobicContact CD1-CD1 4.2Å; L396-L465 HydrophobicContact CD2-CD1 4.44Å; T461-L465 PolarHBondContact O-N 3.23Å; P462-L465 PolarHBondContact O-N 3.22Å; L465-L468 PolarHBondContact O-N 3.1Å; L465-F469 HydrophobicContact CB-CD2 4.44Å; L465-F469 HydrophobicContact CB-CE2 4.47Å; L465-F469 HydrophobicContact CD2-CE2 4.36Å; L465-F469 WeakPolarHBondContact O-CD2 3.46Å; L465-F469 PolarHBondContact O-N 3.4Å
466R88.4Confident86.5Confident85 Ų8540.3 Ų40.332%0.32120%0.203SC..Hα-helixtrans-57.3-51.8172.7175.1-179.4167.4160.8-0.8111.2L393 F399 P462 F464 L468 A470L393-R466 HydrophobicContact CD1-CB 4.33Å; L393-R466 HydrophobicContact CD1-CG 3.86Å; L393-R466 WeakPolarHBondContact CD1-O 3.31Å; F399-R466 HydrophobicContact CE2-CG 4.24Å; F399-R466 HydrophobicContact CZ-CG 4.45Å; P462-R466 VanDerWaalsContact O-CB 3.29Å; P462-R466 WeakPolarHBondContact O-CB 3.49Å; P462-R466 PolarHBondContact O-N 3.47Å; F464-R466 VanDerWaalsContact C-N 3.31Å; F464-R466 PolarHBondContact O-N 3.14Å; R466-L468 VanDerWaalsContact C-N 3.33Å; R466-L468 PolarHBondContact O-N 3.43Å; R466-A470 VanDerWaalsContact O-CB 3.23Å; R466-A470 WeakPolarHBondContact O-CB 3.34Å; R466-A470 PolarHBondContact O-N 2.94Å
467G90.2Very high87.8Confident1 Ų135.8 Ų35.81%0.0118%0.18CC..Hα-helixtrans-60.3-43.2177.700000112.4F194 L463 F464 F471F194-G467 WeakPolarHBondContact O-CA 3.47Å; L463-G467 PolarHBondContact O-N 3.46Å; L463-G467 VanDerWaalsContact O-N 3.15Å; F464-G467 PolarHBondContact O-N 2.91Å; G467-F471 VanDerWaalsContact O-CB 3.26Å; G467-F471 WeakPolarHBondContact O-CB 3.48Å; G467-F471 PolarHBondContact O-N 2.85Å
468L91.1Very high89Confident55 Ų5528.5 Ų28.529%0.28815%0.154SC..Hα-helixtrans-64.4-48.2-179.3-174.967000112.8F464 L465 R466 F471 L472F464-L468 HydrophobicContact CE1-CD2 4.15Å; F464-L468 HydrophobicContact CZ-CD2 4.38Å; F464-L468 WeakPolarHBondContact O-CB 3.48Å; F464-L468 PolarHBondContact O-N 3.35Å; L465-L468 PolarHBondContact O-N 3.1Å; R466-L468 VanDerWaalsContact C-N 3.33Å; R466-L468 PolarHBondContact O-N 3.43Å; L468-F471 PolarHBondContact O-N 3.45Å; L468-L472 VanDerWaalsContact O-CB 3.26Å; L468-L472 WeakPolarHBondContact O-CB 3.13Å; L468-L472 PolarHBondContact O-N 3.18Å
469F92.4Very high90.2Very high13 Ų1325.6 Ų25.66%0.05713%0.134CC..Hα-helixtrans-71.9-34.5179.8-77-66.6000112.6V141 A392 L393 L396 L465 L472 T473V141-F469 HydrophobicContact CG2-CE1 4.4Å; V141-F469 HydrophobicContact CG2-CE2 4.26Å; V141-F469 HydrophobicContact CG2-CZ 3.61Å; A392-F469 HydrophobicContact CB-CD1 4.1Å; A392-F469 HydrophobicContact CB-CD2 4.21Å; A392-F469 HydrophobicContact CB-CE1 4.06Å; A392-F469 HydrophobicContact CB-CE2 4.2Å; A392-F469 HydrophobicContact CB-CG 4.2Å; A392-F469 HydrophobicContact CB-CZ 4.14Å; L393-F469 HydrophobicContact CB-CB 4.04Å; L393-F469 HydrophobicContact CD1-CB 4.29Å; L396-F469 HydrophobicContact CD1-CD2 3.93Å; L396-F469 HydrophobicContact CD1-CE2 3.5Å; L396-F469 HydrophobicContact CD1-CZ 4.46Å; L465-F469 HydrophobicContact CB-CD2 4.44Å; L465-F469 HydrophobicContact CB-CE2 4.47Å; L465-F469 HydrophobicContact CD2-CE2 4.36Å; L465-F469 WeakPolarHBondContact O-CD2 3.46Å; L465-F469 PolarHBondContact O-N 3.4Å; F469-L472 HydrophobicContact CD1-CD2 4.38Å; F469-L472 PolarHBondContact O-N 2.77Å; F469-T473 WeakPolarHBondContact O-CB 3.47Å; F469-T473 PolarHBondContact O-N 3.09Å; F469-T473 PolarHBondContact O-OG1 2.9Å
