A0A087XNW5_POEFO Loading...

60S acidic ribosomal protein P0

Ribosomal protein P0 is the functional equivalent of E.coli protein L10.

AlphaFold DB , UniProt , Accession A0A087XNW5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 314 aa.

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

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
1M48.1Very low76.8Confident231 Ų231129.5 Ų129.5100%1.13863%0.633SS**  0136.60-130.9164.3-177.400108
2P54.2Low77.9Confident115 Ų115125.3 Ų125.375%0.74762%0.615SS**  trans-58.4158.6169.8-20.633.3000111E4P2-E4 PolarHBondContact O-N 2.56Å
3R59.6Low78.8Confident250 Ų250117.8 Ų117.894%0.94358%0.576SS**  trans-69.9112.3161.8-93.3179.9165.8161.4-3.3107.4
4E72.9Confident79.5Confident108 Ų108112.9 Ų112.951%0.50555%0.55SS.*  trans-55.7146.7166.1-65.7-176.8140.300110.2P2 R6 W9P2-E4 PolarHBondContact O-N 2.56Å; E4-R6 PolarHBondContact O-N 2.84Å; E4-W9 HydrophobicContact CB-CB 4.25Å
5D86.7Confident80.3Confident124 Ų124112.7 Ų112.766%0.66355%0.552SS**  trans-58.5140.3175.8-87.9-55000111.8A7 T8 W9D5-A7 PolarHBondContact O-N 3.19Å; D5-T8 PolarHBondContact O-N 2.88Å; D5-T8 VanDerWaalsContact O-N 3.09Å; D5-T8 PolarHBondContact O-OG1 3.18Å; D5-W9 WeakPolarHBondContact O-CB 3.43Å; D5-W9 PolarHBondContact O-N 3.21Å
6R83.1Confident80.9Confident197 Ų197112.9 Ų112.974%0.74355%0.549SS*.THydrogen-bonded Turntrans-64.4-12.1-175-162.4-179-178.3-160.64.8113.2E4 K10E4-R6 PolarHBondContact O-N 2.84Å; R6-K10 VanDerWaalsContact O-CD 3.27Å; R6-K10 WeakPolarHBondContact O-CD 3.43Å; R6-K10 WeakPolarHBondContact O-CG 3.48Å
7A86.4Confident81.5Confident75 Ų75106.5 Ų106.562%0.6252%0.518SS*.THydrogen-bonded Turntrans-83.5-53.7170.800000111.6D5 K10 S11D5-A7 PolarHBondContact O-N 3.19Å; A7-K10 WeakPolarHBondContact O-CB 3.3Å; A7-K10 PolarHBondContact O-N 3.19Å; A7-K10 VanDerWaalsContact O-N 3.13Å; A7-S11 PolarHBondContact O-N 3.09Å
8T89.1Confident81.9Confident66 Ų66102.4 Ų102.441%0.40550%0.499SS..Hα-helixtrans-66.1-41.2-178.152.10000111.7D5 K10 S11 N12D5-T8 PolarHBondContact O-N 2.88Å; D5-T8 VanDerWaalsContact O-N 3.09Å; D5-T8 PolarHBondContact O-OG1 3.18Å; T8-K10 PolarHBondContact O-N 3.27Å; T8-S11 WeakPolarHBondContact CA-OG 3.32Å; T8-S11 PolarHBondContact O-N 3.15Å; T8-S11 PolarHBondContact O-OG 3.02Å; T8-N12 WeakPolarHBondContact O-CB 3.16Å; T8-N12 PolarHBondContact O-N 3.23Å; T8-N12 PolarHBondContact O-ND2 3.09Å; T8-N12 PolarHBondContact O-OD1 2.95Å
9W87.9Confident82.4Confident127 Ų127103.2 Ų103.248%0.48150%0.501SS..Hα-helixtrans-56.8-38.3172.5179.580000112.4E4 D5 Y13E4-W9 HydrophobicContact CB-CB 4.25Å; D5-W9 WeakPolarHBondContact O-CB 3.43Å; D5-W9 PolarHBondContact O-N 3.21Å; W9-Y13 VanDerWaalsContact O-CB 3.27Å; W9-Y13 WeakPolarHBondContact O-CB 3.38Å; W9-Y13 PolarHBondContact O-N 2.87Å
10K87.4Confident82.8Confident78 Ų7898.7 Ų98.734%0.33948%0.479SS..Hα-helixtrans-69.8-45.5176.8-76.3176.2-173.7170.70112.1R6 A7 T8 N12 Y13 F14 M60R6-K10 VanDerWaalsContact O-CD 3.27Å; R6-K10 WeakPolarHBondContact O-CD 3.43Å; R6-K10 WeakPolarHBondContact O-CG 3.48Å; A7-K10 WeakPolarHBondContact O-CB 3.3Å; A7-K10 PolarHBondContact O-N 3.19Å; A7-K10 VanDerWaalsContact O-N 3.13Å; T8-K10 PolarHBondContact O-N 3.27Å; K10-N12 VanDerWaalsContact C-N 3.34Å; K10-Y13 PolarHBondContact O-N 2.74Å; K10-F14 HydrophobicContact CB-CE2 4.5Å; K10-F14 WeakPolarHBondContact O-CD2 3.41Å; K10-F14 PolarHBondContact O-N 3.09Å; K10-M60 HydrophobicContact CB-CE 3.93Å; K10-M60 HydrophobicContact CD-CE 4.28Å; K10-M60 HydrophobicContact CD-SD 4.48Å; K10-M60 HydrophobicContact CG-CE 3.72Å; K10-M60 HydrophobicContact CG-SD 4.41Å
11S88.9Confident83Confident54 Ų5495.2 Ų95.238%0.37846%0.463SS..Hα-helixtrans-63-43.5178.6510000111A7 T8 Y13 F14 L15A7-S11 PolarHBondContact O-N 3.09Å; T8-S11 WeakPolarHBondContact CA-OG 3.32Å; T8-S11 PolarHBondContact O-N 3.15Å; T8-S11 PolarHBondContact O-OG 3.02Å; S11-Y13 VanDerWaalsContact C-N 3.27Å; S11-Y13 PolarHBondContact O-N 2.98Å; S11-F14 PolarHBondContact O-N 2.99Å; S11-F14 VanDerWaalsContact O-N 3.15Å; S11-L15 WeakPolarHBondContact O-CG 3.35Å; S11-L15 PolarHBondContact O-N 3.44Å
12N90.6Very high84.9Confident78 Ų7889.1 Ų89.142%0.41744%0.435SS..Hα-helixtrans-60.4-38.9175.8-63.1-1.8000111.2T8 K10 K16T8-N12 WeakPolarHBondContact O-CB 3.16Å; T8-N12 PolarHBondContact O-N 3.23Å; T8-N12 PolarHBondContact O-ND2 3.09Å; T8-N12 PolarHBondContact O-OD1 2.95Å; K10-N12 VanDerWaalsContact C-N 3.34Å; N12-K16 VanDerWaalsContact O-CB 3.31Å; N12-K16 WeakPolarHBondContact O-CB 3.36Å; N12-K16 PolarHBondContact O-N 3Å
13Y89.6Confident86.6Confident29 Ų2986.8 Ų86.811%0.11442%0.417CS..Hα-helixtrans-69.8-36.8175.1-172.7-97.5000113.6W9 K10 S11 I17 L54 M55 G56 M60W9-Y13 VanDerWaalsContact O-CB 3.27Å; W9-Y13 WeakPolarHBondContact O-CB 3.38Å; W9-Y13 PolarHBondContact O-N 2.87Å; K10-Y13 PolarHBondContact O-N 2.74Å; S11-Y13 VanDerWaalsContact C-N 3.27Å; S11-Y13 PolarHBondContact O-N 2.98Å; Y13-I17 HydrophobicContact CD1-CD1 4.01Å; Y13-I17 HydrophobicContact CE1-CD1 3.34Å; Y13-I17 HydrophobicContact CE1-CG1 4.17Å; Y13-I17 PolarHBondContact O-N 2.92Å; Y13-I17 VanDerWaalsContact O-N 3.1Å; Y13-L54 HydrophobicContact CE2-CD1 4.25Å; Y13-L54 HydrophobicContact CE2-CG 4.47Å; Y13-M55 PolarHBondContact OH-O 3.15Å; Y13-G56 WeakPolarHBondContact OH-CA 3.49Å; Y13-M60 HydrophobicContact CD1-CE 4.28Å; Y13-M60 HydrophobicContact CE1-CB 4.29Å
14F88.8Confident88Confident48 Ų4877.3 Ų77.321%0.21138%0.381CS..Hα-helixtrans-63.2-53.6172-80.7-65.5000111K10 S11 K16 I17 I18 M60 K63 A64K10-F14 HydrophobicContact CB-CE2 4.5Å; K10-F14 WeakPolarHBondContact O-CD2 3.41Å; K10-F14 PolarHBondContact O-N 3.09Å; S11-F14 PolarHBondContact O-N 2.99Å; S11-F14 VanDerWaalsContact O-N 3.15Å; F14-K16 PolarHBondContact O-N 2.84Å; F14-I17 PolarHBondContact O-N 3.23Å; F14-I18 WeakPolarHBondContact O-CD1 3.49Å; F14-I18 VanDerWaalsContact O-CG1 3.28Å; F14-I18 WeakPolarHBondContact O-CG1 3.21Å; F14-I18 PolarHBondContact O-N 2.68Å; F14-M60 HydrophobicContact CD2-CE 3.99Å; F14-M60 HydrophobicContact CE1-CE 4.25Å; F14-M60 WeakPolarHBondContact CE1-O 3.38Å; F14-M60 HydrophobicContact CE2-CE 3.34Å; F14-M60 HydrophobicContact CE2-SD 4.27Å; F14-M60 HydrophobicContact CZ-CE 3.49Å; F14-M60 VanDerWaalsContact CZ-CE 3.49Å; F14-M60 HydrophobicContact CZ-SD 4.03Å; F14-K63 HydrophobicContact CE1-CB 4.19Å; F14-K63 HydrophobicContact CE1-CG 4.34Å; F14-K63 HydrophobicContact CZ-CB 4.38Å; F14-K63 HydrophobicContact CZ-CD 4.37Å; F14-K63 HydrophobicContact CZ-CG 4.39Å; F14-A64 HydrophobicContact CD1-CB 3.6Å; F14-A64 HydrophobicContact CE1-CB 3.87Å
15L90.5Very high88.7Confident111 Ų11174.7 Ų74.758%0.58137%0.374SS*.Hα-helixtrans-55.6-39177.9-68171.2000111.9S11 I18 Q19S11-L15 WeakPolarHBondContact O-CG 3.35Å; S11-L15 PolarHBondContact O-N 3.44Å; L15-I18 PolarHBondContact O-N 2.91Å; L15-Q19 WeakPolarHBondContact O-CB 3.49Å; L15-Q19 PolarHBondContact O-N 3.25Å
16K91.3Very high88.9Confident115 Ų11569.9 Ų69.950%0.535%0.347SS..Hα-helixtrans-69.5-33.6176.2-175.7162.6-174.5159.30114.2N12 F14 L20 L54N12-K16 VanDerWaalsContact O-CB 3.31Å; N12-K16 WeakPolarHBondContact O-CB 3.36Å; N12-K16 PolarHBondContact O-N 3Å; F14-K16 PolarHBondContact O-N 2.84Å; K16-L20 HydrophobicContact CG-CD1 4.16Å; K16-L20 WeakPolarHBondContact O-CB 3.35Å; K16-L20 WeakPolarHBondContact O-CD1 3.4Å; K16-L20 WeakPolarHBondContact O-CG 3.36Å; K16-L20 PolarHBondContact O-N 3.48Å; K16-L54 HydrophobicContact CD-CD1 4.49Å; K16-L54 HydrophobicContact CG-CD1 4.49Å
17I90.1Very high89.3Confident4 Ų460.6 Ų60.62%0.02131%0.312CS..Hα-helixtrans-65.4-46.8170.9-78.4172.7000110.1Y13 F14 L20 L21 L54 M61 A64Y13-I17 HydrophobicContact CD1-CD1 4.01Å; Y13-I17 HydrophobicContact CE1-CD1 3.34Å; Y13-I17 HydrophobicContact CE1-CG1 4.17Å; Y13-I17 PolarHBondContact O-N 2.92Å; Y13-I17 VanDerWaalsContact O-N 3.1Å; F14-I17 PolarHBondContact O-N 3.23Å; I17-L20 PolarHBondContact O-N 3.12Å; I17-L21 HydrophobicContact CG2-CD1 3.57Å; I17-L21 HydrophobicContact CG2-CG 4.28Å; I17-L21 WeakPolarHBondContact O-CG 3.44Å; I17-L21 PolarHBondContact O-N 2.99Å; I17-L54 HydrophobicContact CD1-CD2 4.23Å; I17-L54 HydrophobicContact CG1-CD2 3.42Å; I17-L54 VanDerWaalsContact CG1-CD2 3.42Å; I17-M61 HydrophobicContact CD1-CB 4.37Å; I17-M61 HydrophobicContact CD1-CG 3.94Å; I17-A64 HydrophobicContact CB-CB 4.16Å; I17-A64 HydrophobicContact CD1-CB 4.01Å; I17-A64 HydrophobicContact CG2-CB 3.66Å
18I88.6Confident89.5Confident34 Ų3457 Ų5717%0.17428%0.282CS..Hα-helixtrans-57.5-56.3-177.5-71.4164.1000109.9F14 L15 L20 L21 D22 H68F14-I18 WeakPolarHBondContact O-CD1 3.49Å; F14-I18 VanDerWaalsContact O-CG1 3.28Å; F14-I18 WeakPolarHBondContact O-CG1 3.21Å; F14-I18 PolarHBondContact O-N 2.68Å; L15-I18 PolarHBondContact O-N 2.91Å; I18-L20 VanDerWaalsContact C-N 3.25Å; I18-L20 PolarHBondContact O-N 3.45Å; I18-L21 WeakPolarHBondContact O-CB 3.42Å; I18-L21 PolarHBondContact O-N 3.3Å; I18-D22 WeakPolarHBondContact CG2-OD2 3.38Å; I18-D22 PolarHBondContact O-N 3.14Å; I18-H68 VanDerWaalsContact CD1-NE2 3.32Å; I18-H68 WeakPolarHBondContact CD1-NE2 3.2Å; I18-H68 WeakPolarHBondContact CG1-NE2 3.49Å; I18-H68 WeakPolarHBondContact CG2-CE1 3.31Å
19Q91.4Very high89.7Confident116 Ų11653.9 Ų53.954%0.54226%0.263SS..Hα-helixtrans-53.9-40.9176.3-179.6176.38.300112.4L15 D22 D23L15-Q19 WeakPolarHBondContact O-CB 3.49Å; L15-Q19 PolarHBondContact O-N 3.25Å; Q19-D22 PolarHBondContact O-N 3.29Å; Q19-D23 VanDerWaalsContact CG-OD2 3.25Å; Q19-D23 WeakPolarHBondContact CG-OD2 3.26Å; Q19-D23 PolarHBondContact NE2-OD2 2.94Å; Q19-D23 WeakPolarHBondContact O-CB 3.43Å; Q19-D23 VanDerWaalsContact O-CG 3.29Å; Q19-D23 PolarHBondContact O-N 3.49Å
20L91.3Very high89.9Confident13 Ų1347.9 Ų47.97%0.06824%0.24CC..Hα-helixtrans-73.1-24.7178.9-70.4173.3000114.1K16 I17 I18 Y24 V52 L54 F90K16-L20 HydrophobicContact CG-CD1 4.16Å; K16-L20 WeakPolarHBondContact O-CB 3.35Å; K16-L20 WeakPolarHBondContact O-CD1 3.4Å; K16-L20 WeakPolarHBondContact O-CG 3.36Å; K16-L20 PolarHBondContact O-N 3.48Å; I17-L20 PolarHBondContact O-N 3.12Å; I18-L20 VanDerWaalsContact C-N 3.25Å; I18-L20 PolarHBondContact O-N 3.45Å; L20-Y24 HydrophobicContact CD2-CD2 3.94Å; L20-Y24 HydrophobicContact CD2-CE2 3.6Å; L20-Y24 WeakPolarHBondContact O-CB 3.4Å; L20-Y24 WeakPolarHBondContact O-CD2 3.38Å; L20-Y24 PolarHBondContact O-N 2.79Å; L20-V52 HydrophobicContact CD1-CG1 4.11Å; L20-V52 HydrophobicContact CD2-CB 4.27Å; L20-V52 HydrophobicContact CD2-CG1 3.98Å; L20-V52 HydrophobicContact CD2-CG2 4.49Å; L20-L54 HydrophobicContact CD1-CB 4.32Å; L20-L54 HydrophobicContact CD1-CD1 4.1Å; L20-L54 HydrophobicContact CD1-CD2 4.31Å; L20-L54 HydrophobicContact CD1-CG 4.48Å; L20-F90 HydrophobicContact CB-CD1 4.22Å; L20-F90 HydrophobicContact CB-CD2 3.9Å; L20-F90 HydrophobicContact CB-CE1 4.2Å; L20-F90 HydrophobicContact CB-CE2 3.86Å; L20-F90 HydrophobicContact CB-CG 4.08Å; L20-F90 HydrophobicContact CB-CZ 4.01Å; L20-F90 HydrophobicContact CD1-CD2 4.01Å; L20-F90 HydrophobicContact CD1-CE2 4.05Å; L20-F90 HydrophobicContact CG-CD2 4.41Å; L20-F90 VanDerWaalsContact O-CD1 3.23Å; L20-F90 WeakPolarHBondContact O-CD1 3.43Å
21L86.9Confident90.1Very high26 Ų2644.3 Ų44.314%0.13623%0.226CC..Hα-helixtrans-77.5-34.9172.5-73.6164000111.9I17 I18 I65 L75 F90I17-L21 HydrophobicContact CG2-CD1 3.57Å; I17-L21 HydrophobicContact CG2-CG 4.28Å; I17-L21 WeakPolarHBondContact O-CG 3.44Å; I17-L21 PolarHBondContact O-N 2.99Å; I18-L21 WeakPolarHBondContact O-CB 3.42Å; I18-L21 PolarHBondContact O-N 3.3Å; L21-I65 HydrophobicContact CD1-CG1 4.04Å; L21-L75 HydrophobicContact CD2-CD2 4.07Å; L21-F90 HydrophobicContact CD2-CE1 3.91Å; L21-F90 HydrophobicContact CD2-CZ 4.42Å; L21-F90 HydrophobicContact CG-CE1 4.21Å
22D87Confident90Very high103 Ų10342.1 Ų42.155%0.55121%0.211SC*.Hα-helixtrans-81.4-36.8179.3-58.4-32.8000111.4I18 Q19I18-D22 WeakPolarHBondContact CG2-OD2 3.38Å; I18-D22 PolarHBondContact O-N 3.14Å; Q19-D22 PolarHBondContact O-N 3.29Å
23D89.9Confident89.8Confident67 Ų6742.3 Ų42.336%0.35821%0.212SC..Hα-helixtrans-72.2-30.6178.8-83.1-28.3000113.4Q19 K92Q19-D23 VanDerWaalsContact CG-OD2 3.25Å; Q19-D23 WeakPolarHBondContact CG-OD2 3.26Å; Q19-D23 PolarHBondContact NE2-OD2 2.94Å; Q19-D23 WeakPolarHBondContact O-CB 3.43Å; Q19-D23 VanDerWaalsContact O-CG 3.29Å; Q19-D23 PolarHBondContact O-N 3.49Å; D23-K92 WeakPolarHBondContact O-CE 3.48Å; D23-K92 PolarHBondContact O-NZ 3.01Å
24Y89.6Confident89.5Confident51 Ų5144.8 Ų44.820%0.223%0.227CC..  trans-126.3113.2-167.3-64.4-98.5000112.4L20 K26 F90 K92L20-Y24 HydrophobicContact CD2-CD2 3.94Å; L20-Y24 HydrophobicContact CD2-CE2 3.6Å; L20-Y24 WeakPolarHBondContact O-CB 3.4Å; L20-Y24 WeakPolarHBondContact O-CD2 3.38Å; L20-Y24 PolarHBondContact O-N 2.79Å; Y24-K26 VanDerWaalsContact C-N 3.32Å; Y24-K26 PolarHBondContact O-N 3.38Å; Y24-F90 HydrophobicContact CD1-CB 4.11Å; Y24-F90 HydrophobicContact CD2-CB 4.06Å; Y24-F90 HydrophobicContact CG-CB 3.75Å; Y24-K92 HydrophobicContact CD1-CD 4.2Å; Y24-K92 HydrophobicContact CD1-CG 3.43Å; Y24-K92 VanDerWaalsContact CD1-CG 3.43Å; Y24-K92 HydrophobicContact CE1-CD 4.32Å; Y24-K92 HydrophobicContact CE1-CG 3.76Å; Y24-K92 HydrophobicContact CG-CG 4.3Å
25P87.6Confident89.3Confident53 Ų5343.7 Ų43.734%0.34422%0.224SC..SBendtrans-75.1-19.9-175.630.4-35.9000114.2N195P25-N195 PolarHBondContact O-N 3.1Å
26K90.9Very high89.1Confident22 Ų2240 Ų4010%0.09621%0.214CC..EExtended strand (participates in β ladder)trans-113.2136-178.6-67.1163.5174.6168.70109.9Y24 T91 K92 E93 D94 L95 Y193 D194Y24-K26 VanDerWaalsContact C-N 3.32Å; Y24-K26 PolarHBondContact O-N 3.38Å; K26-T91 WeakPolarHBondContact CB-OG1 3.34Å; K26-T91 PolarHBondContact O-N 3.38Å; K26-T91 PolarHBondContact O-OG1 3.2Å; K26-K92 PolarHBondContact NZ-O 3.02Å; K26-K92 VanDerWaalsContact NZ-O 3.13Å; K26-E93 WeakPolarHBondContact CD-O 3.42Å; K26-E93 PolarHBondContact NZ-O 3.06Å; K26-D94 IonicContact NZ-OD1 2.69Å; K26-D94 PolarHBondContact NZ-OD1 3.32Å; K26-L95 HydrophobicContact CB-CD2 3.94Å; K26-L95 HydrophobicContact CD-CD2 4.02Å; K26-L95 HydrophobicContact CD-CG 4.25Å; K26-L95 HydrophobicContact CG-CD2 4.06Å; K26-Y193 WeakPolarHBondContact CA-O 3.34Å; K26-D194 HydrophobicContact CG-CB 4.41Å
27C90.9Very high88.9Confident2 Ų239.3 Ų39.31%0.01422%0.223CC..EExtended strand (participates in β ladder)trans-149149.9168.5770000114.2V89 F90 Y193C27-V89 CarbonylContact C-O 3.46Å; C27-V89 WeakPolarHBondContact CA-O 3.31Å; C27-V89 WeakPolarHBondContact CB-O 3.31Å; C27-F90 HydrophobicContact CB-CD1 3.67Å; C27-F90 HydrophobicContact CB-CE1 4.01Å; C27-F90 HydrophobicContact CB-CG 4.31Å; C27-Y193 PolarHBondContact N-O 3.33Å; C27-Y193 WeakPolarHBondContact O-CB 3.22Å; C27-Y193 PolarHBondContact O-N 3.06Å
28F92.3Very high88.8Confident0 Ų047.1 Ų47.10%026%0.257CS..EExtended strand (participates in β ladder)trans-100.8135.8174.3-62.4-93.1000110.9V30 F88 V89 T91 L95 V98 I189 V192 L204F28-V30 HydrophobicContact CB-CG1 4.06Å; F28-F88 VanDerWaalsContact O-CA 3.32Å; F28-F88 WeakPolarHBondContact O-CA 3.42Å; F28-V89 HydrophobicContact CB-CB 4.23Å; F28-V89 HydrophobicContact CD2-CB 4.42Å; F28-V89 PolarHBondContact N-O 3.43Å; F28-V89 PolarHBondContact O-N 2.65Å; F28-T91 HydrophobicContact CD2-CG2 4.44Å; F28-T91 HydrophobicContact CE2-CG2 4.19Å; F28-L95 HydrophobicContact CE1-CD2 4.31Å; F28-L95 HydrophobicContact CE2-CD2 3.88Å; F28-L95 HydrophobicContact CZ-CB 4.01Å; F28-L95 HydrophobicContact CZ-CD2 3.6Å; F28-L95 HydrophobicContact CZ-CG 4.44Å; F28-L95 WeakPolarHBondContact CZ-O 3.49Å; F28-V98 HydrophobicContact CD2-CG1 4.13Å; F28-V98 HydrophobicContact CE2-CB 3.83Å; F28-V98 HydrophobicContact CE2-CG1 3.6Å; F28-V98 HydrophobicContact CZ-CB 4.15Å; F28-V98 HydrophobicContact CZ-CG1 4.24Å; F28-I189 HydrophobicContact CD1-CD1 3.94Å; F28-I189 HydrophobicContact CD1-CG1 4.11Å; F28-I189 HydrophobicContact CD1-CG2 3.82Å; F28-I189 HydrophobicContact CE1-CD1 4.07Å; F28-V192 HydrophobicContact CD1-CB 4.41Å; F28-V192 HydrophobicContact CD1-CG1 3.95Å; F28-V192 HydrophobicContact CD1-CG2 3.94Å; F28-V192 HydrophobicContact CE1-CB 4.5Å; F28-V192 HydrophobicContact CE1-CG1 3.77Å; F28-V192 HydrophobicContact CE1-CG2 3.98Å; F28-V192 HydrophobicContact CZ-CG1 4.36Å; F28-L204 HydrophobicContact CE1-CD1 4.16Å
29I92.1Very high88.8Confident1 Ų146.4 Ų46.41%0.00525%0.253CS..EExtended strand (participates in β ladder)trans-87111.4163.4-60-172.7000107.2L78 H81 V86 F88 Q190 Q191I29-L78 HydrophobicContact CD1-CD2 4Å; I29-H81 HydrophobicContact CD1-CB 3.74Å; I29-V86 HydrophobicContact CG2-CG1 3.62Å; I29-V86 HydrophobicContact CG2-CG2 4.49Å; I29-F88 HydrophobicContact CD1-CE1 4.35Å; I29-F88 HydrophobicContact CG1-CD1 4.26Å; I29-F88 HydrophobicContact CG1-CE1 3.87Å; I29-Q190 HydrophobicContact CG2-CB 4.28Å; I29-Q190 PolarHBondContact O-N 2.94Å; I29-Q191 HydrophobicContact CB-CB 4.26Å; I29-Q191 HydrophobicContact CD1-CB 4.29Å; I29-Q191 HydrophobicContact CG1-CB 4.48Å; I29-Q191 PolarHBondContact N-O 2.9Å; I29-Q191 PolarHBondContact O-N 3.44Å
30V92.1Very high88.7Confident0 Ų042 Ų420%023%0.233CC..EExtended strand (participates in β ladder)trans-112131.1-178.1-67.30000111.9F28 V86 G87 V89 L102 L187 I188 I189F28-V30 HydrophobicContact CB-CG1 4.06Å; V30-V86 CarbonylContact O-C 3.51Å; V30-V86 WeakPolarHBondContact O-CA 3.47Å; V30-G87 WeakPolarHBondContact CG2-O 3.29Å; V30-G87 PolarHBondContact N-O 3.24Å; V30-G87 PolarHBondContact O-N 3.07Å; V30-V89 HydrophobicContact CG1-CG2 3.93Å; V30-V89 HydrophobicContact CG2-CG2 3.81Å; V30-L102 HydrophobicContact CG1-CD1 4.5Å; V30-L187 HydrophobicContact CB-CB 4.21Å; V30-L187 HydrophobicContact CB-CD2 4.25Å; V30-L187 HydrophobicContact CG1-CB 4.33Å; V30-L187 HydrophobicContact CG2-CD1 4.31Å; V30-L187 HydrophobicContact CG2-CD2 4.08Å; V30-I188 CarbonylContact C-O 3.53Å; V30-I188 WeakPolarHBondContact CA-O 3.48Å; V30-I189 HydrophobicContact CG1-CG1 4.21Å
31G91.5Very high88.6Confident3 Ų347.3 Ų47.33%0.03126%0.257CS..EExtended strand (participates in β ladder)trans-79.5130.316500000110.4I188G31-I188 PolarHBondContact N-O 3.21Å; G31-I188 PolarHBondContact O-N 3.48Å; G31-I188 VanDerWaalsContact O-N 3.09Å
32A87.4Confident88.7Confident8 Ų849.3 Ų49.37%0.06627%0.27CS..  trans-110.932-176.600000112.8M55 N85 L187A32-M55 HydrophobicContact CB-CE 3.65Å; A32-M55 HydrophobicContact CB-SD 4.48Å; A32-N85 VanDerWaalsContact C-ND2 3.34Å; A32-N85 PolarHBondContact N-O 2.73Å; A32-N85 PolarHBondContact O-ND2 2.77Å; A32-L187 HydrophobicContact CB-CD2 3.82Å
