A0A060WPZ4_ONCMY Loading...

60S acidic ribosomal protein P0

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

AlphaFold DB , UniProt , Accession A0A060WPZ4, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110494133, Length 315 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M48.6Very low77.1Confident218 Ų218130.2 Ų130.2100%1.07463%0.627SS**  0127.10-155.7145.1176.700107.3
2P55.7Low78.2Confident116 Ų116126.3 Ų126.375%0.75361%0.613SS**  trans-55.8143.3178.2-17.329.9000109.1E4P2-E4 PolarHBondContact O-N 2.95Å
3R60.8Low79.1Confident247 Ų247118.6 Ų118.693%0.93257%0.573SS**  trans-60.8107.9169.9-105.5177163.6164.1-4106.8
4E74.4Confident79.8Confident100 Ų100113.4 Ų113.447%0.46755%0.546SS..  trans-53.3144.4169.7-75.6178.9163.900109.7P2 R6 W9P2-E4 PolarHBondContact O-N 2.95Å; E4-R6 PolarHBondContact O-N 2.94Å; E4-W9 HydrophobicContact CB-CB 4.37Å
5D87.1Confident80.5Confident125 Ų125114.2 Ų114.267%0.66855%0.551SS**  trans-55.8138.4173.7-76.1-37.2000110.6T7 T8 W9D5-T7 PolarHBondContact O-N 3.04Å; D5-T8 PolarHBondContact O-N 2.94Å; D5-T8 VanDerWaalsContact O-N 3.09Å; D5-T8 PolarHBondContact O-OG1 3.11Å; D5-W9 PolarHBondContact O-N 3.2Å
6R82.9Confident81.2Confident188 Ų188114.3 Ų114.371%0.70955%0.548SS*.Hα-helixtrans-57.1-29.3-173.3-171.5172.272.11690.2112.8E4 K10E4-R6 PolarHBondContact O-N 2.94Å; R6-K10 WeakPolarHBondContact O-CB 3.21Å; R6-K10 WeakPolarHBondContact O-CG 3.47Å; R6-K10 PolarHBondContact O-N 2.84Å
7T85.9Confident81.8Confident114 Ų114107.8 Ų107.870%0.69952%0.517SS*.Hα-helixtrans-74.2-45.6179.8-51.70000111.4D5 K10 S11D5-T7 PolarHBondContact O-N 3.04Å; T7-K10 PolarHBondContact O-N 3.02Å; T7-S11 PolarHBondContact O-N 2.59Å; T7-S11 PolarHBondContact O-OG 3.43Å
8T89.2Confident82.2Confident63 Ų63103.5 Ų103.539%0.38750%0.497SS..Hα-helixtrans-68.8-39.2178.655.30000111.2D5 K10 S11 N12D5-T8 PolarHBondContact O-N 2.94Å; D5-T8 VanDerWaalsContact O-N 3.09Å; D5-T8 PolarHBondContact O-OG1 3.11Å; T8-K10 VanDerWaalsContact C-N 3.31Å; T8-K10 PolarHBondContact O-N 3.24Å; T8-S11 WeakPolarHBondContact CA-OG 3.5Å; T8-S11 PolarHBondContact O-N 2.94Å; T8-S11 PolarHBondContact O-OG 2.85Å; T8-N12 WeakPolarHBondContact O-CB 3.44Å; T8-N12 PolarHBondContact O-N 2.85Å; T8-N12 PolarHBondContact O-ND2 2.68Å; T8-N12 PolarHBondContact O-OD1 3.02Å
9W87.6Confident82.7Confident129 Ų129104.2 Ų104.249%0.48950%0.5SS..Hα-helixtrans-59.7-42.4173.4178.578000112.3E4 D5 N12 Y13E4-W9 HydrophobicContact CB-CB 4.37Å; D5-W9 PolarHBondContact O-N 3.2Å; W9-N12 PolarHBondContact O-N 3.28Å; W9-Y13 WeakPolarHBondContact O-CB 3.41Å; W9-Y13 PolarHBondContact O-N 3.18Å
10K87.3Confident83.1Confident76 Ų7699.8 Ų99.833%0.3348%0.479SS..Hα-helixtrans-64.6-46.5177.2-78.9179.6-178.4-179.90111.6R6 T7 T8 N12 Y13 F14 M60R6-K10 WeakPolarHBondContact O-CB 3.21Å; R6-K10 WeakPolarHBondContact O-CG 3.47Å; R6-K10 PolarHBondContact O-N 2.84Å; T7-K10 PolarHBondContact O-N 3.02Å; T8-K10 VanDerWaalsContact C-N 3.31Å; T8-K10 PolarHBondContact O-N 3.24Å; K10-N12 VanDerWaalsContact C-N 3.34Å; K10-Y13 PolarHBondContact O-N 3.23Å; K10-F14 WeakPolarHBondContact O-CD2 3.26Å; K10-F14 PolarHBondContact O-N 3.27Å; K10-M60 HydrophobicContact CB-CE 3.9Å; K10-M60 HydrophobicContact CD-CE 4.12Å; K10-M60 HydrophobicContact CD-SD 4.31Å; K10-M60 HydrophobicContact CG-CE 3.62Å; K10-M60 HydrophobicContact CG-SD 4.4Å
11S88.6Confident83.3Confident56 Ų5696.2 Ų96.239%0.39246%0.462SS..Hα-helixtrans-61.7-43.4177.955.60000111.3T7 T8 Y13 F14 M15T7-S11 PolarHBondContact O-N 2.59Å; T7-S11 PolarHBondContact O-OG 3.43Å; T8-S11 WeakPolarHBondContact CA-OG 3.5Å; T8-S11 PolarHBondContact O-N 2.94Å; T8-S11 PolarHBondContact O-OG 2.85Å; S11-Y13 VanDerWaalsContact C-N 3.3Å; S11-Y13 PolarHBondContact O-N 3.28Å; S11-F14 PolarHBondContact O-N 3.2Å; S11-M15 WeakPolarHBondContact O-CG 3.4Å; S11-M15 PolarHBondContact O-N 3.12Å
12N90.6Very high85.1Confident84 Ų8490.8 Ų90.845%0.44944%0.438SS..Hα-helixtrans-61.2-40.3176.5-67.7-9.1000111.6T8 W9 K10 M15 K16T8-N12 WeakPolarHBondContact O-CB 3.44Å; T8-N12 PolarHBondContact O-N 2.85Å; T8-N12 PolarHBondContact O-ND2 2.68Å; T8-N12 PolarHBondContact O-OD1 3.02Å; W9-N12 PolarHBondContact O-N 3.28Å; K10-N12 VanDerWaalsContact C-N 3.34Å; N12-M15 PolarHBondContact O-N 3.14Å; N12-K16 WeakPolarHBondContact O-CB 3.24Å; N12-K16 PolarHBondContact O-N 2.98Å
13Y89.7Confident86.7Confident26 Ų2688.7 Ų88.710%0.10242%0.42CS..Hα-helixtrans-65.1-41.4175.4-175.3-93.8000112.5W9 K10 S11 K16 I17 L54 M55 G56 M60 M61W9-Y13 WeakPolarHBondContact O-CB 3.41Å; W9-Y13 PolarHBondContact O-N 3.18Å; K10-Y13 PolarHBondContact O-N 3.23Å; S11-Y13 VanDerWaalsContact C-N 3.3Å; S11-Y13 PolarHBondContact O-N 3.28Å; Y13-K16 PolarHBondContact O-N 3.36Å; Y13-I17 HydrophobicContact CD1-CD1 3.9Å; Y13-I17 HydrophobicContact CD1-CG1 4.42Å; Y13-I17 HydrophobicContact CE1-CD1 3.16Å; Y13-I17 HydrophobicContact CE1-CG1 3.98Å; Y13-I17 PolarHBondContact O-N 3.38Å; Y13-L54 HydrophobicContact CE2-CD2 4.48Å; Y13-L54 WeakPolarHBondContact OH-CD2 3.2Å; Y13-M55 PolarHBondContact OH-O 3.36Å; Y13-G56 VanDerWaalsContact OH-CA 3.23Å; Y13-G56 WeakPolarHBondContact OH-CA 3.31Å; Y13-G56 PolarHBondContact OH-N 3.37Å; Y13-M60 HydrophobicContact CD1-CE 4.37Å; Y13-M60 HydrophobicContact CE1-CB 4.35Å; Y13-M61 HydrophobicContact CE1-CG 4.37Å
14F89.1Confident88.1Confident45 Ų4579.4 Ų79.420%0.19739%0.385CS..Hα-helixtrans-60-53.2174-80.3-69.4000110.7K10 S11 K16 I17 I18 M60 K63 A64K10-F14 WeakPolarHBondContact O-CD2 3.26Å; K10-F14 PolarHBondContact O-N 3.27Å; S11-F14 PolarHBondContact O-N 3.2Å; F14-K16 PolarHBondContact O-N 3.02Å; F14-I17 PolarHBondContact O-N 3.26Å; F14-I17 VanDerWaalsContact O-N 3.14Å; F14-I18 HydrophobicContact CB-CD1 4.47Å; F14-I18 WeakPolarHBondContact O-CB 3.41Å; F14-I18 WeakPolarHBondContact O-CD1 3.47Å; F14-I18 WeakPolarHBondContact O-CG1 3.27Å; F14-I18 PolarHBondContact O-N 3.3Å; F14-M60 HydrophobicContact CD2-CE 3.97Å; F14-M60 HydrophobicContact CE1-CE 4.4Å; F14-M60 WeakPolarHBondContact CE1-O 3.19Å; F14-M60 HydrophobicContact CE2-CE 3.23Å; F14-M60 HydrophobicContact CE2-SD 4.06Å; F14-M60 HydrophobicContact CZ-CE 3.48Å; F14-M60 VanDerWaalsContact CZ-CE 3.48Å; F14-M60 HydrophobicContact CZ-SD 3.89Å; F14-K63 HydrophobicContact CE1-CB 4.17Å; F14-K63 HydrophobicContact CE1-CG 4.38Å; F14-K63 HydrophobicContact CZ-CB 4.33Å; F14-K63 HydrophobicContact CZ-CD 4.31Å; F14-K63 HydrophobicContact CZ-CG 4.41Å; F14-A64 HydrophobicContact CD1-CB 3.5Å; F14-A64 VanDerWaalsContact CD1-CB 3.5Å; F14-A64 HydrophobicContact CE1-CB 3.72Å
15M90.7Very high88.7Confident126 Ų12677.1 Ų77.162%0.62138%0.379SS*.Hα-helixtrans-56-41178.5-66.5-59.4-70.300111.9S11 N12 I18 Q19S11-M15 WeakPolarHBondContact O-CG 3.4Å; S11-M15 PolarHBondContact O-N 3.12Å; N12-M15 PolarHBondContact O-N 3.14Å; M15-I18 PolarHBondContact O-N 3.34Å; M15-Q19 WeakPolarHBondContact O-CB 3.41Å; M15-Q19 PolarHBondContact O-N 3.49Å
16K91.5Very high88.9Confident116 Ų11672.9 Ų72.950%0.50436%0.355SS..Hα-helixtrans-65.3-42.5178.3-175.6172.3-177.3171.60113.2N12 Y13 F14 I18 L20 L54N12-K16 WeakPolarHBondContact O-CB 3.24Å; N12-K16 PolarHBondContact O-N 2.98Å; Y13-K16 PolarHBondContact O-N 3.36Å; F14-K16 PolarHBondContact O-N 3.02Å; K16-I18 VanDerWaalsContact C-N 3.33Å; K16-L20 HydrophobicContact CG-CD1 4.14Å; K16-L20 WeakPolarHBondContact O-CB 3.33Å; K16-L20 VanDerWaalsContact O-CG 3.25Å; K16-L20 WeakPolarHBondContact O-CG 3.24Å; K16-L20 PolarHBondContact O-N 3.03Å; K16-L20 VanDerWaalsContact O-N 3.1Å; K16-L54 HydrophobicContact CD-CD1 4.45Å; K16-L54 HydrophobicContact CG-CD1 4.27Å
17I90.4Very high89.3Confident3 Ų364 Ų642%0.01532%0.322CS..Hα-helixtrans-63.1-45.8176.1-76.9-176.7000110.4Y13 F14 Q19 L20 L21 L54 M61 A64Y13-I17 HydrophobicContact CD1-CD1 3.9Å; Y13-I17 HydrophobicContact CD1-CG1 4.42Å; Y13-I17 HydrophobicContact CE1-CD1 3.16Å; Y13-I17 HydrophobicContact CE1-CG1 3.98Å; Y13-I17 PolarHBondContact O-N 3.38Å; F14-I17 PolarHBondContact O-N 3.26Å; F14-I17 VanDerWaalsContact O-N 3.14Å; I17-Q19 VanDerWaalsContact C-N 3.35Å; I17-L20 PolarHBondContact O-N 3.11Å; I17-L20 VanDerWaalsContact O-N 3.16Å; I17-L21 HydrophobicContact CG2-CD1 3.64Å; I17-L21 HydrophobicContact CG2-CG 4.19Å; I17-L21 WeakPolarHBondContact O-CG 3.29Å; I17-L21 PolarHBondContact O-N 3.39Å; I17-L54 HydrophobicContact CD1-CD2 3.88Å; I17-L54 HydrophobicContact CG1-CD1 3.82Å; I17-L54 HydrophobicContact CG1-CD2 3.65Å; I17-L54 HydrophobicContact CG1-CG 4.42Å; I17-M61 HydrophobicContact CD1-CB 4.41Å; I17-M61 HydrophobicContact CD1-CG 3.87Å; I17-A64 HydrophobicContact CB-CB 4.46Å; I17-A64 HydrophobicContact CD1-CB 4.4Å; I17-A64 HydrophobicContact CG2-CB 3.95Å
18I88.9Confident89.6Confident31 Ų3158.6 Ų58.616%0.15929%0.288CS..Hα-helixtrans-58.6-51.5-177.7-69.2167.8000109.9F14 M15 K16 L20 L21 D22 H68F14-I18 HydrophobicContact CB-CD1 4.47Å; F14-I18 WeakPolarHBondContact O-CB 3.41Å; F14-I18 WeakPolarHBondContact O-CD1 3.47Å; F14-I18 WeakPolarHBondContact O-CG1 3.27Å; F14-I18 PolarHBondContact O-N 3.3Å; M15-I18 PolarHBondContact O-N 3.34Å; K16-I18 VanDerWaalsContact C-N 3.33Å; I18-L20 VanDerWaalsContact C-N 3.27Å; I18-L20 PolarHBondContact O-N 3.42Å; I18-L21 PolarHBondContact O-N 3.18Å; I18-D22 PolarHBondContact O-N 3.06Å; I18-H68 WeakPolarHBondContact CD1-NE2 3.36Å; I18-H68 WeakPolarHBondContact CG1-CD2 3.33Å; I18-H68 WeakPolarHBondContact CG1-NE2 3.46Å; I18-H68 WeakPolarHBondContact CG2-CE1 3.48Å; I18-H68 VanDerWaalsContact CG2-NE2 3.34Å; I18-H68 WeakPolarHBondContact CG2-NE2 3.45Å
19Q91.4Very high89.7Confident117 Ų11755.6 Ų55.655%0.54727%0.27SS..Hα-helixtrans-56.4-42.2176.2-175.8176.7700111.9M15 I17 D22 D23M15-Q19 WeakPolarHBondContact O-CB 3.41Å; M15-Q19 PolarHBondContact O-N 3.49Å; I17-Q19 VanDerWaalsContact C-N 3.35Å; Q19-D22 PolarHBondContact O-N 3.35Å; Q19-D23 WeakPolarHBondContact CG-OD2 3.31Å; Q19-D23 WeakPolarHBondContact O-CB 3.34Å; Q19-D23 PolarHBondContact O-N 3.14Å
20L91.2Very high89.9Confident15 Ų1549.4 Ų49.48%0.07925%0.247CC..Hα-helixtrans-70.2-30.9178.1-70.7169.5000113.5K16 I17 I18 Y24 V52 L54 F90K16-L20 HydrophobicContact CG-CD1 4.14Å; K16-L20 WeakPolarHBondContact O-CB 3.33Å; K16-L20 VanDerWaalsContact O-CG 3.25Å; K16-L20 WeakPolarHBondContact O-CG 3.24Å; K16-L20 PolarHBondContact O-N 3.03Å; K16-L20 VanDerWaalsContact O-N 3.1Å; I17-L20 PolarHBondContact O-N 3.11Å; I17-L20 VanDerWaalsContact O-N 3.16Å; I18-L20 VanDerWaalsContact C-N 3.27Å; I18-L20 PolarHBondContact O-N 3.42Å; L20-Y24 HydrophobicContact CD2-CD2 3.89Å; L20-Y24 HydrophobicContact CD2-CE2 3.56Å; L20-Y24 WeakPolarHBondContact O-CB 3.29Å; L20-Y24 WeakPolarHBondContact O-CD2 3.34Å; L20-Y24 PolarHBondContact O-N 2.7Å; L20-V52 HydrophobicContact CD1-CG1 4.27Å; L20-V52 HydrophobicContact CD2-CB 4.26Å; L20-V52 HydrophobicContact CD2-CG1 4.06Å; L20-L54 HydrophobicContact CD1-CB 4.3Å; L20-L54 HydrophobicContact CD1-CD1 3.52Å; L20-F90 HydrophobicContact CB-CD1 4.44Å; L20-F90 HydrophobicContact CB-CD2 3.87Å; L20-F90 HydrophobicContact CB-CE1 4.45Å; L20-F90 HydrophobicContact CB-CE2 3.85Å; L20-F90 HydrophobicContact CB-CG 4.16Å; L20-F90 HydrophobicContact CB-CZ 4.16Å; L20-F90 HydrophobicContact CD1-CD2 4.04Å; L20-F90 HydrophobicContact CD1-CE2 4.09Å; L20-F90 HydrophobicContact CG-CD2 4.39Å
21L87Confident90.1Very high26 Ų2645.9 Ų45.914%0.13623%0.231CC..Hα-helixtrans-71.6-34.7174.9-74.3168.3000112I17 I18 I65 L75 F90I17-L21 HydrophobicContact CG2-CD1 3.64Å; I17-L21 HydrophobicContact CG2-CG 4.19Å; I17-L21 WeakPolarHBondContact O-CG 3.29Å; I17-L21 PolarHBondContact O-N 3.39Å; I18-L21 PolarHBondContact O-N 3.18Å; L21-I65 HydrophobicContact CD1-CG1 4.06Å; L21-L75 HydrophobicContact CD2-CD2 4.22Å; L21-F90 HydrophobicContact CD2-CE1 3.81Å; L21-F90 HydrophobicContact CD2-CZ 4.19Å; L21-F90 HydrophobicContact CG-CE1 4.31Å; L21-F90 HydrophobicContact CG-CZ 4.43Å
22D87.1Confident90.1Very high104 Ų10443.5 Ų43.556%0.55622%0.216SC*.Hα-helixtrans-79.6-39.6178.1-64.1-26.5000111.3I18 Q19I18-D22 PolarHBondContact O-N 3.06Å; Q19-D22 PolarHBondContact O-N 3.35Å
23D90Very high89.9Confident72 Ų7243.5 Ų43.539%0.38522%0.216SC..Hα-helixtrans-71.9-32.8-177.5-75.6-18.5000112.8Q19 K92Q19-D23 WeakPolarHBondContact CG-OD2 3.31Å; Q19-D23 WeakPolarHBondContact O-CB 3.34Å; Q19-D23 PolarHBondContact O-N 3.14Å; D23-K92 WeakPolarHBondContact O-CE 3.4Å; D23-K92 PolarHBondContact O-NZ 2.88Å; D23-K92 VanDerWaalsContact O-NZ 3.15Å
24Y89.6Confident89.5Confident51 Ų5146.7 Ų46.720%0.223%0.234CC..  trans-118.1116.8-171.4-65.3-93.8000111.8L20 K26 V52 F90 K92L20-Y24 HydrophobicContact CD2-CD2 3.89Å; L20-Y24 HydrophobicContact CD2-CE2 3.56Å; L20-Y24 WeakPolarHBondContact O-CB 3.29Å; L20-Y24 WeakPolarHBondContact O-CD2 3.34Å; L20-Y24 PolarHBondContact O-N 2.7Å; Y24-K26 VanDerWaalsContact C-N 3.31Å; Y24-K26 PolarHBondContact O-N 3.35Å; Y24-V52 HydrophobicContact CE2-CG2 4.46Å; Y24-F90 HydrophobicContact CD1-CB 4.11Å; Y24-F90 HydrophobicContact CD2-CB 3.91Å; Y24-F90 HydrophobicContact CG-CB 3.69Å; Y24-K92 HydrophobicContact CD1-CD 4.26Å; Y24-K92 HydrophobicContact CD1-CG 3.48Å; Y24-K92 VanDerWaalsContact CD1-CG 3.48Å; Y24-K92 HydrophobicContact CE1-CD 4.2Å; Y24-K92 HydrophobicContact CE1-CG 3.76Å; Y24-K92 HydrophobicContact CG-CG 4.41Å
25P87.4Confident89.4Confident52 Ų5245.8 Ų45.834%0.33823%0.232SC..SBendtrans-72.8-24.4-178.727.3-32.8000113.3N195P25-N195 VanDerWaalsContact CB-OD1 3.31Å; P25-N195 WeakPolarHBondContact CB-OD1 3.49Å; P25-N195 PolarHBondContact O-N 3.27Å
26K91Very high89.1Confident36 Ų3641.5 Ų41.516%0.15722%0.22CC..EExtended strand (participates in β ladder)trans-113.4138.2-175.6-59170-179.7-1760110.6Y24 T91 E93 L95 Y193Y24-K26 VanDerWaalsContact C-N 3.31Å; Y24-K26 PolarHBondContact O-N 3.35Å; K26-T91 WeakPolarHBondContact CB-O 3.37Å; K26-T91 PolarHBondContact O-N 3.37Å; K26-T91 VanDerWaalsContact O-N 3.1Å; K26-E93 WeakPolarHBondContact CD-O 3.26Å; K26-E93 PolarHBondContact NZ-O 3.46Å; K26-L95 HydrophobicContact CB-CD2 3.98Å; K26-L95 HydrophobicContact CD-CD2 3.92Å; K26-L95 HydrophobicContact CD-CG 4.01Å; K26-L95 HydrophobicContact CG-CD2 4.26Å; K26-Y193 WeakPolarHBondContact CA-O 3.23Å
27C91.1Very high88.9Confident2 Ų240.6 Ų40.61%0.01423%0.229CC..EExtended strand (participates in β ladder)trans-143.3145.2170.871.50000113.5V89 F90 Y193C27-V89 CarbonylContact C-O 3.52Å; C27-V89 VanDerWaalsContact CA-O 3.29Å; C27-V89 WeakPolarHBondContact CA-O 3.22Å; C27-F90 HydrophobicContact CB-CD1 3.65Å; C27-F90 HydrophobicContact CB-CE1 3.8Å; C27-F90 HydrophobicContact CB-CG 4.48Å; C27-Y193 PolarHBondContact N-O 2.83Å; C27-Y193 WeakPolarHBondContact O-CB 3.24Å; C27-Y193 PolarHBondContact O-N 3.46Å; C27-Y193 WeakPolarHBondContact SG-CB 3.31Å