470A93.4Very high91.2Very high5 Ų524.9 Ų24.94%0.04113%0.129CC..Hα-helixtrans-60.5-49.8171.600000110.7L393 R466 T473 W474L393-A470 HydrophobicContact CD1-CB 4.1Å; L393-A470 HydrophobicContact CD2-CB 4.12Å; R466-A470 VanDerWaalsContact O-CB 3.23Å; R466-A470 WeakPolarHBondContact O-CB 3.34Å; R466-A470 PolarHBondContact O-N 2.94Å; A470-T473 PolarHBondContact O-N 2.92Å; A470-W474 PolarHBondContact O-N 3.36Å; A470-W474 VanDerWaalsContact O-N 3.09Å
471F94.8Very high92Very high4 Ų423.1 Ų23.12%0.01812%0.12CC..Hα-helixtrans-63.8-43.2176.9179.1-104.3000112.5V184 L185 F194 L196 L232 C236 G467 L468 T473 W474 W475V184-F471 HydrophobicContact CG1-CE2 4.14Å; L185-F471 HydrophobicContact CD2-CE2 4.08Å; L185-F471 HydrophobicContact CD2-CZ 3.94Å; F194-F471 HydrophobicContact CD1-CD2 4.4Å; F194-F471 HydrophobicContact CD2-CD2 4.03Å; F194-F471 HydrophobicContact CE2-CD2 4.1Å; F194-F471 HydrophobicContact CE2-CE2 4.42Å; F194-F471 HydrophobicContact CG-CD2 4.18Å; F194-F471 HydrophobicContact CZ-CD2 4.36Å; L196-F471 HydrophobicContact CD1-CB 3.96Å; L196-F471 HydrophobicContact CD1-CD1 4.45Å; L196-F471 HydrophobicContact CD1-CD2 3.6Å; L196-F471 HydrophobicContact CD1-CE2 4.18Å; L196-F471 HydrophobicContact CD1-CG 3.74Å; L196-F471 HydrophobicContact CD2-CB 4Å; L196-F471 HydrophobicContact CD2-CG 4.39Å; L196-F471 HydrophobicContact CG-CB 4.14Å; L196-F471 HydrophobicContact CG-CG 4.44Å; L232-F471 HydrophobicContact CD1-CD1 4.24Å; L232-F471 HydrophobicContact CD1-CE1 3.89Å; L232-F471 HydrophobicContact CD2-CD1 4.22Å; L232-F471 HydrophobicContact CD2-CE1 3.94Å; L232-F471 HydrophobicContact CD2-CZ 4.47Å; L232-F471 HydrophobicContact CG-CE1 4Å; C236-F471 WeakPolarHBondContact SG-CE1 3.43Å; C236-F471 VanDerWaalsContact SG-CZ 3.54Å; G467-F471 VanDerWaalsContact O-CB 3.26Å; G467-F471 WeakPolarHBondContact O-CB 3.48Å; G467-F471 PolarHBondContact O-N 2.85Å; L468-F471 PolarHBondContact O-N 3.45Å; F471-T473 PolarHBondContact O-N 2.83Å; F471-W474 PolarHBondContact O-N 3.17Å; F471-W475 HydrophobicContact CE1-CB 4.34Å; F471-W475 HydrophobicContact CE2-CE3 4.5Å; F471-W475 HydrophobicContact CZ-CB 4.44Å; F471-W475 HydrophobicContact CZ-CD2 4.4Å; F471-W475 HydrophobicContact CZ-CE3 4.14Å; F471-W475 VanDerWaalsContact O-CB 3.23Å; F471-W475 WeakPolarHBondContact O-CB 3.34Å; F471-W475 PolarHBondContact O-N 3.48Å