33D86.4Confident88.9Confident83 Ų8344.6 Ų44.644%0.44425%0.245SC..THydrogen-bonded Turntrans-71.4136.1-176.6-67-54.4000112.5V35 N85D33-V35 PolarHBondContact O-N 2.89Å; D33-N85 VanDerWaalsContact OD1-CB 3.3Å; D33-N85 WeakPolarHBondContact OD1-CB 3.35Å
34N82.3Confident88.9Confident81 Ų8147.1 Ų47.143%0.43325%0.249SC..THydrogen-bonded Turntrans58.3-2.1-172.1-66.2-52.7000117.2G36 R112 F185N34-G36 PolarHBondContact O-N 3.16Å; N34-R112 PolarHBondContact OD1-NH1 3.47Å; N34-F185 HydrophobicContact CB-CD1 4.27Å; N34-F185 HydrophobicContact CB-CD2 3.98Å; N34-F185 HydrophobicContact CB-CE2 4.24Å; N34-F185 HydrophobicContact CB-CG 4.02Å
35V85.7Confident89Confident24 Ų2450 Ų5015%0.14527%0.268CS..  trans-67.8125.4-178.8-171.50000111.4D33 Q39 M40 L187D33-V35 PolarHBondContact O-N 2.89Å; V35-Q39 HydrophobicContact CG1-CB 4.1Å; V35-Q39 HydrophobicContact CG1-CG 3.87Å; V35-M40 HydrophobicContact CG1-CG 3.74Å; V35-M40 HydrophobicContact CG1-SD 3.67Å; V35-L187 HydrophobicContact CG2-CD2 4.48Å
36G85.4Confident89Confident35 Ų3549.9 Ų49.936%0.36127%0.268SS..  trans-80.1153.3-178.200000114.1N34 K38 Q39 M40N34-G36 PolarHBondContact O-N 3.16Å; G36-K38 VanDerWaalsContact C-N 3.28Å; G36-K38 PolarHBondContact O-N 3.5Å; G36-Q39 WeakPolarHBondContact O-CA 3.48Å; G36-Q39 WeakPolarHBondContact O-CB 3.42Å; G36-Q39 PolarHBondContact O-N 3.32Å; G36-M40 PolarHBondContact O-N 3.4Å
37S88.4Confident88.9Confident99 Ų9948.9 Ų48.969%0.69226%0.264SS*.Hα-helixtrans-56.3-38.1179.6-52.40000113.7M40 Q41S37-M40 PolarHBondContact O-N 3.27Å; S37-Q41 WeakPolarHBondContact O-CG 3.47Å; S37-Q41 PolarHBondContact O-N 3.45Å; S37-Q41 VanDerWaalsContact O-N 3.13Å
38K88.2Confident88.9Confident169 Ų16958.2 Ų58.274%0.73530%0.299SS*.Hα-helixtrans-66.5-40.5174.8-172.5178.3179.7-177.30111.6G36 Q41 T42G36-K38 VanDerWaalsContact C-N 3.28Å; G36-K38 PolarHBondContact O-N 3.5Å; K38-Q41 WeakPolarHBondContact O-CB 3.48Å; K38-Q41 PolarHBondContact O-N 3.27Å; K38-Q41 VanDerWaalsContact O-N 3.15Å; K38-T42 PolarHBondContact O-N 2.89Å; K38-T42 PolarHBondContact O-OG1 3.49Å
39Q87.4Confident88.6Confident19 Ų1962.1 Ų62.19%0.08934%0.339CS..Hα-helixtrans-64.2-43175.5-178.4177.612.600111.4V35 G36 Q41 T42 I43 N105 V107 F185V35-Q39 HydrophobicContact CG1-CB 4.1Å; V35-Q39 HydrophobicContact CG1-CG 3.87Å; G36-Q39 WeakPolarHBondContact O-CA 3.48Å; G36-Q39 WeakPolarHBondContact O-CB 3.42Å; G36-Q39 PolarHBondContact O-N 3.32Å; Q39-Q41 PolarHBondContact O-N 3.07Å; Q39-T42 PolarHBondContact O-N 2.77Å; Q39-I43 HydrophobicContact CG-CD1 3.86Å; Q39-I43 HydrophobicContact CG-CG1 4.42Å; Q39-I43 WeakPolarHBondContact O-CB 3.36Å; Q39-I43 WeakPolarHBondContact O-CG1 3.22Å; Q39-I43 PolarHBondContact O-N 2.82Å; Q39-N105 PolarHBondContact NE2-O 3.15Å; Q39-V107 HydrophobicContact CB-CG2 4.26Å; Q39-V107 VanDerWaalsContact CD-CG2 3.47Å; Q39-V107 HydrophobicContact CG-CB 4.4Å; Q39-V107 HydrophobicContact CG-CG2 3.64Å; Q39-F185 PolarHBondContact NE2-O 3.5Å
40M89.1Confident88.4Confident24 Ų2465 Ų6512%0.11835%0.352CS..Hα-helixtrans-61.8-28.4173.1-73-59.7-71.200113.2V35 G36 S37 R44 V53 M55 L187V35-M40 HydrophobicContact CG1-CG 3.74Å; V35-M40 HydrophobicContact CG1-SD 3.67Å; G36-M40 PolarHBondContact O-N 3.4Å; S37-M40 PolarHBondContact O-N 3.27Å; M40-R44 WeakPolarHBondContact O-CB 3.47Å; M40-R44 WeakPolarHBondContact O-CD 3.39Å; M40-R44 WeakPolarHBondContact O-CG 3.38Å; M40-R44 PolarHBondContact O-N 3.35Å; M40-V53 HydrophobicContact CE-CG1 3.93Å; M40-M55 HydrophobicContact CE-CG 3.89Å; M40-M55 HydrophobicContact CE-SD 3.72Å; M40-L187 HydrophobicContact SD-CD1 4.49Å; M40-L187 HydrophobicContact SD-CD2 3.99Å; M40-L187 HydrophobicContact SD-CG 4.43Å
41Q90Very high88.4Confident123 Ų12365.5 Ų65.558%0.57536%0.356SS*.Hα-helixtrans-73.3-45.7172.2-70.6166.6-8.300111.4S37 K38 Q39 I43 R44 L45S37-Q41 WeakPolarHBondContact O-CG 3.47Å; S37-Q41 PolarHBondContact O-N 3.45Å; S37-Q41 VanDerWaalsContact O-N 3.13Å; K38-Q41 WeakPolarHBondContact O-CB 3.48Å; K38-Q41 PolarHBondContact O-N 3.27Å; K38-Q41 VanDerWaalsContact O-N 3.15Å; Q39-Q41 PolarHBondContact O-N 3.07Å; Q41-I43 PolarHBondContact O-N 3.17Å; Q41-R44 PolarHBondContact O-N 2.94Å; Q41-L45 WeakPolarHBondContact O-CG 3.37Å; Q41-L45 PolarHBondContact O-N 2.76Å
42T89.4Confident88.5Confident69 Ų6967.5 Ų67.542%0.42337%0.367SS..Hα-helixtrans-58.7-45.8174.6-58.20000112K38 Q39 R44 L45 S46K38-T42 PolarHBondContact O-N 2.89Å; K38-T42 PolarHBondContact O-OG1 3.49Å; Q39-T42 PolarHBondContact O-N 2.77Å; T42-R44 VanDerWaalsContact C-N 3.32Å; T42-R44 PolarHBondContact O-N 3.27Å; T42-L45 WeakPolarHBondContact O-CA 3.33Å; T42-L45 WeakPolarHBondContact O-CB 3.17Å; T42-L45 PolarHBondContact O-N 3.43Å; T42-S46 PolarHBondContact O-N 3.2Å; T42-S46 PolarHBondContact O-OG 2.93Å
43I89.8Confident88.7Confident3 Ų367.9 Ų67.92%0.01537%0.369CS..Hα-helixtrans-61.4-39.8176.2-70.2169.6000111.3Q39 Q41 L45 S46 L47 N105 L187Q39-I43 HydrophobicContact CG-CD1 3.86Å; Q39-I43 HydrophobicContact CG-CG1 4.42Å; Q39-I43 WeakPolarHBondContact O-CB 3.36Å; Q39-I43 WeakPolarHBondContact O-CG1 3.22Å; Q39-I43 PolarHBondContact O-N 2.82Å; Q41-I43 PolarHBondContact O-N 3.17Å; I43-L45 PolarHBondContact O-N 3.12Å; I43-S46 PolarHBondContact O-N 3.47Å; I43-S46 PolarHBondContact O-OG 3.33Å; I43-L47 HydrophobicContact CG2-CD1 3.63Å; I43-L47 HydrophobicContact CG2-CG 4.32Å; I43-L47 VanDerWaalsContact O-CB 3.27Å; I43-L47 WeakPolarHBondContact O-CB 3.33Å; I43-L47 VanDerWaalsContact O-CG 3.28Å; I43-L47 WeakPolarHBondContact O-CG 3.38Å; I43-L47 PolarHBondContact O-N 3.01Å; I43-N105 HydrophobicContact CG1-CB 4Å; I43-L187 HydrophobicContact CD1-CD1 4.19Å; I43-L187 HydrophobicContact CD1-CG 4.09Å; I43-L187 HydrophobicContact CG2-CD1 3.85Å
44R90.5Very high89Confident120 Ų12064.6 Ų64.645%0.45335%0.351SS..Hα-helixtrans-70.8-18.2174.7-77.1172.1172-177.9-2.5114M40 Q41 T42 V53M40-R44 WeakPolarHBondContact O-CB 3.47Å; M40-R44 WeakPolarHBondContact O-CD 3.39Å; M40-R44 WeakPolarHBondContact O-CG 3.38Å; M40-R44 PolarHBondContact O-N 3.35Å; Q41-R44 PolarHBondContact O-N 2.94Å; T42-R44 VanDerWaalsContact C-N 3.32Å; T42-R44 PolarHBondContact O-N 3.27Å; R44-V53 HydrophobicContact CG-CB 4.12Å; R44-V53 HydrophobicContact CG-CG2 4.27Å; R44-V53 PolarHBondContact NH2-O 3.41Å
45L91.6Very high89.3Confident113 Ų11363.2 Ų63.259%0.59234%0.343SS*.Hα-helixtrans-83.1-44.7172.3-74.5160.1000110.9Q41 T42 I43 R48Q41-L45 WeakPolarHBondContact O-CG 3.37Å; Q41-L45 PolarHBondContact O-N 2.76Å; T42-L45 WeakPolarHBondContact O-CA 3.33Å; T42-L45 WeakPolarHBondContact O-CB 3.17Å; T42-L45 PolarHBondContact O-N 3.43Å; I43-L45 PolarHBondContact O-N 3.12Å; L45-R48 VanDerWaalsContact O-CB 3.26Å; L45-R48 WeakPolarHBondContact O-CB 3.29Å; L45-R48 PolarHBondContact O-N 3.03Å
46S88.8Confident89.4Confident49 Ų4963.4 Ų63.434%0.34335%0.349SS..Hα-helixtrans-69.3-32.2178.560.40000113.5T42 I43 R48 N105T42-S46 PolarHBondContact O-N 3.2Å; T42-S46 PolarHBondContact O-OG 2.93Å; I43-S46 PolarHBondContact O-N 3.47Å; I43-S46 PolarHBondContact O-OG 3.33Å; S46-R48 VanDerWaalsContact C-N 3.3Å; S46-R48 PolarHBondContact O-N 2.75Å; S46-N105 PolarHBondContact OG-ND2 3.3Å
47L88.6Confident89.7Confident1 Ų168.6 Ų68.61%0.00536%0.362CS..THydrogen-bonded Turntrans-81.9-1.8175.8-69176.2000114.2I43 G49 K50 A51 V53 V89 V98 L101 L102I43-L47 HydrophobicContact CG2-CD1 3.63Å; I43-L47 HydrophobicContact CG2-CG 4.32Å; I43-L47 VanDerWaalsContact O-CB 3.27Å; I43-L47 WeakPolarHBondContact O-CB 3.33Å; I43-L47 VanDerWaalsContact O-CG 3.28Å; I43-L47 WeakPolarHBondContact O-CG 3.38Å; I43-L47 PolarHBondContact O-N 3.01Å; L47-G49 PolarHBondContact O-N 3.5Å; L47-K50 PolarHBondContact O-N 2.87Å; L47-A51 HydrophobicContact CB-CB 4.17Å; L47-A51 HydrophobicContact CD2-CB 4.17Å; L47-A51 PolarHBondContact O-N 2.93Å; L47-A51 VanDerWaalsContact O-O 3.08Å; L47-V53 HydrophobicContact CD1-CG2 3.44Å; L47-V53 VanDerWaalsContact CD1-CG2 3.44Å; L47-V89 HydrophobicContact CD1-CG1 4.23Å; L47-V98 HydrophobicContact CD2-CG1 4.45Å; L47-L101 HydrophobicContact CD2-CB 4.42Å; L47-L102 HydrophobicContact CD1-CD2 3.94Å
48R89.8Confident89.8Confident199 Ų19965.6 Ų65.675%0.75134%0.338SS*.THydrogen-bonded Turntrans-67.8124-171-161.9177.5-167.2175.83111.1L45 S46L45-R48 VanDerWaalsContact O-CB 3.26Å; L45-R48 WeakPolarHBondContact O-CB 3.29Å; L45-R48 PolarHBondContact O-N 3.03Å; S46-R48 VanDerWaalsContact C-N 3.3Å; S46-R48 PolarHBondContact O-N 2.75Å
49G86.5Confident89.8Confident82 Ų8261.4 Ų61.485%0.84533%0.327SS*.THydrogen-bonded Turntrans98.5-50.7-173.400000112L47L47-G49 PolarHBondContact O-N 3.5Å
50K88.4Confident89.8Confident61 Ų6162 Ų6227%0.26533%0.33SS..THydrogen-bonded Turntrans-71.4-42.3178.8-64.8-162.5150.5-85.50113.9L47 E93 E97 L101L47-K50 PolarHBondContact O-N 2.87Å; K50-E93 WeakPolarHBondContact CB-OE2 3.27Å; K50-E93 WeakPolarHBondContact CD-OE2 3.46Å; K50-E93 WeakPolarHBondContact CE-OE2 3.4Å; K50-E93 WeakPolarHBondContact CG-OE1 3.22Å; K50-E93 WeakPolarHBondContact CG-OE2 3.36Å; K50-E93 VanDerWaalsContact NZ-CD 3.26Å; K50-E93 IonicContact NZ-OE1 3.15Å; K50-E93 PolarHBondContact NZ-OE1 3.09Å; K50-E93 IonicContact NZ-OE2 3.32Å; K50-E93 PolarHBondContact NZ-OE2 3.48Å; K50-E97 IonicContact NZ-OE2 2.71Å; K50-E97 PolarHBondContact NZ-OE2 2.98Å; K50-L101 HydrophobicContact CD-CD1 3.54Å
51A91.4Very high89.8Confident11 Ų1160.8 Ų60.89%0.09132%0.324CS..EExtended strand (participates in β ladder)trans-150157.3-168.600000114.9L47 V89 F90 T91L47-A51 HydrophobicContact CB-CB 4.17Å; L47-A51 HydrophobicContact CD2-CB 4.17Å; L47-A51 PolarHBondContact O-N 2.93Å; L47-A51 VanDerWaalsContact O-O 3.08Å; A51-V89 HydrophobicContact CB-CG1 3.78Å; A51-F90 CarbonylContact C-O 3.57Å; A51-F90 VanDerWaalsContact CA-O 3.29Å; A51-F90 WeakPolarHBondContact CA-O 3.45Å; A51-T91 HydrophobicContact CB-CG2 3.58Å
52V92.8Very high89.8Confident45 Ų4558.4 Ų58.427%0.27331%0.31SS..EExtended strand (participates in β ladder)trans-119.5113.9178.2-177.60000111.5L20 V89 F90L20-V52 HydrophobicContact CD1-CG1 4.11Å; L20-V52 HydrophobicContact CD2-CB 4.27Å; L20-V52 HydrophobicContact CD2-CG1 3.98Å; L20-V52 HydrophobicContact CD2-CG2 4.49Å; V52-V89 WeakPolarHBondContact O-CA 3.47Å; V52-F90 HydrophobicContact CB-CB 4.49Å; V52-F90 PolarHBondContact N-O 2.89Å; V52-F90 PolarHBondContact O-N 3.14Å
53V92.4Very high89.8Confident15 Ų1562.2 Ų62.29%0.09132%0.32CS..EExtended strand (participates in β ladder)trans-89.8110179.3-173.60000112.2M40 R44 L47 V89M40-V53 HydrophobicContact CE-CG1 3.93Å; R44-V53 HydrophobicContact CG-CB 4.12Å; R44-V53 HydrophobicContact CG-CG2 4.27Å; R44-V53 PolarHBondContact NH2-O 3.41Å; L47-V53 HydrophobicContact CD1-CG2 3.44Å; L47-V53 VanDerWaalsContact CD1-CG2 3.44Å; V53-V89 HydrophobicContact CG1-CG2 4.39Å; V53-V89 HydrophobicContact CG2-CG1 4.24Å; V53-V89 HydrophobicContact CG2-CG2 4.16Å
54L91.8Very high89.7Confident15 Ų1562.3 Ų62.38%0.07932%0.321CS..EExtended strand (participates in β ladder)trans-109113.9175.8-16783.6000111.4Y13 K16 I17 L20 G87 F88 F90Y13-L54 HydrophobicContact CE2-CD1 4.25Å; Y13-L54 HydrophobicContact CE2-CG 4.47Å; K16-L54 HydrophobicContact CD-CD1 4.49Å; K16-L54 HydrophobicContact CG-CD1 4.49Å; I17-L54 HydrophobicContact CD1-CD2 4.23Å; I17-L54 HydrophobicContact CG1-CD2 3.42Å; I17-L54 VanDerWaalsContact CG1-CD2 3.42Å; L20-L54 HydrophobicContact CD1-CB 4.32Å; L20-L54 HydrophobicContact CD1-CD1 4.1Å; L20-L54 HydrophobicContact CD1-CD2 4.31Å; L20-L54 HydrophobicContact CD1-CG 4.48Å; L54-G87 WeakPolarHBondContact O-CA 3.49Å; L54-F88 PolarHBondContact N-O 3.41Å; L54-F88 PolarHBondContact O-N 3.37Å; L54-F90 HydrophobicContact CB-CD2 4.42Å; L54-F90 HydrophobicContact CB-CE2 3.99Å; L54-F90 HydrophobicContact CD2-CE2 4.25Å
55M90.1Very high89.5Confident52 Ų5256.6 Ų56.626%0.25630%0.3SS..EExtended strand (participates in β ladder)trans-89.7154.7167.1-59.3-53.8-6100110.3Y13 A32 M40Y13-M55 PolarHBondContact OH-O 3.15Å; A32-M55 HydrophobicContact CB-CE 3.65Å; A32-M55 HydrophobicContact CB-SD 4.48Å; M40-M55 HydrophobicContact CE-CG 3.89Å; M40-M55 HydrophobicContact CE-SD 3.72Å
56G88.1Confident89.3Confident27 Ų2758.7 Ų58.728%0.27830%0.3SS..  trans-161.7169.7-178.500000115.4Y13Y13-G56 WeakPolarHBondContact OH-CA 3.49Å
57K90.1Very high88.9Confident145 Ų14558.8 Ų58.863%0.6331%0.309SS*.  trans-84.7124.2166.7-176.5171.1-179.4169.10109.2T59 M60 M61K57-T59 WeakPolarHBondContact CE-OG1 3.46Å; K57-T59 PolarHBondContact O-N 3.29Å; K57-M60 HydrophobicContact CB-CG 4.24Å; K57-M60 WeakPolarHBondContact O-CA 3.22Å; K57-M60 WeakPolarHBondContact O-CB 3.49Å; K57-M60 PolarHBondContact O-N 2.75Å; K57-M61 PolarHBondContact O-N 2.95Å; K57-M61 VanDerWaalsContact O-N 3.08Å
58N90.3Very high88.6Confident35 Ų3560.4 Ų60.419%0.18732%0.316CS..Hα-helixtrans-48.8-38.5-175.7-57.27.7000113.8R62 I82 G84N58-R62 WeakPolarHBondContact O-CB 3.37Å; N58-R62 PolarHBondContact O-N 3.09Å; N58-I82 HydrophobicContact CB-CG2 3.85Å; N58-G84 PolarHBondContact ND2-O 2.84Å
59T89.1Confident88Confident82 Ų8253.1 Ų53.150%0.50329%0.292SS..Hα-helixtrans-70.2-28.3178.161.40000114K57 K63K57-T59 WeakPolarHBondContact CE-OG1 3.46Å; K57-T59 PolarHBondContact O-N 3.29Å; T59-K63 PolarHBondContact O-N 3.44Å
60M88Confident87.5Confident30 Ų3057.9 Ų57.915%0.14829%0.292CS..Hα-helixtrans-75.4-51.6172.8-68-71.8-62.900109.7K10 Y13 F14 K57 R62 K63 A64K10-M60 HydrophobicContact CB-CE 3.93Å; K10-M60 HydrophobicContact CD-CE 4.28Å; K10-M60 HydrophobicContact CD-SD 4.48Å; K10-M60 HydrophobicContact CG-CE 3.72Å; K10-M60 HydrophobicContact CG-SD 4.41Å; Y13-M60 HydrophobicContact CD1-CE 4.28Å; Y13-M60 HydrophobicContact CE1-CB 4.29Å; F14-M60 HydrophobicContact CD2-CE 3.99Å; F14-M60 HydrophobicContact CE1-CE 4.25Å; F14-M60 WeakPolarHBondContact CE1-O 3.38Å; F14-M60 HydrophobicContact CE2-CE 3.34Å; F14-M60 HydrophobicContact CE2-SD 4.27Å; F14-M60 HydrophobicContact CZ-CE 3.49Å; F14-M60 VanDerWaalsContact CZ-CE 3.49Å; F14-M60 HydrophobicContact CZ-SD 4.03Å; K57-M60 HydrophobicContact CB-CG 4.24Å; K57-M60 WeakPolarHBondContact O-CA 3.22Å; K57-M60 WeakPolarHBondContact O-CB 3.49Å; K57-M60 PolarHBondContact O-N 2.75Å; M60-R62 VanDerWaalsContact C-N 3.35Å; M60-R62 PolarHBondContact O-N 3.3Å; M60-K63 PolarHBondContact O-N 2.93Å; M60-A64 PolarHBondContact O-N 2.89Å
61M89.3Confident87Confident0 Ų060.9 Ų60.90%031%0.311CS..Hα-helixtrans-58.3-45.9-179.2-58.5-169.2-67.100111.5I17 K57 K63 A64 I65 I82 F88I17-M61 HydrophobicContact CD1-CB 4.37Å; I17-M61 HydrophobicContact CD1-CG 3.94Å; K57-M61 PolarHBondContact O-N 2.95Å; K57-M61 VanDerWaalsContact O-N 3.08Å; M61-K63 VanDerWaalsContact C-N 3.28Å; M61-K63 PolarHBondContact O-N 2.83Å; M61-A64 WeakPolarHBondContact O-CB 3.2Å; M61-A64 PolarHBondContact O-N 2.89Å; M61-A64 VanDerWaalsContact O-N 3.15Å; M61-I65 WeakPolarHBondContact O-CG1 3.44Å; M61-I65 PolarHBondContact O-N 3.35Å; M61-I82 HydrophobicContact CE-CG2 3.91Å; M61-F88 HydrophobicContact CB-CE2 4.26Å; M61-F88 HydrophobicContact CE-CE2 4.36Å; M61-F88 HydrophobicContact CG-CE2 4.49Å; M61-F88 HydrophobicContact SD-CD2 3.79Å; M61-F88 HydrophobicContact SD-CE2 3.69Å
62R89.8Confident86.3Confident73 Ų7363.2 Ų63.228%0.27532%0.322SS..Hα-helixtrans-64.4-28176.4-161.3-176-64.4136.12.9113.4N58 M60 R66 L79 I82N58-R62 WeakPolarHBondContact O-CB 3.37Å; N58-R62 PolarHBondContact O-N 3.09Å; M60-R62 VanDerWaalsContact C-N 3.35Å; M60-R62 PolarHBondContact O-N 3.3Å; R62-R66 WeakPolarHBondContact O-CB 3.24Å; R62-R66 VanDerWaalsContact O-CG 3.26Å; R62-R66 WeakPolarHBondContact O-CG 3.3Å; R62-R66 PolarHBondContact O-N 3.42Å; R62-L79 HydrophobicContact CG-CD2 3.83Å; R62-I82 PolarHBondContact NH2-O 3.28Å
63K89.4Confident85.8Confident149 Ų14965.3 Ų65.365%0.64834%0.336SS*.Hα-helixtrans-77.1-36.9172.8-175.3170.4-178.7177.90111.8F14 T59 M60 M61 G67F14-K63 HydrophobicContact CE1-CB 4.19Å; F14-K63 HydrophobicContact CE1-CG 4.34Å; F14-K63 HydrophobicContact CZ-CB 4.38Å; F14-K63 HydrophobicContact CZ-CD 4.37Å; F14-K63 HydrophobicContact CZ-CG 4.39Å; T59-K63 PolarHBondContact O-N 3.44Å; M60-K63 PolarHBondContact O-N 2.93Å; M61-K63 VanDerWaalsContact C-N 3.28Å; M61-K63 PolarHBondContact O-N 2.83Å; K63-G67 PolarHBondContact O-N 3.12Å
64A86.9Confident85.2Confident4 Ų465.7 Ų65.73%0.03334%0.341CS..Hα-helixtrans-61.1-54.3177.100000110.6F14 I17 M60 M61 R66 G67 H68F14-A64 HydrophobicContact CD1-CB 3.6Å; F14-A64 HydrophobicContact CE1-CB 3.87Å; I17-A64 HydrophobicContact CB-CB 4.16Å; I17-A64 HydrophobicContact CD1-CB 4.01Å; I17-A64 HydrophobicContact CG2-CB 3.66Å; M60-A64 PolarHBondContact O-N 2.89Å; M61-A64 WeakPolarHBondContact O-CB 3.2Å; M61-A64 PolarHBondContact O-N 2.89Å; M61-A64 VanDerWaalsContact O-N 3.15Å; A64-R66 VanDerWaalsContact C-N 3.34Å; A64-R66 PolarHBondContact O-N 3.15Å; A64-G67 PolarHBondContact O-N 3.05Å; A64-H68 PolarHBondContact O-N 3.38Å
65I86.8Confident84.7Confident1 Ų165.3 Ų65.31%0.00534%0.339CS..Hα-helixtrans-61.4-41.5-178.2-62.7163.6000111.2L21 M61 G67 H68 L69 L75 L79 I82 F88L21-I65 HydrophobicContact CD1-CG1 4.04Å; M61-I65 WeakPolarHBondContact O-CG1 3.44Å; M61-I65 PolarHBondContact O-N 3.35Å; I65-G67 VanDerWaalsContact C-N 3.26Å; I65-G67 PolarHBondContact O-N 3Å; I65-H68 PolarHBondContact O-N 3.35Å; I65-L69 PolarHBondContact O-N 2.9Å; I65-L75 HydrophobicContact CG2-CB 3.74Å; I65-L75 HydrophobicContact CG2-CD1 4.38Å; I65-L79 HydrophobicContact CB-CD2 4.03Å; I65-L79 HydrophobicContact CG2-CD2 3.75Å; I65-I82 HydrophobicContact CD1-CD1 3.59Å; I65-F88 HydrophobicContact CD1-CE2 4.25Å; I65-F88 HydrophobicContact CD1-CZ 3.87Å
66R86.1Confident84.4Confident156 Ų15668.5 Ų68.559%0.58935%0.354SS*.Hα-helixtrans-63.1-28.2174.6-80178.6171.9-175.7-3.7114.1R62 A64 H68 L79R62-R66 WeakPolarHBondContact O-CB 3.24Å; R62-R66 VanDerWaalsContact O-CG 3.26Å; R62-R66 WeakPolarHBondContact O-CG 3.3Å; R62-R66 PolarHBondContact O-N 3.42Å; A64-R66 VanDerWaalsContact C-N 3.34Å; A64-R66 PolarHBondContact O-N 3.15Å; R66-H68 VanDerWaalsContact C-N 3.28Å; R66-L79 HydrophobicContact CG-CD1 3.82Å; R66-L79 HydrophobicContact CG-CD2 4.21Å
67G81.9Confident84.3Confident51 Ų5172.3 Ų72.353%0.52636%0.362SS..Hα-helixtrans-76.4-13.6174.200000114K63 A64 I65K63-G67 PolarHBondContact O-N 3.12Å; A64-G67 PolarHBondContact O-N 3.05Å; I65-G67 VanDerWaalsContact C-N 3.26Å; I65-G67 PolarHBondContact O-N 3Å