28F92.3Very high88.8Confident0 Ų049 Ų490%027%0.265CS..EExtended strand (participates in β ladder)trans-98.5135.5169-65.3-84.1000110.3V30 F88 V89 T91 L95 I98 I189 V192 L204F28-V30 HydrophobicContact CB-CG1 4.08Å; F28-F88 CarbonylContact O-C 3.51Å; F28-F88 VanDerWaalsContact O-CA 3.32Å; F28-F88 WeakPolarHBondContact O-CA 3.49Å; F28-V89 HydrophobicContact CB-CB 4.16Å; F28-V89 HydrophobicContact CD2-CB 4.49Å; F28-V89 PolarHBondContact N-O 2.79Å; F28-V89 PolarHBondContact O-N 3.17Å; F28-T91 HydrophobicContact CD2-CG2 4.28Å; F28-T91 HydrophobicContact CE2-CG2 4.24Å; F28-L95 HydrophobicContact CE1-CD2 4.12Å; F28-L95 HydrophobicContact CE2-CD2 3.75Å; F28-L95 HydrophobicContact CZ-CB 3.95Å; F28-L95 HydrophobicContact CZ-CD2 3.44Å; F28-L95 VanDerWaalsContact CZ-CD2 3.44Å; F28-L95 HydrophobicContact CZ-CG 4.31Å; F28-L95 WeakPolarHBondContact CZ-O 3.49Å; F28-I98 HydrophobicContact CD2-CG2 4.08Å; F28-I98 HydrophobicContact CE2-CB 3.94Å; F28-I98 HydrophobicContact CE2-CG2 3.62Å; F28-I98 HydrophobicContact CZ-CB 4.44Å; F28-I98 HydrophobicContact CZ-CG2 4.42Å; F28-I189 HydrophobicContact CD1-CD1 4.37Å; F28-I189 HydrophobicContact CD1-CG1 4.46Å; F28-I189 HydrophobicContact CD1-CG2 3.74Å; F28-I189 HydrophobicContact CE1-CD1 4.46Å; F28-I189 HydrophobicContact CE1-CG2 4.4Å; F28-V192 HydrophobicContact CD1-CB 4.25Å; F28-V192 HydrophobicContact CD1-CG1 3.91Å; F28-V192 HydrophobicContact CD1-CG2 3.7Å; F28-V192 HydrophobicContact CE1-CB 4.27Å; F28-V192 HydrophobicContact CE1-CG1 3.66Å; F28-V192 HydrophobicContact CE1-CG2 3.67Å; F28-V192 HydrophobicContact CZ-CG1 4.31Å; F28-L204 HydrophobicContact CE1-CD1 4.11Å
29I92.1Very high88.7Confident0 Ų048.5 Ų48.50%026%0.262CS..EExtended strand (participates in β ladder)trans-89.7111.4164.2-59.1-173.4000107L78 H81 V86 F88 Q190 Q191I29-L78 HydrophobicContact CD1-CD2 3.8Å; I29-L78 HydrophobicContact CG1-CD2 4.5Å; I29-H81 HydrophobicContact CD1-CB 3.76Å; I29-V86 HydrophobicContact CG2-CG1 3.4Å; I29-V86 VanDerWaalsContact CG2-CG1 3.4Å; I29-F88 HydrophobicContact CD1-CE1 4.25Å; I29-F88 HydrophobicContact CG1-CD1 4.18Å; I29-F88 HydrophobicContact CG1-CE1 3.79Å; I29-Q190 HydrophobicContact CG2-CB 4.35Å; I29-Q190 PolarHBondContact O-N 3.39Å; I29-Q191 HydrophobicContact CB-CB 4.18Å; I29-Q191 HydrophobicContact CD1-CB 4.18Å; I29-Q191 HydrophobicContact CG1-CB 4.41Å; I29-Q191 PolarHBondContact N-O 3.2Å; I29-Q191 PolarHBondContact O-N 2.93Å
30V91.9Very high88.6Confident0 Ų044.1 Ų44.10%024%0.242CC..EExtended strand (participates in β ladder)trans-110.8134.2-178.1-65.40000111.3F28 V86 G87 V89 L102 L187 L188 I189F28-V30 HydrophobicContact CB-CG1 4.08Å; V30-V86 CarbonylContact O-C 3.59Å; V30-V86 VanDerWaalsContact O-CA 3.32Å; V30-V86 WeakPolarHBondContact O-CA 3.47Å; V30-G87 WeakPolarHBondContact CG2-O 3.4Å; V30-G87 PolarHBondContact N-O 3.42Å; V30-G87 PolarHBondContact O-N 3.33Å; V30-V89 HydrophobicContact CG1-CG2 3.86Å; V30-V89 HydrophobicContact CG2-CG2 3.79Å; V30-L102 HydrophobicContact CG1-CD1 4.44Å; V30-L187 HydrophobicContact CB-CB 4.32Å; V30-L187 HydrophobicContact CB-CD2 4.16Å; V30-L187 HydrophobicContact CG1-CB 4.46Å; V30-L187 HydrophobicContact CG2-CD2 3.96Å; V30-L188 CarbonylContact C-O 3.52Å; V30-L188 WeakPolarHBondContact CA-O 3.39Å; V30-I189 HydrophobicContact CG1-CG1 4.33Å
31G91.4Very high88.5Confident1 Ų149.5 Ų49.51%0.0127%0.267CS..EExtended strand (participates in β ladder)trans-83126.1165.800000110.1N85 L188G31-N85 WeakPolarHBondContact CA-O 2.94Å; G31-L188 PolarHBondContact N-O 3.11Å; G31-L188 PolarHBondContact O-N 2.86Å; G31-L188 VanDerWaalsContact O-N 3.11Å
32A87.4Confident88.6Confident7 Ų751 Ų516%0.05828%0.283CS..  trans-108.343.4-179.700000112V35 M55 N85 L187A32-V35 HydrophobicContact CB-CG2 4.34Å; A32-M55 HydrophobicContact CB-CE 3.68Å; A32-N85 PolarHBondContact N-O 3Å; A32-N85 PolarHBondContact O-ND2 3Å; A32-L187 HydrophobicContact CB-CD2 3.89Å
33D86.5Confident88.7Confident84 Ų8446.3 Ų46.345%0.44926%0.257SS..THydrogen-bonded Turntrans-75.7134.4179.1-66.8-40.5000111.4V35 N85D33-V35 PolarHBondContact O-N 2.98Å; D33-N85 WeakPolarHBondContact OD1-CB 3.28Å
34N82.2Confident88.8Confident92 Ų9248.9 Ų48.949%0.49226%0.262SS..THydrogen-bonded Turntrans58.215.9-178.6-58.6-43.8000115.8F185N34-F185 HydrophobicContact CB-CD1 4.17Å; N34-F185 HydrophobicContact CB-CD2 4.07Å; N34-F185 HydrophobicContact CB-CE1 4.45Å; N34-F185 HydrophobicContact CB-CE2 4.4Å; N34-F185 HydrophobicContact CB-CG 4Å
35V85.4Confident88.8Confident26 Ų2652.3 Ų52.316%0.15828%0.283CS..  trans-84123178.4-170.50000110.5A32 D33 Q39 M40A32-V35 HydrophobicContact CB-CG2 4.34Å; D33-V35 PolarHBondContact O-N 2.98Å; V35-Q39 HydrophobicContact CG1-CB 4.05Å; V35-Q39 HydrophobicContact CG1-CG 3.81Å; V35-M40 HydrophobicContact CB-CG 4.49Å; V35-M40 HydrophobicContact CB-SD 4.47Å; V35-M40 HydrophobicContact CG1-CG 3.68Å; V35-M40 HydrophobicContact CG1-SD 3.68Å
36G85.1Confident88.9Confident36 Ų3652.3 Ų52.337%0.37128%0.284SS..  trans-75154.9178.400000113.3K38 Q39 M40G36-K38 VanDerWaalsContact C-N 3.29Å; G36-K38 PolarHBondContact O-N 2.98Å; G36-Q39 WeakPolarHBondContact O-CB 2.98Å; G36-Q39 PolarHBondContact O-N 3.32Å; G36-Q39 VanDerWaalsContact O-N 3.09Å; G36-M40 PolarHBondContact O-N 3.48Å
37S87.9Confident88.8Confident97 Ų9750.6 Ų50.668%0.67828%0.277SS*.Hα-helixtrans-58.5-38.7178.4-54.20000113.2M40 Q41S37-M40 PolarHBondContact O-N 3.28Å; S37-Q41 WeakPolarHBondContact O-CG 3.45Å; S37-Q41 PolarHBondContact O-N 2.99Å
38K87.9Confident88.7Confident181 Ų18159.8 Ų59.879%0.78731%0.311SS*.Hα-helixtrans-65.6-38.8176.4-172.1176.2-178.9-179.30111.8G36 Q41 A42G36-K38 VanDerWaalsContact C-N 3.29Å; G36-K38 PolarHBondContact O-N 2.98Å; K38-Q41 PolarHBondContact O-N 3.46Å; K38-A42 PolarHBondContact O-N 3.4Å
39Q87.3Confident88.5Confident20 Ų2063.7 Ų63.79%0.09335%0.351CS..Hα-helixtrans-65.6-44.6175.2179.4177.31200111V35 G36 Q41 A42 I43 V107 F185V35-Q39 HydrophobicContact CG1-CB 4.05Å; V35-Q39 HydrophobicContact CG1-CG 3.81Å; G36-Q39 WeakPolarHBondContact O-CB 2.98Å; G36-Q39 PolarHBondContact O-N 3.32Å; G36-Q39 VanDerWaalsContact O-N 3.09Å; Q39-Q41 VanDerWaalsContact C-N 3.26Å; Q39-Q41 PolarHBondContact O-N 2.87Å; Q39-A42 PolarHBondContact O-N 3.42Å; Q39-A42 VanDerWaalsContact O-N 3.16Å; Q39-I43 HydrophobicContact CG-CD1 3.84Å; Q39-I43 HydrophobicContact CG-CG1 4.44Å; Q39-I43 VanDerWaalsContact O-CG1 3.3Å; Q39-I43 WeakPolarHBondContact O-CG1 3.36Å; Q39-I43 PolarHBondContact O-N 3.36Å; Q39-V107 HydrophobicContact CB-CG2 4.23Å; Q39-V107 VanDerWaalsContact CD-CG2 3.46Å; Q39-V107 HydrophobicContact CG-CB 4.34Å; Q39-V107 HydrophobicContact CG-CG2 3.59Å; Q39-F185 PolarHBondContact NE2-O 3.45Å
40M88.8Confident88.3Confident24 Ų2467 Ų6712%0.11837%0.366CS..Hα-helixtrans-60.2-36.1174.6-74.8-60.6-70.800112.8V35 G36 S37 R44 V53 M55 L187V35-M40 HydrophobicContact CB-CG 4.49Å; V35-M40 HydrophobicContact CB-SD 4.47Å; V35-M40 HydrophobicContact CG1-CG 3.68Å; V35-M40 HydrophobicContact CG1-SD 3.68Å; G36-M40 PolarHBondContact O-N 3.48Å; S37-M40 PolarHBondContact O-N 3.28Å; M40-R44 WeakPolarHBondContact O-CB 3.36Å; M40-R44 VanDerWaalsContact O-CG 3.25Å; M40-R44 WeakPolarHBondContact O-CG 3.46Å; M40-R44 PolarHBondContact O-N 3.37Å; M40-V53 HydrophobicContact CE-CG1 4.01Å; M40-M55 HydrophobicContact CE-CG 3.87Å; M40-M55 HydrophobicContact CE-SD 3.91Å; M40-L187 HydrophobicContact SD-CD2 4.05Å
41Q89.7Confident88.3Confident129 Ų12967.5 Ų67.560%0.60337%0.37SS*.Hα-helixtrans-67.1-44174.5-72.5172.12.600111.7S37 K38 Q39 R44 L45S37-Q41 WeakPolarHBondContact O-CG 3.45Å; S37-Q41 PolarHBondContact O-N 2.99Å; K38-Q41 PolarHBondContact O-N 3.46Å; Q39-Q41 VanDerWaalsContact C-N 3.26Å; Q39-Q41 PolarHBondContact O-N 2.87Å; Q41-R44 PolarHBondContact O-N 2.84Å; Q41-L45 PolarHBondContact O-N 2.9Å
42A89.2Confident88.4Confident57 Ų5769.7 Ų69.747%0.47138%0.383SS..Hα-helixtrans-60.9-44.4175.600000111.7K38 Q39 R44 L45 S46K38-A42 PolarHBondContact O-N 3.4Å; Q39-A42 PolarHBondContact O-N 3.42Å; Q39-A42 VanDerWaalsContact O-N 3.16Å; A42-R44 PolarHBondContact O-N 3.2Å; A42-L45 WeakPolarHBondContact O-CA 3.4Å; A42-L45 WeakPolarHBondContact O-CB 3.41Å; A42-L45 PolarHBondContact O-N 3.01Å; A42-S46 PolarHBondContact O-N 2.93Å
43I89.4Confident88.6Confident5 Ų570.3 Ų70.33%0.02639%0.386CS..Hα-helixtrans-62.4-41.7176.2-67.2166.5000111.3Q39 L45 S46 L47 L102 N105 L187Q39-I43 HydrophobicContact CG-CD1 3.84Å; Q39-I43 HydrophobicContact CG-CG1 4.44Å; Q39-I43 VanDerWaalsContact O-CG1 3.3Å; Q39-I43 WeakPolarHBondContact O-CG1 3.36Å; Q39-I43 PolarHBondContact O-N 3.36Å; I43-L45 PolarHBondContact O-N 2.96Å; I43-S46 WeakPolarHBondContact CA-OG 3.43Å; I43-S46 PolarHBondContact O-N 3.19Å; I43-S46 PolarHBondContact O-OG 3.08Å; I43-L47 HydrophobicContact CG2-CD1 3.58Å; I43-L47 HydrophobicContact CG2-CG 4.22Å; I43-L47 VanDerWaalsContact O-CB 3.29Å; I43-L47 WeakPolarHBondContact O-CB 3.48Å; I43-L47 VanDerWaalsContact O-CG 3.26Å; I43-L47 WeakPolarHBondContact O-CG 3.23Å; I43-L47 PolarHBondContact O-N 2.83Å; I43-L102 HydrophobicContact CG2-CD2 4.4Å; I43-N105 HydrophobicContact CG1-CB 4.22Å; I43-L187 HydrophobicContact CD1-CD1 3.79Å; I43-L187 HydrophobicContact CD1-CG 3.97Å; I43-L187 HydrophobicContact CG2-CD1 3.7Å
44R90.4Very high88.8Confident127 Ų12766.7 Ų66.748%0.47937%0.367SS..Hα-helixtrans-65.2-28.7174.8-75.6174.7-175.9-172.43.2112.6M40 Q41 A42 R48 V53M40-R44 WeakPolarHBondContact O-CB 3.36Å; M40-R44 VanDerWaalsContact O-CG 3.25Å; M40-R44 WeakPolarHBondContact O-CG 3.46Å; M40-R44 PolarHBondContact O-N 3.37Å; Q41-R44 PolarHBondContact O-N 2.84Å; A42-R44 PolarHBondContact O-N 3.2Å; R44-R48 PolarHBondContact O-N 3.01Å; R44-V53 HydrophobicContact CG-CB 4.22Å; R44-V53 HydrophobicContact CG-CG2 4.32Å
45L91.2Very high89.2Confident123 Ų12364.7 Ų64.764%0.64436%0.355SS*.Hα-helixtrans-74.3-43.3176.5-138.876.9000111Q41 A42 I43 R48Q41-L45 PolarHBondContact O-N 2.9Å; A42-L45 WeakPolarHBondContact O-CA 3.4Å; A42-L45 WeakPolarHBondContact O-CB 3.41Å; A42-L45 PolarHBondContact O-N 3.01Å; I43-L45 PolarHBondContact O-N 2.96Å; L45-R48 VanDerWaalsContact O-CB 3.27Å; L45-R48 WeakPolarHBondContact O-CB 3.28Å; L45-R48 PolarHBondContact O-N 3.3Å
46S88.9Confident89.3Confident51 Ų5164.9 Ų64.936%0.35736%0.362SS..Hα-helixtrans-68.5-35.2178.462.60000112.6A42 I43 R48 N105A42-S46 PolarHBondContact O-N 2.93Å; I43-S46 WeakPolarHBondContact CA-OG 3.43Å; I43-S46 PolarHBondContact O-N 3.19Å; I43-S46 PolarHBondContact O-OG 3.08Å; S46-R48 VanDerWaalsContact C-N 3.27Å; S46-R48 PolarHBondContact O-N 3.19Å; S46-N105 PolarHBondContact OG-ND2 3.28Å; S46-N105 VanDerWaalsContact OG-ND2 3.14Å
47L88.4Confident89.6Confident0 Ų070.1 Ų70.10%037%0.374CS..THydrogen-bonded Turntrans-81-3.2177.5-68.7175.6000113.9I43 G49 K50 A51 V53 V89 I98 L102I43-L47 HydrophobicContact CG2-CD1 3.58Å; I43-L47 HydrophobicContact CG2-CG 4.22Å; I43-L47 VanDerWaalsContact O-CB 3.29Å; I43-L47 WeakPolarHBondContact O-CB 3.48Å; I43-L47 VanDerWaalsContact O-CG 3.26Å; I43-L47 WeakPolarHBondContact O-CG 3.23Å; I43-L47 PolarHBondContact O-N 2.83Å; L47-G49 PolarHBondContact O-N 3.4Å; L47-K50 PolarHBondContact O-N 3.34Å; L47-K50 VanDerWaalsContact O-N 3.14Å; L47-A51 HydrophobicContact CB-CB 4.11Å; L47-A51 HydrophobicContact CD1-CB 4.5Å; L47-A51 HydrophobicContact CD2-CB 4.08Å; L47-A51 HydrophobicContact CG-CB 4.46Å; L47-A51 PolarHBondContact O-N 2.96Å; L47-V53 HydrophobicContact CD1-CG2 3.5Å; L47-V53 VanDerWaalsContact CD1-CG2 3.5Å; L47-V89 HydrophobicContact CD1-CG1 4.2Å; L47-I98 HydrophobicContact CD2-CG2 4.46Å; L47-L102 HydrophobicContact CD1-CD2 3.89Å
48R89.7Confident89.7Confident196 Ų19667.2 Ų67.274%0.7435%0.351SS*.THydrogen-bonded Turntrans-64.6126.6-173.5-160.3174.9-161.41723.1110.7R44 L45 S46 K50R44-R48 PolarHBondContact O-N 3.01Å; L45-R48 VanDerWaalsContact O-CB 3.27Å; L45-R48 WeakPolarHBondContact O-CB 3.28Å; L45-R48 PolarHBondContact O-N 3.3Å; S46-R48 VanDerWaalsContact C-N 3.27Å; S46-R48 PolarHBondContact O-N 3.19Å; R48-K50 VanDerWaalsContact C-N 3.32Å
49G86.9Confident89.8Confident82 Ų8262.4 Ų62.485%0.84534%0.337SS*.THydrogen-bonded Turntrans95.5-30.7-177.600000113.6L47L47-G49 PolarHBondContact O-N 3.4Å
50K88.8Confident89.8Confident69 Ų6962.7 Ų62.730%0.334%0.339SS..THydrogen-bonded Turntrans-99.1-40.5-178.2-58.7-167.9149-138.20113.4L47 R48 E93 E97 M101L47-K50 PolarHBondContact O-N 3.34Å; L47-K50 VanDerWaalsContact O-N 3.14Å; R48-K50 VanDerWaalsContact C-N 3.32Å; K50-E93 WeakPolarHBondContact CB-OE2 3.46Å; K50-E93 WeakPolarHBondContact CD-OE2 3.38Å; K50-E93 VanDerWaalsContact CE-OE2 3.26Å; K50-E93 WeakPolarHBondContact CE-OE2 3.36Å; K50-E93 WeakPolarHBondContact CG-OE1 3.33Å; K50-E93 WeakPolarHBondContact CG-OE2 3.41Å; K50-E93 IonicContact NZ-OE2 2.73Å; K50-E93 PolarHBondContact NZ-OE2 2.89Å; K50-E97 IonicContact NZ-OE2 3.07Å; K50-E97 PolarHBondContact NZ-OE2 3.33Å; K50-M101 HydrophobicContact CD-CE 3.75Å; K50-M101 HydrophobicContact CD-SD 3.87Å
51A91.6Very high89.8Confident10 Ų1061.5 Ų61.58%0.08333%0.333CS..EExtended strand (participates in β ladder)trans-142.5152.7-174.500000113L47 V89 F90 T91L47-A51 HydrophobicContact CB-CB 4.11Å; L47-A51 HydrophobicContact CD1-CB 4.5Å; L47-A51 HydrophobicContact CD2-CB 4.08Å; L47-A51 HydrophobicContact CG-CB 4.46Å; L47-A51 PolarHBondContact O-N 2.96Å; A51-V89 HydrophobicContact CB-CG1 3.74Å; A51-F90 CarbonylContact C-O 3.52Å; A51-F90 WeakPolarHBondContact CA-O 3.46Å; A51-F90 WeakPolarHBondContact CB-O 3.35Å; A51-T91 HydrophobicContact CB-CG2 3.47Å; A51-T91 VanDerWaalsContact CB-CG2 3.47Å
52V92.6Very high89.8Confident48 Ų4858.3 Ų58.329%0.29132%0.316SS..EExtended strand (participates in β ladder)trans-116117.8175.4-177.90000109.8L20 Y24 F90L20-V52 HydrophobicContact CD1-CG1 4.27Å; L20-V52 HydrophobicContact CD2-CB 4.26Å; L20-V52 HydrophobicContact CD2-CG1 4.06Å; Y24-V52 HydrophobicContact CE2-CG2 4.46Å; V52-F90 PolarHBondContact N-O 2.84Å; V52-F90 PolarHBondContact O-N 3.14Å
53V92.3Very high89.9Confident19 Ų1962.7 Ų62.712%0.11532%0.324CS..EExtended strand (participates in β ladder)trans-88.1122.2175.5-174.10000110.2M40 R44 L47 M55 F88 V89M40-V53 HydrophobicContact CE-CG1 4.01Å; R44-V53 HydrophobicContact CG-CB 4.22Å; R44-V53 HydrophobicContact CG-CG2 4.32Å; L47-V53 HydrophobicContact CD1-CG2 3.5Å; L47-V53 VanDerWaalsContact CD1-CG2 3.5Å; V53-M55 HydrophobicContact CG1-SD 4.47Å; V53-F88 WeakPolarHBondContact CA-O 3.47Å; V53-V89 HydrophobicContact CG1-CG2 4.4Å; V53-V89 HydrophobicContact CG2-CG1 4.29Å; V53-V89 HydrophobicContact CG2-CG2 4.13Å
54L91.8Very high89.7Confident9 Ų962.6 Ų62.65%0.04732%0.324CS..EExtended strand (participates in β ladder)trans-120.3118174.5-176.6134.4000110.3Y13 K16 I17 L20 M61 F88 F90Y13-L54 HydrophobicContact CE2-CD2 4.48Å; Y13-L54 WeakPolarHBondContact OH-CD2 3.2Å; K16-L54 HydrophobicContact CD-CD1 4.45Å; K16-L54 HydrophobicContact CG-CD1 4.27Å; I17-L54 HydrophobicContact CD1-CD2 3.88Å; I17-L54 HydrophobicContact CG1-CD1 3.82Å; I17-L54 HydrophobicContact CG1-CD2 3.65Å; I17-L54 HydrophobicContact CG1-CG 4.42Å; L20-L54 HydrophobicContact CD1-CB 4.3Å; L20-L54 HydrophobicContact CD1-CD1 3.52Å; L54-M61 HydrophobicContact CD2-SD 4.43Å; L54-F88 HydrophobicContact CD2-CD2 4.46Å; L54-F88 PolarHBondContact N-O 3.44Å; L54-F88 PolarHBondContact O-N 2.86Å; L54-F90 HydrophobicContact CB-CD2 4.38Å; L54-F90 HydrophobicContact CB-CE2 4Å
55M89.9Confident89.6Confident49 Ų4956.7 Ų56.724%0.24130%0.302CS..EExtended strand (participates in β ladder)trans-106145172.4-59.9-61.3-60.900109.4Y13 A32 M40 V53 G87Y13-M55 PolarHBondContact OH-O 3.36Å; A32-M55 HydrophobicContact CB-CE 3.68Å; M40-M55 HydrophobicContact CE-CG 3.87Å; M40-M55 HydrophobicContact CE-SD 3.91Å; V53-M55 HydrophobicContact CG1-SD 4.47Å; M55-G87 WeakPolarHBondContact SD-CA 3.35Å
56G88.1Confident89.3Confident30 Ų3058 Ų5831%0.30930%0.298SS..  trans-178.7-166.3161.900000114.4Y13 N58 M61Y13-G56 VanDerWaalsContact OH-CA 3.23Å; Y13-G56 WeakPolarHBondContact OH-CA 3.31Å; Y13-G56 PolarHBondContact OH-N 3.37Å; G56-N58 PolarHBondContact O-N 3.42Å; G56-M61 VanDerWaalsContact O-CE 3.3Å; G56-M61 WeakPolarHBondContact O-CE 3.43Å