472L95.4Very high92.7Very high24 Ų2423.9 Ų23.913%0.12612%0.123CC..Hα-helixtrans-61.2-44.4178-179.863.1000111.8V144 I239 L468 F469 W474 W475 V476V144-L472 HydrophobicContact CG1-CD2 3.89Å; I239-L472 HydrophobicContact CD1-CD1 3.71Å; L468-L472 VanDerWaalsContact O-CB 3.26Å; L468-L472 WeakPolarHBondContact O-CB 3.13Å; L468-L472 PolarHBondContact O-N 3.18Å; F469-L472 HydrophobicContact CD1-CD2 4.38Å; F469-L472 PolarHBondContact O-N 2.77Å; L472-W474 VanDerWaalsContact C-N 3.33Å; L472-W474 PolarHBondContact O-N 3.19Å; L472-W475 PolarHBondContact O-N 2.84Å; L472-V476 HydrophobicContact CD1-CG2 4.05Å; L472-V476 HydrophobicContact CG-CG2 4.48Å; L472-V476 WeakPolarHBondContact O-CB 3.31Å; L472-V476 VanDerWaalsContact O-CG2 3.28Å; L472-V476 WeakPolarHBondContact O-CG2 3.07Å; L472-V476 PolarHBondContact O-N 3.09Å
473T95.9Very high93.3Very high0 Ų020.1 Ų20.10%010%0.099CC..Hα-helixtrans-59-46.8177.3-56.80000110.5V281 W285 I386 S389 F469 A470 F471 A477V281-T473 HydrophobicContact CG1-CG2 4.39Å; W285-T473 HydrophobicContact CH2-CG2 4Å; I386-T473 HydrophobicContact CG2-CG2 3.96Å; S389-T473 VanDerWaalsContact CB-OG1 3.23Å; S389-T473 WeakPolarHBondContact CB-OG1 3.48Å; F469-T473 WeakPolarHBondContact O-CB 3.47Å; F469-T473 PolarHBondContact O-N 3.09Å; F469-T473 PolarHBondContact O-OG1 2.9Å; A470-T473 PolarHBondContact O-N 2.92Å; F471-T473 PolarHBondContact O-N 2.83Å; T473-A477 PolarHBondContact O-N 3.29Å
474W96.6Very high93.8Very high22 Ų2216.6 Ų16.68%0.0838%0.081CC..Hα-helixtrans-66.2-43.9177.4-174.291.4000112.5V184 L192 F194 L282 W285 A470 F471 L472 A477 A478V184-W474 HydrophobicContact CB-CH2 4.47Å; V184-W474 HydrophobicContact CB-CZ3 4.42Å; V184-W474 HydrophobicContact CG1-CH2 3.89Å; V184-W474 HydrophobicContact CG1-CZ3 3.69Å; V184-W474 HydrophobicContact CG2-CH2 3.69Å; V184-W474 HydrophobicContact CG2-CZ3 3.98Å; L192-W474 HydrophobicContact CD2-CZ2 4.44Å; F194-W474 HydrophobicContact CD1-CB 4.45Å; F194-W474 HydrophobicContact CD1-CG 4.49Å; F194-W474 HydrophobicContact CE1-CB 3.77Å; F194-W474 AromaticContact CE1-CD1 3.78Å; F194-W474 AromaticContact CE1-CD2 3.55Å; F194-W474 HydrophobicContact CE1-CD2 3.55Å; F194-W474 AromaticContact CE1-CE2 3.99Å; F194-W474 HydrophobicContact CE1-CE3 4.06Å; F194-W474 AromaticContact CE1-CG 3.42Å; F194-W474 HydrophobicContact CE1-CG 3.42Å; F194-W474 VanDerWaalsContact CE1-CG 3.42Å; F194-W474 AromaticContact CZ-CD2 3.51Å; F194-W474 HydrophobicContact CZ-CD2 3.51Å; F194-W474 AromaticContact CZ-CE2 3.74Å; F194-W474 AromaticContact CZ-CE3 3.7Å; F194-W474 HydrophobicContact CZ-CE3 3.7Å; F194-W474 AromaticContact CZ-CG 3.92Å; F194-W474 HydrophobicContact CZ-CG 3.92Å; F194-W474 HydrophobicContact CZ-CH2 4.35Å; F194-W474 HydrophobicContact CZ-CZ2 4.16Å; F194-W474 HydrophobicContact CZ-CZ3 4.13Å; L282-W474 HydrophobicContact CD2-CD2 3.81Å; L282-W474 VanDerWaalsContact CD2-CE2 3.45Å; L282-W474 HydrophobicContact CD2-CG 3.98Å; L282-W474 HydrophobicContact CD2-CZ2 3.91Å; L282-W474 WeakPolarHBondContact CD2-O 3.4Å; L282-W474 PolarHBondContact O-NE1 3.32Å; W285-W474 AromaticContact CG-CD1 3.99Å; A470-W474 PolarHBondContact O-N 3.36Å; A470-W474 VanDerWaalsContact O-N 3.09Å; F471-W474 PolarHBondContact O-N 3.17Å; L472-W474 VanDerWaalsContact C-N 3.33Å; L472-W474 PolarHBondContact O-N 3.19Å; W474-A477 WeakPolarHBondContact O-CB 3.26Å; W474-A477 PolarHBondContact O-N 2.88Å; W474-A478 HydrophobicContact CE3-CB 4.29Å; W474-A478 HydrophobicContact CH2-CB 4.34Å; W474-A478 HydrophobicContact CZ3-CB 4.05Å; W474-A478 PolarHBondContact O-N 3.42Å