68H81.1Confident84Confident35 Ų3565.4 Ų65.416%0.16233%0.332CS..SBendtrans-111.66.5179.5-85.6-110.8000113.2I18 A64 I65 R66 E70 N71 N72I18-H68 VanDerWaalsContact CD1-NE2 3.32Å; I18-H68 WeakPolarHBondContact CD1-NE2 3.2Å; I18-H68 WeakPolarHBondContact CG1-NE2 3.49Å; I18-H68 WeakPolarHBondContact CG2-CE1 3.31Å; A64-H68 PolarHBondContact O-N 3.38Å; I65-H68 PolarHBondContact O-N 3.35Å; R66-H68 VanDerWaalsContact C-N 3.28Å; H68-E70 PolarHBondContact O-N 3.25Å; H68-N71 PolarHBondContact O-N 3.33Å; H68-N71 VanDerWaalsContact O-N 3.11Å; H68-N72 PolarHBondContact O-N 3.44Å; H68-N72 VanDerWaalsContact O-N 3.1Å
69L77.4Confident83.8Confident47 Ų4764.5 Ų64.525%0.24633%0.327CS..THydrogen-bonded Turntrans-65.3-27.7179.3-158.6155.3000111.6I65 N71 N72 P73 E76I65-L69 PolarHBondContact O-N 2.9Å; L69-N71 VanDerWaalsContact C-N 3.32Å; L69-N71 PolarHBondContact O-N 3.5Å; L69-N72 CarbonylContact O-C 3.26Å; L69-N72 VanDerWaalsContact O-C 3.26Å; L69-N72 PolarHBondContact O-N 2.82Å; L69-P73 HydrophobicContact CD2-CB 4.33Å; L69-P73 WeakPolarHBondContact O-CA 3.13Å; L69-E76 HydrophobicContact CD1-CB 3.97Å; L69-E76 HydrophobicContact CD1-CG 4.32Å
70E77Confident83.8Confident181 Ų18163.8 Ų63.885%0.84632%0.324SS*.THydrogen-bonded Turntrans-63.3-34.3172.8-65.4175.2-162.900112.6H68H68-E70 PolarHBondContact O-N 3.25Å
71N77.9Confident83.8Confident124 Ų12465.4 Ų65.466%0.66333%0.331SS*.THydrogen-bonded Turntrans-84.8-34.8177.6-67.9-0.5000112.3H68 L69H68-N71 PolarHBondContact O-N 3.33Å; H68-N71 VanDerWaalsContact O-N 3.11Å; L69-N71 VanDerWaalsContact C-N 3.32Å; L69-N71 PolarHBondContact O-N 3.5Å
72N77Confident83.7Confident61 Ų6165.4 Ų65.433%0.32633%0.331SS..  trans-143.297.1177.8-171.8-19.8000111H68 L69 A74 L75 Y193H68-N72 PolarHBondContact O-N 3.44Å; H68-N72 VanDerWaalsContact O-N 3.1Å; L69-N72 CarbonylContact O-C 3.26Å; L69-N72 VanDerWaalsContact O-C 3.26Å; L69-N72 PolarHBondContact O-N 2.82Å; N72-A74 PolarHBondContact O-N 2.96Å; N72-A74 WeakPolarHBondContact OD1-CB 3.44Å; N72-A74 PolarHBondContact OD1-N 2.93Å; N72-A74 VanDerWaalsContact OD1-N 3.17Å; N72-L75 HydrophobicContact CB-CD1 3.92Å; N72-L75 HydrophobicContact CB-CG 4.02Å; N72-L75 WeakPolarHBondContact O-CB 3.31Å; N72-L75 WeakPolarHBondContact O-CG 3.46Å; N72-L75 PolarHBondContact O-N 3.05Å; N72-Y193 PolarHBondContact ND2-OH 2.86Å
73P80.8Confident83.7Confident88 Ų8868.4 Ų68.457%0.57135%0.346SS*.G310 helixtrans-68.7-22.6-175.927.2-35.1000112.7L69 L75 E76L69-P73 HydrophobicContact CD2-CB 4.33Å; L69-P73 WeakPolarHBondContact O-CA 3.13Å; P73-L75 PolarHBondContact O-N 3.44Å; P73-E76 WeakPolarHBondContact O-CB 3.37Å; P73-E76 PolarHBondContact O-N 3.37Å
74A80.9Confident83.6Confident23 Ų2364 Ų6419%0.1934%0.343CS..G310 helixtrans-68.1-16.8-178.700000113.2N72 E76 K77N72-A74 PolarHBondContact O-N 2.96Å; N72-A74 WeakPolarHBondContact OD1-CB 3.44Å; N72-A74 PolarHBondContact OD1-N 2.93Å; N72-A74 VanDerWaalsContact OD1-N 3.17Å; A74-E76 PolarHBondContact O-N 3.37Å; A74-K77 WeakPolarHBondContact O-CB 3.23Å; A74-K77 WeakPolarHBondContact O-CG 3.19Å; A74-K77 PolarHBondContact O-N 2.77Å
75L81Confident83.8Confident8 Ų867.5 Ų67.54%0.04236%0.361CS..G310 helixtrans-60.9-19.5169.8-66.3175.4000113.5L21 I65 N72 P73 K77 L78 Y193L21-L75 HydrophobicContact CD2-CD2 4.07Å; I65-L75 HydrophobicContact CG2-CB 3.74Å; I65-L75 HydrophobicContact CG2-CD1 4.38Å; N72-L75 HydrophobicContact CB-CD1 3.92Å; N72-L75 HydrophobicContact CB-CG 4.02Å; N72-L75 WeakPolarHBondContact O-CB 3.31Å; N72-L75 WeakPolarHBondContact O-CG 3.46Å; N72-L75 PolarHBondContact O-N 3.05Å; P73-L75 PolarHBondContact O-N 3.44Å; L75-K77 PolarHBondContact O-N 2.8Å; L75-L78 HydrophobicContact CD2-CD1 3.74Å; L75-L78 WeakPolarHBondContact O-CB 3.49Å; L75-L78 PolarHBondContact O-N 3Å; L75-L78 VanDerWaalsContact O-N 3.09Å; L75-Y193 HydrophobicContact CD2-CE1 4.11Å; L75-Y193 HydrophobicContact CD2-CE2 4.47Å; L75-Y193 WeakPolarHBondContact CD2-OH 3.29Å
76E84.5Confident84Confident119 Ų11967.5 Ų67.556%0.55636%0.361SS*.G310 helixtrans-57.6-35.6175.8-172.9165.1-150.100112L69 P73 A74 L78 L79L69-E76 HydrophobicContact CD1-CB 3.97Å; L69-E76 HydrophobicContact CD1-CG 4.32Å; P73-E76 WeakPolarHBondContact O-CB 3.37Å; P73-E76 PolarHBondContact O-N 3.37Å; A74-E76 PolarHBondContact O-N 3.37Å; E76-L78 PolarHBondContact O-N 3.27Å; E76-L79 HydrophobicContact CG-CD1 4.1Å; E76-L79 WeakPolarHBondContact O-CB 3.42Å; E76-L79 WeakPolarHBondContact O-CG 3.49Å; E76-L79 PolarHBondContact O-N 3.36Å
77K84.9Confident84.3Confident107 Ų10760 Ų6047%0.46533%0.333SS..G310 helixtrans-58.6-21.9178.1-60.2177.2-173.6171.50113.1A74 L75 P80 H81 G196 V198A74-K77 WeakPolarHBondContact O-CB 3.23Å; A74-K77 WeakPolarHBondContact O-CG 3.19Å; A74-K77 PolarHBondContact O-N 2.77Å; L75-K77 PolarHBondContact O-N 2.8Å; K77-P80 WeakPolarHBondContact O-CD 3.44Å; K77-H81 PolarHBondContact O-CD2 2.98Å; K77-H81 VanDerWaalsContact O-CD2 3.29Å; K77-G196 WeakPolarHBondContact CD-O 3.41Å; K77-G196 WeakPolarHBondContact CE-O 3.39Å; K77-G196 PolarHBondContact NZ-O 3.31Å; K77-V198 HydrophobicContact CB-CB 4.5Å; K77-V198 HydrophobicContact CB-CG2 3.62Å; K77-V198 HydrophobicContact CD-CG2 4.44Å
78L84.8Confident84.8Confident0 Ų057.8 Ų57.80%031%0.309CS..G310 helixtrans-79.5-30.1178.8-58.3174000112.9I29 L75 E76 H81 Y193 V198I29-L78 HydrophobicContact CD1-CD2 4Å; L75-L78 HydrophobicContact CD2-CD1 3.74Å; L75-L78 WeakPolarHBondContact O-CB 3.49Å; L75-L78 PolarHBondContact O-N 3Å; L75-L78 VanDerWaalsContact O-N 3.09Å; E76-L78 PolarHBondContact O-N 3.27Å; L78-H81 PolarHBondContact O-N 3.31Å; L78-Y193 HydrophobicContact CD1-CD2 4.16Å; L78-Y193 HydrophobicContact CD1-CE2 4.3Å; L78-Y193 HydrophobicContact CD1-CG 4.28Å; L78-Y193 HydrophobicContact CD2-CD2 3.67Å; L78-Y193 HydrophobicContact CD2-CE2 4.43Å; L78-Y193 HydrophobicContact CD2-CG 3.93Å; L78-Y193 HydrophobicContact CG-CD2 4.1Å; L78-Y193 HydrophobicContact CG-CE2 4.39Å; L78-V198 HydrophobicContact CD2-CG2 3.74Å
79L85.4Confident85.4Confident15 Ų1556.1 Ų56.18%0.07930%0.301CS..THydrogen-bonded Turntrans-57.2-35.1-171.2-52.4179000114.8R62 I65 R66 E76 H81R62-L79 HydrophobicContact CG-CD2 3.83Å; I65-L79 HydrophobicContact CB-CD2 4.03Å; I65-L79 HydrophobicContact CG2-CD2 3.75Å; R66-L79 HydrophobicContact CG-CD1 3.82Å; R66-L79 HydrophobicContact CG-CD2 4.21Å; E76-L79 HydrophobicContact CG-CD1 4.1Å; E76-L79 WeakPolarHBondContact O-CB 3.42Å; E76-L79 WeakPolarHBondContact O-CG 3.49Å; E76-L79 PolarHBondContact O-N 3.36Å; L79-H81 VanDerWaalsContact C-N 3.34Å
80P89.3Confident86.1Confident67 Ų6754 Ų5444%0.43529%0.29SS..THydrogen-bonded Turntrans-68.4-25.4175.9-21.834.9000114.8K77 K83K77-P80 WeakPolarHBondContact O-CD 3.44Å; P80-K83 VanDerWaalsContact O-CD 3.27Å; P80-K83 WeakPolarHBondContact O-CD 3.44Å; P80-K83 WeakPolarHBondContact O-CE 3.38Å; P80-K83 PolarHBondContact O-NZ 3.44Å
81H87.8Confident86.9Confident65 Ų6545.4 Ų45.430%0.30125%0.25SC..THydrogen-bonded Turntrans-92.2-15.4-173-59.2-81.3000113.3I29 K77 L78 L79 K83 Q191I29-H81 HydrophobicContact CD1-CB 3.74Å; K77-H81 PolarHBondContact O-CD2 2.98Å; K77-H81 VanDerWaalsContact O-CD2 3.29Å; L78-H81 PolarHBondContact O-N 3.31Å; L79-H81 VanDerWaalsContact C-N 3.34Å; H81-K83 PolarHBondContact O-N 3.36Å; H81-Q191 HydrophobicContact CB-CG 4.2Å; H81-Q191 WeakPolarHBondContact ND1-CG 3.42Å
82I88.2Confident87.5Confident0 Ų045 Ų450%024%0.242CC..  trans-74.775.1175.9-50.4167.6000110N58 M61 R62 I65 F88N58-I82 HydrophobicContact CB-CG2 3.85Å; M61-I82 HydrophobicContact CE-CG2 3.91Å; R62-I82 PolarHBondContact NH2-O 3.28Å; I65-I82 HydrophobicContact CD1-CD1 3.59Å; I82-F88 HydrophobicContact CD1-CZ 3.91Å; I82-F88 HydrophobicContact CG1-CZ 4.06Å
83K88.3Confident88Confident136 Ų13645.3 Ų45.359%0.59124%0.241SC*.  trans-139.7145.2-177.3-68.5171.5-179.9147.50110P80 H81 V86P80-K83 VanDerWaalsContact O-CD 3.27Å; P80-K83 WeakPolarHBondContact O-CD 3.44Å; P80-K83 WeakPolarHBondContact O-CE 3.38Å; P80-K83 PolarHBondContact O-NZ 3.44Å; H81-K83 PolarHBondContact O-N 3.36Å; K83-V86 WeakPolarHBondContact O-CG2 3.44Å
84G88.7Confident88.3Confident56 Ų5645.6 Ų45.658%0.57724%0.238SC*.SBendtrans77.3-157-173.200000112.8N58 V86N58-G84 PolarHBondContact ND2-O 2.84Å; G84-V86 PolarHBondContact O-N 2.95Å
85N90Very high88.6Confident77 Ų7745.2 Ų45.241%0.41223%0.233SC..SBendtrans-89.984.4-178.7-179.224000110.7A32 D33A32-N85 VanDerWaalsContact C-ND2 3.34Å; A32-N85 PolarHBondContact N-O 2.73Å; A32-N85 PolarHBondContact O-ND2 2.77Å; D33-N85 VanDerWaalsContact OD1-CB 3.3Å; D33-N85 WeakPolarHBondContact OD1-CB 3.35Å
86V90.9Very high89Confident1 Ų148.2 Ų48.21%0.00625%0.252CS..EExtended strand (participates in β ladder)trans-112141.8-167.2167.20000112.7I29 V30 K83 G84I29-V86 HydrophobicContact CG2-CG1 3.62Å; I29-V86 HydrophobicContact CG2-CG2 4.49Å; V30-V86 CarbonylContact O-C 3.51Å; V30-V86 WeakPolarHBondContact O-CA 3.47Å; K83-V86 WeakPolarHBondContact O-CG2 3.44Å; G84-V86 PolarHBondContact O-N 2.95Å
87G92.1Very high89.1Confident0 Ų047.2 Ų47.20%025%0.247CC..EExtended strand (participates in β ladder)trans-124.3170.6164.900000112.3V30 L54V30-G87 WeakPolarHBondContact CG2-O 3.29Å; V30-G87 PolarHBondContact N-O 3.24Å; V30-G87 PolarHBondContact O-N 3.07Å; L54-G87 WeakPolarHBondContact O-CA 3.49Å
88F92.5Very high89.3Confident4 Ų442.1 Ų42.12%0.01823%0.225CC..EExtended strand (participates in β ladder)trans-109.4142.5168.8-68.9-78.2000110.4F28 I29 L54 M61 I65 I82 F90F28-F88 VanDerWaalsContact O-CA 3.32Å; F28-F88 WeakPolarHBondContact O-CA 3.42Å; I29-F88 HydrophobicContact CD1-CE1 4.35Å; I29-F88 HydrophobicContact CG1-CD1 4.26Å; I29-F88 HydrophobicContact CG1-CE1 3.87Å; L54-F88 PolarHBondContact N-O 3.41Å; L54-F88 PolarHBondContact O-N 3.37Å; M61-F88 HydrophobicContact CB-CE2 4.26Å; M61-F88 HydrophobicContact CE-CE2 4.36Å; M61-F88 HydrophobicContact CG-CE2 4.49Å; M61-F88 HydrophobicContact SD-CD2 3.79Å; M61-F88 HydrophobicContact SD-CE2 3.69Å; I65-F88 HydrophobicContact CD1-CE2 4.25Å; I65-F88 HydrophobicContact CD1-CZ 3.87Å; I82-F88 HydrophobicContact CD1-CZ 3.91Å; I82-F88 HydrophobicContact CG1-CZ 4.06Å; F88-F90 HydrophobicContact CB-CD2 4.12Å; F88-F90 HydrophobicContact CB-CE2 3.48Å; F88-F90 VanDerWaalsContact CB-CE2 3.48Å; F88-F90 HydrophobicContact CB-CZ 3.75Å; F88-F90 HydrophobicContact CG-CE2 4.3Å; F88-F90 HydrophobicContact CG-CZ 4.11Å
89V93.2Very high89.4Confident0 Ų043.6 Ų43.60%023%0.231CC..EExtended strand (participates in β ladder)trans-118.3112.5166.3-173.10000107.8C27 F28 V30 L47 A51 V52 V53 T91C27-V89 CarbonylContact C-O 3.46Å; C27-V89 WeakPolarHBondContact CA-O 3.31Å; C27-V89 WeakPolarHBondContact CB-O 3.31Å; F28-V89 HydrophobicContact CB-CB 4.23Å; F28-V89 HydrophobicContact CD2-CB 4.42Å; F28-V89 PolarHBondContact N-O 3.43Å; F28-V89 PolarHBondContact O-N 2.65Å; V30-V89 HydrophobicContact CG1-CG2 3.93Å; V30-V89 HydrophobicContact CG2-CG2 3.81Å; L47-V89 HydrophobicContact CD1-CG1 4.23Å; A51-V89 HydrophobicContact CB-CG1 3.78Å; V52-V89 WeakPolarHBondContact O-CA 3.47Å; V53-V89 HydrophobicContact CG1-CG2 4.39Å; V53-V89 HydrophobicContact CG2-CG1 4.24Å; V53-V89 HydrophobicContact CG2-CG2 4.16Å; V89-T91 HydrophobicContact CG1-CG2 4.42Å
90F93.7Very high89.6Confident3 Ų347.3 Ų47.31%0.01325%0.25CS..EExtended strand (participates in β ladder)trans-94.1135.1-177.5-64.9-85.1000111L20 L21 Y24 C27 A51 V52 L54 F88L20-F90 HydrophobicContact CB-CD1 4.22Å; L20-F90 HydrophobicContact CB-CD2 3.9Å; L20-F90 HydrophobicContact CB-CE1 4.2Å; L20-F90 HydrophobicContact CB-CE2 3.86Å; L20-F90 HydrophobicContact CB-CG 4.08Å; L20-F90 HydrophobicContact CB-CZ 4.01Å; L20-F90 HydrophobicContact CD1-CD2 4.01Å; L20-F90 HydrophobicContact CD1-CE2 4.05Å; L20-F90 HydrophobicContact CG-CD2 4.41Å; L20-F90 VanDerWaalsContact O-CD1 3.23Å; L20-F90 WeakPolarHBondContact O-CD1 3.43Å; L21-F90 HydrophobicContact CD2-CE1 3.91Å; L21-F90 HydrophobicContact CD2-CZ 4.42Å; L21-F90 HydrophobicContact CG-CE1 4.21Å; Y24-F90 HydrophobicContact CD1-CB 4.11Å; Y24-F90 HydrophobicContact CD2-CB 4.06Å; Y24-F90 HydrophobicContact CG-CB 3.75Å; C27-F90 HydrophobicContact CB-CD1 3.67Å; C27-F90 HydrophobicContact CB-CE1 4.01Å; C27-F90 HydrophobicContact CB-CG 4.31Å; A51-F90 CarbonylContact C-O 3.57Å; A51-F90 VanDerWaalsContact CA-O 3.29Å; A51-F90 WeakPolarHBondContact CA-O 3.45Å; V52-F90 HydrophobicContact CB-CB 4.49Å; V52-F90 PolarHBondContact N-O 2.89Å; V52-F90 PolarHBondContact O-N 3.14Å; L54-F90 HydrophobicContact CB-CD2 4.42Å; L54-F90 HydrophobicContact CB-CE2 3.99Å; L54-F90 HydrophobicContact CD2-CE2 4.25Å; F88-F90 HydrophobicContact CB-CD2 4.12Å; F88-F90 HydrophobicContact CB-CE2 3.48Å; F88-F90 VanDerWaalsContact CB-CE2 3.48Å; F88-F90 HydrophobicContact CB-CZ 3.75Å; F88-F90 HydrophobicContact CG-CE2 4.3Å; F88-F90 HydrophobicContact CG-CZ 4.11Å
91T92.6Very high89.5Confident0 Ų046.7 Ų46.70%024%0.243CC..EExtended strand (participates in β ladder)trans-144.5154.9-170.953.10000112.1K26 F28 A51 V89 V98K26-T91 WeakPolarHBondContact CB-OG1 3.34Å; K26-T91 PolarHBondContact O-N 3.38Å; K26-T91 PolarHBondContact O-OG1 3.2Å; F28-T91 HydrophobicContact CD2-CG2 4.44Å; F28-T91 HydrophobicContact CE2-CG2 4.19Å; A51-T91 HydrophobicContact CB-CG2 3.58Å; V89-T91 HydrophobicContact CG1-CG2 4.42Å; T91-V98 HydrophobicContact CG2-CB 4.23Å; T91-V98 HydrophobicContact CG2-CG1 3.81Å; T91-V98 HydrophobicContact CG2-CG2 3.72Å
92K90.8Very high89.4Confident114 Ų11443.8 Ų43.850%0.49623%0.23SC..SBendtrans-113.7-33.8168.5-47.3-159.9-168.5-154.70111.4D23 Y24 K26D23-K92 WeakPolarHBondContact O-CE 3.48Å; D23-K92 PolarHBondContact O-NZ 3.01Å; Y24-K92 HydrophobicContact CD1-CD 4.2Å; Y24-K92 HydrophobicContact CD1-CG 3.43Å; Y24-K92 VanDerWaalsContact CD1-CG 3.43Å; Y24-K92 HydrophobicContact CE1-CD 4.32Å; Y24-K92 HydrophobicContact CE1-CG 3.76Å; Y24-K92 HydrophobicContact CG-CG 4.3Å; K26-K92 PolarHBondContact NZ-O 3.02Å; K26-K92 VanDerWaalsContact NZ-O 3.13Å
93E88.4Confident89.3Confident68 Ų6846.5 Ų46.532%0.31824%0.244SC..SBendtrans-61.2179.3170.8-55.1-177.416100113.2K26 K50K26-E93 WeakPolarHBondContact CD-O 3.42Å; K26-E93 PolarHBondContact NZ-O 3.06Å; K50-E93 WeakPolarHBondContact CB-OE2 3.27Å; K50-E93 WeakPolarHBondContact CD-OE2 3.46Å; K50-E93 WeakPolarHBondContact CE-OE2 3.4Å; K50-E93 WeakPolarHBondContact CG-OE1 3.22Å; K50-E93 WeakPolarHBondContact CG-OE2 3.36Å; K50-E93 VanDerWaalsContact NZ-CD 3.26Å; K50-E93 IonicContact NZ-OE1 3.15Å; K50-E93 PolarHBondContact NZ-OE1 3.09Å; K50-E93 IonicContact NZ-OE2 3.32Å; K50-E93 PolarHBondContact NZ-OE2 3.48Å
94D87.3Confident89.2Confident94 Ų9443.8 Ų43.850%0.50325%0.247SC..  trans-82.6148.6-170.5-67.9-44.6000115.4K26 T96 E97 V98K26-D94 IonicContact NZ-OD1 2.69Å; K26-D94 PolarHBondContact NZ-OD1 3.32Å; D94-T96 VanDerWaalsContact C-N 3.28Å; D94-T96 PolarHBondContact O-N 3.42Å; D94-E97 PolarHBondContact O-N 3.03Å; D94-V98 PolarHBondContact O-N 3.44Å
95L86.9Confident89Confident16 Ų1643 Ų438%0.08423%0.23CC..Hα-helixtrans-70-28.7-165.7-62.2170.7000112.1K26 F28 R99 V192 D194 L204K26-L95 HydrophobicContact CB-CD2 3.94Å; K26-L95 HydrophobicContact CD-CD2 4.02Å; K26-L95 HydrophobicContact CD-CG 4.25Å; K26-L95 HydrophobicContact CG-CD2 4.06Å; F28-L95 HydrophobicContact CE1-CD2 4.31Å; F28-L95 HydrophobicContact CE2-CD2 3.88Å; F28-L95 HydrophobicContact CZ-CB 4.01Å; F28-L95 HydrophobicContact CZ-CD2 3.6Å; F28-L95 HydrophobicContact CZ-CG 4.44Å; F28-L95 WeakPolarHBondContact CZ-O 3.49Å; L95-R99 WeakPolarHBondContact O-CB 3.14Å; L95-R99 PolarHBondContact O-N 2.85Å; L95-V192 HydrophobicContact CD1-CG1 3.94Å; L95-V192 HydrophobicContact CD2-CG1 3.76Å; L95-V192 HydrophobicContact CG-CG1 4.35Å; L95-D194 HydrophobicContact CD1-CB 4.25Å; L95-L204 HydrophobicContact CB-CD1 3.96Å; L95-L204 HydrophobicContact CB-CD2 3.94Å; L95-L204 HydrophobicContact CD1-CD2 4.21Å
96T88.2Confident88.7Confident71 Ų7144 Ų4444%0.43623%0.23SC..Hα-helixtrans-67.9-55.117643.70000111.4D94 V98 R99 D100D94-T96 VanDerWaalsContact C-N 3.28Å; D94-T96 PolarHBondContact O-N 3.42Å; T96-V98 VanDerWaalsContact C-N 3.32Å; T96-V98 PolarHBondContact O-N 2.94Å; T96-R99 WeakPolarHBondContact O-CB 3.41Å; T96-R99 PolarHBondContact O-N 2.87Å; T96-R99 VanDerWaalsContact O-N 3.13Å; T96-D100 PolarHBondContact O-N 2.81Å
97E87.8Confident88.4Confident97 Ų9747 Ų4745%0.45325%0.249SC..Hα-helixtrans-54.2-47.2177.7-72.8-167.7-158.700112.4K50 D94 R99 D100 L101K50-E97 IonicContact NZ-OE2 2.71Å; K50-E97 PolarHBondContact NZ-OE2 2.98Å; D94-E97 PolarHBondContact O-N 3.03Å; E97-R99 VanDerWaalsContact C-N 3.35Å; E97-D100 PolarHBondContact O-N 2.95Å; E97-L101 WeakPolarHBondContact O-CB 3.31Å; E97-L101 VanDerWaalsContact O-CG 3.29Å; E97-L101 WeakPolarHBondContact O-CG 3.1Å; E97-L101 PolarHBondContact O-N 3.44Å
98V88.3Confident88.1Confident0 Ų051.2 Ų51.20%028%0.276CS..Hα-helixtrans-68.3-37.9-178178.50000111F28 L47 T91 D94 T96 L101 L102F28-V98 HydrophobicContact CD2-CG1 4.13Å; F28-V98 HydrophobicContact CE2-CB 3.83Å; F28-V98 HydrophobicContact CE2-CG1 3.6Å; F28-V98 HydrophobicContact CZ-CB 4.15Å; F28-V98 HydrophobicContact CZ-CG1 4.24Å; L47-V98 HydrophobicContact CD2-CG1 4.45Å; T91-V98 HydrophobicContact CG2-CB 4.23Å; T91-V98 HydrophobicContact CG2-CG1 3.81Å; T91-V98 HydrophobicContact CG2-CG2 3.72Å; D94-V98 PolarHBondContact O-N 3.44Å; T96-V98 VanDerWaalsContact C-N 3.32Å; T96-V98 PolarHBondContact O-N 2.94Å; V98-L101 PolarHBondContact O-N 3.36Å; V98-L102 HydrophobicContact CG1-CD1 4Å; V98-L102 HydrophobicContact CG1-CG 4.39Å; V98-L102 WeakPolarHBondContact O-CB 3Å; V98-L102 VanDerWaalsContact O-CG 3.23Å; V98-L102 WeakPolarHBondContact O-CG 3.27Å; V98-L102 PolarHBondContact O-N 3.02Å
99R87.4Confident87.6Confident32 Ų3252.2 Ų52.212%0.12128%0.284CS..Hα-helixtrans-59.8-46.5173169.6178.2-163-106.27.3111.2L95 T96 E97 L102 L103 I189 P201 D205L95-R99 WeakPolarHBondContact O-CB 3.14Å; L95-R99 PolarHBondContact O-N 2.85Å; T96-R99 WeakPolarHBondContact O-CB 3.41Å; T96-R99 PolarHBondContact O-N 2.87Å; T96-R99 VanDerWaalsContact O-N 3.13Å; E97-R99 VanDerWaalsContact C-N 3.35Å; R99-L102 WeakPolarHBondContact O-CB 3.43Å; R99-L102 PolarHBondContact O-N 2.89Å; R99-L103 HydrophobicContact CG-CD1 3.76Å; R99-L103 HydrophobicContact CG-CG 4.39Å; R99-L103 WeakPolarHBondContact O-CB 3.48Å; R99-L103 VanDerWaalsContact O-CG 3.27Å; R99-L103 WeakPolarHBondContact O-CG 3.44Å; R99-L103 PolarHBondContact O-N 3.43Å; R99-I189 HydrophobicContact CB-CD1 3.95Å; R99-I189 HydrophobicContact CG-CD1 3.82Å; R99-P201 PolarHBondContact NH2-O 3.37Å; R99-D205 IonicContact CZ-OD1 2.75Å; R99-D205 IonicContact CZ-OD2 2.71Å; R99-D205 IonicContact NH1-OD1 3.7Å; R99-D205 PolarHBondContact NH1-OD1 3.2Å; R99-D205 IonicContact NH2-OD1 2.74Å; R99-D205 PolarHBondContact NH2-OD1 2.92Å; R99-D205 IonicContact NH2-OD2 2.67Å; R99-D205 PolarHBondContact NH2-OD2 2.79Å