57K90.3Very high89.1Confident146 Ų14658.2 Ų58.264%0.63531%0.308SS*.  trans-76.5128-169.4-170.7173.4-179.3172.10111.1T59 M60 M61K57-T59 VanDerWaalsContact C-N 3.27Å; K57-T59 PolarHBondContact O-N 3.34Å; K57-T59 VanDerWaalsContact O-N 3.12Å; K57-M60 HydrophobicContact CB-CB 4.34Å; K57-M60 HydrophobicContact CB-CG 4.14Å; K57-M60 WeakPolarHBondContact O-CA 3.4Å; K57-M60 WeakPolarHBondContact O-CB 3.15Å; K57-M60 PolarHBondContact O-N 2.94Å; K57-M61 PolarHBondContact O-N 3.02Å
58N90.4Very high88.8Confident36 Ų3659.8 Ų59.819%0.19332%0.315CS..Hα-helixtrans-50.3-43.7-177.6-62-1.1000113.7G56 M60 M61 R62 I82 G84G56-N58 PolarHBondContact O-N 3.42Å; N58-M60 VanDerWaalsContact C-N 3.3Å; N58-M60 PolarHBondContact O-N 3.07Å; N58-M61 PolarHBondContact O-N 2.73Å; N58-R62 VanDerWaalsContact O-CB 3.24Å; N58-R62 WeakPolarHBondContact O-CB 3.42Å; N58-R62 PolarHBondContact O-N 3.39Å; N58-I82 HydrophobicContact CB-CG2 4.01Å; N58-G84 PolarHBondContact ND2-O 3.5Å
59T89.1Confident88.3Confident80 Ų8053 Ų5349%0.49129%0.293SS..Hα-helixtrans-66.3-32.7-179.958.80000112.8K57 K63K57-T59 VanDerWaalsContact C-N 3.27Å; K57-T59 PolarHBondContact O-N 3.34Å; K57-T59 VanDerWaalsContact O-N 3.12Å; T59-K63 WeakPolarHBondContact O-CB 3.25Å; T59-K63 PolarHBondContact O-N 3.34Å
60M88.4Confident87.9Confident26 Ų2657.7 Ų57.713%0.12829%0.294CS..Hα-helixtrans-73.9-48.6177.4-70.4-75-63.800110.4K10 Y13 F14 K57 N58 R62 K63 A64K10-M60 HydrophobicContact CB-CE 3.9Å; K10-M60 HydrophobicContact CD-CE 4.12Å; K10-M60 HydrophobicContact CD-SD 4.31Å; K10-M60 HydrophobicContact CG-CE 3.62Å; K10-M60 HydrophobicContact CG-SD 4.4Å; Y13-M60 HydrophobicContact CD1-CE 4.37Å; Y13-M60 HydrophobicContact CE1-CB 4.35Å; F14-M60 HydrophobicContact CD2-CE 3.97Å; F14-M60 HydrophobicContact CE1-CE 4.4Å; F14-M60 WeakPolarHBondContact CE1-O 3.19Å; F14-M60 HydrophobicContact CE2-CE 3.23Å; F14-M60 HydrophobicContact CE2-SD 4.06Å; F14-M60 HydrophobicContact CZ-CE 3.48Å; F14-M60 VanDerWaalsContact CZ-CE 3.48Å; F14-M60 HydrophobicContact CZ-SD 3.89Å; K57-M60 HydrophobicContact CB-CB 4.34Å; K57-M60 HydrophobicContact CB-CG 4.14Å; K57-M60 WeakPolarHBondContact O-CA 3.4Å; K57-M60 WeakPolarHBondContact O-CB 3.15Å; K57-M60 PolarHBondContact O-N 2.94Å; N58-M60 VanDerWaalsContact C-N 3.3Å; N58-M60 PolarHBondContact O-N 3.07Å; M60-R62 VanDerWaalsContact C-N 3.32Å; M60-R62 PolarHBondContact O-N 3.34Å; M60-K63 PolarHBondContact O-N 3.23Å; M60-K63 VanDerWaalsContact O-N 3.13Å; M60-A64 PolarHBondContact O-N 3.18Å
61M89.3Confident87.4Confident0 Ų060.2 Ų60.20%031%0.31CS..Hα-helixtrans-59.6-44.3178.3-61.1-171.2-6100111.2Y13 I17 L54 G56 K57 N58 K63 A64 I65 I82 F88Y13-M61 HydrophobicContact CE1-CG 4.37Å; I17-M61 HydrophobicContact CD1-CB 4.41Å; I17-M61 HydrophobicContact CD1-CG 3.87Å; L54-M61 HydrophobicContact CD2-SD 4.43Å; G56-M61 VanDerWaalsContact O-CE 3.3Å; G56-M61 WeakPolarHBondContact O-CE 3.43Å; K57-M61 PolarHBondContact O-N 3.02Å; N58-M61 PolarHBondContact O-N 2.73Å; M61-K63 VanDerWaalsContact C-N 3.31Å; M61-K63 PolarHBondContact O-N 3.4Å; M61-A64 WeakPolarHBondContact O-CB 3.35Å; M61-A64 PolarHBondContact O-N 3.12Å; M61-I65 VanDerWaalsContact O-CG1 3.32Å; M61-I65 WeakPolarHBondContact O-CG1 3.44Å; M61-I65 PolarHBondContact O-N 3.47Å; M61-I82 HydrophobicContact CE-CG2 3.94Å; M61-F88 HydrophobicContact CB-CE2 4.22Å; M61-F88 HydrophobicContact CE-CE2 4.26Å; M61-F88 HydrophobicContact CG-CE2 4.43Å; M61-F88 HydrophobicContact SD-CD2 3.78Å; M61-F88 HydrophobicContact SD-CE2 3.67Å
62R89.9Confident86.7Confident62 Ų6262.8 Ų62.823%0.23432%0.323CS..Hα-helixtrans-61.2-38176.4-163.5179.9-63.6126.13112.8N58 M60 R66 L79 I82N58-R62 VanDerWaalsContact O-CB 3.24Å; N58-R62 WeakPolarHBondContact O-CB 3.42Å; N58-R62 PolarHBondContact O-N 3.39Å; M60-R62 VanDerWaalsContact C-N 3.32Å; M60-R62 PolarHBondContact O-N 3.34Å; R62-R66 WeakPolarHBondContact O-CB 3.3Å; R62-R66 VanDerWaalsContact O-CG 3.31Å; R62-R66 WeakPolarHBondContact O-CG 3.37Å; R62-R66 PolarHBondContact O-N 3.21Å; R62-R66 VanDerWaalsContact O-N 3.11Å; R62-L79 HydrophobicContact CG-CD2 3.67Å; R62-I82 PolarHBondContact NH2-O 2.89Å
63K89.4Confident86.2Confident149 Ų14964.9 Ų64.965%0.64834%0.337SS*.Hα-helixtrans-69.6-38.2176.9-171.8172.5-177.8178.20111.6F14 T59 M60 M61 G67F14-K63 HydrophobicContact CE1-CB 4.17Å; F14-K63 HydrophobicContact CE1-CG 4.38Å; F14-K63 HydrophobicContact CZ-CB 4.33Å; F14-K63 HydrophobicContact CZ-CD 4.31Å; F14-K63 HydrophobicContact CZ-CG 4.41Å; T59-K63 WeakPolarHBondContact O-CB 3.25Å; T59-K63 PolarHBondContact O-N 3.34Å; M60-K63 PolarHBondContact O-N 3.23Å; M60-K63 VanDerWaalsContact O-N 3.13Å; M61-K63 VanDerWaalsContact C-N 3.31Å; M61-K63 PolarHBondContact O-N 3.4Å; K63-G67 PolarHBondContact O-N 2.96Å; K63-G67 VanDerWaalsContact O-N 3.1Å
64A87.1Confident85.6Confident3 Ų365 Ų653%0.02534%0.341CS..Hα-helixtrans-62.3-50.1177.700000110.7F14 I17 M60 M61 R66 G67 H68F14-A64 HydrophobicContact CD1-CB 3.5Å; F14-A64 VanDerWaalsContact CD1-CB 3.5Å; F14-A64 HydrophobicContact CE1-CB 3.72Å; I17-A64 HydrophobicContact CB-CB 4.46Å; I17-A64 HydrophobicContact CD1-CB 4.4Å; I17-A64 HydrophobicContact CG2-CB 3.95Å; M60-A64 PolarHBondContact O-N 3.18Å; M61-A64 WeakPolarHBondContact O-CB 3.35Å; M61-A64 PolarHBondContact O-N 3.12Å; A64-R66 PolarHBondContact O-N 2.94Å; A64-G67 PolarHBondContact O-N 3.09Å; A64-G67 VanDerWaalsContact O-N 3.17Å; A64-H68 PolarHBondContact O-N 3.28Å
65I86.9Confident85.1Confident2 Ų265 Ų651%0.0134%0.34CS..Hα-helixtrans-64.3-41.8-178.5-64.4165000111.2L21 M61 G67 H68 L69 L75 L79 I82 F88L21-I65 HydrophobicContact CD1-CG1 4.06Å; M61-I65 VanDerWaalsContact O-CG1 3.32Å; M61-I65 WeakPolarHBondContact O-CG1 3.44Å; M61-I65 PolarHBondContact O-N 3.47Å; I65-G67 VanDerWaalsContact C-N 3.3Å; I65-G67 PolarHBondContact O-N 2.94Å; I65-H68 CarbonylContact O-C 3.54Å; I65-H68 PolarHBondContact O-N 2.83Å; I65-H68 VanDerWaalsContact O-N 3.09Å; I65-L69 PolarHBondContact O-N 3.11Å; I65-L75 HydrophobicContact CG2-CB 3.71Å; I65-L75 HydrophobicContact CG2-CD1 4.38Å; I65-L79 HydrophobicContact CB-CD2 4.25Å; I65-L79 HydrophobicContact CG2-CD2 4Å; I65-I82 HydrophobicContact CD1-CD1 3.55Å; I65-F88 HydrophobicContact CD1-CE2 4.33Å; I65-F88 HydrophobicContact CD1-CZ 3.99Å
66R86.2Confident84.9Confident151 Ų15168.3 Ų68.357%0.5736%0.355SS*.Hα-helixtrans-62.9-35175.2-77.1178.3-175.2163.6-3.6113.2R62 A64 H68 L69 L79R62-R66 WeakPolarHBondContact O-CB 3.3Å; R62-R66 VanDerWaalsContact O-CG 3.31Å; R62-R66 WeakPolarHBondContact O-CG 3.37Å; R62-R66 PolarHBondContact O-N 3.21Å; R62-R66 VanDerWaalsContact O-N 3.11Å; A64-R66 PolarHBondContact O-N 2.94Å; R66-H68 PolarHBondContact O-N 2.96Å; R66-L69 WeakPolarHBondContact O-CB 3.38Å; R66-L69 PolarHBondContact O-N 3.25Å; R66-L79 HydrophobicContact CG-CD1 4.09Å; R66-L79 HydrophobicContact CG-CD2 4.12Å
67G83.3Confident84.7Confident55 Ų5572.4 Ų72.457%0.56736%0.364SS*.Hα-helixtrans-69-22.1174.800000113.4K63 A64 I65K63-G67 PolarHBondContact O-N 2.96Å; K63-G67 VanDerWaalsContact O-N 3.1Å; A64-G67 PolarHBondContact O-N 3.09Å; A64-G67 VanDerWaalsContact O-N 3.17Å; I65-G67 VanDerWaalsContact C-N 3.3Å; I65-G67 PolarHBondContact O-N 2.94Å
68H82.2Confident84.5Confident33 Ų3365.4 Ų65.415%0.15333%0.334CS..THydrogen-bonded Turntrans-97.83.7178.9-87-91.8000114.2I18 A64 I65 R66 E70 N71 N72 L75I18-H68 WeakPolarHBondContact CD1-NE2 3.36Å; I18-H68 WeakPolarHBondContact CG1-CD2 3.33Å; I18-H68 WeakPolarHBondContact CG1-NE2 3.46Å; I18-H68 WeakPolarHBondContact CG2-CE1 3.48Å; I18-H68 VanDerWaalsContact CG2-NE2 3.34Å; I18-H68 WeakPolarHBondContact CG2-NE2 3.45Å; A64-H68 PolarHBondContact O-N 3.28Å; I65-H68 CarbonylContact O-C 3.54Å; I65-H68 PolarHBondContact O-N 2.83Å; I65-H68 VanDerWaalsContact O-N 3.09Å; R66-H68 PolarHBondContact O-N 2.96Å; H68-E70 PolarHBondContact O-N 3.5Å; H68-N71 PolarHBondContact O-N 3.41Å; H68-N72 PolarHBondContact O-N 2.96Å; H68-L75 HydrophobicContact CB-CD1 4.37Å
69L78.8Confident84.2Confident53 Ų5364.8 Ų64.828%0.27733%0.331SS..THydrogen-bonded Turntrans-67.5-26.9-175.1-160.8147000112.2I65 R66 N71 N72 E76I65-L69 PolarHBondContact O-N 3.11Å; R66-L69 WeakPolarHBondContact O-CB 3.38Å; R66-L69 PolarHBondContact O-N 3.25Å; L69-N71 VanDerWaalsContact C-N 3.27Å; L69-N71 PolarHBondContact O-N 3.07Å; L69-N72 CarbonylContact O-C 3.32Å; L69-N72 VanDerWaalsContact O-C 3.32Å; L69-N72 PolarHBondContact O-N 3.36Å; L69-E76 HydrophobicContact CD1-CB 3.97Å; L69-E76 HydrophobicContact CD1-CG 4.19Å
70E78.3Confident84.2Confident182 Ų18264.2 Ų64.285%0.8533%0.328SS*.THydrogen-bonded Turntrans-63.7-32175.5-65179.1-173.900112.5H68H68-E70 PolarHBondContact O-N 3.5Å
71N79Confident84.2Confident122 Ų12265.9 Ų65.965%0.65234%0.336SS*.THydrogen-bonded Turntrans-87.3-34.3179.3-65-13000112.1H68 L69H68-N71 PolarHBondContact O-N 3.41Å; L69-N71 VanDerWaalsContact C-N 3.27Å; L69-N71 PolarHBondContact O-N 3.07Å
72N77.5Confident84.2Confident64 Ų6465.9 Ų65.934%0.34234%0.336SS..  trans-141.798.2179.1-166.1-15000111.3H68 L69 A74 L75H68-N72 PolarHBondContact O-N 2.96Å; L69-N72 CarbonylContact O-C 3.32Å; L69-N72 VanDerWaalsContact O-C 3.32Å; L69-N72 PolarHBondContact O-N 3.36Å; N72-A74 PolarHBondContact O-N 2.89Å; N72-A74 WeakPolarHBondContact OD1-CB 3.48Å; N72-A74 PolarHBondContact OD1-N 2.74Å; N72-L75 HydrophobicContact CB-CD1 3.96Å; N72-L75 HydrophobicContact CB-CG 4.04Å; N72-L75 PolarHBondContact O-N 3Å
73P81.4Confident84.1Confident91 Ų9169.7 Ų69.759%0.59135%0.354SS*.G310 helixtrans-68-21.4-176.827.4-34.6000112.3L75 E76P73-L75 PolarHBondContact O-N 3.4Å; P73-E76 WeakPolarHBondContact O-CB 3.02Å; P73-E76 PolarHBondContact O-N 3.29Å
74A80.6Confident84Confident23 Ų2365.2 Ų65.219%0.1935%0.35CS..G310 helixtrans-71-14.4-176.700000113.4N72 E76 K77N72-A74 PolarHBondContact O-N 2.89Å; N72-A74 WeakPolarHBondContact OD1-CB 3.48Å; N72-A74 PolarHBondContact OD1-N 2.74Å; A74-E76 PolarHBondContact O-N 3.21Å; A74-K77 PolarHBondContact O-N 3.37Å
75L81.3Confident84.2Confident8 Ų868.9 Ų68.94%0.04237%0.369CS..G310 helixtrans-66.4-17.5173.1-64.5175.9000113.3L21 I65 H68 N72 P73 K77 L78 Y193L21-L75 HydrophobicContact CD2-CD2 4.22Å; I65-L75 HydrophobicContact CG2-CB 3.71Å; I65-L75 HydrophobicContact CG2-CD1 4.38Å; H68-L75 HydrophobicContact CB-CD1 4.37Å; N72-L75 HydrophobicContact CB-CD1 3.96Å; N72-L75 HydrophobicContact CB-CG 4.04Å; N72-L75 PolarHBondContact O-N 3Å; P73-L75 PolarHBondContact O-N 3.4Å; L75-K77 PolarHBondContact O-N 2.84Å; L75-L78 HydrophobicContact CD2-CD1 3.75Å; L75-L78 WeakPolarHBondContact O-CB 3.5Å; L75-L78 PolarHBondContact O-N 2.79Å; L75-Y193 HydrophobicContact CD2-CE1 4.18Å; L75-Y193 HydrophobicContact CD2-CE2 4.46Å
76E84.6Confident84.4Confident119 Ų11968.9 Ų68.956%0.55637%0.369SS*.G310 helixtrans-58.4-35.4177-167173.9-174.300111.9L69 P73 A74 L78 L79L69-E76 HydrophobicContact CD1-CB 3.97Å; L69-E76 HydrophobicContact CD1-CG 4.19Å; P73-E76 WeakPolarHBondContact O-CB 3.02Å; P73-E76 PolarHBondContact O-N 3.29Å; A74-E76 PolarHBondContact O-N 3.21Å; E76-L78 PolarHBondContact O-N 3.27Å; E76-L78 VanDerWaalsContact O-N 3.14Å; E76-L79 HydrophobicContact CG-CD1 4.07Å; E76-L79 WeakPolarHBondContact O-CB 3.38Å; E76-L79 WeakPolarHBondContact O-CG 3.27Å; E76-L79 PolarHBondContact O-N 2.98Å; E76-L79 VanDerWaalsContact O-N 3.17Å
77K85.1Confident84.6Confident115 Ų11561.7 Ų61.750%0.534%0.342SS..G310 helixtrans-62.9-19.8178.4-62.3179.8-172.5166.50113.2A74 L75 P80 H81 G196 V198A74-K77 PolarHBondContact O-N 3.37Å; L75-K77 PolarHBondContact O-N 2.84Å; K77-P80 WeakPolarHBondContact O-CD 3.48Å; K77-P80 WeakPolarHBondContact O-CG 3.41Å; K77-H81 PolarHBondContact O-CD2 3.42Å; K77-H81 VanDerWaalsContact O-CD2 3.28Å; K77-G196 PolarHBondContact NZ-O 3.46Å; K77-V198 HydrophobicContact CB-CG2 3.7Å
78L84.9Confident85.1Confident0 Ų059.2 Ų59.20%032%0.316CS..G310 helixtrans-79.9-29.1178.2-62.5172.1000113.1I29 L75 E76 P80 H81 I82 Y193 V198I29-L78 HydrophobicContact CD1-CD2 3.8Å; I29-L78 HydrophobicContact CG1-CD2 4.5Å; L75-L78 HydrophobicContact CD2-CD1 3.75Å; L75-L78 WeakPolarHBondContact O-CB 3.5Å; L75-L78 PolarHBondContact O-N 2.79Å; E76-L78 PolarHBondContact O-N 3.27Å; E76-L78 VanDerWaalsContact O-N 3.14Å; L78-P80 VanDerWaalsContact C-CD 3.45Å; L78-H81 PolarHBondContact O-N 3.05Å; L78-H81 VanDerWaalsContact O-N 3.08Å; L78-I82 WeakPolarHBondContact O-CG1 3.44Å; L78-Y193 HydrophobicContact CD1-CD1 4.49Å; L78-Y193 HydrophobicContact CD1-CD2 3.93Å; L78-Y193 HydrophobicContact CD1-CE2 4.12Å; L78-Y193 HydrophobicContact CD1-CG 4.09Å; L78-Y193 HydrophobicContact CD2-CD2 3.62Å; L78-Y193 HydrophobicContact CD2-CE2 4.45Å; L78-Y193 HydrophobicContact CD2-CG 3.89Å; L78-Y193 HydrophobicContact CG-CD2 3.89Å; L78-Y193 HydrophobicContact CG-CE2 4.25Å; L78-Y193 HydrophobicContact CG-CG 4.38Å; L78-V198 HydrophobicContact CD2-CG2 3.73Å; L78-V198 HydrophobicContact CG-CG2 4.38Å
79L85.5Confident85.6Confident23 Ų2357.7 Ų57.712%0.1231%0.309CS..G310 helixtrans-53.1-42.2-175.2-58.4175.8000115.2R62 I65 R66 E76 H81R62-L79 HydrophobicContact CG-CD2 3.67Å; I65-L79 HydrophobicContact CB-CD2 4.25Å; I65-L79 HydrophobicContact CG2-CD2 4Å; R66-L79 HydrophobicContact CG-CD1 4.09Å; R66-L79 HydrophobicContact CG-CD2 4.12Å; E76-L79 HydrophobicContact CG-CD1 4.07Å; E76-L79 WeakPolarHBondContact O-CB 3.38Å; E76-L79 WeakPolarHBondContact O-CG 3.27Å; E76-L79 PolarHBondContact O-N 2.98Å; E76-L79 VanDerWaalsContact O-N 3.17Å; L79-H81 VanDerWaalsContact C-N 3.27Å; L79-H81 PolarHBondContact O-N 3.36Å
80P89.4Confident86.3Confident67 Ų6755.2 Ų55.244%0.43530%0.296SS..G310 helixtrans-68.2-24.4179.724.7-34.2000113.9K77 L78 K83K77-P80 WeakPolarHBondContact O-CD 3.48Å; K77-P80 WeakPolarHBondContact O-CG 3.41Å; L78-P80 VanDerWaalsContact C-CD 3.45Å; P80-K83 WeakPolarHBondContact O-CD 3.33Å; P80-K83 WeakPolarHBondContact O-CE 3.48Å
81H87.5Confident87Confident62 Ų6246.5 Ų46.529%0.28726%0.255SS..G310 helixtrans-89-11.4-175.6-58.4-67.3000113.5I29 K77 L78 L79 K83 Q191I29-H81 HydrophobicContact CD1-CB 3.76Å; K77-H81 PolarHBondContact O-CD2 3.42Å; K77-H81 VanDerWaalsContact O-CD2 3.28Å; L78-H81 PolarHBondContact O-N 3.05Å; L78-H81 VanDerWaalsContact O-N 3.08Å; L79-H81 VanDerWaalsContact C-N 3.27Å; L79-H81 PolarHBondContact O-N 3.36Å; H81-K83 VanDerWaalsContact C-N 3.29Å; H81-K83 PolarHBondContact O-N 3.33Å; H81-Q191 HydrophobicContact CB-CG 4.08Å
82I88.2Confident87.5Confident0 Ų046.6 Ų46.60%025%0.25CC..  trans-80.975.4175.8-53.2165.8000109.8N58 M61 R62 I65 L78 F88N58-I82 HydrophobicContact CB-CG2 4.01Å; M61-I82 HydrophobicContact CE-CG2 3.94Å; R62-I82 PolarHBondContact NH2-O 2.89Å; I65-I82 HydrophobicContact CD1-CD1 3.55Å; L78-I82 WeakPolarHBondContact O-CG1 3.44Å; I82-F88 HydrophobicContact CD1-CE2 4.48Å; I82-F88 HydrophobicContact CD1-CZ 3.82Å; I82-F88 HydrophobicContact CG1-CZ 3.95Å
83K88.2Confident88.1Confident141 Ų14146.7 Ų46.761%0.61325%0.248SC*.  trans-138.9140.6179.3-65.6176.9-177168.80110.9P80 H81 V86P80-K83 WeakPolarHBondContact O-CD 3.33Å; P80-K83 WeakPolarHBondContact O-CE 3.48Å; H81-K83 VanDerWaalsContact C-N 3.29Å; H81-K83 PolarHBondContact O-N 3.33Å; K83-V86 WeakPolarHBondContact O-CG2 3.44Å
84G88.6Confident88.4Confident55 Ų5546 Ų4657%0.56724%0.24SC*.SBendtrans84.8-155.8-175.800000112.8N58 V86N58-G84 PolarHBondContact ND2-O 3.5Å; G84-V86 PolarHBondContact O-N 2.78Å