475W97.5Very high94.2Very high1 Ų120.2 Ų20.20%0.00410%0.101CC..Hα-helixtrans-65-43.6-177.3-173.8-107.4000112S177 V180 A181 V184 C236 F471 L472 A477 A478 C479S177-W475 WeakPolarHBondContact O-CH2 3.43Å; S177-W475 WeakPolarHBondContact O-CZ2 3.46Å; V180-W475 HydrophobicContact CB-CH2 4.15Å; V180-W475 HydrophobicContact CG1-CH2 3.95Å; V180-W475 HydrophobicContact CG1-CZ3 4.05Å; A181-W475 HydrophobicContact CB-CH2 3.59Å; A181-W475 HydrophobicContact CB-CZ2 3.98Å; A181-W475 HydrophobicContact CB-CZ3 4.12Å; V184-W475 HydrophobicContact CG2-CZ3 4.5Å; C236-W475 VanDerWaalsContact CA-NE1 3.3Å; C236-W475 HydrophobicContact CB-CD2 4.11Å; C236-W475 VanDerWaalsContact CB-CE2 3.41Å; C236-W475 HydrophobicContact CB-CH2 4.26Å; C236-W475 HydrophobicContact CB-CZ2 3.51Å; C236-W475 PolarHBondContact O-NE1 3.49Å; F471-W475 HydrophobicContact CE1-CB 4.34Å; F471-W475 HydrophobicContact CE2-CE3 4.5Å; F471-W475 HydrophobicContact CZ-CB 4.44Å; F471-W475 HydrophobicContact CZ-CD2 4.4Å; F471-W475 HydrophobicContact CZ-CE3 4.14Å; F471-W475 VanDerWaalsContact O-CB 3.23Å; F471-W475 WeakPolarHBondContact O-CB 3.34Å; F471-W475 PolarHBondContact O-N 3.48Å; L472-W475 PolarHBondContact O-N 2.84Å; W475-A477 VanDerWaalsContact C-N 3.3Å; W475-A477 PolarHBondContact O-N 3.43Å; W475-A478 WeakPolarHBondContact O-CB 3.4Å; W475-A478 PolarHBondContact O-N 3.37Å; W475-A478 VanDerWaalsContact O-N 3.12Å; W475-C479 VanDerWaalsContact CE2-SG 3.59Å; W475-C479 PolarHBondContact NE1-SG 3.28Å; W475-C479 VanDerWaalsContact NE1-SG 3.37Å; W475-C479 PolarHBondContact O-N 3.33Å; W475-C479 PolarHBondContact O-SG 2.94Å; W475-C479 VanDerWaalsContact O-SG 3.32Å
476V97.5Very high94.5Very high0 Ų023.5 Ų23.50%011%0.114CC..Hα-helixtrans-61.4-41.6175.4172.20000110.5I239 L243 I385 I386 L472 Q480I239-V476 HydrophobicContact CG2-CG2 4.17Å; L243-V476 HydrophobicContact CD1-CB 4.29Å; L243-V476 HydrophobicContact CD1-CG1 3.89Å; L243-V476 HydrophobicContact CD1-CG2 4.34Å; I385-V476 HydrophobicContact CG2-CG1 4.37Å; I385-V476 HydrophobicContact CG2-CG2 3.79Å; I386-V476 HydrophobicContact CD1-CG1 3.99Å; I386-V476 HydrophobicContact CG1-CB 4.13Å; I386-V476 HydrophobicContact CG1-CG1 3.7Å; L472-V476 HydrophobicContact CD1-CG2 4.05Å; L472-V476 HydrophobicContact CG-CG2 4.48Å; L472-V476 WeakPolarHBondContact O-CB 3.31Å; L472-V476 VanDerWaalsContact O-CG2 3.28Å; L472-V476 WeakPolarHBondContact O-CG2 3.07Å; L472-V476 PolarHBondContact O-N 3.09Å; V476-Q480 WeakPolarHBondContact O-CG 3.22Å; V476-Q480 PolarHBondContact O-N 2.86Å
477A97.1Very high94.5Very high0 Ų019.4 Ų19.40%010%0.098CC..Hα-helixtrans-62.9-41.1173.300000112.1P278 V281 L282 I386 T473 W474 W475 Q480 V481P278-A477 HydrophobicContact CB-CB 4.16Å; V281-A477 HydrophobicContact CB-CB 3.96Å; V281-A477 HydrophobicContact CG1-CB 3.72Å; L282-A477 HydrophobicContact CD2-CB 4.18Å; L282-A477 HydrophobicContact CG-CB 4.49Å; I386-A477 HydrophobicContact CD1-CB 4.31Å; T473-A477 PolarHBondContact O-N 3.29Å; W474-A477 WeakPolarHBondContact O-CB 3.26Å; W474-A477 PolarHBondContact O-N 2.88Å; W475-A477 VanDerWaalsContact C-N 3.3Å; W475-A477 PolarHBondContact O-N 3.43Å; A477-Q480 WeakPolarHBondContact O-CB 3.48Å; A477-Q480 PolarHBondContact O-N 3.32Å; A477-V481 WeakPolarHBondContact O-CG2 3.47Å; A477-V481 PolarHBondContact O-N 3.49Å