100D88.4Confident87.2Confident92 Ų9253.8 Ų53.849%0.49230%0.298SS..Hα-helixtrans-70.3-37.2-177.4-64.3-21.1000111.2T96 E97 L102 L103 A104T96-D100 PolarHBondContact O-N 2.81Å; E97-D100 PolarHBondContact O-N 2.95Å; D100-L102 PolarHBondContact O-N 3.3Å; D100-L103 PolarHBondContact O-N 3.44Å; D100-A104 WeakPolarHBondContact O-CB 3.48Å; D100-A104 PolarHBondContact O-N 2.93Å
101L87.6Confident86.8Confident55 Ų5553.8 Ų53.829%0.28830%0.298SS..Hα-helixtrans-62.4-39.4169.6-71.2170.9000112.6L47 K50 E97 V98 N105L47-L101 HydrophobicContact CD2-CB 4.42Å; K50-L101 HydrophobicContact CD-CD1 3.54Å; E97-L101 WeakPolarHBondContact O-CB 3.31Å; E97-L101 VanDerWaalsContact O-CG 3.29Å; E97-L101 WeakPolarHBondContact O-CG 3.1Å; E97-L101 PolarHBondContact O-N 3.44Å; V98-L101 PolarHBondContact O-N 3.36Å; L101-N105 PolarHBondContact O-N 3.4Å; L101-N105 PolarHBondContact O-ND2 2.95Å
102L86.8Confident86.5Confident4 Ų460.9 Ų60.92%0.02133%0.325CS..Hα-helixtrans-67.1-39.9174.6-75.5167.7000112V30 L47 V98 R99 D100 L187 I189V30-L102 HydrophobicContact CG1-CD1 4.5Å; L47-L102 HydrophobicContact CD1-CD2 3.94Å; V98-L102 HydrophobicContact CG1-CD1 4Å; V98-L102 HydrophobicContact CG1-CG 4.39Å; V98-L102 WeakPolarHBondContact O-CB 3Å; V98-L102 VanDerWaalsContact O-CG 3.23Å; V98-L102 WeakPolarHBondContact O-CG 3.27Å; V98-L102 PolarHBondContact O-N 3.02Å; R99-L102 WeakPolarHBondContact O-CB 3.43Å; R99-L102 PolarHBondContact O-N 2.89Å; D100-L102 PolarHBondContact O-N 3.3Å; L102-L187 HydrophobicContact CD2-CB 4.2Å; L102-L187 HydrophobicContact CD2-CD1 3.76Å; L102-I189 HydrophobicContact CD1-CD1 4.01Å; L102-I189 HydrophobicContact CD1-CG1 4.14Å
103L85.3Confident86.4Confident57 Ų5758.4 Ų58.430%0.29833%0.325SS..Hα-helixtrans-77.8-28.3-179.3-69.4174.7000113.3R99 D100 K106R99-L103 HydrophobicContact CG-CD1 3.76Å; R99-L103 HydrophobicContact CG-CG 4.39Å; R99-L103 WeakPolarHBondContact O-CB 3.48Å; R99-L103 VanDerWaalsContact O-CG 3.27Å; R99-L103 WeakPolarHBondContact O-CG 3.44Å; R99-L103 PolarHBondContact O-N 3.43Å; D100-L103 PolarHBondContact O-N 3.44Å; L103-K106 WeakPolarHBondContact O-CD 3.45Å; L103-K106 VanDerWaalsContact O-CE 3.27Å; L103-K106 WeakPolarHBondContact O-CE 3.44Å; L103-K106 VanDerWaalsContact O-CG 3.24Å; L103-K106 WeakPolarHBondContact O-CG 3.29Å
104A87.2Confident86.4Confident79 Ų7957.8 Ų57.865%0.65334%0.337SS*.Hα-helixtrans-71.8-35172.600000112D100 K106D100-A104 WeakPolarHBondContact O-CB 3.48Å; D100-A104 PolarHBondContact O-N 2.93Å; A104-K106 PolarHBondContact O-N 3.21Å
105N83.3Confident86.4Confident40 Ų4055 Ų5521%0.21433%0.327CS..THydrogen-bonded Turntrans-79.934.2178.8-76.7-82.9000114Q39 I43 S46 L101Q39-N105 PolarHBondContact NE2-O 3.15Å; I43-N105 HydrophobicContact CG1-CB 4Å; S46-N105 PolarHBondContact OG-ND2 3.3Å; L101-N105 PolarHBondContact O-N 3.4Å; L101-N105 PolarHBondContact O-ND2 2.95Å
106K84.6Confident86.5Confident98 Ų9859.5 Ų59.543%0.42635%0.35SS..  trans-74.2140.9166.9-72.1168.1-170.21700109.8L103 A104L103-K106 WeakPolarHBondContact O-CD 3.45Å; L103-K106 VanDerWaalsContact O-CE 3.27Å; L103-K106 WeakPolarHBondContact O-CE 3.44Å; L103-K106 VanDerWaalsContact O-CG 3.24Å; L103-K106 WeakPolarHBondContact O-CG 3.29Å; A104-K106 PolarHBondContact O-N 3.21Å
107V84.4Confident86.5Confident64 Ų6456.2 Ų56.239%0.38833%0.33SS..EExtended strand (participates in β ladder)trans-108.7129.5176.7170.30000108.8Q39 F185Q39-V107 HydrophobicContact CB-CG2 4.26Å; Q39-V107 VanDerWaalsContact CD-CG2 3.47Å; Q39-V107 HydrophobicContact CG-CB 4.4Å; Q39-V107 HydrophobicContact CG-CG2 3.64Å; V107-F185 PolarHBondContact N-O 3.48Å; V107-F185 PolarHBondContact O-N 2.92Å
108P85Confident86.5Confident88 Ų8855.1 Ų55.157%0.57133%0.331SS*.EExtended strand (participates in β ladder)trans-65135.7172.528.6-34.5000109.8
109A83.3Confident86.4Confident24 Ų2458.1 Ų58.120%0.19835%0.352CS..EExtended strand (participates in β ladder)trans-133.8137.4-171.500000110.8S181 F183 F185A109-S181 CarbonylContact O-C 3.57Å; A109-F183 PolarHBondContact N-O 2.98Å; A109-F185 HydrophobicContact CB-CD2 3.46Å; A109-F185 VanDerWaalsContact CB-CD2 3.46Å; A109-F185 HydrophobicContact CB-CE2 3.93Å; A109-F185 HydrophobicContact CB-CG 4.49Å
110A83.9Confident86.6Confident34 Ų3461.4 Ų61.428%0.28137%0.372SS..PPolyproline II helixtrans-65.9144.3172.300000111R112 N176A110-R112 PolarHBondContact O-N 3.42Å; A110-N176 WeakPolarHBondContact CB-OD1 3.35Å
111A86.2Confident86.7Confident2 Ų257.1 Ų57.12%0.01735%0.349CS..PPolyproline II helixtrans-60.9132.8170.400000109.9V167 L175 P182 F183A111-V167 HydrophobicContact CB-CG1 3.92Å; A111-V167 HydrophobicContact CB-CG2 4.3Å; A111-L175 HydrophobicContact CB-CD1 3.93Å; A111-P182 HydrophobicContact CB-CG 4.38Å; A111-F183 HydrophobicContact CB-CD2 4.13Å; A111-F183 HydrophobicContact CB-CE2 3.57Å; A111-F183 HydrophobicContact CB-CZ 4.23Å
112R84.9Confident86.8Confident150 Ų15058.9 Ų58.957%0.56636%0.362SS*.PPolyproline II helixtrans-101.5134177.5-66.6-177.6-178.1159.73.5109.5N34 A110 G114 A115N34-R112 PolarHBondContact OD1-NH1 3.47Å; A110-R112 PolarHBondContact O-N 3.42Å; R112-G114 PolarHBondContact O-N 3.05Å; R112-A115 HydrophobicContact CB-CB 4.21Å; R112-A115 WeakPolarHBondContact O-CB 3.42Å; R112-A115 PolarHBondContact O-N 2.88Å
113A89.6Confident86.9Confident61 Ų6158.8 Ų58.850%0.50436%0.362SS..THydrogen-bonded Turntrans-54.4132.7175.700000111.2A115 A169 A172A113-A115 PolarHBondContact O-N 3.42Å; A113-A169 HydrophobicContact CB-CB 4.11Å; A113-A172 HydrophobicContact CB-CB 4.26Å
114G87Confident87.2Confident55 Ų5559.1 Ų59.157%0.56737%0.367SS*.THydrogen-bonded Turntrans76.7-3.2-177.700000115.8R112 V167R112-G114 PolarHBondContact O-N 3.05Å; G114-V167 PolarHBondContact N-O 2.84Å
115A87.4Confident87.4Confident35 Ų3557.5 Ų57.529%0.28935%0.354SS..PPolyproline II helixtrans-72.9154169.100000111R112 A113 K166 V167R112-A115 HydrophobicContact CB-CB 4.21Å; R112-A115 WeakPolarHBondContact O-CB 3.42Å; R112-A115 PolarHBondContact O-N 2.88Å; A113-A115 PolarHBondContact O-N 3.42Å; A115-K166 WeakPolarHBondContact O-CA 3.39Å; A115-V167 WeakPolarHBondContact O-CG2 3.21Å; A115-V167 PolarHBondContact O-N 2.82Å
116I89.5Confident87.7Confident111 Ų11161.5 Ų61.557%0.56937%0.371SS*.BIsolated β-bridgetrans-82.4133.7171-62.2172.9000108.3P118 D165 K166I116-P118 WeakPolarHBondContact O-CD 3.36Å; I116-D165 WeakPolarHBondContact CA-O 3.38Å; I116-K166 HydrophobicContact CG1-CG 4.42Å
117A88.4Confident88Confident2 Ų259.6 Ų59.62%0.01737%0.366CS..PPolyproline II helixtrans-75.5119.9178.300000111.5I161 G164 D165 V167 F183A117-I161 HydrophobicContact CB-CG2 3.77Å; A117-G164 PolarHBondContact O-N 2.91Å; A117-D165 PolarHBondContact N-O 3.31Å; A117-V167 HydrophobicContact CB-CG2 4.45Å; A117-F183 HydrophobicContact CB-CE1 4.24Å; A117-F183 HydrophobicContact CB-CZ 3.78Å
118P87.3Confident88.1Confident74 Ų7457.9 Ų57.948%0.48136%0.356SS..SBendtrans-79.5-20.1176.532.3-36.9000113.7I116 F183I116-P118 WeakPolarHBondContact O-CD 3.36Å; P118-F183 HydrophobicContact CG-CB 4.33Å; P118-F183 HydrophobicContact CG-CD1 3.75Å; P118-F183 HydrophobicContact CG-CE1 4.19Å; P118-F183 HydrophobicContact CG-CG 3.95Å
119C87.4Confident88.2Confident64 Ų6456.3 Ų56.343%0.43236%0.355SS..SBendtrans-135.1156.1179-58.50000109
120D90.9Very high88.5Confident101 Ų10156.5 Ų56.554%0.5435%0.353SS..  trans-63.2146.7167.9-62.2-30.3000110.2I161 K162 T163D120-I161 WeakPolarHBondContact CA-O 3.19Å; D120-K162 WeakPolarHBondContact OD1-CA 3.34Å; D120-T163 PolarHBondContact OD1-N 3.33Å; D120-T163 PolarHBondContact OD1-OG1 3.41Å
121V89.8Confident88.7Confident2 Ų256.6 Ų56.61%0.01236%0.357CS..EExtended strand (participates in β ladder)trans-122.1110.5-177.6-175.10000110.4L160 I161 L175 P182 F183V121-L160 PolarHBondContact O-N 3.43Å; V121-I161 HydrophobicContact CB-CB 4.12Å; V121-I161 HydrophobicContact CB-CD1 4.45Å; V121-I161 HydrophobicContact CB-CG1 4.2Å; V121-I161 HydrophobicContact CG2-CB 4.19Å; V121-I161 HydrophobicContact CG2-CD1 4.33Å; V121-I161 HydrophobicContact CG2-CG1 4.45Å; V121-I161 PolarHBondContact N-O 3.22Å; V121-I161 PolarHBondContact O-N 2.94Å; V121-L175 HydrophobicContact CG1-CD1 3.96Å; V121-L175 HydrophobicContact CG1-CD2 3.81Å; V121-P182 HydrophobicContact CB-CB 4.46Å; V121-P182 HydrophobicContact CG1-CB 3.85Å; V121-P182 HydrophobicContact CG1-CG 3.91Å; V121-P182 HydrophobicContact CG2-CB 3.93Å; V121-P182 HydrophobicContact CG2-CG 3.94Å; V121-F183 HydrophobicContact CG2-CE1 3.47Å; V121-F183 VanDerWaalsContact CG2-CE1 3.47Å; V121-F183 HydrophobicContact CG2-CZ 3.75Å
122T89.9Confident88.8Confident92 Ų9259.5 Ų59.556%0.56438%0.375SS*.EExtended strand (participates in β ladder)trans-100.9148.2170.551.40000111.3V158T122-V158 WeakPolarHBondContact CA-O 3.09Å
123V89.9Confident89Confident1 Ų160.7 Ų60.71%0.00639%0.387CS..EExtended strand (participates in β ladder)trans-112.9125.1167.5177.80000108.2I154 D157 V158 L160 L174 L175 L178 I180V123-I154 HydrophobicContact CG1-CD1 3.48Å; V123-I154 VanDerWaalsContact CG1-CD1 3.48Å; V123-D157 WeakPolarHBondContact O-CA 3.48Å; V123-V158 PolarHBondContact N-O 3.3Å; V123-V158 PolarHBondContact O-N 2.8Å; V123-L160 HydrophobicContact CG2-CD1 3.51Å; V123-L160 HydrophobicContact CG2-CG 4Å; V123-L174 HydrophobicContact CG2-CD2 4.31Å; V123-L175 HydrophobicContact CG2-CD2 3.93Å; V123-L178 HydrophobicContact CG1-CD1 3.61Å; V123-I180 HydrophobicContact CG1-CD1 4.09Å; V123-I180 HydrophobicContact CG2-CD1 4.26Å
124P90.4Very high88.7Confident64 Ų6461.9 Ų61.942%0.41638%0.381SS..  trans-79.2156.9-176.532.1-35.9000113.1Q126 D157P124-Q126 PolarHBondContact O-N 3.26Å; P124-Q126 VanDerWaalsContact O-N 3.1Å; P124-D157 WeakPolarHBondContact CA-OD1 3.47Å
125A91.8Very high88.7Confident45 Ų4560.8 Ų60.837%0.37236%0.363SS..SBendtrans-64.7102.6169.900000111.1I154 D157A125-I154 WeakPolarHBondContact CA-O 3.46Å; A125-D157 PolarHBondContact N-OD1 2.83Å
126Q90.1Very high88.8Confident125 Ų12562.6 Ų62.658%0.58437%0.374SS*.  trans-154.3151.9-174.1-179.450.647.800110.8P124 T128 I154P124-Q126 PolarHBondContact O-N 3.26Å; P124-Q126 VanDerWaalsContact O-N 3.1Å; Q126-T128 PolarHBondContact O-N 3.3Å; Q126-I154 PolarHBondContact N-O 3.08Å; Q126-I154 PolarHBondContact O-N 3.15Å
127N90.5Very high88.6Confident57 Ų5761 Ų6131%0.30536%0.363SS..BIsolated β-bridgetrans-71.6119.6166.1-175-10.5000109.7G129 T151 I152 E153N127-G129 PolarHBondContact OD1-N 3.39Å; N127-T151 PolarHBondContact ND2-OG1 3.06Å; N127-T151 WeakPolarHBondContact OD1-CB 3.31Å; N127-T151 PolarHBondContact OD1-OG1 3.47Å; N127-I152 PolarHBondContact OD1-O 3.47Å; N127-E153 HydrophobicContact CB-CG 4.43Å
128T86.9Confident88.6Confident29 Ų2961.1 Ų61.118%0.17836%0.363CS..  trans-78.4-15.9-174.868.20000114.2Q126 L130 F138 I152 I154 L178Q126-T128 PolarHBondContact O-N 3.3Å; T128-L130 PolarHBondContact O-N 3.06Å; T128-L130 VanDerWaalsContact O-N 3.16Å; T128-L130 PolarHBondContact OG1-N 3.33Å; T128-F138 HydrophobicContact CG2-CE1 4.24Å; T128-F138 HydrophobicContact CG2-CZ 4.17Å; T128-I152 WeakPolarHBondContact CB-O 3.42Å; T128-I152 WeakPolarHBondContact CG2-O 3.48Å; T128-I152 PolarHBondContact N-O 2.93Å; T128-I152 PolarHBondContact OG1-O 2.98Å; T128-I154 HydrophobicContact CG2-CD1 3.85Å; T128-I154 HydrophobicContact CG2-CG1 3.89Å; T128-L178 HydrophobicContact CG2-CD2 3.54Å
129G87.3Confident88.6Confident54 Ų5463.9 Ų63.956%0.55737%0.37SS*.  trans69.3-0.3-172.600000115.1N127N127-G129 PolarHBondContact OD1-N 3.39Å
130L88.8Confident88.7Confident29 Ų2965 Ų6515%0.15238%0.384CS..  trans-79.6142.3178.5-63.3171.1000111.3T128 F138 T151 I152 M177 L178T128-L130 PolarHBondContact O-N 3.06Å; T128-L130 VanDerWaalsContact O-N 3.16Å; T128-L130 PolarHBondContact OG1-N 3.33Å; L130-F138 HydrophobicContact CD1-CE2 3.92Å; L130-F138 HydrophobicContact CD1-CZ 3.79Å; L130-T151 CarbonylContact O-C 3.56Å; L130-T151 WeakPolarHBondContact O-CA 3.43Å; L130-I152 HydrophobicContact CB-CD1 4.3Å; L130-I152 PolarHBondContact O-N 3.48Å; L130-M177 HydrophobicContact CD1-CB 4.43Å; L130-L178 HydrophobicContact CD1-CD2 4.3Å
131G88.9Confident88.5Confident35 Ų3561.9 Ų61.936%0.36137%0.367SS..  trans-71.1163.6174.400000113.5E133 K134 I152G131-E133 PolarHBondContact O-N 3.2Å; G131-E133 VanDerWaalsContact O-N 3.12Å; G131-K134 PolarHBondContact O-N 2.91Å; G131-I152 VanDerWaalsContact O-CD1 3.31Å; G131-I152 WeakPolarHBondContact O-CD1 3.35Å
132P87.9Confident88.3Confident63 Ų6364.5 Ų64.541%0.40940%0.395SS..G310 helixtrans-67.5-18.5-166.228.2-36.3000114.5K134 T135 I147P132-K134 PolarHBondContact O-N 3.22Å; P132-K134 VanDerWaalsContact O-N 3.09Å; P132-T135 WeakPolarHBondContact O-CB 3.29Å; P132-T135 VanDerWaalsContact O-CG2 3.3Å; P132-T135 WeakPolarHBondContact O-CG2 3.45Å; P132-T135 PolarHBondContact O-N 2.89Å; P132-T135 VanDerWaalsContact O-N 3.15Å; P132-T135 PolarHBondContact O-OG1 3.39Å; P132-I147 HydrophobicContact CB-CD1 4.04Å
133E88.5Confident88.3Confident176 Ų17660.4 Ų60.482%0.82237%0.369SS*.G310 helixtrans-51.8-31.6177.7-59177.316400113.6G131G131-E133 PolarHBondContact O-N 3.2Å; G131-E133 VanDerWaalsContact O-N 3.12Å
134K84.6Confident88.3Confident85 Ų8563.8 Ų63.837%0.3739%0.39SS..G310 helixtrans-95.14-174.2-64.2-177.6179.1178.60114.3G131 P132 S136 F137 F138 I152 M177G131-K134 PolarHBondContact O-N 2.91Å; P132-K134 PolarHBondContact O-N 3.22Å; P132-K134 VanDerWaalsContact O-N 3.09Å; K134-S136 VanDerWaalsContact C-N 3.28Å; K134-S136 PolarHBondContact O-N 3.5Å; K134-F137 VanDerWaalsContact O-CB 3.26Å; K134-F137 WeakPolarHBondContact O-CB 3.29Å; K134-F137 PolarHBondContact O-N 3.44Å; K134-F138 WeakPolarHBondContact O-CD2 3.4Å; K134-I152 HydrophobicContact CB-CD1 4.28Å; K134-M177 HydrophobicContact CD-SD 3.92Å; K134-M177 PolarHBondContact NZ-SD 3.06Å
135T87.1Confident88.4Confident32 Ų3262 Ų6220%0.19638%0.378CS..Hα-helixtrans-55.3-39.1-178.742.60000113.7P132 F137 F138 Q139 I147 I152P132-T135 WeakPolarHBondContact O-CB 3.29Å; P132-T135 VanDerWaalsContact O-CG2 3.3Å; P132-T135 WeakPolarHBondContact O-CG2 3.45Å; P132-T135 PolarHBondContact O-N 2.89Å; P132-T135 VanDerWaalsContact O-N 3.15Å; P132-T135 PolarHBondContact O-OG1 3.39Å; T135-F137 PolarHBondContact O-N 3.39Å; T135-F138 PolarHBondContact O-N 3.39Å; T135-Q139 WeakPolarHBondContact O-CG 3.33Å; T135-Q139 PolarHBondContact O-N 3.5Å; T135-I147 HydrophobicContact CG2-CD1 4.13Å; T135-I147 HydrophobicContact CG2-CG1 4.01Å; T135-I152 HydrophobicContact CG2-CD1 3.63Å; T135-I152 HydrophobicContact CG2-CG1 3.71Å
136S89Confident88.3Confident73 Ų7365.8 Ų65.851%0.5139%0.386SS..Hα-helixtrans-57.4-29.6176.154.80000113.5K134 A140K134-S136 VanDerWaalsContact C-N 3.28Å; K134-S136 PolarHBondContact O-N 3.5Å; S136-A140 WeakPolarHBondContact O-CB 3.41Å; S136-A140 PolarHBondContact O-N 2.74Å
137F85.6Confident88.4Confident78 Ų7864.3 Ų64.334%0.34238%0.381SS..Hα-helixtrans-73.5-35.5-178.8-147.4-98.7000112.4K134 T135 L141 S170 T173 L174K134-F137 VanDerWaalsContact O-CB 3.26Å; K134-F137 WeakPolarHBondContact O-CB 3.29Å; K134-F137 PolarHBondContact O-N 3.44Å; T135-F137 PolarHBondContact O-N 3.39Å; F137-L141 HydrophobicContact CD1-CD1 4.47Å; F137-S170 WeakPolarHBondContact CE1-O 3.44Å; F137-T173 WeakPolarHBondContact CZ-OG1 3.45Å; F137-L174 HydrophobicContact CE1-CB 4.41Å
138F88.7Confident88.3Confident4 Ų463 Ų632%0.01838%0.376CS..Hα-helixtrans-71.4-42.4173.4-70.6-93000111.1T128 L130 K134 T135 A140 L141 G142 I143 T145 I152 I154 L174 L178T128-F138 HydrophobicContact CG2-CE1 4.24Å; T128-F138 HydrophobicContact CG2-CZ 4.17Å; L130-F138 HydrophobicContact CD1-CE2 3.92Å; L130-F138 HydrophobicContact CD1-CZ 3.79Å; K134-F138 WeakPolarHBondContact O-CD2 3.4Å; T135-F138 PolarHBondContact O-N 3.39Å; F138-A140 PolarHBondContact O-N 2.94Å; F138-L141 CarbonylContact O-C 3.58Å; F138-L141 PolarHBondContact O-N 2.8Å; F138-L141 VanDerWaalsContact O-N 3.14Å; F138-G142 PolarHBondContact O-N 3.2Å; F138-I143 HydrophobicContact CB-CB 4.31Å; F138-I143 HydrophobicContact CD1-CB 4.36Å; F138-I143 HydrophobicContact CD1-CD1 3.92Å; F138-I143 HydrophobicContact CD1-CG2 4.29Å; F138-I143 PolarHBondContact O-N 2.98Å; F138-T145 HydrophobicContact CB-CG2 3.65Å; F138-T145 HydrophobicContact CD1-CG2 3.72Å; F138-T145 HydrophobicContact CG-CG2 3.78Å; F138-I152 HydrophobicContact CD2-CD1 4.15Å; F138-I152 HydrophobicContact CD2-CG2 4.25Å; F138-I152 HydrophobicContact CE2-CD1 4.04Å; F138-I152 HydrophobicContact CE2-CG2 4.34Å; F138-I154 HydrophobicContact CE1-CD1 4.2Å; F138-I154 HydrophobicContact CE1-CG1 4.5Å; F138-L174 HydrophobicContact CD1-CD1 3.72Å; F138-L174 HydrophobicContact CE1-CD1 3.63Å; F138-L174 HydrophobicContact CE1-CG 4.16Å; F138-L174 HydrophobicContact CG-CD1 4.33Å; F138-L174 HydrophobicContact CZ-CD1 4.17Å; F138-L174 HydrophobicContact CZ-CG 4.44Å; F138-L178 HydrophobicContact CZ-CD2 4.28Å
139Q87.8Confident88.4Confident132 Ų13274.1 Ų74.162%0.61742%0.415SS*.Hα-helixtrans-62.3-41.2176.5-68.8173.9-11.700112.4T135 L141 G142T135-Q139 WeakPolarHBondContact O-CG 3.33Å; T135-Q139 PolarHBondContact O-N 3.5Å; Q139-L141 PolarHBondContact O-N 2.75Å; Q139-G142 PolarHBondContact O-N 2.98Å
140A87.8Confident88.4Confident88 Ų8873.5 Ų73.573%0.72741%0.409SS*.THydrogen-bonded Turntrans-64.3-19.9175.900000113.9S136 F138S136-A140 WeakPolarHBondContact O-CB 3.41Å; S136-A140 PolarHBondContact O-N 2.74Å; F138-A140 PolarHBondContact O-N 2.94Å
141L86.9Confident88.5Confident35 Ų3573.8 Ų73.818%0.18341%0.412CS..THydrogen-bonded Turntrans-99.58.6174.4-70.6171.6000112.9F137 F138 Q139 I143 E171 L174F137-L141 HydrophobicContact CD1-CD1 4.47Å; F138-L141 CarbonylContact O-C 3.58Å; F138-L141 PolarHBondContact O-N 2.8Å; F138-L141 VanDerWaalsContact O-N 3.14Å; Q139-L141 PolarHBondContact O-N 2.75Å; L141-I143 HydrophobicContact CB-CD1 4.08Å; L141-I143 HydrophobicContact CB-CG1 4.1Å; L141-I143 PolarHBondContact O-N 3.28Å; L141-E171 HydrophobicContact CD2-CG 3.9Å; L141-L174 HydrophobicContact CD1-CB 4.15Å; L141-L174 HydrophobicContact CD1-CD1 3.57Å; L141-L174 HydrophobicContact CD1-CG 4.47Å
142G86.1Confident88.6Confident58 Ų5872.1 Ų72.160%0.59840%0.395SS*.THydrogen-bonded Turntrans71.610179.700000115.2F138 Q139F138-G142 PolarHBondContact O-N 3.2Å; Q139-G142 PolarHBondContact O-N 2.98Å