85N90Very high88.7Confident81 Ų8145.5 Ų45.543%0.43323%0.233SC..SBendtrans-87.986.7177.9-173.114.7000110.3G31 A32 D33G31-N85 WeakPolarHBondContact CA-O 2.94Å; A32-N85 PolarHBondContact N-O 3Å; A32-N85 PolarHBondContact O-ND2 3Å; D33-N85 WeakPolarHBondContact OD1-CB 3.28Å
86V90.8Very high89Confident1 Ų146.9 Ų46.91%0.00625%0.246CC..EExtended strand (participates in β ladder)trans-112.9143.4-169.4176.60000111.8I29 V30 K83 G84I29-V86 HydrophobicContact CG2-CG1 3.4Å; I29-V86 VanDerWaalsContact CG2-CG1 3.4Å; V30-V86 CarbonylContact O-C 3.59Å; V30-V86 VanDerWaalsContact O-CA 3.32Å; V30-V86 WeakPolarHBondContact O-CA 3.47Å; K83-V86 WeakPolarHBondContact O-CG2 3.44Å; G84-V86 PolarHBondContact O-N 2.78Å
87G92.1Very high89.1Confident0 Ų045.8 Ų45.80%024%0.241CC..EExtended strand (participates in β ladder)trans-126.4165.8168.500000112.5V30 M55V30-G87 WeakPolarHBondContact CG2-O 3.4Å; V30-G87 PolarHBondContact N-O 3.42Å; V30-G87 PolarHBondContact O-N 3.33Å; M55-G87 WeakPolarHBondContact SD-CA 3.35Å
88F92.4Very high89.3Confident4 Ų440.3 Ų40.32%0.01822%0.217CC..EExtended strand (participates in β ladder)trans-108.7138.3169.8-68.8-71.7000110.3F28 I29 V53 L54 M61 I65 I82 F90F28-F88 CarbonylContact O-C 3.51Å; F28-F88 VanDerWaalsContact O-CA 3.32Å; F28-F88 WeakPolarHBondContact O-CA 3.49Å; I29-F88 HydrophobicContact CD1-CE1 4.25Å; I29-F88 HydrophobicContact CG1-CD1 4.18Å; I29-F88 HydrophobicContact CG1-CE1 3.79Å; V53-F88 WeakPolarHBondContact CA-O 3.47Å; L54-F88 HydrophobicContact CD2-CD2 4.46Å; L54-F88 PolarHBondContact N-O 3.44Å; L54-F88 PolarHBondContact O-N 2.86Å; M61-F88 HydrophobicContact CB-CE2 4.22Å; M61-F88 HydrophobicContact CE-CE2 4.26Å; M61-F88 HydrophobicContact CG-CE2 4.43Å; M61-F88 HydrophobicContact SD-CD2 3.78Å; M61-F88 HydrophobicContact SD-CE2 3.67Å; I65-F88 HydrophobicContact CD1-CE2 4.33Å; I65-F88 HydrophobicContact CD1-CZ 3.99Å; I82-F88 HydrophobicContact CD1-CE2 4.48Å; I82-F88 HydrophobicContact CD1-CZ 3.82Å; I82-F88 HydrophobicContact CG1-CZ 3.95Å; F88-F90 HydrophobicContact CB-CD2 4.22Å; F88-F90 HydrophobicContact CB-CE2 3.57Å; F88-F90 HydrophobicContact CB-CZ 3.75Å; F88-F90 HydrophobicContact CG-CE2 4.39Å; F88-F90 HydrophobicContact CG-CZ 4.13Å
89V93.1Very high89.4Confident0 Ų042 Ų420%022%0.224CC..EExtended strand (participates in β ladder)trans-117.1111.7167.2-174.20000107.4C27 F28 V30 L47 A51 V53 T91C27-V89 CarbonylContact C-O 3.52Å; C27-V89 VanDerWaalsContact CA-O 3.29Å; C27-V89 WeakPolarHBondContact CA-O 3.22Å; F28-V89 HydrophobicContact CB-CB 4.16Å; F28-V89 HydrophobicContact CD2-CB 4.49Å; F28-V89 PolarHBondContact N-O 2.79Å; F28-V89 PolarHBondContact O-N 3.17Å; V30-V89 HydrophobicContact CG1-CG2 3.86Å; V30-V89 HydrophobicContact CG2-CG2 3.79Å; L47-V89 HydrophobicContact CD1-CG1 4.2Å; A51-V89 HydrophobicContact CB-CG1 3.74Å; V53-V89 HydrophobicContact CG1-CG2 4.4Å; V53-V89 HydrophobicContact CG2-CG1 4.29Å; V53-V89 HydrophobicContact CG2-CG2 4.13Å; V89-T91 HydrophobicContact CG1-CG2 4.16Å
90F93.7Very high89.6Confident1 Ų145.3 Ų45.30%0.00424%0.241CC..EExtended strand (participates in β ladder)trans-93.6134.8-178.3-66.2-77.6000110.8L20 L21 Y24 C27 A51 V52 L54 F88L20-F90 HydrophobicContact CB-CD1 4.44Å; L20-F90 HydrophobicContact CB-CD2 3.87Å; L20-F90 HydrophobicContact CB-CE1 4.45Å; L20-F90 HydrophobicContact CB-CE2 3.85Å; L20-F90 HydrophobicContact CB-CG 4.16Å; L20-F90 HydrophobicContact CB-CZ 4.16Å; L20-F90 HydrophobicContact CD1-CD2 4.04Å; L20-F90 HydrophobicContact CD1-CE2 4.09Å; L20-F90 HydrophobicContact CG-CD2 4.39Å; L21-F90 HydrophobicContact CD2-CE1 3.81Å; L21-F90 HydrophobicContact CD2-CZ 4.19Å; L21-F90 HydrophobicContact CG-CE1 4.31Å; L21-F90 HydrophobicContact CG-CZ 4.43Å; Y24-F90 HydrophobicContact CD1-CB 4.11Å; Y24-F90 HydrophobicContact CD2-CB 3.91Å; Y24-F90 HydrophobicContact CG-CB 3.69Å; C27-F90 HydrophobicContact CB-CD1 3.65Å; C27-F90 HydrophobicContact CB-CE1 3.8Å; C27-F90 HydrophobicContact CB-CG 4.48Å; A51-F90 CarbonylContact C-O 3.52Å; A51-F90 WeakPolarHBondContact CA-O 3.46Å; A51-F90 WeakPolarHBondContact CB-O 3.35Å; V52-F90 PolarHBondContact N-O 2.84Å; V52-F90 PolarHBondContact O-N 3.14Å; L54-F90 HydrophobicContact CB-CD2 4.38Å; L54-F90 HydrophobicContact CB-CE2 4Å; F88-F90 HydrophobicContact CB-CD2 4.22Å; F88-F90 HydrophobicContact CB-CE2 3.57Å; F88-F90 HydrophobicContact CB-CZ 3.75Å; F88-F90 HydrophobicContact CG-CE2 4.39Å; F88-F90 HydrophobicContact CG-CZ 4.13Å
91T92.6Very high89.5Confident0 Ų044.3 Ų44.30%023%0.232CC..EExtended strand (participates in β ladder)trans-146.6144.4-168.956.40000111.3K26 F28 A51 V89 I98K26-T91 WeakPolarHBondContact CB-O 3.37Å; K26-T91 PolarHBondContact O-N 3.37Å; K26-T91 VanDerWaalsContact O-N 3.1Å; F28-T91 HydrophobicContact CD2-CG2 4.28Å; F28-T91 HydrophobicContact CE2-CG2 4.24Å; A51-T91 HydrophobicContact CB-CG2 3.47Å; A51-T91 VanDerWaalsContact CB-CG2 3.47Å; V89-T91 HydrophobicContact CG1-CG2 4.16Å; T91-I98 HydrophobicContact CG2-CB 4.39Å; T91-I98 HydrophobicContact CG2-CD1 3.21Å; T91-I98 HydrophobicContact CG2-CG1 4.05Å; T91-I98 HydrophobicContact CG2-CG2 3.89Å
92K90.6Very high89.4Confident124 Ų12441.5 Ų41.554%0.53922%0.218SC..SBendtrans-103.6-23.7169.2-63.5-176.1178.1-170.40112.2D23 Y24D23-K92 WeakPolarHBondContact O-CE 3.4Å; D23-K92 PolarHBondContact O-NZ 2.88Å; D23-K92 VanDerWaalsContact O-NZ 3.15Å; Y24-K92 HydrophobicContact CD1-CD 4.26Å; Y24-K92 HydrophobicContact CD1-CG 3.48Å; Y24-K92 VanDerWaalsContact CD1-CG 3.48Å; Y24-K92 HydrophobicContact CE1-CD 4.2Å; Y24-K92 HydrophobicContact CE1-CG 3.76Å; Y24-K92 HydrophobicContact CG-CG 4.41Å
93E88.6Confident89.3Confident65 Ų6543.8 Ų43.830%0.30423%0.231SC..SBendtrans-73-172.9-178.4-64.2-174.8-179.800112K26 K50 I98K26-E93 WeakPolarHBondContact CD-O 3.26Å; K26-E93 PolarHBondContact NZ-O 3.46Å; K50-E93 WeakPolarHBondContact CB-OE2 3.46Å; K50-E93 WeakPolarHBondContact CD-OE2 3.38Å; K50-E93 VanDerWaalsContact CE-OE2 3.26Å; K50-E93 WeakPolarHBondContact CE-OE2 3.36Å; K50-E93 WeakPolarHBondContact CG-OE1 3.33Å; K50-E93 WeakPolarHBondContact CG-OE2 3.41Å; K50-E93 IonicContact NZ-OE2 2.73Å; K50-E93 PolarHBondContact NZ-OE2 2.89Å; E93-I98 HydrophobicContact CB-CD1 3.86Å
94D87.9Confident89.2Confident78 Ų7841 Ų4142%0.41723%0.233SC..  trans-71.1143.7179.6-173.143000113A96 E97 I98D94-A96 WeakPolarHBondContact OD2-CB 3.29Å; D94-A96 PolarHBondContact OD2-N 3.06Å; D94-E97 HydrophobicContact CB-CG 4.35Å; D94-I98 VanDerWaalsContact O-CD1 3.29Å; D94-I98 WeakPolarHBondContact O-CD1 3.38Å; D94-I98 PolarHBondContact O-N 3.04Å
95L86.8Confident88.9Confident11 Ų1141.1 Ų41.16%0.05822%0.221CC..Hα-helixtrans-71-34.9-175.2-66.5169.6000111.6K26 F28 R99 V192 D194 L204K26-L95 HydrophobicContact CB-CD2 3.98Å; K26-L95 HydrophobicContact CD-CD2 3.92Å; K26-L95 HydrophobicContact CD-CG 4.01Å; K26-L95 HydrophobicContact CG-CD2 4.26Å; F28-L95 HydrophobicContact CE1-CD2 4.12Å; F28-L95 HydrophobicContact CE2-CD2 3.75Å; F28-L95 HydrophobicContact CZ-CB 3.95Å; F28-L95 HydrophobicContact CZ-CD2 3.44Å; F28-L95 VanDerWaalsContact CZ-CD2 3.44Å; F28-L95 HydrophobicContact CZ-CG 4.31Å; F28-L95 WeakPolarHBondContact CZ-O 3.49Å; L95-R99 VanDerWaalsContact O-CB 3.25Å; L95-R99 WeakPolarHBondContact O-CB 3.28Å; L95-R99 PolarHBondContact O-N 2.64Å; L95-V192 HydrophobicContact CD1-CG1 3.93Å; L95-V192 HydrophobicContact CD2-CG1 3.72Å; L95-V192 HydrophobicContact CG-CG1 4.36Å; L95-D194 HydrophobicContact CD1-CB 4.21Å; L95-L204 HydrophobicContact CB-CD1 4.16Å; L95-L204 HydrophobicContact CB-CD2 3.92Å; L95-L204 HydrophobicContact CD1-CD2 4.19Å
96A87.8Confident88.7Confident38 Ų3841.9 Ų41.931%0.31422%0.221SC..Hα-helixtrans-67.9-47.1-178.700000110.9D94 I98 R99 D100D94-A96 WeakPolarHBondContact OD2-CB 3.29Å; D94-A96 PolarHBondContact OD2-N 3.06Å; A96-I98 VanDerWaalsContact C-N 3.34Å; A96-I98 PolarHBondContact O-N 3.16Å; A96-R99 WeakPolarHBondContact O-CB 3.25Å; A96-R99 PolarHBondContact O-N 2.99Å; A96-D100 PolarHBondContact O-N 3.32Å
97E87.9Confident88.3Confident96 Ų9644.7 Ų44.745%0.44924%0.238SC..Hα-helixtrans-57.6-45.4178.8-67.2-173-165.700112.5K50 D94 R99 D100 M101K50-E97 IonicContact NZ-OE2 3.07Å; K50-E97 PolarHBondContact NZ-OE2 3.33Å; D94-E97 HydrophobicContact CB-CG 4.35Å; E97-R99 VanDerWaalsContact C-N 3.34Å; E97-D100 PolarHBondContact O-N 3.39Å; E97-M101 HydrophobicContact CB-CE 3.83Å; E97-M101 WeakPolarHBondContact O-CE 3.25Å; E97-M101 WeakPolarHBondContact O-CG 3.43Å; E97-M101 PolarHBondContact O-N 3.32Å
98I88.6Confident87.9Confident0 Ų048.7 Ų48.70%026%0.264CS..Hα-helixtrans-71.1-35.7-178.1-68.8150.8000110.8F28 L47 T91 E93 D94 A96 D100 M101 L102F28-I98 HydrophobicContact CD2-CG2 4.08Å; F28-I98 HydrophobicContact CE2-CB 3.94Å; F28-I98 HydrophobicContact CE2-CG2 3.62Å; F28-I98 HydrophobicContact CZ-CB 4.44Å; F28-I98 HydrophobicContact CZ-CG2 4.42Å; L47-I98 HydrophobicContact CD2-CG2 4.46Å; T91-I98 HydrophobicContact CG2-CB 4.39Å; T91-I98 HydrophobicContact CG2-CD1 3.21Å; T91-I98 HydrophobicContact CG2-CG1 4.05Å; T91-I98 HydrophobicContact CG2-CG2 3.89Å; E93-I98 HydrophobicContact CB-CD1 3.86Å; D94-I98 VanDerWaalsContact O-CD1 3.29Å; D94-I98 WeakPolarHBondContact O-CD1 3.38Å; D94-I98 PolarHBondContact O-N 3.04Å; A96-I98 VanDerWaalsContact C-N 3.34Å; A96-I98 PolarHBondContact O-N 3.16Å; I98-D100 VanDerWaalsContact C-N 3.34Å; I98-M101 HydrophobicContact CG1-CE 4.42Å; I98-M101 PolarHBondContact O-N 3.11Å; I98-L102 HydrophobicContact CG2-CD1 3.99Å; I98-L102 HydrophobicContact CG2-CG 4.27Å; I98-L102 WeakPolarHBondContact O-CB 3.44Å; I98-L102 WeakPolarHBondContact O-CG 3.38Å; I98-L102 PolarHBondContact O-N 2.66Å
99R87.4Confident87.5Confident35 Ų3549.6 Ų49.613%0.13227%0.272CS..Hα-helixtrans-59.4-47172.3168.5170.7-174.8-99.31.8111.1L95 A96 E97 M101 L102 L103 I189 D205L95-R99 VanDerWaalsContact O-CB 3.25Å; L95-R99 WeakPolarHBondContact O-CB 3.28Å; L95-R99 PolarHBondContact O-N 2.64Å; A96-R99 WeakPolarHBondContact O-CB 3.25Å; A96-R99 PolarHBondContact O-N 2.99Å; E97-R99 VanDerWaalsContact C-N 3.34Å; R99-M101 VanDerWaalsContact C-N 3.33Å; R99-M101 PolarHBondContact O-N 2.86Å; R99-L102 PolarHBondContact O-N 2.91Å; R99-L102 VanDerWaalsContact O-N 3.15Å; R99-L103 HydrophobicContact CG-CD1 3.86Å; R99-L103 HydrophobicContact CG-CG 4.39Å; R99-L103 WeakPolarHBondContact O-CB 3.4Å; R99-L103 WeakPolarHBondContact O-CG 3.42Å; R99-L103 PolarHBondContact O-N 2.79Å; R99-I189 HydrophobicContact CB-CD1 3.91Å; R99-I189 HydrophobicContact CG-CD1 3.68Å; R99-D205 IonicContact CZ-OD1 3.54Å; R99-D205 IonicContact CZ-OD2 2.66Å; R99-D205 IonicContact NH1-OD1 3.94Å; R99-D205 PolarHBondContact NH1-OD1 3.4Å; R99-D205 IonicContact NH1-OD2 2.64Å; R99-D205 IonicContact NH2-OD1 3.9Å; R99-D205 PolarHBondContact NH2-OD1 2.84Å; R99-D205 IonicContact NH2-OD2 3Å; R99-D205 PolarHBondContact NH2-OD2 2.73Å
100D88.4Confident87Confident92 Ų9251.2 Ų51.249%0.49229%0.285SS..Hα-helixtrans-64.6-40.1178.7-68.5-16.1000111.2A96 E97 I98 L102 L103 A104A96-D100 PolarHBondContact O-N 3.32Å; E97-D100 PolarHBondContact O-N 3.39Å; I98-D100 VanDerWaalsContact C-N 3.34Å; D100-L102 VanDerWaalsContact C-N 3.34Å; D100-L102 PolarHBondContact O-N 2.76Å; D100-L103 PolarHBondContact O-N 3.26Å; D100-A104 WeakPolarHBondContact O-CB 3.35Å; D100-A104 PolarHBondContact O-N 2.89Å
101M87.4Confident86.5Confident47 Ų4751.2 Ų51.223%0.23229%0.286CS..Hα-helixtrans-62.5-38.2172.8-75.5-177.1-108.100112.9K50 E97 I98 R99 N105K50-M101 HydrophobicContact CD-CE 3.75Å; K50-M101 HydrophobicContact CD-SD 3.87Å; E97-M101 HydrophobicContact CB-CE 3.83Å; E97-M101 WeakPolarHBondContact O-CE 3.25Å; E97-M101 WeakPolarHBondContact O-CG 3.43Å; E97-M101 PolarHBondContact O-N 3.32Å; I98-M101 HydrophobicContact CG1-CE 4.42Å; I98-M101 PolarHBondContact O-N 3.11Å; R99-M101 VanDerWaalsContact C-N 3.33Å; R99-M101 PolarHBondContact O-N 2.86Å; M101-N105 PolarHBondContact O-N 2.95Å; M101-N105 PolarHBondContact O-ND2 2.84Å
102L86.9Confident86.1Confident2 Ų259.1 Ų59.11%0.0132%0.316CS..Hα-helixtrans-69.5-41.1176.4-73.5170.8000111.6V30 I43 L47 I98 R99 D100 L187 I189V30-L102 HydrophobicContact CG1-CD1 4.44Å; I43-L102 HydrophobicContact CG2-CD2 4.4Å; L47-L102 HydrophobicContact CD1-CD2 3.89Å; I98-L102 HydrophobicContact CG2-CD1 3.99Å; I98-L102 HydrophobicContact CG2-CG 4.27Å; I98-L102 WeakPolarHBondContact O-CB 3.44Å; I98-L102 WeakPolarHBondContact O-CG 3.38Å; I98-L102 PolarHBondContact O-N 2.66Å; R99-L102 PolarHBondContact O-N 2.91Å; R99-L102 VanDerWaalsContact O-N 3.15Å; D100-L102 VanDerWaalsContact C-N 3.34Å; D100-L102 PolarHBondContact O-N 2.76Å; L102-L187 HydrophobicContact CD2-CB 4.44Å; L102-L187 HydrophobicContact CD2-CD1 3.79Å; L102-I189 HydrophobicContact CB-CD1 4.45Å; L102-I189 HydrophobicContact CD1-CD1 4.04Å; L102-I189 HydrophobicContact CD1-CG1 4.13Å
103L85.6Confident86.1Confident49 Ų4956.2 Ų56.226%0.25732%0.315SS..Hα-helixtrans-75.6-30.8179.9-70177000113.2R99 D100 N105 K106R99-L103 HydrophobicContact CG-CD1 3.86Å; R99-L103 HydrophobicContact CG-CG 4.39Å; R99-L103 WeakPolarHBondContact O-CB 3.4Å; R99-L103 WeakPolarHBondContact O-CG 3.42Å; R99-L103 PolarHBondContact O-N 2.79Å; D100-L103 PolarHBondContact O-N 3.26Å; L103-N105 VanDerWaalsContact C-N 3.32Å; L103-K106 VanDerWaalsContact O-CD 3.25Å; L103-K106 WeakPolarHBondContact O-CD 3.42Å; L103-K106 WeakPolarHBondContact O-CE 3.4Å; L103-K106 WeakPolarHBondContact O-CG 3.43Å
104A86.8Confident85.9Confident81 Ų8155.6 Ų55.667%0.66933%0.326SS*.Hα-helixtrans-68.2-33.9174.700000111.6D100 K106D100-A104 WeakPolarHBondContact O-CB 3.35Å; D100-A104 PolarHBondContact O-N 2.89Å; A104-K106 PolarHBondContact O-N 3.36Å
105N82.6Confident85.9Confident59 Ų5953.6 Ų53.632%0.31632%0.32SS..  trans-81.942179.1-73.2-54.3000113.2I43 S46 M101 L103I43-N105 HydrophobicContact CG1-CB 4.22Å; S46-N105 PolarHBondContact OG-ND2 3.28Å; S46-N105 VanDerWaalsContact OG-ND2 3.14Å; M101-N105 PolarHBondContact O-N 2.95Å; M101-N105 PolarHBondContact O-ND2 2.84Å; L103-N105 VanDerWaalsContact C-N 3.32Å
106K83.9Confident86Confident96 Ų9658.4 Ų58.442%0.41735%0.345SS..PPolyproline II helixtrans-80.5130.7169.8-77.4170.5-172.7179.60109.4L103 A104L103-K106 VanDerWaalsContact O-CD 3.25Å; L103-K106 WeakPolarHBondContact O-CD 3.42Å; L103-K106 WeakPolarHBondContact O-CE 3.4Å; L103-K106 WeakPolarHBondContact O-CG 3.43Å; A104-K106 PolarHBondContact O-N 3.36Å
107V83.6Confident86Confident60 Ų6056.7 Ų56.736%0.36433%0.33SS..EExtended strand (participates in β ladder)trans-99.1128177.2174.20000108.6Q39 A109 S184 F185Q39-V107 HydrophobicContact CB-CG2 4.23Å; Q39-V107 VanDerWaalsContact CD-CG2 3.46Å; Q39-V107 HydrophobicContact CG-CB 4.34Å; Q39-V107 HydrophobicContact CG-CG2 3.59Å; V107-A109 PolarHBondContact O-N 3.44Å; V107-S184 WeakPolarHBondContact O-CA 3.45Å; V107-F185 PolarHBondContact N-O 2.94Å; V107-F185 PolarHBondContact O-N 2.87Å
108P84.2Confident85.9Confident84 Ų8455.7 Ų55.755%0.54533%0.332SS..EExtended strand (participates in β ladder)trans-62.5129.6170.625.9-32.4000109.1S181P108-S181 WeakPolarHBondContact CB-OG 3.32Å
109A82.3Confident85.8Confident23 Ų2359.2 Ų59.219%0.1936%0.356CS..EExtended strand (participates in β ladder)trans-126.7134.4-176.200000109.4V107 F183 F185V107-A109 PolarHBondContact O-N 3.44Å; A109-F183 PolarHBondContact N-O 3.32Å; A109-F183 PolarHBondContact O-N 2.91Å; A109-F183 VanDerWaalsContact O-O 3.05Å; A109-F185 HydrophobicContact CB-CD2 3.3Å; A109-F185 HydrophobicContact CB-CE2 3.77Å; A109-F185 HydrophobicContact CB-CG 4.36Å