478A97Very high94.5Very high6 Ų621 Ų215%0.0511%0.106CC..Hα-helixtrans-62.4-47.9178.500000111.2L282 W474 W475 Q480 V481 I482L282-A478 HydrophobicContact CD2-CB 3.72Å; W474-A478 HydrophobicContact CE3-CB 4.29Å; W474-A478 HydrophobicContact CH2-CB 4.34Å; W474-A478 HydrophobicContact CZ3-CB 4.05Å; W474-A478 PolarHBondContact O-N 3.42Å; W475-A478 WeakPolarHBondContact O-CB 3.4Å; W475-A478 PolarHBondContact O-N 3.37Å; W475-A478 VanDerWaalsContact O-N 3.12Å; A478-Q480 VanDerWaalsContact C-N 3.29Å; A478-Q480 PolarHBondContact O-N 2.92Å; A478-V481 PolarHBondContact O-N 3.05Å; A478-I482 WeakPolarHBondContact O-CG1 3.23Å; A478-I482 PolarHBondContact O-N 3.47Å
479C96.9Very high94.4Very high4 Ų424.8 Ų24.83%0.02712%0.117CC..Hα-helixtrans-58.6-41.4174.9-67.60000111.5G240 L243 W475 S483G240-C479 VanDerWaalsContact CA-SG 3.55Å; L243-C479 HydrophobicContact CB-CB 4.06Å; L243-C479 HydrophobicContact CD1-CB 3.56Å; L243-C479 HydrophobicContact CG-CB 4.46Å; W475-C479 VanDerWaalsContact CE2-SG 3.59Å; W475-C479 PolarHBondContact NE1-SG 3.28Å; W475-C479 VanDerWaalsContact NE1-SG 3.37Å; W475-C479 PolarHBondContact O-N 3.33Å; W475-C479 PolarHBondContact O-SG 2.94Å; W475-C479 VanDerWaalsContact O-SG 3.32Å; C479-S483 WeakPolarHBondContact O-CB 3.43Å; C479-S483 PolarHBondContact O-N 2.78Å; C479-S483 PolarHBondContact O-OG 3.14Å
480Q95.8Very high94.1Very high5 Ų528.5 Ų28.52%0.02313%0.134CC..Hα-helixtrans-62.8-43.4175.4-75.5-158.5-44.400112.8P278 P382 V476 A477 A478 S483 S484P278-Q480 HydrophobicContact CB-CB 4.24Å; P278-Q480 HydrophobicContact CG-CB 4.19Å; P382-Q480 HydrophobicContact CB-CG 4.34Å; V476-Q480 WeakPolarHBondContact O-CG 3.22Å; V476-Q480 PolarHBondContact O-N 2.86Å; A477-Q480 WeakPolarHBondContact O-CB 3.48Å; A477-Q480 PolarHBondContact O-N 3.32Å; A478-Q480 VanDerWaalsContact C-N 3.29Å; A478-Q480 PolarHBondContact O-N 2.92Å; Q480-S483 PolarHBondContact O-OG 2.68Å; Q480-S484 WeakPolarHBondContact O-CB 3.36Å; Q480-S484 PolarHBondContact O-N 2.95Å; Q480-S484 PolarHBondContact O-OG 3.35Å
481V96.1Very high93.5Very high19 Ų1929.6 Ų29.612%0.11514%0.138CC..Hα-helixtrans-61.4-52.1176.7173.70000110.2P278 V279 L282 A477 A478 S483 S484 L485P278-V481 HydrophobicContact CB-CG2 3.63Å; V279-V481 HydrophobicContact CG2-CG1 4.25Å; V279-V481 HydrophobicContact CG2-CG2 3.69Å; L282-V481 HydrophobicContact CD1-CB 4.21Å; L282-V481 HydrophobicContact CD1-CG2 3.75Å; A477-V481 WeakPolarHBondContact O-CG2 3.47Å; A477-V481 PolarHBondContact O-N 3.49Å; A478-V481 PolarHBondContact O-N 3.05Å; V481-S483 PolarHBondContact O-N 3.18Å; V481-S484 PolarHBondContact O-N 3.49Å; V481-S484 PolarHBondContact O-OG 3.49Å; V481-S484 VanDerWaalsContact O-OG 3.09Å; V481-L485 HydrophobicContact CG1-CD1 3.7Å; V481-L485 HydrophobicContact CG1-CG 4.23Å; V481-L485 WeakPolarHBondContact O-CB 2.91Å; V481-L485 VanDerWaalsContact O-CG 3.25Å; V481-L485 WeakPolarHBondContact O-CG 3.41Å; V481-L485 PolarHBondContact O-N 3.17Å