143I89.9Confident88.7Confident5 Ų572.3 Ų72.33%0.02639%0.39CS..  trans-80.7122.3-176.6-51.9170.4000109.5F138 L141 T145 I154 L160 L174F138-I143 HydrophobicContact CB-CB 4.31Å; F138-I143 HydrophobicContact CD1-CB 4.36Å; F138-I143 HydrophobicContact CD1-CD1 3.92Å; F138-I143 HydrophobicContact CD1-CG2 4.29Å; F138-I143 PolarHBondContact O-N 2.98Å; L141-I143 HydrophobicContact CB-CD1 4.08Å; L141-I143 HydrophobicContact CB-CG1 4.1Å; L141-I143 PolarHBondContact O-N 3.28Å; I143-T145 HydrophobicContact CG2-CG2 4.03Å; I143-T145 PolarHBondContact O-N 3.31Å; I143-T145 VanDerWaalsContact O-N 3.09Å; I143-I154 HydrophobicContact CG2-CG1 4.33Å; I143-I154 HydrophobicContact CG2-CG2 3.95Å; I143-L160 HydrophobicContact CD1-CD1 4.47Å; I143-L160 HydrophobicContact CD1-CD2 3.85Å; I143-L160 HydrophobicContact CG1-CD2 3.88Å; I143-L174 HydrophobicContact CD1-CD1 3.49Å; I143-L174 VanDerWaalsContact CD1-CD1 3.49Å; I143-L174 HydrophobicContact CD1-CD2 4.44Å
144T90.6Very high88.9Confident73 Ų7364.2 Ų64.245%0.44835%0.352SS..  trans-74.697.1178.241.20000111.6L155 S156T144-L155 WeakPolarHBondContact O-CB 3.45Å; T144-L155 PolarHBondContact O-N 3.12Å; T144-S156 PolarHBondContact OG1-OG 2.8Å
145T90.9Very high89.2Confident27 Ų2765 Ų6517%0.16636%0.36CS..EExtended strand (participates in β ladder)trans-113.2149.4179.358.80000113.9F138 I143 I152 E153 I154F138-T145 HydrophobicContact CB-CG2 3.65Å; F138-T145 HydrophobicContact CD1-CG2 3.72Å; F138-T145 HydrophobicContact CG-CG2 3.78Å; I143-T145 HydrophobicContact CG2-CG2 4.03Å; I143-T145 PolarHBondContact O-N 3.31Å; I143-T145 VanDerWaalsContact O-N 3.09Å; T145-I152 HydrophobicContact CG2-CG2 3.78Å; T145-E153 CarbonylContact C-O 3.5Å; T145-E153 WeakPolarHBondContact CA-O 3.38Å; T145-I154 HydrophobicContact CG2-CG1 4.01Å
146K91Very high89.4Confident124 Ų12465.9 Ų65.954%0.53937%0.368SS..EExtended strand (participates in β ladder)trans-122.1149.9172.8-173.5176.5178.4-176.80110.2E153 L155K146-E153 PolarHBondContact N-O 2.95Å; K146-E153 PolarHBondContact O-N 2.85Å; K146-L155 HydrophobicContact CB-CD1 4.32Å; K146-L155 HydrophobicContact CB-CD2 3.87Å; K146-L155 HydrophobicContact CB-CG 4.2Å; K146-L155 HydrophobicContact CD-CD2 4.25Å
147I91.9Very high89.4Confident94 Ų9467.8 Ų67.848%0.48237%0.372SS..EExtended strand (participates in β ladder)trans-87.3114.3170.4-56.6171.7000108.2P132 T135P132-I147 HydrophobicContact CB-CD1 4.04Å; T135-I147 HydrophobicContact CG2-CD1 4.13Å; T135-I147 HydrophobicContact CG2-CG1 4.01Å
148S89Confident89.5Confident28 Ų2865.8 Ų65.820%0.19637%0.366CS..EExtended strand (participates in β ladder)trans-119119.6178.2-750000109.2G150 T151 E153S148-G150 PolarHBondContact O-N 3.04Å; S148-G150 VanDerWaalsContact O-N 3.09Å; S148-T151 PolarHBondContact N-O 2.71Å; S148-T151 PolarHBondContact O-N 3.3Å; S148-T151 VanDerWaalsContact O-O 3.11Å; S148-T151 PolarHBondContact O-OG1 3.24Å; S148-E153 WeakPolarHBondContact CB-OE2 3.27Å; S148-E153 PolarHBondContact OG-OE2 3.46Å
149R87.1Confident89.6Confident263 Ų26368.3 Ų68.399%0.99239%0.393SS*.THydrogen-bonded Turntrans52.728.8179.4-57.2-179.3179.3170.80.3115
150G88.3Confident89.5Confident42 Ų4263.7 Ų63.743%0.43337%0.372SS..THydrogen-bonded Turntrans90.9-3.3-178.800000115.3S148S148-G150 PolarHBondContact O-N 3.04Å; S148-G150 VanDerWaalsContact O-N 3.09Å
151T90.8Very high89.5Confident35 Ų3559.8 Ų59.822%0.21534%0.34CS..EExtended strand (participates in β ladder)trans-110.9152.9175.445.80000111.9N127 L130 S148N127-T151 PolarHBondContact ND2-OG1 3.06Å; N127-T151 WeakPolarHBondContact OD1-CB 3.31Å; N127-T151 PolarHBondContact OD1-OG1 3.47Å; L130-T151 CarbonylContact O-C 3.56Å; L130-T151 WeakPolarHBondContact O-CA 3.43Å; S148-T151 PolarHBondContact N-O 2.71Å; S148-T151 PolarHBondContact O-N 3.3Å; S148-T151 VanDerWaalsContact O-O 3.11Å; S148-T151 PolarHBondContact O-OG1 3.24Å
152I90.9Very high89.7Confident0 Ų065 Ų650%036%0.361CS..EExtended strand (participates in β ladder)trans-80.2125.9176.1-56.2172.7000110N127 T128 L130 G131 K134 T135 F138 T145N127-I152 PolarHBondContact OD1-O 3.47Å; T128-I152 WeakPolarHBondContact CB-O 3.42Å; T128-I152 WeakPolarHBondContact CG2-O 3.48Å; T128-I152 PolarHBondContact N-O 2.93Å; T128-I152 PolarHBondContact OG1-O 2.98Å; L130-I152 HydrophobicContact CB-CD1 4.3Å; L130-I152 PolarHBondContact O-N 3.48Å; G131-I152 VanDerWaalsContact O-CD1 3.31Å; G131-I152 WeakPolarHBondContact O-CD1 3.35Å; K134-I152 HydrophobicContact CB-CD1 4.28Å; T135-I152 HydrophobicContact CG2-CD1 3.63Å; T135-I152 HydrophobicContact CG2-CG1 3.71Å; F138-I152 HydrophobicContact CD2-CD1 4.15Å; F138-I152 HydrophobicContact CD2-CG2 4.25Å; F138-I152 HydrophobicContact CE2-CD1 4.04Å; F138-I152 HydrophobicContact CE2-CG2 4.34Å; T145-I152 HydrophobicContact CG2-CG2 3.78Å
153E90.9Very high89.9Confident67 Ų6766.3 Ų66.331%0.31336%0.357SS..EExtended strand (participates in β ladder)trans-118.4130.8179.3-176.7170.3-121.400110.5N127 T145 K146 S148N127-E153 HydrophobicContact CB-CG 4.43Å; T145-E153 CarbonylContact C-O 3.5Å; T145-E153 WeakPolarHBondContact CA-O 3.38Å; K146-E153 PolarHBondContact N-O 2.95Å; K146-E153 PolarHBondContact O-N 2.85Å; S148-E153 WeakPolarHBondContact CB-OE2 3.27Å; S148-E153 PolarHBondContact OG-OE2 3.46Å
154I91.8Very high89.9Confident6 Ų668.5 Ų68.53%0.03138%0.381CS..EExtended strand (participates in β ladder)trans-86.5126.6177.6-59.1173.6000108.4V123 A125 Q126 T128 F138 I143 T145 S156 L178V123-I154 HydrophobicContact CG1-CD1 3.48Å; V123-I154 VanDerWaalsContact CG1-CD1 3.48Å; A125-I154 WeakPolarHBondContact CA-O 3.46Å; Q126-I154 PolarHBondContact N-O 3.08Å; Q126-I154 PolarHBondContact O-N 3.15Å; T128-I154 HydrophobicContact CG2-CD1 3.85Å; T128-I154 HydrophobicContact CG2-CG1 3.89Å; F138-I154 HydrophobicContact CE1-CD1 4.2Å; F138-I154 HydrophobicContact CE1-CG1 4.5Å; I143-I154 HydrophobicContact CG2-CG1 4.33Å; I143-I154 HydrophobicContact CG2-CG2 3.95Å; T145-I154 HydrophobicContact CG2-CG1 4.01Å; I154-S156 WeakPolarHBondContact CG2-O 3.39Å; I154-L178 HydrophobicContact CD1-CD1 4.23Å
155L91.1Very high89.9Confident101 Ų10169.1 Ų69.153%0.52938%0.381SS..  trans-82-24.8-171.2-66.7175.6000114.7T144 K146T144-L155 WeakPolarHBondContact O-CB 3.45Å; T144-L155 PolarHBondContact O-N 3.12Å; K146-L155 HydrophobicContact CB-CD1 4.32Å; K146-L155 HydrophobicContact CB-CD2 3.87Å; K146-L155 HydrophobicContact CB-CG 4.2Å; K146-L155 HydrophobicContact CD-CD2 4.25Å
156S90.2Very high89.9Confident51 Ų5175.3 Ų75.336%0.35741%0.406SS..SBendtrans-157.6150.1-172.9550000110.3T144 I154 V158T144-S156 PolarHBondContact OG1-OG 2.8Å; I154-S156 WeakPolarHBondContact CG2-O 3.39Å; S156-V158 PolarHBondContact O-N 3.22Å
157D90.7Very high89.9Confident113 Ų11369.6 Ų69.660%0.60438%0.381SS*.  trans-61.9132.7175.5-66.714.3000110.9V123 P124 A125V123-D157 WeakPolarHBondContact O-CA 3.48Å; P124-D157 WeakPolarHBondContact CA-OD1 3.47Å; A125-D157 PolarHBondContact N-OD1 2.83Å
158V88Confident89.9Confident35 Ų3566 Ų6621%0.21237%0.368CS..EExtended strand (participates in β ladder)trans-129.8128.6178.6-179.30000110.2T122 V123 S156 L160T122-V158 WeakPolarHBondContact CA-O 3.09Å; V123-V158 PolarHBondContact N-O 3.3Å; V123-V158 PolarHBondContact O-N 2.8Å; S156-V158 PolarHBondContact O-N 3.22Å; V158-L160 HydrophobicContact CG1-CD2 4.23Å; V158-L160 PolarHBondContact O-N 3.09Å
159G88.8Confident90Very high57 Ų5767.9 Ų67.959%0.58839%0.385SS*.EExtended strand (participates in β ladder)trans-76.6115.116700000110.6
160L86Confident90.1Very high35 Ų3557.5 Ų57.518%0.18335%0.353CS..EExtended strand (participates in β ladder)trans-87.5-42.3-179.7-65.6-174000112.9V121 V123 I143 V158 L174V121-L160 PolarHBondContact O-N 3.43Å; V123-L160 HydrophobicContact CG2-CD1 3.51Å; V123-L160 HydrophobicContact CG2-CG 4Å; I143-L160 HydrophobicContact CD1-CD1 4.47Å; I143-L160 HydrophobicContact CD1-CD2 3.85Å; I143-L160 HydrophobicContact CG1-CD2 3.88Å; V158-L160 HydrophobicContact CG1-CD2 4.23Å; V158-L160 PolarHBondContact O-N 3.09Å; L160-L174 HydrophobicContact CD1-CD2 4.13Å
161I89Confident90.1Very high7 Ų757.4 Ų57.44%0.03634%0.341CS..EExtended strand (participates in β ladder)trans-136.7138.4-169-37.1-179.5000109A117 D120 V121 D165 V167 E171 L175A117-I161 HydrophobicContact CB-CG2 3.77Å; D120-I161 WeakPolarHBondContact CA-O 3.19Å; V121-I161 HydrophobicContact CB-CB 4.12Å; V121-I161 HydrophobicContact CB-CD1 4.45Å; V121-I161 HydrophobicContact CB-CG1 4.2Å; V121-I161 HydrophobicContact CG2-CB 4.19Å; V121-I161 HydrophobicContact CG2-CD1 4.33Å; V121-I161 HydrophobicContact CG2-CG1 4.45Å; V121-I161 PolarHBondContact N-O 3.22Å; V121-I161 PolarHBondContact O-N 2.94Å; I161-D165 HydrophobicContact CG2-CB 4.01Å; I161-V167 HydrophobicContact CD1-CB 4.23Å; I161-V167 HydrophobicContact CD1-CG1 3.93Å; I161-V167 HydrophobicContact CD1-CG2 3.91Å; I161-E171 HydrophobicContact CD1-CB 4.05Å; I161-E171 HydrophobicContact CD1-CG 4.46Å; I161-E171 WeakPolarHBondContact CD1-OE2 3.39Å; I161-E171 HydrophobicContact CG1-CG 4.44Å; I161-E171 WeakPolarHBondContact CG1-OE2 3.23Å; I161-L175 HydrophobicContact CD1-CD1 4.28Å
162K90.6Very high90.1Very high145 Ų14556 Ų5663%0.6333%0.333SS*.  trans-102.2158.8174.5-60.1177.8-179.6176.80111.8D120 G164 D165D120-K162 WeakPolarHBondContact OD1-CA 3.34Å; K162-G164 PolarHBondContact O-N 2.97Å; K162-D165 WeakPolarHBondContact O-CB 3.47Å; K162-D165 PolarHBondContact O-N 2.81Å; K162-D165 VanDerWaalsContact O-N 3.09Å
163T91.4Very high90Very high85 Ų8558.9 Ų58.952%0.52135%0.351SS..THydrogen-bonded Turntrans-47.9125.3169.145.20000111.8D120D120-T163 PolarHBondContact OD1-N 3.33Å; D120-T163 PolarHBondContact OD1-OG1 3.41Å
164G89.2Confident89.9Confident51 Ų5155.9 Ų55.953%0.52634%0.337SS..THydrogen-bonded Turntrans89.2-16179.800000115.9A117 K162A117-G164 PolarHBondContact O-N 2.91Å; K162-G164 PolarHBondContact O-N 2.97Å
165D91Very high89.8Confident85 Ų8555.6 Ų55.646%0.45534%0.335SS..PPolyproline II helixtrans-72.8157.7175.2-75.6-36000112I116 A117 I161 K162I116-D165 WeakPolarHBondContact CA-O 3.38Å; A117-D165 PolarHBondContact N-O 3.31Å; I161-D165 HydrophobicContact CG2-CB 4.01Å; K162-D165 WeakPolarHBondContact O-CB 3.47Å; K162-D165 PolarHBondContact O-N 2.81Å; K162-D165 VanDerWaalsContact O-N 3.09Å
166K90.9Very high89.7Confident158 Ų15854.7 Ų54.769%0.68733%0.331SS*.BIsolated β-bridgetrans-91120.3176.2-70.8179.3-177.9173.20110.4A115 I116 G168A115-K166 WeakPolarHBondContact O-CA 3.39Å; I116-K166 HydrophobicContact CG1-CG 4.42Å; K166-G168 PolarHBondContact O-N 3.19Å
167V90.9Very high89.6Confident3 Ų356 Ų562%0.01833%0.332CS..PPolyproline II helixtrans-57.5120.6178.9179.60000111.1A111 G114 A115 A117 I161 E171 A172 F183A111-V167 HydrophobicContact CB-CG1 3.92Å; A111-V167 HydrophobicContact CB-CG2 4.3Å; G114-V167 PolarHBondContact N-O 2.84Å; A115-V167 WeakPolarHBondContact O-CG2 3.21Å; A115-V167 PolarHBondContact O-N 2.82Å; A117-V167 HydrophobicContact CB-CG2 4.45Å; I161-V167 HydrophobicContact CD1-CB 4.23Å; I161-V167 HydrophobicContact CD1-CG1 3.93Å; I161-V167 HydrophobicContact CD1-CG2 3.91Å; V167-E171 HydrophobicContact CG1-CB 4.48Å; V167-A172 HydrophobicContact CG1-CB 3.82Å; V167-F183 HydrophobicContact CG2-CE2 4.14Å; V167-F183 HydrophobicContact CG2-CZ 4.27Å
168G91.1Very high89.5Confident19 Ų1952.1 Ų52.120%0.19631%0.311CS..PPolyproline II helixtrans-66.4153.2173.500000113.1K166 S170 E171 A172K166-G168 PolarHBondContact O-N 3.19Å; G168-S170 VanDerWaalsContact C-N 3.3Å; G168-S170 PolarHBondContact O-N 2.95Å; G168-E171 VanDerWaalsContact N-CD 3.35Å; G168-E171 PolarHBondContact N-OE2 2.92Å; G168-E171 PolarHBondContact O-N 3.43Å; G168-A172 WeakPolarHBondContact O-CB 3.37Å; G168-A172 PolarHBondContact O-N 3.39Å
169A91.1Very high89.4Confident67 Ų6757.1 Ų57.155%0.55434%0.337SS*.Hα-helixtrans-66.1-33.5177.900000112.6A113 T173A113-A169 HydrophobicContact CB-CB 4.11Å; A169-T173 WeakPolarHBondContact O-CB 3.44Å; A169-T173 WeakPolarHBondContact O-CG2 3.39Å; A169-T173 PolarHBondContact O-N 3.14Å; A169-T173 VanDerWaalsContact O-N 3.15Å; A169-T173 PolarHBondContact O-OG1 3.3Å
170S89.6Confident89.5Confident46 Ų4656.6 Ų56.632%0.32232%0.32SS..Hα-helixtrans-67.9-49.3171.839.20000112F137 G168 A172 T173 L174F137-S170 WeakPolarHBondContact CE1-O 3.44Å; G168-S170 VanDerWaalsContact C-N 3.3Å; G168-S170 PolarHBondContact O-N 2.95Å; S170-A172 PolarHBondContact O-N 3.47Å; S170-T173 PolarHBondContact O-N 3.04Å; S170-T173 PolarHBondContact O-OG1 3.35Å; S170-T173 VanDerWaalsContact O-OG1 3.07Å; S170-L174 WeakPolarHBondContact O-CB 3.35Å; S170-L174 PolarHBondContact O-N 2.83Å
171E88.8Confident89.6Confident39 Ų3957.5 Ų57.518%0.18233%0.329CS..Hα-helixtrans-57.4-49.2176.1-65.4144.2-134.700111.8L141 I161 V167 G168 T173 L174 L175L141-E171 HydrophobicContact CD2-CG 3.9Å; I161-E171 HydrophobicContact CD1-CB 4.05Å; I161-E171 HydrophobicContact CD1-CG 4.46Å; I161-E171 WeakPolarHBondContact CD1-OE2 3.39Å; I161-E171 HydrophobicContact CG1-CG 4.44Å; I161-E171 WeakPolarHBondContact CG1-OE2 3.23Å; V167-E171 HydrophobicContact CG1-CB 4.48Å; G168-E171 VanDerWaalsContact N-CD 3.35Å; G168-E171 PolarHBondContact N-OE2 2.92Å; G168-E171 PolarHBondContact O-N 3.43Å; E171-T173 VanDerWaalsContact C-N 3.35Å; E171-T173 PolarHBondContact O-N 3.46Å; E171-L174 PolarHBondContact O-N 3.02Å; E171-L175 WeakPolarHBondContact O-CB 3.38Å; E171-L175 VanDerWaalsContact O-CG 3.29Å; E171-L175 WeakPolarHBondContact O-CG 3.2Å; E171-L175 PolarHBondContact O-N 2.85Å
172A90.1Very high89.4Confident5 Ų559 Ų594%0.04134%0.339CS..Hα-helixtrans-57.8-45.9177.500000111.8A113 V167 G168 S170 N176A113-A172 HydrophobicContact CB-CB 4.26Å; V167-A172 HydrophobicContact CG1-CB 3.82Å; G168-A172 WeakPolarHBondContact O-CB 3.37Å; G168-A172 PolarHBondContact O-N 3.39Å; S170-A172 PolarHBondContact O-N 3.47Å; A172-N176 PolarHBondContact O-N 3.29Å; A172-N176 VanDerWaalsContact O-N 3.09Å; A172-N176 PolarHBondContact O-ND2 2.85Å
173T89.4Confident89.2Confident62 Ų6252.3 Ų52.338%0.3831%0.311SS..Hα-helixtrans-71-34.4-179.146.60000112.7F137 A169 S170 E171 M177F137-T173 WeakPolarHBondContact CZ-OG1 3.45Å; A169-T173 WeakPolarHBondContact O-CB 3.44Å; A169-T173 WeakPolarHBondContact O-CG2 3.39Å; A169-T173 PolarHBondContact O-N 3.14Å; A169-T173 VanDerWaalsContact O-N 3.15Å; A169-T173 PolarHBondContact O-OG1 3.3Å; S170-T173 PolarHBondContact O-N 3.04Å; S170-T173 PolarHBondContact O-OG1 3.35Å; S170-T173 VanDerWaalsContact O-OG1 3.07Å; E171-T173 VanDerWaalsContact C-N 3.35Å; E171-T173 PolarHBondContact O-N 3.46Å; T173-M177 WeakPolarHBondContact O-CG 3.44Å; T173-M177 PolarHBondContact O-N 3.08Å
174L88.3Confident88.9Confident4 Ų451.9 Ų51.92%0.02131%0.311CS..Hα-helixtrans-63.3-50.2171.8179.7151.6000111.6V123 F137 F138 L141 I143 L160 S170 E171 N176 M177 L178V123-L174 HydrophobicContact CG2-CD2 4.31Å; F137-L174 HydrophobicContact CE1-CB 4.41Å; F138-L174 HydrophobicContact CD1-CD1 3.72Å; F138-L174 HydrophobicContact CE1-CD1 3.63Å; F138-L174 HydrophobicContact CE1-CG 4.16Å; F138-L174 HydrophobicContact CG-CD1 4.33Å; F138-L174 HydrophobicContact CZ-CD1 4.17Å; F138-L174 HydrophobicContact CZ-CG 4.44Å; L141-L174 HydrophobicContact CD1-CB 4.15Å; L141-L174 HydrophobicContact CD1-CD1 3.57Å; L141-L174 HydrophobicContact CD1-CG 4.47Å; I143-L174 HydrophobicContact CD1-CD1 3.49Å; I143-L174 VanDerWaalsContact CD1-CD1 3.49Å; I143-L174 HydrophobicContact CD1-CD2 4.44Å; L160-L174 HydrophobicContact CD1-CD2 4.13Å; S170-L174 WeakPolarHBondContact O-CB 3.35Å; S170-L174 PolarHBondContact O-N 2.83Å; E171-L174 PolarHBondContact O-N 3.02Å; L174-N176 VanDerWaalsContact C-N 3.28Å; L174-N176 PolarHBondContact O-N 3.4Å; L174-M177 PolarHBondContact O-N 3.22Å; L174-L178 HydrophobicContact CD2-CD1 3.57Å; L174-L178 HydrophobicContact CD2-CG 4.13Å; L174-L178 HydrophobicContact CG-CD1 4.37Å; L174-L178 PolarHBondContact O-N 3.42Å
175L89.8Confident88.6Confident0 Ų051.5 Ų51.50%030%0.295CS..Hα-helixtrans-58.8-41.5-180-70.8164000111.4A111 V121 V123 I161 E171 L178 N179 I180 P182A111-L175 HydrophobicContact CB-CD1 3.93Å; V121-L175 HydrophobicContact CG1-CD1 3.96Å; V121-L175 HydrophobicContact CG1-CD2 3.81Å; V123-L175 HydrophobicContact CG2-CD2 3.93Å; I161-L175 HydrophobicContact CD1-CD1 4.28Å; E171-L175 WeakPolarHBondContact O-CB 3.38Å; E171-L175 VanDerWaalsContact O-CG 3.29Å; E171-L175 WeakPolarHBondContact O-CG 3.2Å; E171-L175 PolarHBondContact O-N 2.85Å; L175-L178 PolarHBondContact O-N 3Å; L175-N179 PolarHBondContact O-N 2.99Å; L175-I180 HydrophobicContact CD2-CB 4.02Å; L175-I180 HydrophobicContact CD2-CG2 3.91Å; L175-I180 PolarHBondContact O-N 3.46Å; L175-P182 HydrophobicContact CD1-CG 4.41Å
176N89.4Confident88.3Confident82 Ų8247.8 Ų47.844%0.43928%0.276SS..Hα-helixtrans-61.5-42.5172.1-81.4-82.1000112.7A110 A172 L174 L178 N179A110-N176 WeakPolarHBondContact CB-OD1 3.35Å; A172-N176 PolarHBondContact O-N 3.29Å; A172-N176 VanDerWaalsContact O-N 3.09Å; A172-N176 PolarHBondContact O-ND2 2.85Å; L174-N176 VanDerWaalsContact C-N 3.28Å; L174-N176 PolarHBondContact O-N 3.4Å; N176-L178 VanDerWaalsContact C-N 3.33Å; N176-L178 PolarHBondContact O-N 2.97Å; N176-N179 PolarHBondContact O-N 3.13Å; N176-N179 VanDerWaalsContact O-N 3.12Å
177M87.4Confident88.1Confident77 Ų7740.4 Ų40.438%0.37924%0.244SC..Hα-helixtrans-68.4-29177.8-72.2-170.1-140.100113.4L130 K134 T173 L174 N179L130-M177 HydrophobicContact CD1-CB 4.43Å; K134-M177 HydrophobicContact CD-SD 3.92Å; K134-M177 PolarHBondContact NZ-SD 3.06Å; T173-M177 WeakPolarHBondContact O-CG 3.44Å; T173-M177 PolarHBondContact O-N 3.08Å; L174-M177 PolarHBondContact O-N 3.22Å; M177-N179 VanDerWaalsContact C-N 3.27Å
178L87.9Confident88Confident32 Ų3245.5 Ų45.517%0.16827%0.271CS..THydrogen-bonded Turntrans-82.4-1.4172.4-60.5-174.4000113.3V123 T128 L130 F138 I154 L174 L175 N176 I180V123-L178 HydrophobicContact CG1-CD1 3.61Å; T128-L178 HydrophobicContact CG2-CD2 3.54Å; L130-L178 HydrophobicContact CD1-CD2 4.3Å; F138-L178 HydrophobicContact CZ-CD2 4.28Å; I154-L178 HydrophobicContact CD1-CD1 4.23Å; L174-L178 HydrophobicContact CD2-CD1 3.57Å; L174-L178 HydrophobicContact CD2-CG 4.13Å; L174-L178 HydrophobicContact CG-CD1 4.37Å; L174-L178 PolarHBondContact O-N 3.42Å; L175-L178 PolarHBondContact O-N 3Å; N176-L178 VanDerWaalsContact C-N 3.33Å; N176-L178 PolarHBondContact O-N 2.97Å; L178-I180 HydrophobicContact CB-CD1 3.84Å; L178-I180 HydrophobicContact CB-CG1 3.82Å; L178-I180 HydrophobicContact CD1-CD1 3.9Å; L178-I180 PolarHBondContact O-N 3.46Å