110A82.6Confident85.9Confident34 Ų3461.4 Ų61.428%0.28137%0.37SS..PPolyproline II helixtrans-70.7149.117400000111.3R112 N176A110-R112 PolarHBondContact O-N 3.37Å; A110-N176 WeakPolarHBondContact CB-OD1 3.2Å
111A84.9Confident85.9Confident2 Ų257.1 Ų57.12%0.01735%0.347CS..PPolyproline II helixtrans-62126.817500000109.8V167 A172 L175 P182 F183A111-V167 HydrophobicContact CB-CG1 3.95Å; A111-V167 HydrophobicContact CB-CG2 4.28Å; A111-A172 WeakPolarHBondContact O-CB 3.32Å; A111-L175 HydrophobicContact CB-CD1 3.94Å; A111-P182 HydrophobicContact CB-CG 4.25Å; A111-F183 HydrophobicContact CB-CD2 4.09Å; A111-F183 HydrophobicContact CB-CE2 3.52Å; A111-F183 HydrophobicContact CB-CZ 4.25Å
112R84.3Confident86Confident166 Ų16658.4 Ų58.463%0.62636%0.358SS*.PPolyproline II helixtrans-94139.2175.6-67.3-175.9-177.8174.42.6109.5A110 G114 A115A110-R112 PolarHBondContact O-N 3.37Å; R112-G114 PolarHBondContact O-N 3.32Å; R112-A115 HydrophobicContact CB-CB 4.24Å; R112-A115 VanDerWaalsContact O-CB 3.23Å; R112-A115 WeakPolarHBondContact O-CB 3.48Å; R112-A115 PolarHBondContact O-N 2.65Å
113A88.8Confident86.2Confident63 Ų6358.3 Ų58.352%0.52136%0.358SS..THydrogen-bonded Turntrans-56.5131.5175.400000110.8A115 A169 A172A113-A115 VanDerWaalsContact C-N 3.25Å; A113-A115 PolarHBondContact O-N 2.92Å; A113-A169 HydrophobicContact CB-CB 4.07Å; A113-A172 HydrophobicContact CB-CB 4.39Å
114G86.1Confident86.4Confident52 Ų5259 Ų5954%0.53637%0.365SS..THydrogen-bonded Turntrans77.9-1.6-178.600000115.5R112 V167R112-G114 PolarHBondContact O-N 3.32Å; G114-V167 PolarHBondContact N-O 2.88Å
115A86.8Confident86.6Confident35 Ų3557 Ų5729%0.28935%0.348SS..PPolyproline II helixtrans-72.7151.6170.300000110.6R112 A113 K166 V167R112-A115 HydrophobicContact CB-CB 4.24Å; R112-A115 VanDerWaalsContact O-CB 3.23Å; R112-A115 WeakPolarHBondContact O-CB 3.48Å; R112-A115 PolarHBondContact O-N 2.65Å; A113-A115 VanDerWaalsContact C-N 3.25Å; A113-A115 PolarHBondContact O-N 2.92Å; A115-K166 WeakPolarHBondContact O-CA 3.04Å; A115-V167 WeakPolarHBondContact O-CG2 3.43Å; A115-V167 PolarHBondContact O-N 2.94Å
116I89.1Confident86.9Confident113 Ų11360.2 Ų60.258%0.57936%0.362SS*.BIsolated β-bridgetrans-82.1130.3172.6-61.1171.2000107.8P118I116-P118 VanDerWaalsContact O-CD 3.28Å; I116-P118 WeakPolarHBondContact O-CD 3.32Å
117A87.6Confident87.2Confident2 Ų258.8 Ų58.82%0.01736%0.358CS..PPolyproline II helixtrans-72.6120.5178.100000110.9I161 G164 D165 V167 F183A117-I161 HydrophobicContact CB-CG2 3.59Å; A117-G164 PolarHBondContact O-N 3.27Å; A117-D165 PolarHBondContact N-O 3.49Å; A117-V167 HydrophobicContact CB-CG2 4.46Å; A117-F183 HydrophobicContact CB-CE1 4.29Å; A117-F183 HydrophobicContact CB-CZ 3.83Å
118P86.3Confident87.4Confident74 Ų7457.3 Ų57.348%0.48135%0.35SS..SBendtrans-78.6-26.6175.630.6-36000113.4I116 F183I116-P118 VanDerWaalsContact O-CD 3.28Å; I116-P118 WeakPolarHBondContact O-CD 3.32Å; P118-F183 HydrophobicContact CG-CD1 3.68Å; P118-F183 HydrophobicContact CG-CE1 4.06Å; P118-F183 HydrophobicContact CG-CG 4.03Å
119C86.4Confident87.5Confident75 Ų7556 Ų5651%0.50735%0.352SS..SBendtrans-134.4160.9-178.9-59.50000109.9
120D90Very high87.8Confident80 Ų8056.4 Ų56.443%0.42835%0.351SS..  trans-62137.2171.8-66.5-40.8000111.4M159 I161 K162 P163D120-M159 HydrophobicContact CB-CE 4.27Å; D120-I161 WeakPolarHBondContact CA-O 3.44Å; D120-K162 WeakPolarHBondContact OD1-CA 3.3Å; D120-P163 WeakPolarHBondContact OD1-CD 3.44Å; D120-P163 VanDerWaalsContact OD1-CG 3.28Å; D120-P163 WeakPolarHBondContact OD1-CG 3.18Å
121V89Confident88Confident2 Ų256.5 Ų56.51%0.01236%0.355CS..EExtended strand (participates in β ladder)trans-112.9114.9177.8-174.80000109.7L160 I161 L175 P182 F183V121-L160 PolarHBondContact O-N 2.91Å; V121-I161 HydrophobicContact CB-CB 4.17Å; V121-I161 HydrophobicContact CB-CG1 4.37Å; V121-I161 HydrophobicContact CG2-CB 4.24Å; V121-I161 HydrophobicContact CG2-CD1 4.44Å; V121-I161 PolarHBondContact N-O 3.44Å; V121-L175 HydrophobicContact CG1-CD1 3.85Å; V121-L175 HydrophobicContact CG1-CD2 3.77Å; V121-L175 HydrophobicContact CG1-CG 4.48Å; V121-P182 HydrophobicContact CB-CB 4.3Å; V121-P182 HydrophobicContact CG1-CB 3.77Å; V121-P182 HydrophobicContact CG1-CG 3.91Å; V121-P182 HydrophobicContact CG2-CB 3.75Å; V121-P182 HydrophobicContact CG2-CG 3.85Å; V121-F183 HydrophobicContact CG2-CE1 3.54Å; V121-F183 HydrophobicContact CG2-CZ 3.71Å
122T89.1Confident88.1Confident74 Ų7459.5 Ų59.545%0.45437%0.374SS..EExtended strand (participates in β ladder)trans-111143.917660.50000110.7M159T122-M159 HydrophobicContact CG2-CB 4.33Å; T122-M159 HydrophobicContact CG2-CE 4.18Å; T122-M159 HydrophobicContact CG2-CG 3.83Å
123V89.5Confident88.3Confident1 Ų160 Ų601%0.00638%0.384CS..EExtended strand (participates in β ladder)trans-108.5121.8171.2178.70000108.3I154 D157 V158 L160 L174 L175 L178 I180V123-I154 HydrophobicContact CG1-CD1 3.41Å; V123-I154 VanDerWaalsContact CG1-CD1 3.41Å; V123-D157 WeakPolarHBondContact O-CA 3.23Å; V123-V158 PolarHBondContact N-O 3.34Å; V123-V158 PolarHBondContact O-N 3.15Å; V123-L160 HydrophobicContact CG2-CD1 3.36Å; V123-L160 HydrophobicContact CG2-CG 3.9Å; V123-L174 HydrophobicContact CG2-CD2 4.35Å; V123-L175 HydrophobicContact CG2-CD2 4.04Å; V123-L178 HydrophobicContact CG1-CD1 3.72Å; V123-I180 HydrophobicContact CG1-CD1 4.28Å; V123-I180 HydrophobicContact CG2-CD1 4.48Å
124P90.1Very high88.1Confident62 Ų6261.3 Ų61.340%0.40338%0.377SS..  trans-76.3154.7-179.631.1-34.6000112.2Q126 D157P124-Q126 PolarHBondContact O-N 3.17Å; P124-Q126 VanDerWaalsContact O-N 3.11Å; P124-D157 VanDerWaalsContact CA-OD1 3.29Å; P124-D157 WeakPolarHBondContact CA-OD1 3.3Å
125A91.3Very high88.1Confident40 Ų4060.4 Ų60.433%0.33136%0.362SS..SBendtrans-65.5104.7169.400000109.4I154 D157A125-I154 WeakPolarHBondContact CA-O 3.39Å; A125-D157 WeakPolarHBondContact CB-OD1 3.47Å; A125-D157 PolarHBondContact N-OD1 3.02Å
126Q89.8Confident88.2Confident127 Ų12762.4 Ų62.459%0.59337%0.373SS*.  trans-155.2154.1-177.1-172.756.441.800110.5P124 T128 I154P124-Q126 PolarHBondContact O-N 3.17Å; P124-Q126 VanDerWaalsContact O-N 3.11Å; Q126-T128 PolarHBondContact O-N 3.4Å; Q126-I154 PolarHBondContact O-N 3.4Å
127N90.4Very high88Confident65 Ų6560.2 Ų60.235%0.34836%0.36SS..BIsolated β-bridgetrans-71121.7167.5-171.2-4.7000110G129 T151 I152 E153N127-G129 PolarHBondContact OD1-N 3.31Å; N127-T151 PolarHBondContact ND2-OG1 2.9Å; N127-T151 WeakPolarHBondContact OD1-CB 3.37Å; N127-T151 PolarHBondContact OD1-OG1 3.09Å; N127-I152 PolarHBondContact OD1-O 3.47Å; N127-I152 VanDerWaalsContact OD1-O 3.14Å; N127-E153 HydrophobicContact CB-CG 4.42Å
128T86.6Confident88.1Confident29 Ų2960.3 Ų60.318%0.17836%0.36CS..  trans-80.7-16.9-174.165.90000113.4Q126 L130 F138 I152 I154 L178Q126-T128 PolarHBondContact O-N 3.4Å; T128-L130 PolarHBondContact O-N 2.9Å; T128-L130 VanDerWaalsContact O-N 3.14Å; T128-L130 PolarHBondContact OG1-N 3.44Å; T128-F138 HydrophobicContact CG2-CE1 4.34Å; T128-F138 HydrophobicContact CG2-CZ 4.25Å; T128-I152 WeakPolarHBondContact CB-O 3.29Å; T128-I152 PolarHBondContact N-O 2.85Å; T128-I152 PolarHBondContact OG1-O 3.09Å; T128-I154 HydrophobicContact CG2-CD1 3.83Å; T128-I154 HydrophobicContact CG2-CG1 3.88Å; T128-L178 HydrophobicContact CG2-CD2 3.48Å; T128-L178 VanDerWaalsContact CG2-CD2 3.48Å
129G86.8Confident88.1Confident57 Ų5763.2 Ų63.259%0.58837%0.367SS*.  trans67.84.5-174.500000114.5N127N127-G129 PolarHBondContact OD1-N 3.31Å
130L88.2Confident88.2Confident32 Ų3263.8 Ų63.817%0.16838%0.377CS..  trans-82.9142.8176.5-65.9167.2000110.4T128 F138 T151 I152 M177 L178T128-L130 PolarHBondContact O-N 2.9Å; T128-L130 VanDerWaalsContact O-N 3.14Å; T128-L130 PolarHBondContact OG1-N 3.44Å; L130-F138 HydrophobicContact CD1-CE2 3.97Å; L130-F138 HydrophobicContact CD1-CZ 3.75Å; L130-T151 WeakPolarHBondContact O-CA 3.49Å; L130-I152 HydrophobicContact CB-CD1 4.35Å; L130-I152 PolarHBondContact O-N 3.04Å; L130-M177 HydrophobicContact CD1-CB 4.43Å; L130-L178 HydrophobicContact CD1-CD2 4.27Å
131G88Confident88Confident36 Ų3661.6 Ų61.637%0.37137%0.365SS..  trans-69.6165.8175.500000113.2E133 I152G131-E133 PolarHBondContact O-N 3.32Å; G131-E133 VanDerWaalsContact O-N 3.11Å; G131-I152 VanDerWaalsContact O-CD1 3.29Å; G131-I152 WeakPolarHBondContact O-CD1 3.49Å
132P87.3Confident87.8Confident65 Ų6564.2 Ų64.242%0.42239%0.393SS..G310 helixtrans-67.7-14.3-17127.9-35.6000114.4K134 T135 I147P132-K134 PolarHBondContact O-N 3.43Å; P132-T135 WeakPolarHBondContact O-CB 2.99Å; P132-T135 VanDerWaalsContact O-CG2 3.26Å; P132-T135 WeakPolarHBondContact O-CG2 3.33Å; P132-T135 PolarHBondContact O-N 2.93Å; P132-T135 PolarHBondContact O-OG1 3.31Å; P132-I147 HydrophobicContact CB-CD1 4.23Å
133E87.8Confident87.9Confident177 Ų17760.9 Ų60.983%0.82737%0.372SS*.G310 helixtrans-58.5-30.7-179.8-62.8-179.3173.100113.3G131G131-E133 PolarHBondContact O-N 3.32Å; G131-E133 VanDerWaalsContact O-N 3.11Å
134K83.8Confident87.9Confident89 Ų8964.3 Ų64.339%0.38739%0.393SS..G310 helixtrans-98.210.3-174.2-62.8-176.2178.9179.90113.8P132 S136 F137 F138 I152 M177P132-K134 PolarHBondContact O-N 3.43Å; K134-S136 VanDerWaalsContact C-N 3.3Å; K134-S136 PolarHBondContact O-N 3.18Å; K134-F137 VanDerWaalsContact O-CB 3.27Å; K134-F137 WeakPolarHBondContact O-CB 3.26Å; K134-F137 PolarHBondContact O-N 2.92Å; K134-F137 VanDerWaalsContact O-N 3.12Å; K134-F138 WeakPolarHBondContact O-CD2 3.46Å; K134-I152 HydrophobicContact CB-CD1 4.49Å; K134-M177 HydrophobicContact CD-SD 3.95Å; K134-M177 PolarHBondContact NZ-SD 3.36Å; K134-M177 VanDerWaalsContact NZ-SD 3.35Å
135T86.6Confident87.9Confident34 Ų3462.8 Ų62.821%0.20938%0.383CS..Hα-helixtrans-60-36.4-179.146.20000113.4P132 F137 F138 Q139 I147 I152P132-T135 WeakPolarHBondContact O-CB 2.99Å; P132-T135 VanDerWaalsContact O-CG2 3.26Å; P132-T135 WeakPolarHBondContact O-CG2 3.33Å; P132-T135 PolarHBondContact O-N 2.93Å; P132-T135 PolarHBondContact O-OG1 3.31Å; T135-F137 PolarHBondContact O-N 3.36Å; T135-F138 PolarHBondContact O-N 2.94Å; T135-Q139 PolarHBondContact O-N 3.46Å; T135-I147 HydrophobicContact CG2-CD1 4.07Å; T135-I147 HydrophobicContact CG2-CG1 4.04Å; T135-I152 HydrophobicContact CG2-CD1 3.55Å; T135-I152 HydrophobicContact CG2-CG1 3.64Å
136S88.7Confident87.9Confident76 Ų7667.2 Ų67.253%0.53140%0.395SS..Hα-helixtrans-59-29.6176.857.30000112.9K134 A140K134-S136 VanDerWaalsContact C-N 3.3Å; K134-S136 PolarHBondContact O-N 3.18Å; S136-A140 WeakPolarHBondContact O-CB 3.5Å; S136-A140 PolarHBondContact O-N 3.34Å
137F85.7Confident88Confident67 Ų6765.7 Ų65.729%0.29439%0.389SS..Hα-helixtrans-71-40.7-178.9-159.3-108.9000112.6K134 T135 A140 L141 S170 T173 L174K134-F137 VanDerWaalsContact O-CB 3.27Å; K134-F137 WeakPolarHBondContact O-CB 3.26Å; K134-F137 PolarHBondContact O-N 2.92Å; K134-F137 VanDerWaalsContact O-N 3.12Å; T135-F137 PolarHBondContact O-N 3.36Å; F137-A140 PolarHBondContact O-N 2.86Å; F137-L141 HydrophobicContact CD1-CD1 4.32Å; F137-L141 HydrophobicContact CE1-CD1 4.22Å; F137-L141 PolarHBondContact O-N 3.15Å; F137-S170 VanDerWaalsContact CE1-O 3.24Å; F137-S170 WeakPolarHBondContact CE1-O 3.14Å; F137-S170 VanDerWaalsContact CZ-O 3.31Å; F137-S170 WeakPolarHBondContact CZ-O 3.41Å; F137-T173 WeakPolarHBondContact CZ-OG1 3.34Å; F137-L174 HydrophobicContact CD1-CB 4.36Å; F137-L174 HydrophobicContact CD1-CD1 4.35Å; F137-L174 HydrophobicContact CE1-CB 3.88Å
138F88.4Confident87.9Confident5 Ų563.9 Ų63.92%0.02238%0.382CS..Hα-helixtrans-68.1-38.2176.2-69.9-88000111.4T128 L130 K134 T135 L141 G142 I143 T145 I152 I154 L174 L178T128-F138 HydrophobicContact CG2-CE1 4.34Å; T128-F138 HydrophobicContact CG2-CZ 4.25Å; L130-F138 HydrophobicContact CD1-CE2 3.97Å; L130-F138 HydrophobicContact CD1-CZ 3.75Å; K134-F138 WeakPolarHBondContact O-CD2 3.46Å; T135-F138 PolarHBondContact O-N 2.94Å; F138-L141 PolarHBondContact O-N 2.97Å; F138-G142 PolarHBondContact O-N 3.29Å; F138-I143 HydrophobicContact CB-CB 4.43Å; F138-I143 HydrophobicContact CD1-CD1 4.08Å; F138-I143 HydrophobicContact CD1-CG2 4.47Å; F138-I143 PolarHBondContact O-N 3.35Å; F138-T145 HydrophobicContact CB-CG2 3.74Å; F138-T145 HydrophobicContact CD1-CG2 3.97Å; F138-T145 HydrophobicContact CG-CG2 3.92Å; F138-I152 HydrophobicContact CD2-CD1 4.04Å; F138-I152 HydrophobicContact CD2-CG2 4.28Å; F138-I152 HydrophobicContact CE2-CD1 3.93Å; F138-I152 HydrophobicContact CE2-CG2 4.43Å; F138-I154 HydrophobicContact CE1-CD1 4.4Å; F138-L174 HydrophobicContact CD1-CD1 3.67Å; F138-L174 HydrophobicContact CE1-CD1 3.59Å; F138-L174 HydrophobicContact CE1-CD2 4.45Å; F138-L174 HydrophobicContact CE1-CG 4.02Å; F138-L174 HydrophobicContact CG-CD1 4.43Å; F138-L174 HydrophobicContact CZ-CD1 4.3Å; F138-L174 HydrophobicContact CZ-CG 4.46Å; F138-L178 HydrophobicContact CE1-CD1 4.48Å; F138-L178 HydrophobicContact CE1-CD2 4.48Å; F138-L178 HydrophobicContact CZ-CD2 4.32Å
139Q87.3Confident87.9Confident134 Ų13474.7 Ų74.763%0.62642%0.419SS*.Hα-helixtrans-66.6-39.8176.8-68.2177.4-9.800112.3T135 L141 G142T135-Q139 PolarHBondContact O-N 3.46Å; Q139-L141 PolarHBondContact O-N 2.98Å; Q139-G142 PolarHBondContact O-N 2.98Å
140A87.6Confident87.9Confident87 Ų8774.1 Ų74.172%0.71941%0.413SS*.Hα-helixtrans-62.2-27.2176.600000113.1S136 F137 G142S136-A140 WeakPolarHBondContact O-CB 3.5Å; S136-A140 PolarHBondContact O-N 3.34Å; F137-A140 PolarHBondContact O-N 2.86Å; A140-G142 VanDerWaalsContact C-N 3.35Å
141L86.2Confident88Confident35 Ų3574.2 Ų74.218%0.18342%0.415CS..THydrogen-bonded Turntrans-91.95.7176.6-67.6171.5000113.1F137 F138 Q139 I143 E171 L174F137-L141 HydrophobicContact CD1-CD1 4.32Å; F137-L141 HydrophobicContact CE1-CD1 4.22Å; F137-L141 PolarHBondContact O-N 3.15Å; F138-L141 PolarHBondContact O-N 2.97Å; Q139-L141 PolarHBondContact O-N 2.98Å; L141-I143 VanDerWaalsContact C-N 3.26Å; L141-I143 HydrophobicContact CB-CD1 4.21Å; L141-I143 HydrophobicContact CB-CG1 4.21Å; L141-I143 PolarHBondContact O-N 2.98Å; L141-E171 HydrophobicContact CD2-CG 3.72Å; L141-L174 HydrophobicContact CD1-CB 4.13Å; L141-L174 HydrophobicContact CD1-CD1 3.43Å; L141-L174 VanDerWaalsContact CD1-CD1 3.43Å; L141-L174 HydrophobicContact CD1-CG 4.41Å
142G85.9Confident88.1Confident57 Ų5772.5 Ų72.559%0.58840%0.398SS*.THydrogen-bonded Turntrans71.216.5179.900000114.5F138 Q139 A140F138-G142 PolarHBondContact O-N 3.29Å; Q139-G142 PolarHBondContact O-N 2.98Å; A140-G142 VanDerWaalsContact C-N 3.35Å
143I89.6Confident88.3Confident3 Ų373 Ų732%0.01539%0.394CS..  trans-87119.3178.7-53.6171000109F138 L141 T145 I154 L160 L174F138-I143 HydrophobicContact CB-CB 4.43Å; F138-I143 HydrophobicContact CD1-CD1 4.08Å; F138-I143 HydrophobicContact CD1-CG2 4.47Å; F138-I143 PolarHBondContact O-N 3.35Å; L141-I143 VanDerWaalsContact C-N 3.26Å; L141-I143 HydrophobicContact CB-CD1 4.21Å; L141-I143 HydrophobicContact CB-CG1 4.21Å; L141-I143 PolarHBondContact O-N 2.98Å; I143-T145 HydrophobicContact CG2-CG2 4.06Å; I143-T145 PolarHBondContact O-N 3.01Å; I143-I154 HydrophobicContact CG2-CG1 4.36Å; I143-I154 HydrophobicContact CG2-CG2 3.93Å; I143-L160 HydrophobicContact CD1-CD1 4.43Å; I143-L160 HydrophobicContact CD1-CD2 3.77Å; I143-L160 HydrophobicContact CG1-CD2 3.86Å; I143-L174 HydrophobicContact CD1-CD1 3.59Å