482I95.1Very high92.8Very high37 Ų3733.1 Ų33.119%0.1915%0.154CC..Hα-helixtrans-58.1-53.6-178-65.6166.2000110.2F173 L176 V180 A478 S484 L485 F486F173-I482 HydrophobicContact CE1-CG2 4.29Å; L176-I482 HydrophobicContact CD2-CG2 3.72Å; V180-I482 HydrophobicContact CG1-CD1 4.27Å; V180-I482 HydrophobicContact CG2-CD1 4.31Å; A478-I482 WeakPolarHBondContact O-CG1 3.23Å; A478-I482 PolarHBondContact O-N 3.47Å; I482-S484 PolarHBondContact O-N 3.03Å; I482-L485 PolarHBondContact O-N 3.09Å; I482-F486 HydrophobicContact CG2-CD2 4.04Å; I482-F486 HydrophobicContact CG2-CE2 4.16Å; I482-F486 WeakPolarHBondContact O-CD2 3.35Å; I482-F486 PolarHBondContact O-N 3.21Å; I482-F486 VanDerWaalsContact O-N 3.09Å
483S94.3Very high91.6Very high1 Ų138.6 Ų38.61%0.00718%0.175CC..Hα-helixtrans-66.1-35.7-177.754.10000113.8G247 C479 Q480 V481 G487G247-S483 WeakPolarHBondContact CA-OG 3.23Å; C479-S483 WeakPolarHBondContact O-CB 3.43Å; C479-S483 PolarHBondContact O-N 2.78Å; C479-S483 PolarHBondContact O-OG 3.14Å; Q480-S483 PolarHBondContact O-OG 2.68Å; V481-S483 PolarHBondContact O-N 3.18Å; S483-G487 PolarHBondContact O-N 3.37Å
484S93.4Very high90.2Very high6 Ų643.3 Ų43.34%0.04220%0.199CC..Hα-helixtrans-73.2-36.1176.462.70000113.2A251 Q480 V481 I482 G487 I488A251-S484 WeakPolarHBondContact CB-O 3.44Å; Q480-S484 WeakPolarHBondContact O-CB 3.36Å; Q480-S484 PolarHBondContact O-N 2.95Å; Q480-S484 PolarHBondContact O-OG 3.35Å; V481-S484 PolarHBondContact O-N 3.49Å; V481-S484 PolarHBondContact O-OG 3.49Å; V481-S484 VanDerWaalsContact O-OG 3.09Å; I482-S484 PolarHBondContact O-N 3.03Å; S484-G487 CarbonylContact O-C 3.51Å; S484-G487 WeakPolarHBondContact O-CA 3.38Å; S484-G487 PolarHBondContact O-N 3.2Å; S484-G487 VanDerWaalsContact O-N 3.15Å; S484-I488 WeakPolarHBondContact O-CG1 3.43Å; S484-I488 PolarHBondContact O-N 3.12Å
485L93Very high88.6Confident101 Ų10147.4 Ų47.453%0.52922%0.221SC..Hα-helixtrans-63.7-45.8173.5-72.4175.5000111.5V481 I482 G487 I488 Y489V481-L485 HydrophobicContact CG1-CD1 3.7Å; V481-L485 HydrophobicContact CG1-CG 4.23Å; V481-L485 WeakPolarHBondContact O-CB 2.91Å; V481-L485 VanDerWaalsContact O-CG 3.25Å; V481-L485 WeakPolarHBondContact O-CG 3.41Å; V481-L485 PolarHBondContact O-N 3.17Å; I482-L485 PolarHBondContact O-N 3.09Å; L485-G487 PolarHBondContact O-N 3.31Å; L485-I488 PolarHBondContact O-N 3.16Å; L485-Y489 PolarHBondContact O-N 3.5Å