179N87.9Confident88Confident141 Ų14145.2 Ų45.275%0.75426%0.264SS*.THydrogen-bonded Turntrans58.117.5-170.6-55.2-80.5000114.5L175 N176 M177 S181L175-N179 PolarHBondContact O-N 2.99Å; N176-N179 PolarHBondContact O-N 3.13Å; N176-N179 VanDerWaalsContact O-N 3.12Å; M177-N179 VanDerWaalsContact C-N 3.27Å; N179-S181 PolarHBondContact O-N 2.92Å
180I89.1Confident88Confident46 Ų4645.1 Ų45.124%0.23625%0.252CS..  trans-79.5118177.5-59.7174.7000108.3V123 L175 L178 P182V123-I180 HydrophobicContact CG1-CD1 4.09Å; V123-I180 HydrophobicContact CG2-CD1 4.26Å; L175-I180 HydrophobicContact CD2-CB 4.02Å; L175-I180 HydrophobicContact CD2-CG2 3.91Å; L175-I180 PolarHBondContact O-N 3.46Å; L178-I180 HydrophobicContact CB-CD1 3.84Å; L178-I180 HydrophobicContact CB-CG1 3.82Å; L178-I180 HydrophobicContact CD1-CD1 3.9Å; L178-I180 PolarHBondContact O-N 3.46Å; I180-P182 WeakPolarHBondContact O-CD 3.42Å
181S88.4Confident88Confident53 Ų5344.7 Ų44.737%0.37125%0.246SC..  trans-114.381.3178.1340000109.4A109 N179 F183A109-S181 CarbonylContact O-C 3.57Å; N179-S181 PolarHBondContact O-N 2.92Å; S181-F183 VanDerWaalsContact C-N 3.29Å; S181-F183 PolarHBondContact O-N 3.47Å
182P85.1Confident88.1Confident38 Ų3842.9 Ų42.925%0.24724%0.237CC..  trans-76.5-13.5-163.632.3-37.8000114A111 V121 L175 I180A111-P182 HydrophobicContact CB-CG 4.38Å; V121-P182 HydrophobicContact CB-CB 4.46Å; V121-P182 HydrophobicContact CG1-CB 3.85Å; V121-P182 HydrophobicContact CG1-CG 3.91Å; V121-P182 HydrophobicContact CG2-CB 3.93Å; V121-P182 HydrophobicContact CG2-CG 3.94Å; L175-P182 HydrophobicContact CD1-CG 4.41Å; I180-P182 WeakPolarHBondContact O-CD 3.42Å
183F86.9Confident88.1Confident6 Ų643.1 Ų43.13%0.02624%0.237CC..EExtended strand (participates in β ladder)trans-107.8139.1-178.1-51.9-34.3000109.8A109 A111 A117 P118 V121 V167 S181 F185A109-F183 PolarHBondContact N-O 2.98Å; A111-F183 HydrophobicContact CB-CD2 4.13Å; A111-F183 HydrophobicContact CB-CE2 3.57Å; A111-F183 HydrophobicContact CB-CZ 4.23Å; A117-F183 HydrophobicContact CB-CE1 4.24Å; A117-F183 HydrophobicContact CB-CZ 3.78Å; P118-F183 HydrophobicContact CG-CB 4.33Å; P118-F183 HydrophobicContact CG-CD1 3.75Å; P118-F183 HydrophobicContact CG-CE1 4.19Å; P118-F183 HydrophobicContact CG-CG 3.95Å; V121-F183 HydrophobicContact CG2-CE1 3.47Å; V121-F183 VanDerWaalsContact CG2-CE1 3.47Å; V121-F183 HydrophobicContact CG2-CZ 3.75Å; V167-F183 HydrophobicContact CG2-CE2 4.14Å; V167-F183 HydrophobicContact CG2-CZ 4.27Å; S181-F183 VanDerWaalsContact C-N 3.29Å; S181-F183 PolarHBondContact O-N 3.47Å; F183-F185 HydrophobicContact CB-CE2 4.18Å; F183-F185 HydrophobicContact CB-CZ 4.16Å; F183-F185 HydrophobicContact CD2-CZ 4.47Å
184S85.3Confident88.1Confident75 Ų7541.9 Ų41.952%0.52423%0.228SC..EExtended strand (participates in β ladder)trans-110118.3171.263.90000109.4
185F82.8Confident87.8Confident43 Ų4347.4 Ų47.419%0.18926%0.257CS..EExtended strand (participates in β ladder)trans-104.5142.8176-66.5-57.7000110.1N34 Q39 V107 A109 F183N34-F185 HydrophobicContact CB-CD1 4.27Å; N34-F185 HydrophobicContact CB-CD2 3.98Å; N34-F185 HydrophobicContact CB-CE2 4.24Å; N34-F185 HydrophobicContact CB-CG 4.02Å; Q39-F185 PolarHBondContact NE2-O 3.5Å; V107-F185 PolarHBondContact N-O 3.48Å; V107-F185 PolarHBondContact O-N 2.92Å; A109-F185 HydrophobicContact CB-CD2 3.46Å; A109-F185 VanDerWaalsContact CB-CD2 3.46Å; A109-F185 HydrophobicContact CB-CE2 3.93Å; A109-F185 HydrophobicContact CB-CG 4.49Å; F183-F185 HydrophobicContact CB-CE2 4.18Å; F183-F185 HydrophobicContact CB-CZ 4.16Å; F183-F185 HydrophobicContact CD2-CZ 4.47Å
186G83.9Confident87.5Confident7 Ų747.7 Ų47.77%0.07226%0.261CS..  trans-161.4-174-179.500000109.9I188G186-I188 PolarHBondContact O-N 2.91Å
187L87.3Confident87.3Confident3 Ų345.8 Ų45.82%0.01625%0.254CS..  trans-72.6116.2170.6-71.9176.7000109.2V30 A32 V35 M40 I43 L102V30-L187 HydrophobicContact CB-CB 4.21Å; V30-L187 HydrophobicContact CB-CD2 4.25Å; V30-L187 HydrophobicContact CG1-CB 4.33Å; V30-L187 HydrophobicContact CG2-CD1 4.31Å; V30-L187 HydrophobicContact CG2-CD2 4.08Å; A32-L187 HydrophobicContact CB-CD2 3.82Å; V35-L187 HydrophobicContact CG2-CD2 4.48Å; M40-L187 HydrophobicContact SD-CD1 4.49Å; M40-L187 HydrophobicContact SD-CD2 3.99Å; M40-L187 HydrophobicContact SD-CG 4.43Å; I43-L187 HydrophobicContact CD1-CD1 4.19Å; I43-L187 HydrophobicContact CD1-CG 4.09Å; I43-L187 HydrophobicContact CG2-CD1 3.85Å; L102-L187 HydrophobicContact CD2-CB 4.2Å; L102-L187 HydrophobicContact CD2-CD1 3.76Å
188I88.7Confident87.3Confident111 Ų11143.8 Ų43.857%0.56925%0.246SC*.EExtended strand (participates in β ladder)trans-89.3116.7177.2-60.5174.6000107.6V30 G31 G186 Q190V30-I188 CarbonylContact C-O 3.53Å; V30-I188 WeakPolarHBondContact CA-O 3.48Å; G31-I188 PolarHBondContact N-O 3.21Å; G31-I188 PolarHBondContact O-N 3.48Å; G31-I188 VanDerWaalsContact O-N 3.09Å; G186-I188 PolarHBondContact O-N 2.91Å; I188-Q190 PolarHBondContact O-N 3.45Å
189I90.7Very high87.3Confident12 Ų1246.4 Ų46.46%0.06225%0.254CS..EExtended strand (participates in β ladder)trans-68.6115.9173.8-62.2164.1000107.9F28 V30 R99 L102 V192 P201F28-I189 HydrophobicContact CD1-CD1 3.94Å; F28-I189 HydrophobicContact CD1-CG1 4.11Å; F28-I189 HydrophobicContact CD1-CG2 3.82Å; F28-I189 HydrophobicContact CE1-CD1 4.07Å; V30-I189 HydrophobicContact CG1-CG1 4.21Å; R99-I189 HydrophobicContact CB-CD1 3.95Å; R99-I189 HydrophobicContact CG-CD1 3.82Å; L102-I189 HydrophobicContact CD1-CD1 4.01Å; L102-I189 HydrophobicContact CD1-CG1 4.14Å; I189-V192 HydrophobicContact CG2-CG2 3.94Å; I189-P201 HydrophobicContact CB-CB 4.45Å; I189-P201 HydrophobicContact CG2-CB 4.1Å
190Q90.3Very high87.3Confident65 Ų6541.4 Ų41.430%0.30423%0.23SC..EExtended strand (participates in β ladder)trans-88.4-42.1178-68-176.2-11.500111.5I29 I188 P201I29-Q190 HydrophobicContact CG2-CB 4.28Å; I29-Q190 PolarHBondContact O-N 2.94Å; I188-Q190 PolarHBondContact O-N 3.45Å; Q190-P201 WeakPolarHBondContact O-CD 3.47Å
191Q90.8Very high87.1Confident38 Ų3840.7 Ų40.718%0.17823%0.229CC..EExtended strand (participates in β ladder)trans-151.8159.9177.3-65-67.8-72.600109.6I29 H81 V198 Y199I29-Q191 HydrophobicContact CB-CB 4.26Å; I29-Q191 HydrophobicContact CD1-CB 4.29Å; I29-Q191 HydrophobicContact CG1-CB 4.48Å; I29-Q191 PolarHBondContact N-O 2.9Å; I29-Q191 PolarHBondContact O-N 3.44Å; H81-Q191 HydrophobicContact CB-CG 4.2Å; H81-Q191 WeakPolarHBondContact ND1-CG 3.42Å; Q191-V198 HydrophobicContact CB-CG1 4.11Å; Q191-V198 HydrophobicContact CG-CG1 4.28Å; Q191-Y199 WeakPolarHBondContact CA-O 3.36Å; Q191-Y199 PolarHBondContact OE1-O 3.01Å
192V91.6Very high87Confident0 Ų044.7 Ų44.70%024%0.241CC..EExtended strand (participates in β ladder)trans-119.8141.6176.4-165.20000108.8F28 L95 I189 V198 Y199 L204F28-V192 HydrophobicContact CD1-CB 4.41Å; F28-V192 HydrophobicContact CD1-CG1 3.95Å; F28-V192 HydrophobicContact CD1-CG2 3.94Å; F28-V192 HydrophobicContact CE1-CB 4.5Å; F28-V192 HydrophobicContact CE1-CG1 3.77Å; F28-V192 HydrophobicContact CE1-CG2 3.98Å; F28-V192 HydrophobicContact CZ-CG1 4.36Å; L95-V192 HydrophobicContact CD1-CG1 3.94Å; L95-V192 HydrophobicContact CD2-CG1 3.76Å; L95-V192 HydrophobicContact CG-CG1 4.35Å; I189-V192 HydrophobicContact CG2-CG2 3.94Å; V192-V198 CarbonylContact O-C 3.56Å; V192-V198 VanDerWaalsContact O-CA 3.3Å; V192-V198 WeakPolarHBondContact O-CA 3.24Å; V192-Y199 PolarHBondContact N-O 3.24Å; V192-Y199 PolarHBondContact O-N 3.42Å; V192-L204 HydrophobicContact CG1-CD1 4.41Å; V192-L204 HydrophobicContact CG2-CD1 3.82Å; V192-L204 HydrophobicContact CG2-CG 4.49Å
193Y89.6Confident87Confident10 Ų1045.8 Ų45.84%0.03925%0.247CC..EExtended strand (participates in β ladder)trans-119.9132.4173.6179.2-104000110.1K26 C27 N72 L75 L78 G196 S197 V198K26-Y193 WeakPolarHBondContact CA-O 3.34Å; C27-Y193 PolarHBondContact N-O 3.33Å; C27-Y193 WeakPolarHBondContact O-CB 3.22Å; C27-Y193 PolarHBondContact O-N 3.06Å; N72-Y193 PolarHBondContact ND2-OH 2.86Å; L75-Y193 HydrophobicContact CD2-CE1 4.11Å; L75-Y193 HydrophobicContact CD2-CE2 4.47Å; L75-Y193 WeakPolarHBondContact CD2-OH 3.29Å; L78-Y193 HydrophobicContact CD1-CD2 4.16Å; L78-Y193 HydrophobicContact CD1-CE2 4.3Å; L78-Y193 HydrophobicContact CD1-CG 4.28Å; L78-Y193 HydrophobicContact CD2-CD2 3.67Å; L78-Y193 HydrophobicContact CD2-CE2 4.43Å; L78-Y193 HydrophobicContact CD2-CG 3.93Å; L78-Y193 HydrophobicContact CG-CD2 4.1Å; L78-Y193 HydrophobicContact CG-CE2 4.39Å; Y193-G196 VanDerWaalsContact CE2-CA 3.5Å; Y193-G196 WeakPolarHBondContact OH-CA 3.26Å; Y193-G196 PolarHBondContact OH-N 3.05Å; Y193-S197 WeakPolarHBondContact CA-O 3.28Å; Y193-S197 VanDerWaalsContact CD2-O 3.25Å; Y193-S197 WeakPolarHBondContact CD2-O 3.27Å; Y193-V198 HydrophobicContact CD2-CG2 3.91Å
194D88.7Confident86.7Confident36 Ų3647.2 Ų47.219%0.19326%0.255CS..EExtended strand (participates in β ladder)trans-143.8117.9174.3-165.8-15.5000108.7K26 L95 G196 S197 Y199K26-D194 HydrophobicContact CG-CB 4.41Å; L95-D194 HydrophobicContact CD1-CB 4.25Å; D194-G196 PolarHBondContact O-N 2.87Å; D194-S197 PolarHBondContact N-O 3.44Å; D194-S197 VanDerWaalsContact N-O 3.09Å; D194-S197 PolarHBondContact O-N 2.9Å; D194-Y199 HydrophobicContact CB-CE2 4.22Å
195N83.1Confident86.6Confident120 Ų12047.8 Ų47.864%0.64225%0.252SS*.THydrogen-bonded Turntrans45.438171.1-73.2-70.1000115.7P25P25-N195 PolarHBondContact O-N 3.1Å
196G82.1Confident86.6Confident7 Ų749.9 Ų49.97%0.07226%0.264CS..THydrogen-bonded Turntrans96.5-1.5177.300000115.8K77 Y193 D194K77-G196 WeakPolarHBondContact CD-O 3.41Å; K77-G196 WeakPolarHBondContact CE-O 3.39Å; K77-G196 PolarHBondContact NZ-O 3.31Å; Y193-G196 VanDerWaalsContact CE2-CA 3.5Å; Y193-G196 WeakPolarHBondContact OH-CA 3.26Å; Y193-G196 PolarHBondContact OH-N 3.05Å; D194-G196 PolarHBondContact O-N 2.87Å
197S86.3Confident86.7Confident42 Ų4253.6 Ų53.629%0.29429%0.286SS..EExtended strand (participates in β ladder)trans-100.2149.1168.4-75.20000111.2Y193 D194 Y199Y193-S197 WeakPolarHBondContact CA-O 3.28Å; Y193-S197 VanDerWaalsContact CD2-O 3.25Å; Y193-S197 WeakPolarHBondContact CD2-O 3.27Å; D194-S197 PolarHBondContact N-O 3.44Å; D194-S197 VanDerWaalsContact N-O 3.09Å; D194-S197 PolarHBondContact O-N 2.9Å; S197-Y199 VanDerWaalsContact CB-OH 3.24Å; S197-Y199 WeakPolarHBondContact CB-OH 3.2Å
198V87.3Confident86.6Confident34 Ų3460.3 Ų60.321%0.20632%0.317CS..EExtended strand (participates in β ladder)trans-121.6130.4174.61780000108.1K77 L78 Q191 V192 Y193K77-V198 HydrophobicContact CB-CB 4.5Å; K77-V198 HydrophobicContact CB-CG2 3.62Å; K77-V198 HydrophobicContact CD-CG2 4.44Å; L78-V198 HydrophobicContact CD2-CG2 3.74Å; Q191-V198 HydrophobicContact CB-CG1 4.11Å; Q191-V198 HydrophobicContact CG-CG1 4.28Å; V192-V198 CarbonylContact O-C 3.56Å; V192-V198 VanDerWaalsContact O-CA 3.3Å; V192-V198 WeakPolarHBondContact O-CA 3.24Å; Y193-V198 HydrophobicContact CD2-CG2 3.91Å
199Y87.5Confident86.7Confident88 Ų8858.1 Ų58.135%0.34532%0.316SS..EExtended strand (participates in β ladder)trans-126.3147.4-175.7-52.5-67.1000111.6Q191 V192 D194 S197 V203Q191-Y199 WeakPolarHBondContact CA-O 3.36Å; Q191-Y199 PolarHBondContact OE1-O 3.01Å; V192-Y199 PolarHBondContact N-O 3.24Å; V192-Y199 PolarHBondContact O-N 3.42Å; D194-Y199 HydrophobicContact CB-CE2 4.22Å; S197-Y199 VanDerWaalsContact CB-OH 3.24Å; S197-Y199 WeakPolarHBondContact CB-OH 3.2Å; Y199-V203 HydrophobicContact CD1-CG1 4.32Å
200S87.5Confident86.6Confident35 Ų3559.1 Ų59.125%0.24532%0.323CS..  trans-68.2152.9162.665.70000109.9E202 V203S200-E202 PolarHBondContact O-N 3.13Å; S200-E202 VanDerWaalsContact O-N 3.12Å; S200-E202 PolarHBondContact OG-OE2 3.5Å; S200-E202 VanDerWaalsContact OG-OE2 3.08Å; S200-V203 PolarHBondContact O-N 3.49Å; S200-V203 VanDerWaalsContact O-N 3.15Å
201P85.5Confident86.6Confident32 Ų3260.7 Ų60.721%0.20833%0.333CS..G310 helixtrans-60.3-20.6178.225.1-36.3000113.7R99 I189 Q190 V203 L204R99-P201 PolarHBondContact NH2-O 3.37Å; I189-P201 HydrophobicContact CB-CB 4.45Å; I189-P201 HydrophobicContact CG2-CB 4.1Å; Q190-P201 WeakPolarHBondContact O-CD 3.47Å; P201-V203 VanDerWaalsContact C-N 3.29Å; P201-V203 PolarHBondContact O-N 2.65Å; P201-L204 PolarHBondContact O-N 3.29Å
202E86.2Confident86.7Confident137 Ų13764 Ų6464%0.6435%0.348SS*.G310 helixtrans-66.9-26.8178-58.3156.4156.400112.6S200 L204 D205S200-E202 PolarHBondContact O-N 3.13Å; S200-E202 VanDerWaalsContact O-N 3.12Å; S200-E202 PolarHBondContact OG-OE2 3.5Å; S200-E202 VanDerWaalsContact OG-OE2 3.08Å; E202-L204 PolarHBondContact O-N 2.89Å; E202-D205 WeakPolarHBondContact O-CB 3.47Å; E202-D205 PolarHBondContact O-N 2.92Å
203V85.6Confident86.8Confident61 Ų6168.2 Ų68.237%0.3737%0.374SS..G310 helixtrans-65.2-26.4176-176.70000110.9Y199 S200 P201 D205 I206Y199-V203 HydrophobicContact CD1-CG1 4.32Å; S200-V203 PolarHBondContact O-N 3.49Å; S200-V203 VanDerWaalsContact O-N 3.15Å; P201-V203 VanDerWaalsContact C-N 3.29Å; P201-V203 PolarHBondContact O-N 2.65Å; V203-D205 VanDerWaalsContact C-N 3.33Å; V203-I206 HydrophobicContact CG1-CD1 4.33Å; V203-I206 WeakPolarHBondContact O-CG1 3.49Å
204L81Confident87Confident35 Ų3575.8 Ų75.818%0.18340%0.403CS..G310 helixtrans-82.4-5.5174.6-59.9-178.9000113.7F28 L95 V192 P201 E202 I206F28-L204 HydrophobicContact CE1-CD1 4.16Å; L95-L204 HydrophobicContact CB-CD1 3.96Å; L95-L204 HydrophobicContact CB-CD2 3.94Å; L95-L204 HydrophobicContact CD1-CD2 4.21Å; V192-L204 HydrophobicContact CG1-CD1 4.41Å; V192-L204 HydrophobicContact CG2-CD1 3.82Å; V192-L204 HydrophobicContact CG2-CG 4.49Å; P201-L204 PolarHBondContact O-N 3.29Å; E202-L204 PolarHBondContact O-N 2.89Å; L204-I206 VanDerWaalsContact C-N 3.34Å
205D82.1Confident87.3Confident87 Ų8781 Ų8147%0.46542%0.424SS..G310 helixtrans-88.1-1.9171.7-66.5-59.3000112.9R99 E202 V203 T207R99-D205 IonicContact CZ-OD1 2.75Å; R99-D205 IonicContact CZ-OD2 2.71Å; R99-D205 IonicContact NH1-OD1 3.7Å; R99-D205 PolarHBondContact NH1-OD1 3.2Å; R99-D205 IonicContact NH2-OD1 2.74Å; R99-D205 PolarHBondContact NH2-OD1 2.92Å; R99-D205 IonicContact NH2-OD2 2.67Å; R99-D205 PolarHBondContact NH2-OD2 2.79Å; E202-D205 WeakPolarHBondContact O-CB 3.47Å; E202-D205 PolarHBondContact O-N 2.92Å; V203-D205 VanDerWaalsContact C-N 3.33Å; D205-T207 PolarHBondContact O-N 3.31Å
206I82.9Confident87.7Confident88 Ų8879.6 Ų79.645%0.45142%0.416SS..  trans-74.792.5178-57176.7000109.2V203 L204 L211V203-I206 HydrophobicContact CG1-CD1 4.33Å; V203-I206 WeakPolarHBondContact O-CG1 3.49Å; L204-I206 VanDerWaalsContact C-N 3.34Å; I206-L211 HydrophobicContact CG2-CD2 3.82Å; I206-L211 HydrophobicContact CG2-CG 4.15Å
207T85.4Confident88.3Confident85 Ų8584.6 Ų84.652%0.52144%0.438SS..  trans-71.3149.8177.9630000111.9D205 A209 S210 L211D205-T207 PolarHBondContact O-N 3.31Å; T207-A209 PolarHBondContact O-N 3.25Å; T207-S210 WeakPolarHBondContact O-CA 3.36Å; T207-S210 WeakPolarHBondContact O-CB 3.32Å; T207-S210 PolarHBondContact O-N 3.03Å; T207-S210 PolarHBondContact O-OG 3.41Å; T207-S210 PolarHBondContact OG1-N 3.26Å; T207-L211 PolarHBondContact O-N 3.15Å
208E86.3Confident88.6Confident144 Ų14484 Ų8467%0.67344%0.438SS*.Hα-helixtrans-58.2-34177-172.5171.6-148.200112.4S210 L211 H212E208-S210 VanDerWaalsContact C-N 3.27Å; E208-S210 PolarHBondContact O-N 2.93Å; E208-L211 WeakPolarHBondContact O-CA 3.3Å; E208-L211 WeakPolarHBondContact O-CB 3.25Å; E208-L211 PolarHBondContact O-N 3.18Å; E208-H212 PolarHBondContact O-CD2 3.44Å; E208-H212 PolarHBondContact O-N 3.06Å
209A89.4Confident88.8Confident65 Ų6585.1 Ų85.154%0.53745%0.445SS..Hα-helixtrans-59.3-34.4171.800000113.3T207 L211 T213T207-A209 PolarHBondContact O-N 3.25Å; A209-L211 VanDerWaalsContact C-N 3.31Å; A209-T213 WeakPolarHBondContact O-CB 3.5Å; A209-T213 WeakPolarHBondContact O-CG2 3.46Å; A209-T213 PolarHBondContact O-N 3.21Å; A209-T213 PolarHBondContact O-OG1 3Å
210S88.8Confident88.8Confident32 Ų3289.5 Ų89.522%0.22446%0.461CS..Hα-helixtrans-71.9-25.6174.680.40000112.8T207 E208 T213 R214T207-S210 WeakPolarHBondContact O-CA 3.36Å; T207-S210 WeakPolarHBondContact O-CB 3.32Å; T207-S210 PolarHBondContact O-N 3.03Å; T207-S210 PolarHBondContact O-OG 3.41Å; T207-S210 PolarHBondContact OG1-N 3.26Å; E208-S210 VanDerWaalsContact C-N 3.27Å; E208-S210 PolarHBondContact O-N 2.93Å; S210-T213 WeakPolarHBondContact CA-OG1 3.4Å; S210-T213 PolarHBondContact O-OG1 3.28Å; S210-R214 WeakPolarHBondContact O-CD 3.39Å; S210-R214 VanDerWaalsContact O-CG 3.31Å; S210-R214 WeakPolarHBondContact O-CG 2.99Å
211L90.7Very high89Confident98 Ų9892 Ų9251%0.51347%0.472SS..Hα-helixtrans-78.7-46.3173.2-59178.9000110.9I206 T207 E208 A209 T213 R214 F215I206-L211 HydrophobicContact CG2-CD2 3.82Å; I206-L211 HydrophobicContact CG2-CG 4.15Å; T207-L211 PolarHBondContact O-N 3.15Å; E208-L211 WeakPolarHBondContact O-CA 3.3Å; E208-L211 WeakPolarHBondContact O-CB 3.25Å; E208-L211 PolarHBondContact O-N 3.18Å; A209-L211 VanDerWaalsContact C-N 3.31Å; L211-T213 PolarHBondContact O-N 3.18Å; L211-R214 PolarHBondContact O-N 3.13Å; L211-F215 VanDerWaalsContact O-CB 3.31Å; L211-F215 WeakPolarHBondContact O-CB 3.36Å; L211-F215 PolarHBondContact O-N 3.39Å
212H93.2Very high89.2Confident107 Ų10795.5 Ų95.550%0.49549%0.488SS..Hα-helixtrans-58.6-44.7176.1-79.3-58.3000112.8E208 F215 L216E208-H212 PolarHBondContact O-CD2 3.44Å; E208-H212 PolarHBondContact O-N 3.06Å; H212-F215 PolarHBondContact O-N 2.88Å; H212-L216 WeakPolarHBondContact O-CB 3.38Å; H212-L216 VanDerWaalsContact O-CG 3.29Å; H212-L216 WeakPolarHBondContact O-CG 3.26Å; H212-L216 PolarHBondContact O-N 2.9Å
213T94.5Very high89.3Confident89 Ų8989.4 Ų89.455%0.54646%0.461SS..Hα-helixtrans-62-47.1179.144.80000111.9A209 S210 L211 F215 L216 E217A209-T213 WeakPolarHBondContact O-CB 3.5Å; A209-T213 WeakPolarHBondContact O-CG2 3.46Å; A209-T213 PolarHBondContact O-N 3.21Å; A209-T213 PolarHBondContact O-OG1 3Å; S210-T213 WeakPolarHBondContact CA-OG1 3.4Å; S210-T213 PolarHBondContact O-OG1 3.28Å; L211-T213 PolarHBondContact O-N 3.18Å; T213-F215 PolarHBondContact O-N 3.49Å; T213-L216 PolarHBondContact O-N 2.85Å; T213-E217 WeakPolarHBondContact O-CB 3.43Å; T213-E217 PolarHBondContact O-N 3.18Å
214R93.2Very high89.3Confident170 Ų17088.7 Ų88.764%0.64246%0.459SS*.Hα-helixtrans-64.5-36.6174.7-70.8175.3177.4179.41.1113.3S210 L211 E217 G218S210-R214 WeakPolarHBondContact O-CD 3.39Å; S210-R214 VanDerWaalsContact O-CG 3.31Å; S210-R214 WeakPolarHBondContact O-CG 2.99Å; L211-R214 PolarHBondContact O-N 3.13Å; R214-E217 PolarHBondContact O-N 2.87Å; R214-G218 PolarHBondContact O-N 3.04Å