144T90.1Very high88.5Confident74 Ų7464.8 Ų64.845%0.45436%0.356SS..  trans-72.3111.9176.652.10000110.7L155T144-L155 PolarHBondContact O-N 3.35Å
145T90.4Very high88.8Confident30 Ų3065.5 Ų65.518%0.18436%0.363CS..EExtended strand (participates in β ladder)trans-124.3150.5-178.851.90000111.7F138 I143 I152 E153 I154F138-T145 HydrophobicContact CB-CG2 3.74Å; F138-T145 HydrophobicContact CD1-CG2 3.97Å; F138-T145 HydrophobicContact CG-CG2 3.92Å; I143-T145 HydrophobicContact CG2-CG2 4.06Å; I143-T145 PolarHBondContact O-N 3.01Å; T145-I152 HydrophobicContact CG2-CG2 3.77Å; T145-E153 CarbonylContact C-O 3.53Å; T145-E153 VanDerWaalsContact CA-O 3.24Å; T145-E153 WeakPolarHBondContact CA-O 3.21Å; T145-I154 HydrophobicContact CG2-CG1 3.96Å
146K90.6Very high88.9Confident133 Ų13366.5 Ų66.558%0.57837%0.372SS*.EExtended strand (participates in β ladder)trans-127.3143175-173176.4179.9-179.50109.3S148 E153 L155K146-S148 PolarHBondContact O-N 3.1Å; K146-E153 PolarHBondContact N-O 3.43Å; K146-E153 PolarHBondContact O-N 2.92Å; K146-L155 HydrophobicContact CB-CD1 4.39Å; K146-L155 HydrophobicContact CB-CD2 4Å; K146-L155 HydrophobicContact CB-CG 4.27Å; K146-L155 HydrophobicContact CD-CD2 4.44Å
147I91.4Very high89Confident94 Ų9468.3 Ų68.348%0.48238%0.376SS..EExtended strand (participates in β ladder)trans-83.3113.4173.7-56.1171.3000107.7P132 T135 T151P132-I147 HydrophobicContact CB-CD1 4.23Å; T135-I147 HydrophobicContact CG2-CD1 4.07Å; T135-I147 HydrophobicContact CG2-CG1 4.04Å; I147-T151 WeakPolarHBondContact CA-O 3.38Å
148S88.3Confident89.1Confident27 Ų2766.9 Ų66.919%0.18937%0.372CS..EExtended strand (participates in β ladder)trans-117125.3172.963.10000109K146 G150 T151 E153K146-S148 PolarHBondContact O-N 3.1Å; S148-G150 PolarHBondContact O-N 3.1Å; S148-T151 PolarHBondContact N-O 3.38Å; S148-T151 PolarHBondContact O-N 3.37Å; S148-T151 VanDerWaalsContact O-O 3.05Å; S148-T151 PolarHBondContact O-OG1 3.4Å; S148-E153 WeakPolarHBondContact CB-OE2 3.21Å; S148-E153 PolarHBondContact OG-OE2 3.5Å
149R86.6Confident89.1Confident257 Ų25772.3 Ų72.397%0.9740%0.399SS*.THydrogen-bonded Turntrans51.434177-56.9-179.5178.41740.3114.8T151R149-T151 VanDerWaalsContact C-N 3.33Å
150G87.6Confident89Confident44 Ų4467.3 Ų67.345%0.45438%0.376SS..THydrogen-bonded Turntrans83.13179.300000115.3S148S148-G150 PolarHBondContact O-N 3.1Å
151T90.4Very high89Confident35 Ų3563.3 Ų63.322%0.21534%0.343CS..EExtended strand (participates in β ladder)trans-117.7154.1174.648.60000111.5N127 L130 I147 S148 R149N127-T151 PolarHBondContact ND2-OG1 2.9Å; N127-T151 WeakPolarHBondContact OD1-CB 3.37Å; N127-T151 PolarHBondContact OD1-OG1 3.09Å; L130-T151 WeakPolarHBondContact O-CA 3.49Å; I147-T151 WeakPolarHBondContact CA-O 3.38Å; S148-T151 PolarHBondContact N-O 3.38Å; S148-T151 PolarHBondContact O-N 3.37Å; S148-T151 VanDerWaalsContact O-O 3.05Å; S148-T151 PolarHBondContact O-OG1 3.4Å; R149-T151 VanDerWaalsContact C-N 3.33Å
152I90.4Very high89.2Confident0 Ų068.1 Ų68.10%036%0.362CS..EExtended strand (participates in β ladder)trans-83.2124.9178-54.2172000110.1N127 T128 L130 G131 K134 T135 F138 T145N127-I152 PolarHBondContact OD1-O 3.47Å; N127-I152 VanDerWaalsContact OD1-O 3.14Å; T128-I152 WeakPolarHBondContact CB-O 3.29Å; T128-I152 PolarHBondContact N-O 2.85Å; T128-I152 PolarHBondContact OG1-O 3.09Å; L130-I152 HydrophobicContact CB-CD1 4.35Å; L130-I152 PolarHBondContact O-N 3.04Å; G131-I152 VanDerWaalsContact O-CD1 3.29Å; G131-I152 WeakPolarHBondContact O-CD1 3.49Å; K134-I152 HydrophobicContact CB-CD1 4.49Å; T135-I152 HydrophobicContact CG2-CD1 3.55Å; T135-I152 HydrophobicContact CG2-CG1 3.64Å; F138-I152 HydrophobicContact CD2-CD1 4.04Å; F138-I152 HydrophobicContact CD2-CG2 4.28Å; F138-I152 HydrophobicContact CE2-CD1 3.93Å; F138-I152 HydrophobicContact CE2-CG2 4.43Å; T145-I152 HydrophobicContact CG2-CG2 3.77Å
153E90.7Very high89.4Confident74 Ų7469 Ų6935%0.34636%0.358SS..EExtended strand (participates in β ladder)trans-115.2132.5176.8-173.5174.1-169.300111N127 T145 K146 S148N127-E153 HydrophobicContact CB-CG 4.42Å; T145-E153 CarbonylContact C-O 3.53Å; T145-E153 VanDerWaalsContact CA-O 3.24Å; T145-E153 WeakPolarHBondContact CA-O 3.21Å; K146-E153 PolarHBondContact N-O 3.43Å; K146-E153 PolarHBondContact O-N 2.92Å; S148-E153 WeakPolarHBondContact CB-OE2 3.21Å; S148-E153 PolarHBondContact OG-OE2 3.5Å
154I91.6Very high89.3Confident5 Ų571.2 Ų71.23%0.02638%0.382CS..EExtended strand (participates in β ladder)trans-85.6126.2176.7-58.9174.2000108.2V123 A125 Q126 T128 F138 I143 T145 S156 L178V123-I154 HydrophobicContact CG1-CD1 3.41Å; V123-I154 VanDerWaalsContact CG1-CD1 3.41Å; A125-I154 WeakPolarHBondContact CA-O 3.39Å; Q126-I154 PolarHBondContact O-N 3.4Å; T128-I154 HydrophobicContact CG2-CD1 3.83Å; T128-I154 HydrophobicContact CG2-CG1 3.88Å; F138-I154 HydrophobicContact CE1-CD1 4.4Å; I143-I154 HydrophobicContact CG2-CG1 4.36Å; I143-I154 HydrophobicContact CG2-CG2 3.93Å; T145-I154 HydrophobicContact CG2-CG1 3.96Å; I154-S156 WeakPolarHBondContact CG2-O 3.26Å; I154-L178 HydrophobicContact CD1-CD1 4.23Å
155L90.6Very high89.3Confident104 Ų10472 Ų7255%0.54538%0.383SS..  trans-79.6-34.7-173.3-68.2175.1000113.9T144 K146T144-L155 PolarHBondContact O-N 3.35Å; K146-L155 HydrophobicContact CB-CD1 4.39Å; K146-L155 HydrophobicContact CB-CD2 4Å; K146-L155 HydrophobicContact CB-CG 4.27Å; K146-L155 HydrophobicContact CD-CD2 4.44Å
156S89.8Confident89.3Confident56 Ų5678.1 Ų78.139%0.39241%0.407SS..SBendtrans-146.1153.9-174.660.10000111.1I154 V158I154-S156 WeakPolarHBondContact CG2-O 3.26Å; S156-V158 PolarHBondContact O-N 3.13Å
157D90Very high89.3Confident114 Ų11471.9 Ų71.961%0.6138%0.38SS*.  trans-66.2129.4175.3-62.20.6000110.3V123 P124 A125V123-D157 WeakPolarHBondContact O-CA 3.23Å; P124-D157 VanDerWaalsContact CA-OD1 3.29Å; P124-D157 WeakPolarHBondContact CA-OD1 3.3Å; A125-D157 WeakPolarHBondContact CB-OD1 3.47Å; A125-D157 PolarHBondContact N-OD1 3.02Å
158V87.5Confident89.3Confident37 Ų3768.5 Ų68.522%0.22437%0.369CS..EExtended strand (participates in β ladder)trans-127132.1178.7-1780000109.8V123 S156 L160V123-V158 PolarHBondContact N-O 3.34Å; V123-V158 PolarHBondContact O-N 3.15Å; S156-V158 PolarHBondContact O-N 3.13Å; V158-L160 HydrophobicContact CG1-CD2 4.48Å; V158-L160 PolarHBondContact O-N 3.13Å
159M87.8Confident89.4Confident118 Ų11870.4 Ų70.458%0.58139%0.386SS*.EExtended strand (participates in β ladder)trans-79.3115.1171-51.4-176.390.900108.5D120 T122D120-M159 HydrophobicContact CB-CE 4.27Å; T122-M159 HydrophobicContact CG2-CB 4.33Å; T122-M159 HydrophobicContact CG2-CE 4.18Å; T122-M159 HydrophobicContact CG2-CG 3.83Å
160L85.3Confident89.6Confident29 Ų2960.5 Ų60.515%0.15236%0.356CS..EExtended strand (participates in β ladder)trans-86.2-42.3-178.9-67.8-176.3000112.2V121 V123 I143 V158 L174 L175V121-L160 PolarHBondContact O-N 2.91Å; V123-L160 HydrophobicContact CG2-CD1 3.36Å; V123-L160 HydrophobicContact CG2-CG 3.9Å; I143-L160 HydrophobicContact CD1-CD1 4.43Å; I143-L160 HydrophobicContact CD1-CD2 3.77Å; I143-L160 HydrophobicContact CG1-CD2 3.86Å; V158-L160 HydrophobicContact CG1-CD2 4.48Å; V158-L160 PolarHBondContact O-N 3.13Å; L160-L174 HydrophobicContact CD1-CD2 4.34Å; L160-L175 HydrophobicContact CD1-CD2 4.34Å
161I88.6Confident89.6Confident4 Ų460.4 Ų60.42%0.02134%0.344CS..EExtended strand (participates in β ladder)trans-137.1132.4-169.2-44.8178.9000109.2A117 D120 V121 D165 V167 E171A117-I161 HydrophobicContact CB-CG2 3.59Å; D120-I161 WeakPolarHBondContact CA-O 3.44Å; V121-I161 HydrophobicContact CB-CB 4.17Å; V121-I161 HydrophobicContact CB-CG1 4.37Å; V121-I161 HydrophobicContact CG2-CB 4.24Å; V121-I161 HydrophobicContact CG2-CD1 4.44Å; V121-I161 PolarHBondContact N-O 3.44Å; I161-D165 HydrophobicContact CG2-CB 4.03Å; I161-V167 HydrophobicContact CD1-CB 4.17Å; I161-V167 HydrophobicContact CD1-CG1 3.84Å; I161-V167 HydrophobicContact CD1-CG2 3.86Å; I161-E171 HydrophobicContact CD1-CB 4.21Å; I161-E171 WeakPolarHBondContact CD1-OE2 3.45Å
162K89.8Confident89.6Confident135 Ų13558.9 Ų58.959%0.58734%0.335SS*.  trans-92.7164.5173.6-69.6-176.9-178.3179.20110.9D120 G164 D165D120-K162 WeakPolarHBondContact OD1-CA 3.3Å; K162-G164 PolarHBondContact O-N 2.85Å; K162-D165 PolarHBondContact O-N 2.81Å
163P90.5Very high89.5Confident76 Ų7661.8 Ų61.849%0.49435%0.352SS..THydrogen-bonded Turntrans-70.6133-177.8218000108.4D120D120-P163 WeakPolarHBondContact OD1-CD 3.44Å; D120-P163 VanDerWaalsContact OD1-CG 3.28Å; D120-P163 WeakPolarHBondContact OD1-CG 3.18Å
164G88.1Confident89.4Confident50 Ų5058.3 Ų58.352%0.51534%0.336SS..THydrogen-bonded Turntrans93-12.8-179.400000115.2A117 K162A117-G164 PolarHBondContact O-N 3.27Å; K162-G164 PolarHBondContact O-N 2.85Å
165D90.3Very high89.3Confident89 Ų8958.1 Ų58.148%0.47634%0.335SS..PPolyproline II helixtrans-76.6151.4173.7-71.8-23.6000111.3A117 I161 K162A117-D165 PolarHBondContact N-O 3.49Å; I161-D165 HydrophobicContact CG2-CB 4.03Å; K162-D165 PolarHBondContact O-N 2.81Å
166K90.3Very high89.2Confident159 Ų15956.9 Ų56.969%0.69133%0.329SS*.BIsolated β-bridgetrans-83.1127.2175-69.1-177.7-178.3177.40109.3A115 G168A115-K166 WeakPolarHBondContact O-CA 3.04Å; K166-G168 PolarHBondContact O-N 2.89Å
167V90.3Very high89.1Confident3 Ų358 Ų582%0.01833%0.329CS..PPolyproline II helixtrans-64122.8177.7-178.80000110.1A111 G114 A115 A117 I161 E171 A172 F183A111-V167 HydrophobicContact CB-CG1 3.95Å; A111-V167 HydrophobicContact CB-CG2 4.28Å; G114-V167 PolarHBondContact N-O 2.88Å; A115-V167 WeakPolarHBondContact O-CG2 3.43Å; A115-V167 PolarHBondContact O-N 2.94Å; A117-V167 HydrophobicContact CB-CG2 4.46Å; I161-V167 HydrophobicContact CD1-CB 4.17Å; I161-V167 HydrophobicContact CD1-CG1 3.84Å; I161-V167 HydrophobicContact CD1-CG2 3.86Å; V167-E171 HydrophobicContact CG1-CB 4.43Å; V167-A172 HydrophobicContact CG1-CB 3.81Å; V167-F183 HydrophobicContact CG2-CE2 4.26Å; V167-F183 HydrophobicContact CG2-CZ 4.39Å
168G90.9Very high88.9Confident23 Ų2354 Ų5424%0.23731%0.307CS..PPolyproline II helixtrans-66.6152.1173.700000112.3K166 S170 E171 A172K166-G168 PolarHBondContact O-N 2.89Å; G168-S170 VanDerWaalsContact C-N 3.25Å; G168-S170 PolarHBondContact O-N 3.48Å; G168-E171 PolarHBondContact N-OE2 3.4Å; G168-E171 PolarHBondContact O-N 3.29Å; G168-A172 WeakPolarHBondContact O-CB 3.44Å; G168-A172 PolarHBondContact O-N 3.33Å
169A90.9Very high88.9Confident67 Ų6759.1 Ų59.155%0.55433%0.334SS*.Hα-helixtrans-63.4-34.2176.300000112.3A113 T173A113-A169 HydrophobicContact CB-CB 4.07Å; A169-T173 WeakPolarHBondContact O-CG2 3.39Å; A169-T173 PolarHBondContact O-N 3.43Å; A169-T173 PolarHBondContact O-OG1 3.36Å
170S89.4Confident89Confident48 Ų4855.6 Ų55.634%0.33632%0.317SS..Hα-helixtrans-69.2-43.8175.8410000112.4F137 G168 T173 L174F137-S170 VanDerWaalsContact CE1-O 3.24Å; F137-S170 WeakPolarHBondContact CE1-O 3.14Å; F137-S170 VanDerWaalsContact CZ-O 3.31Å; F137-S170 WeakPolarHBondContact CZ-O 3.41Å; G168-S170 VanDerWaalsContact C-N 3.25Å; G168-S170 PolarHBondContact O-N 3.48Å; S170-T173 PolarHBondContact O-N 3.29Å; S170-T173 PolarHBondContact O-OG1 3.07Å; S170-L174 WeakPolarHBondContact O-CB 3.29Å; S170-L174 PolarHBondContact O-N 3.3Å
171E88.3Confident89.1Confident42 Ų4256.7 Ų56.720%0.19633%0.327CS..Hα-helixtrans-63.3-46.6177.1-64.7163.5-176.300111.8L141 I161 V167 G168 T173 L174 L175L141-E171 HydrophobicContact CD2-CG 3.72Å; I161-E171 HydrophobicContact CD1-CB 4.21Å; I161-E171 WeakPolarHBondContact CD1-OE2 3.45Å; V167-E171 HydrophobicContact CG1-CB 4.43Å; G168-E171 PolarHBondContact N-OE2 3.4Å; G168-E171 PolarHBondContact O-N 3.29Å; E171-T173 VanDerWaalsContact C-N 3.33Å; E171-T173 PolarHBondContact O-N 3.5Å; E171-L174 PolarHBondContact O-N 2.95Å; E171-L175 VanDerWaalsContact O-CG 3.31Å; E171-L175 WeakPolarHBondContact O-CG 3.49Å; E171-L175 PolarHBondContact O-N 3.45Å
172A89.4Confident88.8Confident4 Ų458.3 Ų58.33%0.03334%0.338CS..Hα-helixtrans-59.8-42.9177.800000112.2A111 A113 V167 G168 N176A111-A172 WeakPolarHBondContact O-CB 3.32Å; A113-A172 HydrophobicContact CB-CB 4.39Å; V167-A172 HydrophobicContact CG1-CB 3.81Å; G168-A172 WeakPolarHBondContact O-CB 3.44Å; G168-A172 PolarHBondContact O-N 3.33Å; A172-N176 WeakPolarHBondContact O-CB 3.45Å; A172-N176 VanDerWaalsContact O-CG 3.31Å; A172-N176 PolarHBondContact O-N 2.89Å; A172-N176 VanDerWaalsContact O-N 3.08Å; A172-N176 PolarHBondContact O-ND2 3.21Å
173T89Confident88.7Confident60 Ų6052.2 Ų52.237%0.36831%0.311SS..Hα-helixtrans-70.8-35.7179.547.20000111.9F137 A169 S170 E171 N176 M177F137-T173 WeakPolarHBondContact CZ-OG1 3.34Å; A169-T173 WeakPolarHBondContact O-CG2 3.39Å; A169-T173 PolarHBondContact O-N 3.43Å; A169-T173 PolarHBondContact O-OG1 3.36Å; S170-T173 PolarHBondContact O-N 3.29Å; S170-T173 PolarHBondContact O-OG1 3.07Å; E171-T173 VanDerWaalsContact C-N 3.33Å; E171-T173 PolarHBondContact O-N 3.5Å; T173-N176 PolarHBondContact O-N 2.84Å; T173-M177 WeakPolarHBondContact O-CG 3.45Å; T173-M177 PolarHBondContact O-N 2.97Å
174L88.2Confident88.4Confident2 Ų251.9 Ų51.91%0.0131%0.311CS..Hα-helixtrans-59.8-51.8171.7-174.5150.9000111.2V123 F137 F138 L141 I143 L160 S170 E171 N176 M177 L178V123-L174 HydrophobicContact CG2-CD2 4.35Å; F137-L174 HydrophobicContact CD1-CB 4.36Å; F137-L174 HydrophobicContact CD1-CD1 4.35Å; F137-L174 HydrophobicContact CE1-CB 3.88Å; F138-L174 HydrophobicContact CD1-CD1 3.67Å; F138-L174 HydrophobicContact CE1-CD1 3.59Å; F138-L174 HydrophobicContact CE1-CD2 4.45Å; F138-L174 HydrophobicContact CE1-CG 4.02Å; F138-L174 HydrophobicContact CG-CD1 4.43Å; F138-L174 HydrophobicContact CZ-CD1 4.3Å; F138-L174 HydrophobicContact CZ-CG 4.46Å; L141-L174 HydrophobicContact CD1-CB 4.13Å; L141-L174 HydrophobicContact CD1-CD1 3.43Å; L141-L174 VanDerWaalsContact CD1-CD1 3.43Å; L141-L174 HydrophobicContact CD1-CG 4.41Å; I143-L174 HydrophobicContact CD1-CD1 3.59Å; L160-L174 HydrophobicContact CD1-CD2 4.34Å; S170-L174 WeakPolarHBondContact O-CB 3.29Å; S170-L174 PolarHBondContact O-N 3.3Å; E171-L174 PolarHBondContact O-N 2.95Å; L174-N176 VanDerWaalsContact C-N 3.26Å; L174-N176 PolarHBondContact O-N 3.29Å; L174-M177 PolarHBondContact O-N 3.44Å; L174-L178 HydrophobicContact CD2-CD1 3.38Å; L174-L178 HydrophobicContact CD2-CG 3.95Å; L174-L178 HydrophobicContact CG-CD1 4.32Å; L174-L178 PolarHBondContact O-N 3.27Å
175L89.2Confident88Confident0 Ų052 Ų520%030%0.297CS..Hα-helixtrans-59.8-39.7-178.5-69.9166.7000111.5A111 V121 V123 L160 E171 L178 N179 I180 P182A111-L175 HydrophobicContact CB-CD1 3.94Å; V121-L175 HydrophobicContact CG1-CD1 3.85Å; V121-L175 HydrophobicContact CG1-CD2 3.77Å; V121-L175 HydrophobicContact CG1-CG 4.48Å; V123-L175 HydrophobicContact CG2-CD2 4.04Å; L160-L175 HydrophobicContact CD1-CD2 4.34Å; E171-L175 VanDerWaalsContact O-CG 3.31Å; E171-L175 WeakPolarHBondContact O-CG 3.49Å; E171-L175 PolarHBondContact O-N 3.45Å; L175-L178 PolarHBondContact O-N 3.43Å; L175-N179 PolarHBondContact O-N 3.39Å; L175-I180 HydrophobicContact CD2-CB 4.15Å; L175-I180 HydrophobicContact CD2-CG2 4.12Å; L175-I180 PolarHBondContact O-N 2.93Å; L175-P182 HydrophobicContact CD1-CG 4.32Å
176N89.1Confident87.7Confident79 Ų7948 Ų4842%0.42228%0.278SS..Hα-helixtrans-61.7-42.9172.1-76.9-49.4000112.7A110 A172 T173 L174 L178 N179A110-N176 WeakPolarHBondContact CB-OD1 3.2Å; A172-N176 WeakPolarHBondContact O-CB 3.45Å; A172-N176 VanDerWaalsContact O-CG 3.31Å; A172-N176 PolarHBondContact O-N 2.89Å; A172-N176 VanDerWaalsContact O-N 3.08Å; A172-N176 PolarHBondContact O-ND2 3.21Å; T173-N176 PolarHBondContact O-N 2.84Å; L174-N176 VanDerWaalsContact C-N 3.26Å; L174-N176 PolarHBondContact O-N 3.29Å; N176-L178 VanDerWaalsContact C-N 3.34Å; N176-N179 PolarHBondContact O-N 2.91Å