486F91.8Very high86.4Confident104 Ų10454.8 Ų54.846%0.45626%0.255SS..Hα-helixtrans-58.8-38.8170.8-91.1-78.6000111.7F173 L176 L248 I482 Y489 F490F173-F486 HydrophobicContact CE1-CB 4.39Å; F173-F486 HydrophobicContact CE1-CD2 4.11Å; F173-F486 HydrophobicContact CE1-CG 4.41Å; F173-F486 HydrophobicContact CZ-CB 3.76Å; F173-F486 HydrophobicContact CZ-CD2 4.16Å; F173-F486 HydrophobicContact CZ-CG 4Å; L176-F486 HydrophobicContact CD2-CD2 4.45Å; L176-F486 HydrophobicContact CD2-CE2 3.67Å; L176-F486 HydrophobicContact CD2-CZ 4.23Å; L248-F486 HydrophobicContact CD2-CB 4.38Å; I482-F486 HydrophobicContact CG2-CD2 4.04Å; I482-F486 HydrophobicContact CG2-CE2 4.16Å; I482-F486 WeakPolarHBondContact O-CD2 3.35Å; I482-F486 PolarHBondContact O-N 3.21Å; I482-F486 VanDerWaalsContact O-N 3.09Å; F486-Y489 PolarHBondContact O-N 3.44Å; F486-F490 WeakPolarHBondContact O-CB 3.33Å; F486-F490 PolarHBondContact O-N 3.3Å
487G89.6Confident83.3Confident0 Ų063.8 Ų63.80%030%0.303CS..Hα-helixtrans-62.4-43.1176.300000113.2S483 S484 L485 F490 H491S483-G487 PolarHBondContact O-N 3.37Å; S484-G487 CarbonylContact O-C 3.51Å; S484-G487 WeakPolarHBondContact O-CA 3.38Å; S484-G487 PolarHBondContact O-N 3.2Å; S484-G487 VanDerWaalsContact O-N 3.15Å; L485-G487 PolarHBondContact O-N 3.31Å; G487-F490 PolarHBondContact O-N 3.49Å; G487-H491 PolarHBondContact O-N 2.93Å; G487-H491 PolarHBondContact O-ND1 3.34Å
488I90.1Very high82.6Confident34 Ų3467 Ų6717%0.17432%0.318CS..Hα-helixtrans-61.9-50.1174.8-71177.4000109.7A251 F275 S484 L485 F490 H491 Q492A251-I488 HydrophobicContact CB-CG1 3.96Å; F275-I488 HydrophobicContact CE1-CD1 3.53Å; F275-I488 HydrophobicContact CE2-CD1 4.34Å; F275-I488 HydrophobicContact CZ-CD1 3.34Å; F275-I488 HydrophobicContact CZ-CG1 4.1Å; S484-I488 WeakPolarHBondContact O-CG1 3.43Å; S484-I488 PolarHBondContact O-N 3.12Å; L485-I488 PolarHBondContact O-N 3.16Å; I488-F490 VanDerWaalsContact C-N 3.3Å; I488-F490 PolarHBondContact O-N 3.34Å; I488-H491 PolarHBondContact O-N 2.87Å; I488-Q492 HydrophobicContact CG2-CG 4.21Å; I488-Q492 WeakPolarHBondContact O-CB 3.36Å; I488-Q492 WeakPolarHBondContact O-CG 3.46Å; I488-Q492 PolarHBondContact O-N 3.2Å
489Y88.8Confident81.9Confident134 Ų13470.2 Ų70.253%0.52533%0.332SS..Hα-helixtrans-56.6-46.2179.4178.8-98.9000111.6L485 F486 Y493 L494L485-Y489 PolarHBondContact O-N 3.5Å; F486-Y489 PolarHBondContact O-N 3.44Å; Y489-Y493 AromaticContact CD2-CD2 3.69Å; Y489-Y493 HydrophobicContact CD2-CD2 3.69Å; Y489-Y493 HydrophobicContact CD2-CE2 4.25Å; Y489-Y493 HydrophobicContact CD2-CG 4.42Å; Y489-Y493 AromaticContact CE2-CD2 3.98Å; Y489-Y493 HydrophobicContact CE2-CD2 3.98Å; Y489-Y493 HydrophobicContact CE2-CG 4.3Å; Y489-Y493 HydrophobicContact CG-CD2 4.44Å; Y489-Y493 WeakPolarHBondContact O-CB 3.46Å; Y489-Y493 PolarHBondContact O-N 3.15Å; Y489-L494 HydrophobicContact CE1-CD1 4.24Å
490F86Confident81Confident92 Ų9273.8 Ų73.840%0.40435%0.349SS..Iπ-helixtrans-60.5-49178.1-178.5-93.5000112.4F486 G487 I488 L494 M495F486-F490 WeakPolarHBondContact O-CB 3.33Å; F486-F490 PolarHBondContact O-N 3.3Å; G487-F490 PolarHBondContact O-N 3.49Å; I488-F490 VanDerWaalsContact C-N 3.3Å; I488-F490 PolarHBondContact O-N 3.34Å; F490-L494 HydrophobicContact CD2-CB 4.15Å; F490-L494 HydrophobicContact CD2-CD1 3.68Å; F490-L494 HydrophobicContact CE2-CB 4.38Å; F490-L494 HydrophobicContact CE2-CD1 4.29Å; F490-L494 WeakPolarHBondContact O-CA 3.44Å; F490-L494 WeakPolarHBondContact O-CB 3.3Å; F490-L494 PolarHBondContact O-N 3.2Å; F490-M495 HydrophobicContact CD1-CG 4.36Å; F490-M495 HydrophobicContact CE1-CG 3.76Å; F490-M495 HydrophobicContact CE1-SD 4.37Å; F490-M495 HydrophobicContact CZ-CG 4.2Å; F490-M495 PolarHBondContact O-N 3.31Å