215F94.4Very high89.8Confident144 Ų14490.7 Ų90.763%0.63247%0.472SS*.Hα-helixtrans-65.6-45.9175.5-179-96.9000111.5L211 H212 T213 E217 G218 V219L211-F215 VanDerWaalsContact O-CB 3.31Å; L211-F215 WeakPolarHBondContact O-CB 3.36Å; L211-F215 PolarHBondContact O-N 3.39Å; H212-F215 PolarHBondContact O-N 2.88Å; T213-F215 PolarHBondContact O-N 3.49Å; F215-E217 VanDerWaalsContact C-N 3.32Å; F215-E217 PolarHBondContact O-N 3.47Å; F215-G218 PolarHBondContact O-N 2.76Å; F215-V219 HydrophobicContact CD1-CG2 4.24Å; F215-V219 HydrophobicContact CE1-CG2 3.84Å; F215-V219 HydrophobicContact CZ-CG2 4.06Å; F215-V219 WeakPolarHBondContact O-CG2 3.45Å; F215-V219 PolarHBondContact O-N 3.02Å
216L91.9Very high90.1Very high91 Ų9187.4 Ų87.448%0.47646%0.456SS..Hα-helixtrans-64.6-34.9175.6-70.4172.6000112.3H212 T213 V219 R220H212-L216 WeakPolarHBondContact O-CB 3.38Å; H212-L216 VanDerWaalsContact O-CG 3.29Å; H212-L216 WeakPolarHBondContact O-CG 3.26Å; H212-L216 PolarHBondContact O-N 2.9Å; T213-L216 PolarHBondContact O-N 2.85Å; L216-V219 PolarHBondContact O-N 2.92Å; L216-R220 WeakPolarHBondContact O-CB 3.49Å; L216-R220 WeakPolarHBondContact O-CD 3.06Å; L216-R220 WeakPolarHBondContact O-CG 3.18Å; L216-R220 PolarHBondContact O-N 3.08Å
217E94.6Very high90.3Very high112 Ų11285.6 Ų85.652%0.52345%0.446SS..Hα-helixtrans-62.5-47170.6-174.5177.7-170.300111.6T213 R214 F215 V219 R220 N221T213-E217 WeakPolarHBondContact O-CB 3.43Å; T213-E217 PolarHBondContact O-N 3.18Å; R214-E217 PolarHBondContact O-N 2.87Å; F215-E217 VanDerWaalsContact C-N 3.32Å; F215-E217 PolarHBondContact O-N 3.47Å; E217-V219 PolarHBondContact O-N 2.97Å; E217-R220 WeakPolarHBondContact O-CB 3.45Å; E217-R220 PolarHBondContact O-N 2.89Å; E217-N221 WeakPolarHBondContact O-CB 3.5Å; E217-N221 PolarHBondContact O-N 3.39Å; E217-N221 PolarHBondContact O-ND2 3.29Å
218G92.9Very high90.3Very high30 Ų3089.5 Ų89.531%0.30946%0.459SS..Hα-helixtrans-57.7-45.2173.400000113.2R214 F215 R220 N221 I222R214-G218 PolarHBondContact O-N 3.04Å; F215-G218 PolarHBondContact O-N 2.76Å; G218-R220 PolarHBondContact O-N 2.81Å; G218-N221 PolarHBondContact O-N 3.33Å; G218-I222 WeakPolarHBondContact O-CG1 3.14Å; G218-I222 PolarHBondContact O-N 2.89Å
219V90.3Very high90.4Very high58 Ų5888.7 Ų88.735%0.35246%0.458SS..Hα-helixtrans-63.2-40.5175.8172.20000111.7F215 L216 E217 I222 A223F215-V219 HydrophobicContact CD1-CG2 4.24Å; F215-V219 HydrophobicContact CE1-CG2 3.84Å; F215-V219 HydrophobicContact CZ-CG2 4.06Å; F215-V219 WeakPolarHBondContact O-CG2 3.45Å; F215-V219 PolarHBondContact O-N 3.02Å; L216-V219 PolarHBondContact O-N 2.92Å; E217-V219 PolarHBondContact O-N 2.97Å; V219-I222 PolarHBondContact O-N 2.83Å; V219-A223 WeakPolarHBondContact O-CB 3.5Å; V219-A223 PolarHBondContact O-N 3.26Å
220R89.3Confident90.1Very high179 Ų17988.2 Ų88.268%0.67546%0.459SS*.Hα-helixtrans-63.1-43.3175.2-75.1165-179.1-179.90.7111.9L216 E217 G218 A223 S224L216-R220 WeakPolarHBondContact O-CB 3.49Å; L216-R220 WeakPolarHBondContact O-CD 3.06Å; L216-R220 WeakPolarHBondContact O-CG 3.18Å; L216-R220 PolarHBondContact O-N 3.08Å; E217-R220 WeakPolarHBondContact O-CB 3.45Å; E217-R220 PolarHBondContact O-N 2.89Å; G218-R220 PolarHBondContact O-N 2.81Å; R220-A223 PolarHBondContact O-N 2.94Å; R220-S224 PolarHBondContact O-N 2.93Å; R220-S224 PolarHBondContact O-OG 3.48Å
221N91.3Very high89.9Confident89 Ų8994.1 Ų94.148%0.47648%0.478SS..Hα-helixtrans-67.7-36.3179.6-66.5-16.1000112.1E217 G218 S224 V225E217-N221 WeakPolarHBondContact O-CB 3.5Å; E217-N221 PolarHBondContact O-N 3.39Å; E217-N221 PolarHBondContact O-ND2 3.29Å; G218-N221 PolarHBondContact O-N 3.33Å; N221-S224 PolarHBondContact O-OG 3.35Å; N221-S224 VanDerWaalsContact O-OG 3.06Å; N221-V225 VanDerWaalsContact O-CG2 3.31Å; N221-V225 WeakPolarHBondContact O-CG2 3.29Å; N221-V225 PolarHBondContact O-N 3.3Å
222I89.5Confident89.6Confident105 Ų10593.7 Ų93.754%0.53848%0.481SS..Hα-helixtrans-67.4-42171.2-67.7166.5000110.5G218 V219 C226G218-I222 WeakPolarHBondContact O-CG1 3.14Å; G218-I222 PolarHBondContact O-N 2.89Å; V219-I222 PolarHBondContact O-N 2.83Å; I222-C226 WeakPolarHBondContact O-CB 3.5Å; I222-C226 PolarHBondContact O-N 3.49Å; I222-C226 PolarHBondContact O-SG 3.01Å
223A87.1Confident89.2Confident9 Ų990.4 Ų90.47%0.07447%0.468CS..Hα-helixtrans-64.7-43.2179.600000112.6V219 R220 C226 L227 A235V219-A223 WeakPolarHBondContact O-CB 3.5Å; V219-A223 PolarHBondContact O-N 3.26Å; R220-A223 PolarHBondContact O-N 2.94Å; A223-C226 PolarHBondContact O-N 3.31Å; A223-L227 WeakPolarHBondContact O-CB 3.46Å; A223-L227 WeakPolarHBondContact O-CD1 3.23Å; A223-L227 WeakPolarHBondContact O-CG 3.46Å; A223-L227 PolarHBondContact O-N 3.46Å; A223-A235 HydrophobicContact CB-CB 4.39Å
224S87.4Confident88.6Confident46 Ų4694.3 Ų94.332%0.32249%0.485SS..Hα-helixtrans-63.4-47.8176.755.90000112R220 N221 C226 L227 E228R220-S224 PolarHBondContact O-N 2.93Å; R220-S224 PolarHBondContact O-OG 3.48Å; N221-S224 PolarHBondContact O-OG 3.35Å; N221-S224 VanDerWaalsContact O-OG 3.06Å; S224-C226 VanDerWaalsContact C-N 3.34Å; S224-C226 PolarHBondContact O-N 3.09Å; S224-L227 WeakPolarHBondContact O-CB 3.49Å; S224-L227 PolarHBondContact O-N 3.19Å; S224-E228 PolarHBondContact O-N 2.93Å
225V90.9Very high87.9Confident76 Ų7687.8 Ų87.846%0.46147%0.468SS..Hα-helixtrans-60.8-41.8177.4171.60000111.6N221 L227 E228 I229N221-V225 VanDerWaalsContact O-CG2 3.31Å; N221-V225 WeakPolarHBondContact O-CG2 3.29Å; N221-V225 PolarHBondContact O-N 3.3Å; V225-L227 VanDerWaalsContact C-N 3.31Å; V225-L227 PolarHBondContact O-N 3.38Å; V225-E228 PolarHBondContact O-N 2.86Å; V225-I229 HydrophobicContact CG1-CD1 3.66Å; V225-I229 HydrophobicContact CG1-CG1 4.48Å; V225-I229 WeakPolarHBondContact O-CB 3.19Å; V225-I229 VanDerWaalsContact O-CG1 3.29Å; V225-I229 WeakPolarHBondContact O-CG1 3.39Å; V225-I229 PolarHBondContact O-N 2.94Å
226C87.9Confident87.4Confident19 Ų1981 Ų8113%0.12844%0.438CS..Hα-helixtrans-65-33.1175-67.70000112.9I222 A223 S224 G230 Y231 T233I222-C226 WeakPolarHBondContact O-CB 3.5Å; I222-C226 PolarHBondContact O-N 3.49Å; I222-C226 PolarHBondContact O-SG 3.01Å; A223-C226 PolarHBondContact O-N 3.31Å; S224-C226 VanDerWaalsContact C-N 3.34Å; S224-C226 PolarHBondContact O-N 3.09Å; C226-G230 CarbonylContact O-C 3.6Å; C226-G230 PolarHBondContact O-N 3.29Å; C226-G230 VanDerWaalsContact O-N 3.08Å; C226-Y231 PolarHBondContact O-N 3Å; C226-T233 HydrophobicContact CB-CG2 4.31Å; C226-T233 VanDerWaalsContact SG-CG2 3.57Å
227L86.6Confident87.1Confident49 Ų4979.9 Ų79.926%0.25744%0.435SS..Hα-helixtrans-71.9-40176.9-75.3162.5000112.6A223 S224 V225 G230 H239 S240A223-L227 WeakPolarHBondContact O-CB 3.46Å; A223-L227 WeakPolarHBondContact O-CD1 3.23Å; A223-L227 WeakPolarHBondContact O-CG 3.46Å; A223-L227 PolarHBondContact O-N 3.46Å; S224-L227 WeakPolarHBondContact O-CB 3.49Å; S224-L227 PolarHBondContact O-N 3.19Å; V225-L227 VanDerWaalsContact C-N 3.31Å; V225-L227 PolarHBondContact O-N 3.38Å; L227-G230 PolarHBondContact O-N 2.83Å; L227-H239 HydrophobicContact CD1-CB 3.68Å; L227-H239 HydrophobicContact CD2-CB 3.8Å; L227-H239 HydrophobicContact CG-CB 4.27Å; L227-S240 VanDerWaalsContact CD2-OG 3.29Å; L227-S240 WeakPolarHBondContact CD2-OG 3.44Å
228E86.6Confident86.5Confident168 Ų16877.7 Ų77.779%0.78543%0.43SS*.Hα-helixtrans-69.3-40.7177.8-72.3177.5-177.700112.2S224 V225 G230S224-E228 PolarHBondContact O-N 2.93Å; V225-E228 PolarHBondContact O-N 2.86Å; E228-G230 PolarHBondContact O-N 2.79Å
229I88.4Confident86.1Confident126 Ų12680.7 Ų80.765%0.64644%0.436SS*.Hα-helixtrans-72.4-18.2174.3-62.8171.7000111.4V225 Y231V225-I229 HydrophobicContact CG1-CD1 3.66Å; V225-I229 HydrophobicContact CG1-CG1 4.48Å; V225-I229 WeakPolarHBondContact O-CB 3.19Å; V225-I229 VanDerWaalsContact O-CG1 3.29Å; V225-I229 WeakPolarHBondContact O-CG1 3.39Å; V225-I229 PolarHBondContact O-N 2.94Å; I229-Y231 VanDerWaalsContact C-N 3.26Å; I229-Y231 PolarHBondContact O-N 2.99Å
230G82.6Confident85.9Confident55 Ų5580.3 Ų80.357%0.56744%0.436SS*.THydrogen-bonded Turntrans72.416.3-175.500000114C226 L227 E228C226-G230 CarbonylContact O-C 3.6Å; C226-G230 PolarHBondContact O-N 3.29Å; C226-G230 VanDerWaalsContact O-N 3.08Å; L227-G230 PolarHBondContact O-N 2.83Å; E228-G230 PolarHBondContact O-N 2.79Å
231Y84.8Confident85.7Confident156 Ų15676.8 Ų76.861%0.61243%0.434SS*.  trans-85.1122.8-177.3-165-96.4000111.1C226 I229 T233 S236C226-Y231 PolarHBondContact O-N 3Å; I229-Y231 VanDerWaalsContact C-N 3.26Å; I229-Y231 PolarHBondContact O-N 2.99Å; Y231-T233 HydrophobicContact CD1-CG2 3.84Å; Y231-T233 HydrophobicContact CE1-CG2 4.31Å; Y231-T233 PolarHBondContact O-N 2.87Å; Y231-S236 PolarHBondContact O-OG 2.86Å
232P84.2Confident85.5Confident89 Ų8976.5 Ų76.558%0.57843%0.431SS*.  trans-76108.2-177.229.6-33.4000111.3V237P232-V237 HydrophobicContact CB-CG2 3.67Å
233T85.1Confident85.3Confident39 Ų3974.4 Ų74.424%0.23942%0.422CS..  trans-114.2163.2167.167.80000109.4C226 Y231 A235 S236 V237C226-T233 HydrophobicContact CB-CG2 4.31Å; C226-T233 VanDerWaalsContact SG-CG2 3.57Å; Y231-T233 HydrophobicContact CD1-CG2 3.84Å; Y231-T233 HydrophobicContact CE1-CG2 4.31Å; Y231-T233 PolarHBondContact O-N 2.87Å; T233-A235 PolarHBondContact O-N 3.09Å; T233-A235 VanDerWaalsContact O-N 3.09Å; T233-S236 PolarHBondContact N-OG 3.07Å; T233-S236 PolarHBondContact O-N 3.07Å; T233-S236 PolarHBondContact O-OG 3.34Å; T233-S236 PolarHBondContact OG1-N 3.26Å; T233-S236 PolarHBondContact OG1-OG 3.39Å; T233-V237 WeakPolarHBondContact O-CG2 3.22Å; T233-V237 PolarHBondContact O-N 3.15Å
234L81.4Confident85.2Confident170 Ų17075.7 Ų75.789%0.8944%0.435SS*.THydrogen-bonded Turntrans-55.7-30.8179.5-167.2151.1000112.3P238L234-P238 WeakPolarHBondContact O-CD 3.45Å
235A78.5Confident85.1Confident34 Ų3477.7 Ų77.728%0.28144%0.436SS..THydrogen-bonded Turntrans-80.1-35.7174.700000114A223 T233 H239A223-A235 HydrophobicContact CB-CB 4.39Å; T233-A235 PolarHBondContact O-N 3.09Å; T233-A235 VanDerWaalsContact O-N 3.09Å; A235-H239 PolarHBondContact O-ND1 2.93Å
236S84.6Confident84.8Confident0 Ų080 Ų800%044%0.44CS..Hα-helixtrans-82.1-35.1-178.3690000113.4Y231 T233 H239 S240Y231-S236 PolarHBondContact O-OG 2.86Å; T233-S236 PolarHBondContact N-OG 3.07Å; T233-S236 PolarHBondContact O-N 3.07Å; T233-S236 PolarHBondContact O-OG 3.34Å; T233-S236 PolarHBondContact OG1-N 3.26Å; T233-S236 PolarHBondContact OG1-OG 3.39Å; S236-H239 CarbonylContact O-C 3.59Å; S236-H239 WeakPolarHBondContact O-CA 3.46Å; S236-H239 WeakPolarHBondContact O-CB 3.42Å; S236-H239 PolarHBondContact O-N 3.32Å; S236-S240 PolarHBondContact O-N 3.03Å; S236-S240 PolarHBondContact O-OG 2.67Å
237V84.4Confident84.6Confident68 Ų6888.4 Ų88.441%0.41247%0.469SS..Hα-helixtrans-52.2-48.2-173.7165.10000114.3P232 T233 H239 S240 V241P232-V237 HydrophobicContact CB-CG2 3.67Å; T233-V237 WeakPolarHBondContact O-CG2 3.22Å; T233-V237 PolarHBondContact O-N 3.15Å; V237-H239 VanDerWaalsContact C-N 3.32Å; V237-H239 PolarHBondContact O-N 3.03Å; V237-S240 PolarHBondContact O-N 3.46Å; V237-V241 WeakPolarHBondContact O-CG2 3.39Å; V237-V241 PolarHBondContact O-N 2.71Å; V237-V241 VanDerWaalsContact O-N 3.14Å
238P83.2Confident84.5Confident66 Ų6690.1 Ų90.143%0.42948%0.482SS..Hα-helixtrans-60.9-41.9177.2-22.934000112.4L234 V241 I242L234-P238 WeakPolarHBondContact O-CD 3.45Å; P238-V241 PolarHBondContact O-N 2.69Å; P238-I242 WeakPolarHBondContact O-CB 3.36Å; P238-I242 WeakPolarHBondContact O-CD1 3.35Å; P238-I242 VanDerWaalsContact O-CG1 3.31Å; P238-I242 WeakPolarHBondContact O-CG1 3.43Å; P238-I242 PolarHBondContact O-N 3.31Å
239H84.9Confident84.2Confident94 Ų9483 Ų8344%0.43545%0.449SS..Hα-helixtrans-68.5-37.1179.2-63.198.7000112.1L227 A235 S236 V237 I242 N243L227-H239 HydrophobicContact CD1-CB 3.68Å; L227-H239 HydrophobicContact CD2-CB 3.8Å; L227-H239 HydrophobicContact CG-CB 4.27Å; A235-H239 PolarHBondContact O-ND1 2.93Å; S236-H239 CarbonylContact O-C 3.59Å; S236-H239 WeakPolarHBondContact O-CA 3.46Å; S236-H239 WeakPolarHBondContact O-CB 3.42Å; S236-H239 PolarHBondContact O-N 3.32Å; V237-H239 VanDerWaalsContact C-N 3.32Å; V237-H239 PolarHBondContact O-N 3.03Å; H239-I242 PolarHBondContact O-N 2.85Å; H239-N243 VanDerWaalsContact O-CB 3.23Å; H239-N243 WeakPolarHBondContact O-CB 3.1Å; H239-N243 PolarHBondContact O-N 3.41Å; H239-N243 PolarHBondContact O-ND2 3.09Å
240S85.3Confident83.9Confident49 Ų4979.2 Ų79.234%0.34344%0.436SS..Hα-helixtrans-61.2-46.6174.7-64.20000111.7L227 S236 V237 N243 G244L227-S240 VanDerWaalsContact CD2-OG 3.29Å; L227-S240 WeakPolarHBondContact CD2-OG 3.44Å; S236-S240 PolarHBondContact O-N 3.03Å; S236-S240 PolarHBondContact O-OG 2.67Å; V237-S240 PolarHBondContact O-N 3.46Å; S240-N243 PolarHBondContact O-N 2.87Å; S240-G244 PolarHBondContact O-N 3.4Å
241V85.6Confident83.9Confident105 Ų10580.5 Ų80.564%0.63643%0.433SS*.Hα-helixtrans-64.9-46178.3175.80000110.9V237 P238 N243 G244 Y245V237-V241 WeakPolarHBondContact O-CG2 3.39Å; V237-V241 PolarHBondContact O-N 2.71Å; V237-V241 VanDerWaalsContact O-N 3.14Å; P238-V241 PolarHBondContact O-N 2.69Å; V241-N243 VanDerWaalsContact C-N 3.34Å; V241-N243 PolarHBondContact O-N 3.32Å; V241-G244 PolarHBondContact O-N 3.25Å; V241-Y245 WeakPolarHBondContact O-CB 3.27Å; V241-Y245 PolarHBondContact O-N 2.9Å
242I85.9Confident83.7Confident83 Ų8373.4 Ų73.443%0.42641%0.407SS..Hα-helixtrans-61.7-40.3176.8-71.6163.5000111.5P238 H239 Y245 K246P238-I242 WeakPolarHBondContact O-CB 3.36Å; P238-I242 WeakPolarHBondContact O-CD1 3.35Å; P238-I242 VanDerWaalsContact O-CG1 3.31Å; P238-I242 WeakPolarHBondContact O-CG1 3.43Å; P238-I242 PolarHBondContact O-N 3.31Å; H239-I242 PolarHBondContact O-N 2.85Å; I242-Y245 PolarHBondContact O-N 3.13Å; I242-K246 HydrophobicContact CG2-CD 4.15Å; I242-K246 HydrophobicContact CG2-CG 4.48Å; I242-K246 WeakPolarHBondContact O-CB 3.47Å; I242-K246 VanDerWaalsContact O-CG 3.31Å; I242-K246 WeakPolarHBondContact O-CG 3.27Å; I242-K246 PolarHBondContact O-N 2.89Å
243N86Confident83.4Confident62 Ų6271.7 Ų71.733%0.33240%0.395SS..Hα-helixtrans-72-35.9179.1-73-17.7000112.5H239 S240 V241 K246 R247H239-N243 VanDerWaalsContact O-CB 3.23Å; H239-N243 WeakPolarHBondContact O-CB 3.1Å; H239-N243 PolarHBondContact O-N 3.41Å; H239-N243 PolarHBondContact O-ND2 3.09Å; S240-N243 PolarHBondContact O-N 2.87Å; V241-N243 VanDerWaalsContact C-N 3.34Å; V241-N243 PolarHBondContact O-N 3.32Å; N243-K246 PolarHBondContact O-N 2.76Å; N243-R247 WeakPolarHBondContact O-CG 3.2Å; N243-R247 PolarHBondContact O-N 2.95Å
244G84.4Confident83.2Confident35 Ų3577.4 Ų77.436%0.36142%0.419SS..Hα-helixtrans-60.2-48.1169.400000111.7S240 V241 K246 R247 V248S240-G244 PolarHBondContact O-N 3.4Å; V241-G244 PolarHBondContact O-N 3.25Å; G244-K246 PolarHBondContact O-N 3.22Å; G244-R247 PolarHBondContact O-N 3.02Å; G244-V248 PolarHBondContact O-N 3.42Å; G244-V248 VanDerWaalsContact O-N 3.15Å
245Y84.8Confident83Confident89 Ų8973.6 Ų73.635%0.34940%0.402SS..Hα-helixtrans-60.9-43.3176.4-179.9-115.1000112.7V241 I242 R247 V248 L249 F259 L261V241-Y245 WeakPolarHBondContact O-CB 3.27Å; V241-Y245 PolarHBondContact O-N 2.9Å; I242-Y245 PolarHBondContact O-N 3.13Å; Y245-R247 PolarHBondContact O-N 3.39Å; Y245-V248 PolarHBondContact O-N 3.27Å; Y245-L249 HydrophobicContact CD1-CD1 3.84Å; Y245-L249 HydrophobicContact CD1-CG 4.49Å; Y245-L249 HydrophobicContact CE1-CD1 3.36Å; Y245-L249 HydrophobicContact CE1-CG 4.09Å; Y245-L249 HydrophobicContact CE2-CD1 4.33Å; Y245-L249 HydrophobicContact CE2-CD2 4.42Å; Y245-L249 HydrophobicContact CE2-CG 4.17Å; Y245-L249 HydrophobicContact CG-CD1 4.48Å; Y245-L249 WeakPolarHBondContact O-CG 3.07Å; Y245-L249 PolarHBondContact O-N 3.22Å; Y245-F259 HydrophobicContact CE2-CE2 4.36Å; Y245-F259 HydrophobicContact CE2-CZ 4.45Å; Y245-L261 HydrophobicContact CE2-CB 4.21Å; Y245-L261 HydrophobicContact CE2-CD1 4.09Å; Y245-L261 WeakPolarHBondContact OH-CB 3.41Å; Y245-L261 PolarHBondContact OH-O 3.17Å
246K85Confident82.7Confident124 Ų12478.5 Ų78.554%0.53942%0.424SS..Hα-helixtrans-59.3-39.6173.4-77.3173.5179177.40113.2I242 N243 G244 L249 A250I242-K246 HydrophobicContact CG2-CD 4.15Å; I242-K246 HydrophobicContact CG2-CG 4.48Å; I242-K246 WeakPolarHBondContact O-CB 3.47Å; I242-K246 VanDerWaalsContact O-CG 3.31Å; I242-K246 WeakPolarHBondContact O-CG 3.27Å; I242-K246 PolarHBondContact O-N 2.89Å; N243-K246 PolarHBondContact O-N 2.76Å; G244-K246 PolarHBondContact O-N 3.22Å; K246-L249 PolarHBondContact O-N 3.17Å; K246-A250 PolarHBondContact O-N 3.26Å
247R85.2Confident82.1Confident196 Ų19686.6 Ų86.674%0.7446%0.455SS*.Hα-helixtrans-65.3-42.1177.1-73.8173.5179.6178.70.7111.8N243 G244 Y245 A250 V251N243-R247 WeakPolarHBondContact O-CG 3.2Å; N243-R247 PolarHBondContact O-N 2.95Å; G244-R247 PolarHBondContact O-N 3.02Å; Y245-R247 PolarHBondContact O-N 3.39Å; R247-A250 PolarHBondContact O-N 3.33Å; R247-V251 PolarHBondContact O-N 3.18Å
248V83.8Confident81.2Confident85 Ų8586.7 Ų86.752%0.51546%0.459SS..Hα-helixtrans-66.1-40.4175.2176.90000111.3G244 Y245 A252 F259G244-V248 PolarHBondContact O-N 3.42Å; G244-V248 VanDerWaalsContact O-N 3.15Å; Y245-V248 PolarHBondContact O-N 3.27Å; V248-A252 WeakPolarHBondContact O-CB 3.46Å; V248-A252 PolarHBondContact O-N 3.23Å; V248-F259 HydrophobicContact CG1-CE1 4.2Å; V248-F259 HydrophobicContact CG1-CZ 4.14Å
249L80.6Confident80.8Confident18 Ų1885.9 Ų85.99%0.09445%0.449CS..Hα-helixtrans-61.1-44174-78.3174.4000112.8Y245 K246 V251 A252 V253 F259 A262 V265Y245-L249 HydrophobicContact CD1-CD1 3.84Å; Y245-L249 HydrophobicContact CD1-CG 4.49Å; Y245-L249 HydrophobicContact CE1-CD1 3.36Å; Y245-L249 HydrophobicContact CE1-CG 4.09Å; Y245-L249 HydrophobicContact CE2-CD1 4.33Å; Y245-L249 HydrophobicContact CE2-CD2 4.42Å; Y245-L249 HydrophobicContact CE2-CG 4.17Å; Y245-L249 HydrophobicContact CG-CD1 4.48Å; Y245-L249 WeakPolarHBondContact O-CG 3.07Å; Y245-L249 PolarHBondContact O-N 3.22Å; K246-L249 PolarHBondContact O-N 3.17Å; L249-V251 PolarHBondContact O-N 3.1Å; L249-A252 PolarHBondContact O-N 3.06Å; L249-V253 WeakPolarHBondContact O-CG2 3.41Å; L249-V253 PolarHBondContact O-N 3.06Å; L249-F259 HydrophobicContact CD2-CE1 4.46Å; L249-F259 HydrophobicContact CD2-CZ 3.96Å; L249-A262 HydrophobicContact CD2-CB 3.84Å; L249-V265 HydrophobicContact CD1-CG1 4.48Å; L249-V265 HydrophobicContact CD1-CG2 3.9Å; L249-V265 HydrophobicContact CD2-CB 4.18Å; L249-V265 HydrophobicContact CD2-CG2 3.96Å