177M87.1Confident87.5Confident78 Ų7840.6 Ų40.638%0.38425%0.246SC..Hα-helixtrans-68-33.5178.6-71.2-171.1-155.300112.6L130 K134 T173 L174 N179L130-M177 HydrophobicContact CD1-CB 4.43Å; K134-M177 HydrophobicContact CD-SD 3.95Å; K134-M177 PolarHBondContact NZ-SD 3.36Å; K134-M177 VanDerWaalsContact NZ-SD 3.35Å; T173-M177 WeakPolarHBondContact O-CG 3.45Å; T173-M177 PolarHBondContact O-N 2.97Å; L174-M177 PolarHBondContact O-N 3.44Å; M177-N179 PolarHBondContact O-N 2.87Å
178L87.5Confident87.4Confident30 Ų3045.5 Ų45.516%0.15727%0.271CS..THydrogen-bonded Turntrans-79.3-1174.9-63.1-174.1000113.2V123 T128 L130 F138 I154 L174 L175 N176 I180V123-L178 HydrophobicContact CG1-CD1 3.72Å; T128-L178 HydrophobicContact CG2-CD2 3.48Å; T128-L178 VanDerWaalsContact CG2-CD2 3.48Å; L130-L178 HydrophobicContact CD1-CD2 4.27Å; F138-L178 HydrophobicContact CE1-CD1 4.48Å; F138-L178 HydrophobicContact CE1-CD2 4.48Å; F138-L178 HydrophobicContact CZ-CD2 4.32Å; I154-L178 HydrophobicContact CD1-CD1 4.23Å; L174-L178 HydrophobicContact CD2-CD1 3.38Å; L174-L178 HydrophobicContact CD2-CG 3.95Å; L174-L178 HydrophobicContact CG-CD1 4.32Å; L174-L178 PolarHBondContact O-N 3.27Å; L175-L178 PolarHBondContact O-N 3.43Å; N176-L178 VanDerWaalsContact C-N 3.34Å; L178-I180 HydrophobicContact CB-CD1 3.85Å; L178-I180 HydrophobicContact CB-CG1 3.86Å; L178-I180 HydrophobicContact CD1-CD1 3.98Å; L178-I180 PolarHBondContact O-N 3.41Å
179N87.1Confident87.4Confident146 Ų14645.3 Ų45.378%0.78127%0.265SS*.THydrogen-bonded Turntrans54.328.6-171.9-58.1-59.7000113.3L175 N176 M177L175-N179 PolarHBondContact O-N 3.39Å; N176-N179 PolarHBondContact O-N 2.91Å; M177-N179 PolarHBondContact O-N 2.87Å
180I88.6Confident87.4Confident43 Ų4345.5 Ų45.522%0.22125%0.254CS..  trans-92.5112.6175.2-59.3173.7000107.4V123 L175 L178 P182V123-I180 HydrophobicContact CG1-CD1 4.28Å; V123-I180 HydrophobicContact CG2-CD1 4.48Å; L175-I180 HydrophobicContact CD2-CB 4.15Å; L175-I180 HydrophobicContact CD2-CG2 4.12Å; L175-I180 PolarHBondContact O-N 2.93Å; L178-I180 HydrophobicContact CB-CD1 3.85Å; L178-I180 HydrophobicContact CB-CG1 3.86Å; L178-I180 HydrophobicContact CD1-CD1 3.98Å; L178-I180 PolarHBondContact O-N 3.41Å; I180-P182 VanDerWaalsContact O-CD 3.24Å; I180-P182 WeakPolarHBondContact O-CD 3.37Å
181S87.6Confident87.4Confident53 Ų5345 Ų4537%0.37125%0.246SC..  trans-105.190.8173.752.50000109.3P108 F183P108-S181 WeakPolarHBondContact CB-OG 3.32Å; S181-F183 VanDerWaalsContact C-N 3.33Å; S181-F183 PolarHBondContact O-N 3.14Å
182P84Confident87.6Confident38 Ų3843 Ų4325%0.24724%0.237CC..  trans-77.4-18.3-168.231.3-37.7000113.8A111 V121 L175 I180A111-P182 HydrophobicContact CB-CG 4.25Å; V121-P182 HydrophobicContact CB-CB 4.3Å; V121-P182 HydrophobicContact CG1-CB 3.77Å; V121-P182 HydrophobicContact CG1-CG 3.91Å; V121-P182 HydrophobicContact CG2-CB 3.75Å; V121-P182 HydrophobicContact CG2-CG 3.85Å; L175-P182 HydrophobicContact CD1-CG 4.32Å; I180-P182 VanDerWaalsContact O-CD 3.24Å; I180-P182 WeakPolarHBondContact O-CD 3.37Å
183F85.9Confident87.6Confident6 Ų643.3 Ų43.33%0.02624%0.238CC..EExtended strand (participates in β ladder)trans-105.1144.4-177-52.1-37.5000110A109 A111 A117 P118 V121 V167 S181 F185A109-F183 PolarHBondContact N-O 3.32Å; A109-F183 PolarHBondContact O-N 2.91Å; A109-F183 VanDerWaalsContact O-O 3.05Å; A111-F183 HydrophobicContact CB-CD2 4.09Å; A111-F183 HydrophobicContact CB-CE2 3.52Å; A111-F183 HydrophobicContact CB-CZ 4.25Å; A117-F183 HydrophobicContact CB-CE1 4.29Å; A117-F183 HydrophobicContact CB-CZ 3.83Å; P118-F183 HydrophobicContact CG-CD1 3.68Å; P118-F183 HydrophobicContact CG-CE1 4.06Å; P118-F183 HydrophobicContact CG-CG 4.03Å; V121-F183 HydrophobicContact CG2-CE1 3.54Å; V121-F183 HydrophobicContact CG2-CZ 3.71Å; V167-F183 HydrophobicContact CG2-CE2 4.26Å; V167-F183 HydrophobicContact CG2-CZ 4.39Å; S181-F183 VanDerWaalsContact C-N 3.33Å; S181-F183 PolarHBondContact O-N 3.14Å; F183-F185 HydrophobicContact CB-CE2 3.96Å; F183-F185 HydrophobicContact CB-CZ 4.03Å; F183-F185 HydrophobicContact CD2-CE2 4.49Å; F183-F185 HydrophobicContact CD2-CZ 4.37Å; F183-F185 HydrophobicContact CG-CZ 4.49Å
184S84.4Confident87.6Confident70 Ų7042.4 Ų42.449%0.4923%0.23SC..EExtended strand (participates in β ladder)trans-114.4116.5169.366.30000108.3V107V107-S184 WeakPolarHBondContact O-CA 3.45Å
185F81.4Confident87.3Confident51 Ų5147.9 Ų47.922%0.22426%0.26CS..EExtended strand (participates in β ladder)trans-102138.3172.8-63.9-64.8000109.6N34 Q39 V107 A109 F183N34-F185 HydrophobicContact CB-CD1 4.17Å; N34-F185 HydrophobicContact CB-CD2 4.07Å; N34-F185 HydrophobicContact CB-CE1 4.45Å; N34-F185 HydrophobicContact CB-CE2 4.4Å; N34-F185 HydrophobicContact CB-CG 4Å; Q39-F185 PolarHBondContact NE2-O 3.45Å; V107-F185 PolarHBondContact N-O 2.94Å; V107-F185 PolarHBondContact O-N 2.87Å; A109-F185 HydrophobicContact CB-CD2 3.3Å; A109-F185 HydrophobicContact CB-CE2 3.77Å; A109-F185 HydrophobicContact CB-CG 4.36Å; F183-F185 HydrophobicContact CB-CE2 3.96Å; F183-F185 HydrophobicContact CB-CZ 4.03Å; F183-F185 HydrophobicContact CD2-CE2 4.49Å; F183-F185 HydrophobicContact CD2-CZ 4.37Å; F183-F185 HydrophobicContact CG-CZ 4.49Å
186G83.2Confident87Confident7 Ų748.1 Ų48.17%0.07226%0.262CS..  trans-148.5-178.5176.800000109.4L188G186-L188 PolarHBondContact O-N 3.38Å
187L86.8Confident86.9Confident3 Ų346.3 Ų46.32%0.01626%0.256CS..PPolyproline II helixtrans-69117.4167.9-72.7167.6000108.4V30 A32 M40 I43 L102V30-L187 HydrophobicContact CB-CB 4.32Å; V30-L187 HydrophobicContact CB-CD2 4.16Å; V30-L187 HydrophobicContact CG1-CB 4.46Å; V30-L187 HydrophobicContact CG2-CD2 3.96Å; A32-L187 HydrophobicContact CB-CD2 3.89Å; M40-L187 HydrophobicContact SD-CD2 4.05Å; I43-L187 HydrophobicContact CD1-CD1 3.79Å; I43-L187 HydrophobicContact CD1-CG 3.97Å; I43-L187 HydrophobicContact CG2-CD1 3.7Å; L102-L187 HydrophobicContact CD2-CB 4.44Å; L102-L187 HydrophobicContact CD2-CD1 3.79Å
188L88.3Confident86.9Confident106 Ų10644.1 Ų44.156%0.55525%0.247SC*.EExtended strand (participates in β ladder)trans-87.9122.8175.2-65.7177.1000108.6V30 G31 G186 Q190V30-L188 CarbonylContact C-O 3.52Å; V30-L188 WeakPolarHBondContact CA-O 3.39Å; G31-L188 PolarHBondContact N-O 3.11Å; G31-L188 PolarHBondContact O-N 2.86Å; G31-L188 VanDerWaalsContact O-N 3.11Å; G186-L188 PolarHBondContact O-N 3.38Å; L188-Q190 PolarHBondContact O-N 3.28Å
189I90.4Very high86.9Confident19 Ų1947.6 Ų47.610%0.09726%0.258CS..EExtended strand (participates in β ladder)trans-76.5116.1175.6-59163.6000107.3F28 V30 R99 L102 V192 P201F28-I189 HydrophobicContact CD1-CD1 4.37Å; F28-I189 HydrophobicContact CD1-CG1 4.46Å; F28-I189 HydrophobicContact CD1-CG2 3.74Å; F28-I189 HydrophobicContact CE1-CD1 4.46Å; F28-I189 HydrophobicContact CE1-CG2 4.4Å; V30-I189 HydrophobicContact CG1-CG1 4.33Å; R99-I189 HydrophobicContact CB-CD1 3.91Å; R99-I189 HydrophobicContact CG-CD1 3.68Å; L102-I189 HydrophobicContact CB-CD1 4.45Å; L102-I189 HydrophobicContact CD1-CD1 4.04Å; L102-I189 HydrophobicContact CD1-CG1 4.13Å; I189-V192 HydrophobicContact CG2-CG2 3.95Å; I189-P201 HydrophobicContact CB-CB 4.46Å; I189-P201 HydrophobicContact CG2-CB 4.2Å
190Q90Very high86.9Confident70 Ų7042.6 Ų42.633%0.32724%0.235SC..EExtended strand (participates in β ladder)trans-87.9-45.5178.2-70.1-174.5-10.900111.3I29 L188 P201I29-Q190 HydrophobicContact CG2-CB 4.35Å; I29-Q190 PolarHBondContact O-N 3.39Å; L188-Q190 PolarHBondContact O-N 3.28Å; Q190-P201 WeakPolarHBondContact O-CD 3.47Å
191Q90.7Very high86.7Confident38 Ų3842 Ų4218%0.17823%0.234CC..EExtended strand (participates in β ladder)trans-150.9155.9-177.6-65.3-64.5-38.600109.6I29 H81 V198 Y199I29-Q191 HydrophobicContact CB-CB 4.18Å; I29-Q191 HydrophobicContact CD1-CB 4.18Å; I29-Q191 HydrophobicContact CG1-CB 4.41Å; I29-Q191 PolarHBondContact N-O 3.2Å; I29-Q191 PolarHBondContact O-N 2.93Å; H81-Q191 HydrophobicContact CB-CG 4.08Å; Q191-V198 HydrophobicContact CB-CG1 4.03Å; Q191-V198 HydrophobicContact CG-CG1 4.31Å; Q191-Y199 WeakPolarHBondContact CA-O 3.26Å; Q191-Y199 PolarHBondContact OE1-O 2.91Å
192V91.5Very high86.6Confident1 Ų146.3 Ų46.31%0.00625%0.248CC..EExtended strand (participates in β ladder)trans-121.1136.9178.5-169.20000108.3F28 L95 I189 V198 Y199 L204F28-V192 HydrophobicContact CD1-CB 4.25Å; F28-V192 HydrophobicContact CD1-CG1 3.91Å; F28-V192 HydrophobicContact CD1-CG2 3.7Å; F28-V192 HydrophobicContact CE1-CB 4.27Å; F28-V192 HydrophobicContact CE1-CG1 3.66Å; F28-V192 HydrophobicContact CE1-CG2 3.67Å; F28-V192 HydrophobicContact CZ-CG1 4.31Å; L95-V192 HydrophobicContact CD1-CG1 3.93Å; L95-V192 HydrophobicContact CD2-CG1 3.72Å; L95-V192 HydrophobicContact CG-CG1 4.36Å; I189-V192 HydrophobicContact CG2-CG2 3.95Å; V192-V198 CarbonylContact O-C 3.59Å; V192-V198 VanDerWaalsContact O-CA 3.26Å; V192-V198 WeakPolarHBondContact O-CA 3.26Å; V192-Y199 PolarHBondContact N-O 3.41Å; V192-Y199 PolarHBondContact O-N 3.34Å; V192-L204 HydrophobicContact CG1-CD1 4.38Å; V192-L204 HydrophobicContact CG2-CD1 3.77Å
193Y89.5Confident86.6Confident10 Ų1047.7 Ų47.74%0.03926%0.256CS..EExtended strand (participates in β ladder)trans-114.7128.9174.2-179.6-102.4000109.5K26 C27 L75 L78 G196 S197 V198K26-Y193 WeakPolarHBondContact CA-O 3.23Å; C27-Y193 PolarHBondContact N-O 2.83Å; C27-Y193 WeakPolarHBondContact O-CB 3.24Å; C27-Y193 PolarHBondContact O-N 3.46Å; C27-Y193 WeakPolarHBondContact SG-CB 3.31Å; L75-Y193 HydrophobicContact CD2-CE1 4.18Å; L75-Y193 HydrophobicContact CD2-CE2 4.46Å; L78-Y193 HydrophobicContact CD1-CD1 4.49Å; L78-Y193 HydrophobicContact CD1-CD2 3.93Å; L78-Y193 HydrophobicContact CD1-CE2 4.12Å; L78-Y193 HydrophobicContact CD1-CG 4.09Å; L78-Y193 HydrophobicContact CD2-CD2 3.62Å; L78-Y193 HydrophobicContact CD2-CE2 4.45Å; L78-Y193 HydrophobicContact CD2-CG 3.89Å; L78-Y193 HydrophobicContact CG-CD2 3.89Å; L78-Y193 HydrophobicContact CG-CE2 4.25Å; L78-Y193 HydrophobicContact CG-CG 4.38Å; Y193-G196 VanDerWaalsContact CE2-CA 3.48Å; Y193-G196 VanDerWaalsContact CZ-N 3.32Å; Y193-G196 WeakPolarHBondContact OH-CA 3.49Å; Y193-G196 PolarHBondContact OH-N 3.07Å; Y193-S197 WeakPolarHBondContact CA-O 3.24Å; Y193-V198 HydrophobicContact CD2-CG2 3.87Å
194D88.6Confident86.4Confident40 Ų4049.7 Ų49.721%0.21427%0.267CS..EExtended strand (participates in β ladder)trans-138.3115.7173.1-168.2-3.7000108.9L95 G196 S197 Y199L95-D194 HydrophobicContact CD1-CB 4.21Å; D194-G196 PolarHBondContact O-N 2.88Å; D194-S197 PolarHBondContact N-O 2.88Å; D194-S197 PolarHBondContact O-N 2.86Å; D194-Y199 HydrophobicContact CB-CE2 4.48Å
195N83.3Confident86.2Confident118 Ų11850.4 Ų50.463%0.63127%0.265SS*.THydrogen-bonded Turntrans4440.6171.5-68.5-55.6000115.1P25P25-N195 VanDerWaalsContact CB-OD1 3.31Å; P25-N195 WeakPolarHBondContact CB-OD1 3.49Å; P25-N195 PolarHBondContact O-N 3.27Å
196G81.8Confident86.3Confident5 Ų552.6 Ų52.65%0.05228%0.278CS..THydrogen-bonded Turntrans96.60.6175.900000116.4K77 Y193 D194K77-G196 PolarHBondContact NZ-O 3.46Å; Y193-G196 VanDerWaalsContact CE2-CA 3.48Å; Y193-G196 VanDerWaalsContact CZ-N 3.32Å; Y193-G196 WeakPolarHBondContact OH-CA 3.49Å; Y193-G196 PolarHBondContact OH-N 3.07Å; D194-G196 PolarHBondContact O-N 2.88Å
197S86.6Confident86.4Confident41 Ų4155.9 Ų55.929%0.28730%0.297SS..EExtended strand (participates in β ladder)trans-107.5139.8171.1-64.80000110.5Y193 D194 Y199Y193-S197 WeakPolarHBondContact CA-O 3.24Å; D194-S197 PolarHBondContact N-O 2.88Å; D194-S197 PolarHBondContact O-N 2.86Å; S197-Y199 WeakPolarHBondContact CB-OH 3.36Å; S197-Y199 PolarHBondContact OG-OH 2.99Å
198V87.3Confident86.4Confident32 Ų3262.9 Ų62.919%0.19433%0.329CS..EExtended strand (participates in β ladder)trans-113.6126.7175.81800000107.9K77 L78 Q191 V192 Y193K77-V198 HydrophobicContact CB-CG2 3.7Å; L78-V198 HydrophobicContact CD2-CG2 3.73Å; L78-V198 HydrophobicContact CG-CG2 4.38Å; Q191-V198 HydrophobicContact CB-CG1 4.03Å; Q191-V198 HydrophobicContact CG-CG1 4.31Å; V192-V198 CarbonylContact O-C 3.59Å; V192-V198 VanDerWaalsContact O-CA 3.26Å; V192-V198 WeakPolarHBondContact O-CA 3.26Å; Y193-V198 HydrophobicContact CD2-CG2 3.87Å
199Y87.4Confident86.5Confident102 Ų10263.8 Ų63.840%0.434%0.335SS..EExtended strand (participates in β ladder)trans-125.1147.3-178-53.7-73000111Q191 V192 D194 S197 V203Q191-Y199 WeakPolarHBondContact CA-O 3.26Å; Q191-Y199 PolarHBondContact OE1-O 2.91Å; V192-Y199 PolarHBondContact N-O 3.41Å; V192-Y199 PolarHBondContact O-N 3.34Å; D194-Y199 HydrophobicContact CB-CE2 4.48Å; S197-Y199 WeakPolarHBondContact CB-OH 3.36Å; S197-Y199 PolarHBondContact OG-OH 2.99Å; Y199-V203 HydrophobicContact CD1-CG1 4.44Å
200S86.7Confident86.4Confident42 Ų4265 Ų6529%0.29435%0.347SS..  trans-68.3152.2165.357.20000110E202 V203S200-E202 PolarHBondContact O-N 3.29Å; S200-E202 VanDerWaalsContact O-N 3.13Å; S200-V203 PolarHBondContact O-N 2.95Å; S200-V203 VanDerWaalsContact O-N 3.13Å
201P85.1Confident86.4Confident30 Ų3066.5 Ų66.520%0.19536%0.357CS..G310 helixtrans-59-24.9179.124.7-36.4000113.4I189 Q190 V203 L204I189-P201 HydrophobicContact CB-CB 4.46Å; I189-P201 HydrophobicContact CG2-CB 4.2Å; Q190-P201 WeakPolarHBondContact O-CD 3.47Å; P201-V203 PolarHBondContact O-N 3.29Å; P201-L204 WeakPolarHBondContact O-CB 3.48Å; P201-L204 PolarHBondContact O-N 3.45Å; P201-L204 VanDerWaalsContact O-N 3.15Å
202E85.3Confident86.6Confident144 Ų14470.3 Ų70.367%0.67338%0.375SS*.G310 helixtrans-64-27.2178.4-63.2175.1179.500113S200 L204 D205S200-E202 PolarHBondContact O-N 3.29Å; S200-E202 VanDerWaalsContact O-N 3.13Å; E202-L204 PolarHBondContact O-N 3.26Å; E202-D205 WeakPolarHBondContact O-CB 3.45Å; E202-D205 PolarHBondContact O-N 3.49Å; E202-D205 VanDerWaalsContact O-N 3.09Å
203V84.8Confident86.7Confident66 Ų6673 Ų7340%0.440%0.397SS..G310 helixtrans-66.6-28.9177.1-1790000111Y199 S200 P201 D205 I206Y199-V203 HydrophobicContact CD1-CG1 4.44Å; S200-V203 PolarHBondContact O-N 2.95Å; S200-V203 VanDerWaalsContact O-N 3.13Å; P201-V203 PolarHBondContact O-N 3.29Å; V203-D205 VanDerWaalsContact C-N 3.28Å; V203-D205 PolarHBondContact O-N 2.96Å; V203-I206 HydrophobicContact CG1-CD1 4.36Å; V203-I206 WeakPolarHBondContact O-CG1 3.39Å
204L81Confident86.9Confident49 Ų4980.9 Ų80.926%0.25743%0.427SS..G310 helixtrans-77.4-12.6175.4-64.5175.7000113.1F28 L95 V192 P201 E202 I206F28-L204 HydrophobicContact CE1-CD1 4.11Å; L95-L204 HydrophobicContact CB-CD1 4.16Å; L95-L204 HydrophobicContact CB-CD2 3.92Å; L95-L204 HydrophobicContact CD1-CD2 4.19Å; V192-L204 HydrophobicContact CG1-CD1 4.38Å; V192-L204 HydrophobicContact CG2-CD1 3.77Å; P201-L204 WeakPolarHBondContact O-CB 3.48Å; P201-L204 PolarHBondContact O-N 3.45Å; P201-L204 VanDerWaalsContact O-N 3.15Å; E202-L204 PolarHBondContact O-N 3.26Å; L204-I206 VanDerWaalsContact C-N 3.26Å