491H80.5Confident80.2Confident27 Ų2777.9 Ų77.913%0.12537%0.369CS..Iπ-helixtrans-74.1-31-175.7-72.684.1000113.4Q252 L255 G487 I488 M495Q252-H491 WeakPolarHBondContact CB-NE2 3.4Å; Q252-H491 WeakPolarHBondContact CG-NE2 3.26Å; L255-H491 HydrophobicContact CD1-CB 4.24Å; G487-H491 PolarHBondContact O-N 2.93Å; G487-H491 PolarHBondContact O-ND1 3.34Å; I488-H491 PolarHBondContact O-N 2.87Å; H491-M495 VanDerWaalsContact CD2-CE 3.48Å; H491-M495 WeakPolarHBondContact CD2-CE 3.45Å
492Q79.6Confident79.2Confident78 Ų7881.6 Ų81.636%0.36438%0.384SS..Iπ-helixtrans-81.3-40.6179.7-71.4-176.5-19.200112.6L255 I488 Q496L255-Q492 HydrophobicContact CD1-CG 4.24Å; I488-Q492 HydrophobicContact CG2-CG 4.21Å; I488-Q492 WeakPolarHBondContact O-CB 3.36Å; I488-Q492 WeakPolarHBondContact O-CG 3.46Å; I488-Q492 PolarHBondContact O-N 3.2Å; Q492-Q496 PolarHBondContact O-OE1 2.66Å
493Y71.7Confident78.1Confident140 Ų14084.5 Ų84.555%0.54940%0.397SS..Iπ-helixtrans-107.9-27.6-169.7-67-80.1000114.7Y489 N497Y489-Y493 AromaticContact CD2-CD2 3.69Å; Y489-Y493 HydrophobicContact CD2-CD2 3.69Å; Y489-Y493 HydrophobicContact CD2-CE2 4.25Å; Y489-Y493 HydrophobicContact CD2-CG 4.42Å; Y489-Y493 AromaticContact CE2-CD2 3.98Å; Y489-Y493 HydrophobicContact CE2-CD2 3.98Å; Y489-Y493 HydrophobicContact CE2-CG 4.3Å; Y489-Y493 HydrophobicContact CG-CD2 4.44Å; Y489-Y493 WeakPolarHBondContact O-CB 3.46Å; Y489-Y493 PolarHBondContact O-N 3.15Å; Y493-N497 PolarHBondContact O-ND2 3.34Å
494L65.5Low76.9Confident98 Ų9890.5 Ų90.551%0.51343%0.425SS..Iπ-helixtrans-103.1-20.5-174.6-63.1173.3000113.9Y489 F490Y489-L494 HydrophobicContact CE1-CD1 4.24Å; F490-L494 HydrophobicContact CD2-CB 4.15Å; F490-L494 HydrophobicContact CD2-CD1 3.68Å; F490-L494 HydrophobicContact CE2-CB 4.38Å; F490-L494 HydrophobicContact CE2-CD1 4.29Å; F490-L494 WeakPolarHBondContact O-CA 3.44Å; F490-L494 WeakPolarHBondContact O-CB 3.3Å; F490-L494 PolarHBondContact O-N 3.2Å
495M63.2Low75.7Confident109 Ų10997 Ų9754%0.53746%0.455SS..SBendtrans-103.7-14177-82.7-125.9-72.500114.7F490 H491F490-M495 HydrophobicContact CD1-CG 4.36Å; F490-M495 HydrophobicContact CE1-CG 3.76Å; F490-M495 HydrophobicContact CE1-SD 4.37Å; F490-M495 HydrophobicContact CZ-CG 4.2Å; F490-M495 PolarHBondContact O-N 3.31Å; H491-M495 VanDerWaalsContact CD2-CE 3.48Å; H491-M495 WeakPolarHBondContact CD2-CE 3.45Å
496Q50.7Low74.2Confident156 Ų15696.7 Ų96.773%0.72945%0.449SS*.  trans-88.3-16.3174.9-68.9-171.4-7.600113.2Q492Q492-Q496 PolarHBondContact O-OE1 2.66Å
497N33.4Very low72.6Confident188 Ų18896 Ų96100%1.00545%0.448SS*.  trans-93.90165.8-71.5-22.1000109.5Y493Y493-N497 PolarHBondContact O-ND2 3.34Å

Retrieved 497 of 497 residues in 227.5 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).