250A81.9Confident80.2Confident47 Ų4785.7 Ų85.739%0.38846%0.456SS..Hα-helixtrans-57.7-50.2179.400000111.3K246 R247 A252 V253 E254K246-A250 PolarHBondContact O-N 3.26Å; R247-A250 PolarHBondContact O-N 3.33Å; A250-A252 VanDerWaalsContact C-N 3.33Å; A250-A252 PolarHBondContact O-N 3.38Å; A250-V253 PolarHBondContact O-N 3.32Å; A250-V253 VanDerWaalsContact O-N 3.14Å; A250-E254 WeakPolarHBondContact O-CG 3.49Å; A250-E254 PolarHBondContact O-N 3.38Å
251V82.6Confident79.3Confident82 Ų8287.7 Ų87.750%0.49746%0.463SS..Hα-helixtrans-60.1-41.7176.2177.30000111.6R247 L249 V253 E254 T255R247-V251 PolarHBondContact O-N 3.18Å; L249-V251 PolarHBondContact O-N 3.1Å; V251-V253 VanDerWaalsContact C-N 3.31Å; V251-V253 PolarHBondContact O-N 3.04Å; V251-E254 PolarHBondContact O-N 3.01Å; V251-T255 HydrophobicContact CG1-CG2 4.21Å; V251-T255 WeakPolarHBondContact O-CB 3.14Å; V251-T255 WeakPolarHBondContact O-CG2 3.25Å; V251-T255 PolarHBondContact O-N 2.89Å; V251-T255 PolarHBondContact O-OG1 3.26Å
252A80.6Confident78.3Confident7 Ų782.7 Ų82.76%0.05843%0.432CS..Hα-helixtrans-69.1-26.2178.400000113.5V248 L249 A250 D256 Y257 F259 A262 K266V248-A252 WeakPolarHBondContact O-CB 3.46Å; V248-A252 PolarHBondContact O-N 3.23Å; L249-A252 PolarHBondContact O-N 3.06Å; A250-A252 VanDerWaalsContact C-N 3.33Å; A250-A252 PolarHBondContact O-N 3.38Å; A252-D256 PolarHBondContact O-N 3.02Å; A252-Y257 PolarHBondContact O-N 3.05Å; A252-F259 HydrophobicContact CB-CD1 4.05Å; A252-F259 HydrophobicContact CB-CE1 3.66Å; A252-A262 HydrophobicContact CB-CB 4.3Å; A252-K266 VanDerWaalsContact O-CE 3.22Å; A252-K266 WeakPolarHBondContact O-CE 3.31Å; A252-K266 PolarHBondContact O-NZ 2.97Å
253V77.4Confident77.3Confident53 Ų5383.2 Ų83.232%0.32143%0.433SS..Hα-helixtrans-74.5-47.4170.81710000110.5L249 A250 V251 T255 D256 K266 L269L249-V253 WeakPolarHBondContact O-CG2 3.41Å; L249-V253 PolarHBondContact O-N 3.06Å; A250-V253 PolarHBondContact O-N 3.32Å; A250-V253 VanDerWaalsContact O-N 3.14Å; V251-V253 VanDerWaalsContact C-N 3.31Å; V251-V253 PolarHBondContact O-N 3.04Å; V253-T255 VanDerWaalsContact C-N 3.32Å; V253-T255 PolarHBondContact O-N 3.21Å; V253-D256 PolarHBondContact O-N 3.35Å; V253-K266 HydrophobicContact CG2-CG 4.26Å; V253-L269 HydrophobicContact CG1-CD1 4.42Å; V253-L269 HydrophobicContact CG2-CD1 4.11Å
254E80.4Confident76.4Confident159 Ų15986.8 Ų86.874%0.74345%0.446SS*.Hα-helixtrans-67.3-26.4-179.4-70.4173.5176.600114.3A250 V251A250-E254 WeakPolarHBondContact O-CG 3.49Å; A250-E254 PolarHBondContact O-N 3.38Å; V251-E254 PolarHBondContact O-N 3.01Å
255T78.6Confident75.5Confident90 Ų9087 Ų8755%0.55244%0.44SS*.THydrogen-bonded Turntrans-103.68.1-178.359.30000114V251 V253 Y257V251-T255 HydrophobicContact CG1-CG2 4.21Å; V251-T255 WeakPolarHBondContact O-CB 3.14Å; V251-T255 WeakPolarHBondContact O-CG2 3.25Å; V251-T255 PolarHBondContact O-N 2.89Å; V251-T255 PolarHBondContact O-OG1 3.26Å; V253-T255 VanDerWaalsContact C-N 3.32Å; V253-T255 PolarHBondContact O-N 3.21Å; T255-Y257 PolarHBondContact O-N 3.15Å
256D71.1Confident74.4Confident136 Ų13685 Ų8573%0.72743%0.433SS*.  trans54.6-3.4-173.7-83.2-45.5000117.5A252 V253 S258 K266A252-D256 PolarHBondContact O-N 3.02Å; V253-D256 PolarHBondContact O-N 3.35Å; D256-S258 PolarHBondContact O-N 3.25Å; D256-K266 PolarHBondContact O-NZ 3.22Å
257Y72.5Confident73.5Confident170 Ų17081.3 Ų81.367%0.66743%0.426SS*.  trans-55.2132.8178.9-160.6-92.3000112.7A252 T255 K266A252-Y257 PolarHBondContact O-N 3.05Å; T255-Y257 PolarHBondContact O-N 3.15Å; Y257-K266 PolarHBondContact O-NZ 3.44Å
258S64.9Low72.5Confident71 Ų7178.1 Ų78.150%0.49742%0.415SS..  trans-97.9142.9-179.8740000111.9D256 E263D256-S258 PolarHBondContact O-N 3.25Å; S258-E263 WeakPolarHBondContact CB-OE1 3.49Å
259F75.1Confident71.5Confident48 Ų4879.6 Ų79.621%0.21142%0.419CS..  trans-152.1157.4164.472.5-94.9000109.7Y245 V248 L249 A252 L261 A262 E263Y245-F259 HydrophobicContact CE2-CE2 4.36Å; Y245-F259 HydrophobicContact CE2-CZ 4.45Å; V248-F259 HydrophobicContact CG1-CE1 4.2Å; V248-F259 HydrophobicContact CG1-CZ 4.14Å; L249-F259 HydrophobicContact CD2-CE1 4.46Å; L249-F259 HydrophobicContact CD2-CZ 3.96Å; A252-F259 HydrophobicContact CB-CD1 4.05Å; A252-F259 HydrophobicContact CB-CE1 3.66Å; F259-L261 HydrophobicContact CD2-CB 4.12Å; F259-L261 HydrophobicContact CD2-CG 4.49Å; F259-L261 HydrophobicContact CE2-CB 3.78Å; F259-L261 HydrophobicContact CE2-CD1 4.5Å; F259-L261 HydrophobicContact CE2-CG 4.35Å; F259-L261 PolarHBondContact O-N 3.13Å; F259-A262 HydrophobicContact CD1-CB 3.42Å; F259-A262 VanDerWaalsContact CD1-CB 3.42Å; F259-A262 HydrophobicContact CD2-CB 4.29Å; F259-A262 HydrophobicContact CE1-CB 3.4Å; F259-A262 HydrophobicContact CE2-CB 4.26Å; F259-A262 HydrophobicContact CG-CB 3.9Å; F259-A262 HydrophobicContact CZ-CB 3.83Å; F259-A262 PolarHBondContact O-N 2.92Å; F259-E263 PolarHBondContact O-N 3.49Å
260P72.3Confident70.9Confident91 Ų9182.2 Ų82.259%0.59144%0.443SS*.THydrogen-bonded Turntrans-61.4-11.9-164.3-28.636.7000117.3
261L67.3Low69.7Low90 Ų9084.6 Ų84.647%0.47145%0.45SS..THydrogen-bonded Turntrans-106.6-25.5174.6-42.8174.2000112.5Y245 F259Y245-L261 HydrophobicContact CE2-CB 4.21Å; Y245-L261 HydrophobicContact CE2-CD1 4.09Å; Y245-L261 WeakPolarHBondContact OH-CB 3.41Å; Y245-L261 PolarHBondContact OH-O 3.17Å; F259-L261 HydrophobicContact CD2-CB 4.12Å; F259-L261 HydrophobicContact CD2-CG 4.49Å; F259-L261 HydrophobicContact CE2-CB 3.78Å; F259-L261 HydrophobicContact CE2-CD1 4.5Å; F259-L261 HydrophobicContact CE2-CG 4.35Å; F259-L261 PolarHBondContact O-N 3.13Å
262A64.3Low68.5Low0 Ų085 Ų850%045%0.453CS..Hα-helixtrans-73.9-34169.500000112.6L249 A252 F259 K264 V265 K266L249-A262 HydrophobicContact CD2-CB 3.84Å; A252-A262 HydrophobicContact CB-CB 4.3Å; F259-A262 HydrophobicContact CD1-CB 3.42Å; F259-A262 VanDerWaalsContact CD1-CB 3.42Å; F259-A262 HydrophobicContact CD2-CB 4.29Å; F259-A262 HydrophobicContact CE1-CB 3.4Å; F259-A262 HydrophobicContact CE2-CB 4.26Å; F259-A262 HydrophobicContact CG-CB 3.9Å; F259-A262 HydrophobicContact CZ-CB 3.83Å; F259-A262 PolarHBondContact O-N 2.92Å; A262-K264 PolarHBondContact O-N 3.47Å; A262-V265 CarbonylContact O-C 3.57Å; A262-V265 PolarHBondContact O-N 2.95Å; A262-K266 WeakPolarHBondContact O-CB 3.41Å; A262-K266 WeakPolarHBondContact O-CG 3.17Å; A262-K266 PolarHBondContact O-N 2.68Å
263E64Low67.5Low94 Ų9489.7 Ų89.744%0.43948%0.482SS..Hα-helixtrans-56.1-40.8176.6-74.8156.4-160.400111.6S258 F259 K266 A267S258-E263 WeakPolarHBondContact CB-OE1 3.49Å; F259-E263 PolarHBondContact O-N 3.49Å; E263-K266 PolarHBondContact O-N 3.09Å; E263-A267 PolarHBondContact O-N 2.98Å
264K67.3Low66.4Low137 Ų13789.7 Ų89.760%0.59649%0.488SS*.Hα-helixtrans-61.6-46.4173.3-61.3-176.8-178.5-1770111.5A262 A267 Y268A262-K264 PolarHBondContact O-N 3.47Å; K264-A267 PolarHBondContact O-N 2.95Å; K264-Y268 WeakPolarHBondContact O-CD2 3.45Å; K264-Y268 PolarHBondContact O-N 3.18Å
265V65Low65Low41 Ų4186.2 Ų86.225%0.24847%0.47CS..Hα-helixtrans-68.8-36.2-179.8178.60000111.8L249 A262 Y268 L269L249-V265 HydrophobicContact CD1-CG1 4.48Å; L249-V265 HydrophobicContact CD1-CG2 3.9Å; L249-V265 HydrophobicContact CD2-CB 4.18Å; L249-V265 HydrophobicContact CD2-CG2 3.96Å; A262-V265 CarbonylContact O-C 3.57Å; A262-V265 PolarHBondContact O-N 2.95Å; V265-Y268 PolarHBondContact O-N 3.25Å; V265-L269 HydrophobicContact CG1-CD1 4.07Å; V265-L269 HydrophobicContact CG1-CG 4.46Å; V265-L269 WeakPolarHBondContact O-CG 3.28Å; V265-L269 PolarHBondContact O-N 2.91Å
266K63.7Low63.3Low46 Ų4684.9 Ų84.920%0.247%0.468CS..Hα-helixtrans-63.6-40.4172.6-75.9179.2170175.50111.5A252 V253 D256 Y257 A262 E263 L269 A270A252-K266 VanDerWaalsContact O-CE 3.22Å; A252-K266 WeakPolarHBondContact O-CE 3.31Å; A252-K266 PolarHBondContact O-NZ 2.97Å; V253-K266 HydrophobicContact CG2-CG 4.26Å; D256-K266 PolarHBondContact O-NZ 3.22Å; Y257-K266 PolarHBondContact O-NZ 3.44Å; A262-K266 WeakPolarHBondContact O-CB 3.41Å; A262-K266 WeakPolarHBondContact O-CG 3.17Å; A262-K266 PolarHBondContact O-N 2.68Å; E263-K266 PolarHBondContact O-N 3.09Å; K266-L269 PolarHBondContact O-N 2.82Å; K266-A270 WeakPolarHBondContact O-CB 3.35Å; K266-A270 PolarHBondContact O-N 3.36Å
267A65.3Low61.9Low47 Ų4782 Ų8239%0.38846%0.463SS..Hα-helixtrans-63-43.2171.400000112.6E263 K264 L269 A270 D271E263-A267 PolarHBondContact O-N 2.98Å; K264-A267 PolarHBondContact O-N 2.95Å; A267-L269 VanDerWaalsContact C-N 3.28Å; A267-L269 PolarHBondContact O-N 3.19Å; A267-A270 PolarHBondContact O-N 2.99Å; A267-D271 PolarHBondContact O-N 3.25Å
268Y63.6Low60.6Low129 Ų12978.7 Ų78.751%0.50646%0.46SS..Hα-helixtrans-62-30.9174-87-74.7000113.8K264 V265 F275K264-Y268 WeakPolarHBondContact O-CD2 3.45Å; K264-Y268 PolarHBondContact O-N 3.18Å; V265-Y268 PolarHBondContact O-N 3.25Å; Y268-F275 HydrophobicContact CD1-CB 4.03Å; Y268-F275 AromaticContact CD1-CD2 3.73Å; Y268-F275 HydrophobicContact CD1-CD2 3.73Å; Y268-F275 HydrophobicContact CD1-CE2 4.48Å; Y268-F275 AromaticContact CD1-CG 3.98Å; Y268-F275 HydrophobicContact CD1-CG 3.98Å; Y268-F275 HydrophobicContact CE1-CB 3.44Å; Y268-F275 VanDerWaalsContact CE1-CB 3.44Å; Y268-F275 AromaticContact CE1-CD1 4Å; Y268-F275 HydrophobicContact CE1-CD1 4Å; Y268-F275 AromaticContact CE1-CD2 3.58Å; Y268-F275 HydrophobicContact CE1-CD2 3.58Å; Y268-F275 HydrophobicContact CE1-CE2 4.35Å; Y268-F275 AromaticContact CE1-CG 3.37Å; Y268-F275 HydrophobicContact CE1-CG 3.37Å; Y268-F275 HydrophobicContact CG-CD2 4.41Å; Y268-F275 AromaticContact CZ-CG 3.88Å
269L63.5Low59.1Low116 Ų11679.1 Ų79.161%0.60747%0.468SS*.Hα-helixtrans-84.3-28.8178.1-71171.2000113V253 V265 K266 A267V253-L269 HydrophobicContact CG1-CD1 4.42Å; V253-L269 HydrophobicContact CG2-CD1 4.11Å; V265-L269 HydrophobicContact CG1-CD1 4.07Å; V265-L269 HydrophobicContact CG1-CG 4.46Å; V265-L269 WeakPolarHBondContact O-CG 3.28Å; V265-L269 PolarHBondContact O-N 2.91Å; K266-L269 PolarHBondContact O-N 2.82Å; A267-L269 VanDerWaalsContact C-N 3.28Å; A267-L269 PolarHBondContact O-N 3.19Å
270A67.9Low57.1Low73 Ų7380.1 Ų80.160%0.60349%0.486SS*.Hα-helixtrans-74.5-47.6174.800000112K266 A267 P272K266-A270 WeakPolarHBondContact O-CB 3.35Å; K266-A270 PolarHBondContact O-N 3.36Å; A267-A270 PolarHBondContact O-N 2.99Å; A270-P272 VanDerWaalsContact C-CD 3.47Å; A270-P272 VanDerWaalsContact O-CD 3.29Å; A270-P272 WeakPolarHBondContact O-CD 3.32Å
271D56.8Low55.3Low97 Ų9780.7 Ų80.752%0.51949%0.489SS..  trans-120.871.6-176.4-73.4-57.9000112.2A267 T273 A274A267-D271 PolarHBondContact O-N 3.25Å; D271-T273 PolarHBondContact O-N 3Å; D271-T273 VanDerWaalsContact O-N 3.12Å; D271-A274 HydrophobicContact CB-CB 3.92Å; D271-A274 PolarHBondContact O-N 3.49Å; D271-A274 VanDerWaalsContact O-N 3.15Å
272P57.9Low53.6Low89 Ų8981 Ų8158%0.57851%0.505SS*.Hα-helixtrans-63-19.9-179.425.9-35.2000113.7A270A270-P272 VanDerWaalsContact C-CD 3.47Å; A270-P272 VanDerWaalsContact O-CD 3.29Å; A270-P272 WeakPolarHBondContact O-CD 3.32Å
273T58Low52Low107 Ų10785.4 Ų85.466%0.65654%0.541SS*.Hα-helixtrans-80-29.5177.147.30000113.4D271 F275 A276D271-T273 PolarHBondContact O-N 3Å; D271-T273 VanDerWaalsContact O-N 3.12Å; T273-F275 VanDerWaalsContact C-N 3.26Å; T273-F275 PolarHBondContact O-N 3.1Å; T273-A276 PolarHBondContact O-N 3.47Å
274A55.6Low50.6Low53 Ų5387.6 Ų87.644%0.43856%0.56SS.*Hα-helixtrans-63.1-31.6-174.200000113D271D271-A274 HydrophobicContact CB-CB 3.92Å; D271-A274 PolarHBondContact O-N 3.49Å; D271-A274 VanDerWaalsContact O-N 3.15Å
275F50.2Low48.6Very low85 Ų8585.3 Ų85.337%0.37357%0.568SS.*Hα-helixtrans-104.6-10.3179.7-65.1-80.7000114.3Y268 T273 A277 V278 A279Y268-F275 HydrophobicContact CD1-CB 4.03Å; Y268-F275 AromaticContact CD1-CD2 3.73Å; Y268-F275 HydrophobicContact CD1-CD2 3.73Å; Y268-F275 HydrophobicContact CD1-CE2 4.48Å; Y268-F275 AromaticContact CD1-CG 3.98Å; Y268-F275 HydrophobicContact CD1-CG 3.98Å; Y268-F275 HydrophobicContact CE1-CB 3.44Å; Y268-F275 VanDerWaalsContact CE1-CB 3.44Å; Y268-F275 AromaticContact CE1-CD1 4Å; Y268-F275 HydrophobicContact CE1-CD1 4Å; Y268-F275 AromaticContact CE1-CD2 3.58Å; Y268-F275 HydrophobicContact CE1-CD2 3.58Å; Y268-F275 HydrophobicContact CE1-CE2 4.35Å; Y268-F275 AromaticContact CE1-CG 3.37Å; Y268-F275 HydrophobicContact CE1-CG 3.37Å; Y268-F275 HydrophobicContact CG-CD2 4.41Å; Y268-F275 AromaticContact CZ-CG 3.88Å; T273-F275 VanDerWaalsContact C-N 3.26Å; T273-F275 PolarHBondContact O-N 3.1Å; F275-A277 PolarHBondContact O-N 3.21Å; F275-V278 HydrophobicContact CD1-CB 4.5Å; F275-V278 HydrophobicContact CD1-CG2 4.19Å; F275-V278 WeakPolarHBondContact O-CA 3.39Å; F275-V278 PolarHBondContact O-N 2.9Å; F275-A279 PolarHBondContact O-N 3.11Å; F275-A279 VanDerWaalsContact O-N 3.07Å
276A43.5Very low46.8Very low62 Ų6292.9 Ų92.951%0.51260%0.6SS.*Hα-helixtrans-59.8-35.7168.700000111.3T273 V278 A279 A280T273-A276 PolarHBondContact O-N 3.47Å; A276-V278 PolarHBondContact O-N 2.9Å; A276-A279 PolarHBondContact O-N 3.33Å; A276-A280 PolarHBondContact O-N 2.9Å
277A42.1Very low45.1Very low76 Ų7696.9 Ų96.963%0.62863%0.628SS**Hα-helixtrans-64.2-25.1171.600000113.8F275F275-A277 PolarHBondContact O-N 3.21Å
278V44.3Very low43.2Very low100 Ų100100.1 Ų100.161%0.60666%0.655SS**Hα-helixtrans-89.7-23.6-178.8-174.30000111.9F275 A276 A280 P281F275-V278 HydrophobicContact CD1-CB 4.5Å; F275-V278 HydrophobicContact CD1-CG2 4.19Å; F275-V278 WeakPolarHBondContact O-CA 3.39Å; F275-V278 PolarHBondContact O-N 2.9Å; A276-V278 PolarHBondContact O-N 2.9Å; V278-A280 VanDerWaalsContact C-N 3.33Å; V278-P281 WeakPolarHBondContact O-CD 3.36Å
279A33.7Very low41.4Very low80 Ų8098.3 Ų98.366%0.66167%0.667SS**Hα-helixtrans-80.5-11.817000000113.5F275 A276F275-A279 PolarHBondContact O-N 3.11Å; F275-A279 VanDerWaalsContact O-N 3.07Å; A276-A279 PolarHBondContact O-N 3.33Å
280A33.2Very low39.7Very low70 Ų7097.7 Ų97.758%0.57968%0.679SS**G310 helixtrans-79-12.3-175.300000118.6A276 V278 A282A276-A280 PolarHBondContact O-N 2.9Å; V278-A280 VanDerWaalsContact C-N 3.33Å; A280-A282 PolarHBondContact O-N 3.48Å
281P34.6Very low37.8Very low103 Ų103100.1 Ų100.167%0.66969%0.688SS**G310 helixtrans-9425.9-179.938-34000114V278V278-P281 WeakPolarHBondContact O-CD 3.36Å
282A31.7Very low36.2Very low97 Ų97100.5 Ų100.580%0.80271%0.705SS**G310 helixtrans-104.65.7178.100000114.3A280A280-A282 PolarHBondContact O-N 3.48Å
283A30.8Very low34.7Very low91 Ų91101.1 Ų101.175%0.75272%0.718SS**SBendtrans-118.2-4.6-172.600000115.3
284V33.5Very low33.1Very low140 Ų140103.9 Ų103.985%0.84872%0.721SS**SBendtrans-142.876.9-178.2-169.30000110.5
285A25.9Very low31.7Very low90 Ų90107.9 Ų107.974%0.74473%0.73SS**  trans-1515.5176.500000116.2T287A285-T287 PolarHBondContact O-N 3.03Å
286E27.9Very low30.6Very low199 Ų199112.6 Ų112.693%0.9375%0.753SS**  trans-87.376.1168.7-76.8-160.5144.100111.2
287T26.8Very low29.7Very low130 Ų130115 Ų11580%0.79876%0.762SS**  trans-161.376.3161.1-6.90000109.9A285 A289A285-T287 PolarHBondContact O-N 3.03Å; T287-A289 PolarHBondContact O-N 3.34Å
288A25.1Very low29Very low115 Ų115121.6 Ų121.695%0.9578%0.776SS**  trans-73.986.6-177.800000112.2
289A26.2Very low28.1Very low92 Ų92125.1 Ų125.176%0.7679%0.786SS**  trans-93112.7162.500000109.1T287 P291T287-A289 PolarHBondContact O-N 3.34Å; A289-P291 WeakPolarHBondContact O-CD 3.4Å
290A28Very low27.6Very low102 Ų102131 Ų13184%0.84380%0.799SS**PPolyproline II helixtrans-80.8126.9-175.100000112.3
291P27.7Very low27.3Very low125 Ų125133.2 Ų133.281%0.81281%0.811SS**PPolyproline II helixtrans-86.5152.2167.434.7-32.6000111.7A289A289-P291 WeakPolarHBondContact O-CD 3.4Å
292A24.6Very low26.8Very low105 Ų105137 Ų13787%0.86882%0.82SS**PPolyproline II helixtrans-81.8159.4179.700000113.1
293A26.4Very low26.5Very low102 Ų102141.3 Ų141.384%0.84382%0.824SS**PPolyproline II helixtrans-103134.7174.400000112.1
294K24.5Very low26.2Very low165 Ų165141.8 Ų141.872%0.71782%0.821SS**  trans-153.9150169.3-74.9-178139.8-69.50106.5
295E25.4Very low25.9Very low137 Ų137142.7 Ų142.764%0.6482%0.821SS**  cis-112.5-127.6-11.3-139.179.4-104.200107.1
296E26.1Very low26Very low183 Ų183145.5 Ų145.586%0.85582%0.824SS**  cis-138.3116.8-4.1-74.817895.500109.5
297V25.8Very low26.3Very low114 Ų114141.8 Ų141.869%0.69181%0.81SS**  trans31.7121.7134.2-171.50000120.4E299V297-E299 HydrophobicContact CG1-CG 4.09Å
298K26.5Very low26.8Very low213 Ų213143.1 Ų143.193%0.92681%0.809SS**  trans-141.3139.8135.7-105.1-171.8175.3-172.50109
299E25Very low27.4Very low175 Ų175140.7 Ų140.782%0.81880%0.796SS**  trans-106.6-176.8-173.7-65.6-176.7121.800112.9V297V297-E299 HydrophobicContact CG1-CG 4.09Å
300E24.4Very low27.8Very low202 Ų202145.9 Ų145.994%0.94480%0.802SS**  trans73.4130.7-175.8-56.1178.4-178.600114.4
301S26.3Very low28.2Very low118 Ų118144.1 Ų144.183%0.82579%0.793SS**  cis-129.1164.913.8610000114.7
302E24.1Very low28.7Very low183 Ų183145.7 Ų145.786%0.85579%0.794SS**  trans-78.2153.2177.7-54.3164.7119.900113.1
303E24.8Very low29.5Very low187 Ų187150 Ų15087%0.87479%0.794SS**  -175.8138.8120.8-104.5-173.2150.900114.4
304S26.3Very low30.4Very low100 Ų100156.5 Ų156.570%0.69981%0.814SS**  trans38106.6155.566.30000123.1
305D26.3Very low30.7Very low160 Ų160156.1 Ų156.186%0.85682%0.819SS**  53155.7111.7-76.4-29.3000125.8
306D29.2Very low30.9Very low149 Ų149157.1 Ų157.180%0.79783%0.828SS**  trans73.4101.4157-73.4-15.7000122.6
307D32.4Very low31.2Very low121 Ų121155.7 Ų155.765%0.64783%0.827SS**  47.2111.7122.9-168.730.2000120.6G309D307-G309 PolarHBondContact OD1-N 3.41Å
308M38.8Very low31.5Very low157 Ų157158.1 Ų158.177%0.77384%0.835SS**  -153.393.9126.4-94.1-53.9110.300109.9F310M308-F310 PolarHBondContact O-N 3.28Å
309G37.5Very low31.8Very low65 Ų65154.7 Ų154.767%0.6783%0.829SS**  trans-80.8105.3172.100000113.3D307D307-G309 PolarHBondContact OD1-N 3.41Å
310F34.3Very low32.3Very low201 Ų201153.3 Ų153.388%0.88283%0.83SS**  trans-138.8144.3165.9-102.3-87000112.1M308M308-F310 PolarHBondContact O-N 3.28Å
311G36.1Very low32.9Very low64 Ų64149.9 Ų149.966%0.6682%0.822SS**  trans-143.7-155.2172.100000110.6
312L38.3Very low33.4Very low159 Ų159152.3 Ų152.383%0.83282%0.821SS**  trans81.8107.7174.5-159.574.9000116
313F41.8Very low34.1Very low196 Ų196149.8 Ų149.886%0.8682%0.819SS**  trans56.296.3159.8-84-98.4000119.2
314D44Very low35Very low238 Ų238146.4 Ų146.4100%1.27381%0.813SS**  -137.20121.5-158.234.1000107.6

Retrieved 314 of 314 residues in 302.2 ms (Link to these results)