205D81.4Confident87.2Confident84 Ų8485.8 Ų85.845%0.44945%0.446SS..G310 helixtrans-82.7-2.7176.2-73.1-56000113.2R99 E202 V203 T207R99-D205 IonicContact CZ-OD1 3.54Å; R99-D205 IonicContact CZ-OD2 2.66Å; R99-D205 IonicContact NH1-OD1 3.94Å; R99-D205 PolarHBondContact NH1-OD1 3.4Å; R99-D205 IonicContact NH1-OD2 2.64Å; R99-D205 IonicContact NH2-OD1 3.9Å; R99-D205 PolarHBondContact NH2-OD1 2.84Å; R99-D205 IonicContact NH2-OD2 3Å; R99-D205 PolarHBondContact NH2-OD2 2.73Å; E202-D205 WeakPolarHBondContact O-CB 3.45Å; E202-D205 PolarHBondContact O-N 3.49Å; E202-D205 VanDerWaalsContact O-N 3.09Å; V203-D205 VanDerWaalsContact C-N 3.28Å; V203-D205 PolarHBondContact O-N 2.96Å; D205-T207 PolarHBondContact O-N 2.94Å; D205-T207 VanDerWaalsContact O-N 3.09Å
206I82.6Confident87.6Confident97 Ų9784.4 Ų84.450%0.49744%0.439SS..  trans-72.5107.2178.8-58.3173.2000108.5V203 L204 L211V203-I206 HydrophobicContact CG1-CD1 4.36Å; V203-I206 WeakPolarHBondContact O-CG1 3.39Å; L204-I206 VanDerWaalsContact C-N 3.26Å; I206-L211 HydrophobicContact CG2-CD1 4.42Å; I206-L211 HydrophobicContact CG2-CD2 3.92Å; I206-L211 HydrophobicContact CG2-CG 3.96Å
207T85.6Confident88.2Confident77 Ų7788.3 Ų88.347%0.47246%0.456SS..  trans-76.3151.4176.859.30000111.6D205 D209 A210 L211D205-T207 PolarHBondContact O-N 2.94Å; D205-T207 VanDerWaalsContact O-N 3.09Å; T207-D209 PolarHBondContact O-N 2.77Å; T207-A210 WeakPolarHBondContact O-CB 3.28Å; T207-A210 PolarHBondContact O-N 3.39Å; T207-A210 VanDerWaalsContact O-N 3.1Å; T207-A210 PolarHBondContact OG1-N 2.97Å; T207-L211 PolarHBondContact O-N 2.84Å
208E86.4Confident88.5Confident149 Ų14987.7 Ų87.770%0.69646%0.456SS*.Hα-helixtrans-58.9-35.5174-66.7-177.317500111.6A210 L211 H212E208-A210 VanDerWaalsContact C-N 3.31Å; E208-A210 PolarHBondContact O-N 3.3Å; E208-L211 WeakPolarHBondContact O-CB 3.25Å; E208-L211 PolarHBondContact O-N 3Å; E208-L211 VanDerWaalsContact O-N 3.11Å; E208-H212 PolarHBondContact O-N 2.84Å
209D89.8Confident88.6Confident125 Ų12589 Ų8967%0.66846%0.464SS*.Hα-helixtrans-60.6-39.3175.6-65.4-31.7000112.4T207 L211 H212 A213T207-D209 PolarHBondContact O-N 2.77Å; D209-L211 VanDerWaalsContact C-N 3.33Å; D209-H212 PolarHBondContact O-N 2.8Å; D209-A213 WeakPolarHBondContact O-CB 3.42Å; D209-A213 PolarHBondContact O-N 2.85Å
210A89.2Confident88.7Confident44 Ų4492.8 Ų92.836%0.36448%0.478SS..Hα-helixtrans-65.7-3917600000111.1T207 E208 R214T207-A210 WeakPolarHBondContact O-CB 3.28Å; T207-A210 PolarHBondContact O-N 3.39Å; T207-A210 VanDerWaalsContact O-N 3.1Å; T207-A210 PolarHBondContact OG1-N 2.97Å; E208-A210 VanDerWaalsContact C-N 3.31Å; E208-A210 PolarHBondContact O-N 3.3Å; A210-R214 VanDerWaalsContact O-CG 3.28Å; A210-R214 WeakPolarHBondContact O-CG 3.42Å; A210-R214 PolarHBondContact O-N 3.1Å; A210-R214 VanDerWaalsContact O-N 3.1Å
211L90.7Very high88.9Confident103 Ų10395 Ų9554%0.53949%0.486SS..Hα-helixtrans-66.2-43.7175.5-65.1176.2000111.6I206 T207 E208 D209 R214 F215I206-L211 HydrophobicContact CG2-CD1 4.42Å; I206-L211 HydrophobicContact CG2-CD2 3.92Å; I206-L211 HydrophobicContact CG2-CG 3.96Å; T207-L211 PolarHBondContact O-N 2.84Å; E208-L211 WeakPolarHBondContact O-CB 3.25Å; E208-L211 PolarHBondContact O-N 3Å; E208-L211 VanDerWaalsContact O-N 3.11Å; D209-L211 VanDerWaalsContact C-N 3.33Å; L211-R214 PolarHBondContact O-N 3.28Å; L211-F215 WeakPolarHBondContact O-CB 3.36Å; L211-F215 PolarHBondContact O-N 3.4Å
212H93.3Very high89.1Confident117 Ų11798.6 Ų98.654%0.54250%0.503SS..Hα-helixtrans-61.3-44.9175.7-74.5177.4000112E208 D209 R214 F215 L216E208-H212 PolarHBondContact O-N 2.84Å; D209-H212 PolarHBondContact O-N 2.8Å; H212-R214 PolarHBondContact O-N 3.08Å; H212-F215 PolarHBondContact O-N 3.46Å; H212-L216 WeakPolarHBondContact O-CB 3.5Å; H212-L216 VanDerWaalsContact O-CG 3.3Å; H212-L216 WeakPolarHBondContact O-CG 3.38Å; H212-L216 PolarHBondContact O-N 2.89Å
213A94.5Very high89.2Confident58 Ų5892.2 Ų92.248%0.47947%0.474SS..Hα-helixtrans-60.3-45.517800000111.7D209 L216 E217D209-A213 WeakPolarHBondContact O-CB 3.42Å; D209-A213 PolarHBondContact O-N 2.85Å; A213-L216 PolarHBondContact O-N 3.45Å; A213-E217 WeakPolarHBondContact O-CB 3.31Å; A213-E217 PolarHBondContact O-N 3.44Å
214R93.6Very high89.3Confident175 Ų17591.6 Ų91.666%0.6647%0.473SS*.Hα-helixtrans-67.3-37.8177.5-68.2-61.8-173.2-178.33112.9A210 L211 H212 E217 G218A210-R214 VanDerWaalsContact O-CG 3.28Å; A210-R214 WeakPolarHBondContact O-CG 3.42Å; A210-R214 PolarHBondContact O-N 3.1Å; A210-R214 VanDerWaalsContact O-N 3.1Å; L211-R214 PolarHBondContact O-N 3.28Å; H212-R214 PolarHBondContact O-N 3.08Å; R214-E217 WeakPolarHBondContact CD-OE2 3.3Å; R214-E217 IonicContact CZ-OE2 2.85Å; R214-E217 IonicContact NH1-OE1 3.81Å; R214-E217 IonicContact NH1-OE2 3.48Å; R214-E217 PolarHBondContact NH1-OE2 3.09Å; R214-E217 PolarHBondContact O-N 3.14Å; R214-G218 PolarHBondContact O-N 3.47Å
215F94.4Very high89.8Confident143 Ų14392.8 Ų92.863%0.62748%0.482SS*.Hα-helixtrans-63.4-47.6175.2-177.8-99.6000111L211 H212 E217 G218 V219L211-F215 WeakPolarHBondContact O-CB 3.36Å; L211-F215 PolarHBondContact O-N 3.4Å; H212-F215 PolarHBondContact O-N 3.46Å; F215-E217 VanDerWaalsContact C-N 3.32Å; F215-E217 PolarHBondContact O-N 3.31Å; F215-G218 PolarHBondContact O-N 3.01Å; F215-G218 VanDerWaalsContact O-N 3.14Å; F215-V219 HydrophobicContact CD1-CG2 4.2Å; F215-V219 HydrophobicContact CE1-CG2 3.83Å; F215-V219 HydrophobicContact CZ-CG2 4.09Å; F215-V219 WeakPolarHBondContact O-CG2 3.44Å; F215-V219 PolarHBondContact O-N 3.4Å
216L91.9Very high90.1Very high90 Ų9089.7 Ų89.747%0.47147%0.467SS..Hα-helixtrans-63.4-36.9176.6-69.7174.7000112.4H212 A213 V219 R220H212-L216 WeakPolarHBondContact O-CB 3.5Å; H212-L216 VanDerWaalsContact O-CG 3.3Å; H212-L216 WeakPolarHBondContact O-CG 3.38Å; H212-L216 PolarHBondContact O-N 2.89Å; A213-L216 PolarHBondContact O-N 3.45Å; L216-V219 PolarHBondContact O-N 3.12Å; L216-R220 WeakPolarHBondContact O-CB 3.33Å; L216-R220 VanDerWaalsContact O-CG 3.23Å; L216-R220 WeakPolarHBondContact O-CG 3.34Å; L216-R220 PolarHBondContact O-N 2.92Å
217E94.5Very high90.2Very high86 Ų8687.5 Ų87.540%0.40246%0.456SS..Hα-helixtrans-59.8-45.8171.7-173.4178.4-16600111.2A213 R214 F215 V219 R220 N221A213-E217 WeakPolarHBondContact O-CB 3.31Å; A213-E217 PolarHBondContact O-N 3.44Å; R214-E217 WeakPolarHBondContact CD-OE2 3.3Å; R214-E217 IonicContact CZ-OE2 2.85Å; R214-E217 IonicContact NH1-OE1 3.81Å; R214-E217 IonicContact NH1-OE2 3.48Å; R214-E217 PolarHBondContact NH1-OE2 3.09Å; R214-E217 PolarHBondContact O-N 3.14Å; F215-E217 VanDerWaalsContact C-N 3.32Å; F215-E217 PolarHBondContact O-N 3.31Å; E217-V219 PolarHBondContact O-N 2.95Å; E217-R220 PolarHBondContact O-N 3.19Å; E217-N221 PolarHBondContact O-N 2.9Å; E217-N221 PolarHBondContact O-ND2 3.46Å; E217-N221 PolarHBondContact O-OD1 3.03Å
218G92.8Very high90.3Very high29 Ų2991.8 Ų91.830%0.29947%0.471SS..Hα-helixtrans-60.2-45.1174.500000113.2R214 F215 R220 N221 I222R214-G218 PolarHBondContact O-N 3.47Å; F215-G218 PolarHBondContact O-N 3.01Å; F215-G218 VanDerWaalsContact O-N 3.14Å; G218-R220 VanDerWaalsContact C-N 3.33Å; G218-R220 PolarHBondContact O-N 3.06Å; G218-N221 PolarHBondContact O-N 3.36Å; G218-I222 WeakPolarHBondContact O-CG1 3.1Å; G218-I222 PolarHBondContact O-N 2.93Å
219V90.3Very high90.3Very high60 Ų6090.7 Ų90.736%0.36447%0.468SS..Hα-helixtrans-61.1-42.3175.81740000111.2F215 L216 E217 I222 A223F215-V219 HydrophobicContact CD1-CG2 4.2Å; F215-V219 HydrophobicContact CE1-CG2 3.83Å; F215-V219 HydrophobicContact CZ-CG2 4.09Å; F215-V219 WeakPolarHBondContact O-CG2 3.44Å; F215-V219 PolarHBondContact O-N 3.4Å; L216-V219 PolarHBondContact O-N 3.12Å; E217-V219 PolarHBondContact O-N 2.95Å; V219-I222 PolarHBondContact O-N 3.34Å; V219-A223 VanDerWaalsContact O-CB 3.31Å; V219-A223 WeakPolarHBondContact O-CB 3.37Å; V219-A223 PolarHBondContact O-N 3.09Å
220R89Confident89.9Confident180 Ų18087.4 Ų87.468%0.67946%0.464SS*.Hα-helixtrans-62.4-43.3176.6-74.8170.7-176.8177.52.6112L216 E217 G218 A223 S224L216-R220 WeakPolarHBondContact O-CB 3.33Å; L216-R220 VanDerWaalsContact O-CG 3.23Å; L216-R220 WeakPolarHBondContact O-CG 3.34Å; L216-R220 PolarHBondContact O-N 2.92Å; E217-R220 PolarHBondContact O-N 3.19Å; G218-R220 VanDerWaalsContact C-N 3.33Å; G218-R220 PolarHBondContact O-N 3.06Å; R220-A223 PolarHBondContact O-N 3.3Å; R220-S224 PolarHBondContact O-N 3.23Å; R220-S224 PolarHBondContact O-OG 3.37Å
221N91.3Very high89.7Confident90 Ų9092.9 Ų92.948%0.48148%0.476SS..Hα-helixtrans-65.4-40.7178.8-67.2-16000111.8E217 G218 S224 V225E217-N221 PolarHBondContact O-N 2.9Å; E217-N221 PolarHBondContact O-ND2 3.46Å; E217-N221 PolarHBondContact O-OD1 3.03Å; G218-N221 PolarHBondContact O-N 3.36Å; N221-S224 PolarHBondContact O-OG 3.25Å; N221-V225 VanDerWaalsContact O-CG2 3.26Å; N221-V225 WeakPolarHBondContact O-CG2 3.03Å; N221-V225 PolarHBondContact O-N 3.47Å; N221-V225 VanDerWaalsContact O-N 3.1Å
222I89Confident89.4Confident105 Ų10592.2 Ų92.254%0.53848%0.478SS..Hα-helixtrans-65.3-44.7174.5-67167.3000110G218 V219 S224 V225 C226G218-I222 WeakPolarHBondContact O-CG1 3.1Å; G218-I222 PolarHBondContact O-N 2.93Å; V219-I222 PolarHBondContact O-N 3.34Å; I222-S224 PolarHBondContact O-N 2.87Å; I222-V225 PolarHBondContact O-N 3.1Å; I222-C226 WeakPolarHBondContact O-CB 3.21Å; I222-C226 PolarHBondContact O-N 3.36Å; I222-C226 PolarHBondContact O-SG 3.37Å
223A86.8Confident89Confident9 Ų988.5 Ų88.57%0.07446%0.464CS..Hα-helixtrans-61.3-42.5178.700000112.1V219 R220 C226 L227V219-A223 VanDerWaalsContact O-CB 3.31Å; V219-A223 WeakPolarHBondContact O-CB 3.37Å; V219-A223 PolarHBondContact O-N 3.09Å; R220-A223 PolarHBondContact O-N 3.3Å; A223-C226 PolarHBondContact O-N 3.07Å; A223-L227 WeakPolarHBondContact O-CB 3.47Å; A223-L227 WeakPolarHBondContact O-CG 3.46Å; A223-L227 PolarHBondContact O-N 2.95Å
224S87.4Confident88.3Confident54 Ų5493.8 Ų93.838%0.37848%0.483SS..Hα-helixtrans-64.4-44.6177.762.70000111.9R220 N221 I222 L227 E228R220-S224 PolarHBondContact O-N 3.23Å; R220-S224 PolarHBondContact O-OG 3.37Å; N221-S224 PolarHBondContact O-OG 3.25Å; I222-S224 PolarHBondContact O-N 2.87Å; S224-L227 PolarHBondContact O-N 2.99Å; S224-E228 PolarHBondContact O-N 3.01Å
225V90.9Very high87.6Confident74 Ų7487.2 Ų87.245%0.44847%0.466SS..Hα-helixtrans-63.5-44.5177.51720000111.3N221 I222 L227 E228 I229N221-V225 VanDerWaalsContact O-CG2 3.26Å; N221-V225 WeakPolarHBondContact O-CG2 3.03Å; N221-V225 PolarHBondContact O-N 3.47Å; N221-V225 VanDerWaalsContact O-N 3.1Å; I222-V225 PolarHBondContact O-N 3.1Å; V225-L227 VanDerWaalsContact C-N 3.28Å; V225-L227 PolarHBondContact O-N 2.93Å; V225-E228 PolarHBondContact O-N 3.04Å; V225-I229 HydrophobicContact CG1-CD1 3.58Å; V225-I229 HydrophobicContact CG1-CG1 4.39Å; V225-I229 VanDerWaalsContact O-CG1 3.3Å; V225-I229 WeakPolarHBondContact O-CG1 3.35Å; V225-I229 PolarHBondContact O-N 3.4Å
226C87.8Confident87.1Confident18 Ų1880.4 Ų80.412%0.12244%0.436CS..Hα-helixtrans-63.3-34.6177.4-69.70000112.7I222 A223 G230 Y231 T233I222-C226 WeakPolarHBondContact O-CB 3.21Å; I222-C226 PolarHBondContact O-N 3.36Å; I222-C226 PolarHBondContact O-SG 3.37Å; A223-C226 PolarHBondContact O-N 3.07Å; C226-G230 PolarHBondContact O-N 2.88Å; C226-G230 VanDerWaalsContact O-N 3.07Å; C226-Y231 PolarHBondContact O-N 2.91Å; C226-Y231 VanDerWaalsContact O-N 3.09Å; C226-T233 HydrophobicContact CB-CG2 4.39Å; C226-T233 VanDerWaalsContact SG-CG2 3.57Å
227L85.9Confident86.7Confident51 Ų5179 Ų7927%0.26743%0.431SS..Hα-helixtrans-68.4-40.8176.1-74.8169.1000112.5A223 S224 V225 G230 H239 T240A223-L227 WeakPolarHBondContact O-CB 3.47Å; A223-L227 WeakPolarHBondContact O-CG 3.46Å; A223-L227 PolarHBondContact O-N 2.95Å; S224-L227 PolarHBondContact O-N 2.99Å; V225-L227 VanDerWaalsContact C-N 3.28Å; V225-L227 PolarHBondContact O-N 2.93Å; L227-G230 PolarHBondContact O-N 3.14Å; L227-H239 HydrophobicContact CD1-CB 3.69Å; L227-H239 HydrophobicContact CD2-CB 3.76Å; L227-H239 HydrophobicContact CG-CB 4.25Å; L227-T240 VanDerWaalsContact CD2-OG1 3.28Å; L227-T240 WeakPolarHBondContact CD2-OG1 3.32Å
228E86.3Confident86.2Confident168 Ų16878 Ų7879%0.78543%0.432SS*.Hα-helixtrans-68-41177.6-73.1-179.4179.200112.4S224 V225 G230S224-E228 PolarHBondContact O-N 3.01Å; V225-E228 PolarHBondContact O-N 3.04Å; E228-G230 PolarHBondContact O-N 3.03Å
229I87.6Confident85.8Confident126 Ų12681 Ų8165%0.64644%0.438SS*.Hα-helixtrans-72.6-19.8177.8-62.4171.9000111.2V225 Y231V225-I229 HydrophobicContact CG1-CD1 3.58Å; V225-I229 HydrophobicContact CG1-CG1 4.39Å; V225-I229 VanDerWaalsContact O-CG1 3.3Å; V225-I229 WeakPolarHBondContact O-CG1 3.35Å; V225-I229 PolarHBondContact O-N 3.4Å; I229-Y231 VanDerWaalsContact C-N 3.27Å
230G81.7Confident85.6Confident56 Ų5681.3 Ų81.358%0.57744%0.44SS*.THydrogen-bonded Turntrans72.321.2-17500000113.1C226 L227 E228C226-G230 PolarHBondContact O-N 2.88Å; C226-G230 VanDerWaalsContact O-N 3.07Å; L227-G230 PolarHBondContact O-N 3.14Å; E228-G230 PolarHBondContact O-N 3.03Å
231Y84.4Confident85.5Confident158 Ų15878.4 Ų78.462%0.6244%0.437SS*.  trans-90.8118.3178.6-166.8-99.8000110.3C226 I229 T233 S236C226-Y231 PolarHBondContact O-N 2.91Å; C226-Y231 VanDerWaalsContact O-N 3.09Å; I229-Y231 VanDerWaalsContact C-N 3.27Å; Y231-T233 HydrophobicContact CD1-CG2 3.78Å; Y231-T233 HydrophobicContact CE1-CG2 4.17Å; Y231-T233 PolarHBondContact O-N 3.29Å; Y231-T233 VanDerWaalsContact O-N 3.17Å; Y231-S236 PolarHBondContact O-OG 2.94Å
232P83.4Confident85.2Confident89 Ų8978 Ų7858%0.57843%0.434SS*.  trans-76.1107.3-177.229.1-32.1000110.8V237P232-V237 HydrophobicContact CB-CG2 3.73Å
233T84.9Confident85.1Confident40 Ų4076 Ų7625%0.24543%0.425CS..  trans-108.1162.3167.262.20000109.3C226 Y231 A235 S236 V237C226-T233 HydrophobicContact CB-CG2 4.39Å; C226-T233 VanDerWaalsContact SG-CG2 3.57Å; Y231-T233 HydrophobicContact CD1-CG2 3.78Å; Y231-T233 HydrophobicContact CE1-CG2 4.17Å; Y231-T233 PolarHBondContact O-N 3.29Å; Y231-T233 VanDerWaalsContact O-N 3.17Å; T233-A235 PolarHBondContact O-N 2.95Å; T233-A235 VanDerWaalsContact O-N 3.09Å; T233-S236 PolarHBondContact N-OG 3.31Å; T233-S236 PolarHBondContact O-N 3.38Å; T233-S236 PolarHBondContact O-OG 3.17Å; T233-S236 PolarHBondContact OG1-N 3.27Å; T233-S236 PolarHBondContact OG1-OG 3.04Å; T233-V237 VanDerWaalsContact O-CG2 3.29Å; T233-V237 WeakPolarHBondContact O-CG2 3.41Å; T233-V237 PolarHBondContact O-N 3.38Å
234L80.6Confident85Confident169 Ų16977.3 Ų77.389%0.88544%0.439SS*.THydrogen-bonded Turntrans-54.8-33.6179.9-165.6150.4000112.2
235A78Confident84.9Confident37 Ų3778.9 Ų78.931%0.30644%0.437SS..THydrogen-bonded Turntrans-76.5-32.4175.100000113.8T233 H239T233-A235 PolarHBondContact O-N 2.95Å; T233-A235 VanDerWaalsContact O-N 3.09Å; A235-H239 PolarHBondContact O-CD2 3.49Å; A235-H239 VanDerWaalsContact O-CD2 3.27Å
236S83.9Confident84.6Confident0 Ų081.3 Ų81.30%044%0.442CS..THydrogen-bonded Turntrans-88.6-29.8-175.871.30000114Y231 T233 H239 T240Y231-S236 PolarHBondContact O-OG 2.94Å; T233-S236 PolarHBondContact N-OG 3.31Å; T233-S236 PolarHBondContact O-N 3.38Å; T233-S236 PolarHBondContact O-OG 3.17Å; T233-S236 PolarHBondContact OG1-N 3.27Å; T233-S236 PolarHBondContact OG1-OG 3.04Å; S236-H239 PolarHBondContact O-N 3.31Å; S236-T240 PolarHBondContact O-N 2.92Å; S236-T240 PolarHBondContact O-OG1 3.42Å; S236-T240 VanDerWaalsContact O-OG1 3.06Å
237V84.6Confident84.5Confident60 Ų6089.8 Ų89.836%0.36447%0.471SS..Hα-helixtrans-52.4-47.8-175.5168.30000113.7P232 T233 H239 T240 I241P232-V237 HydrophobicContact CB-CG2 3.73Å; T233-V237 VanDerWaalsContact O-CG2 3.29Å; T233-V237 WeakPolarHBondContact O-CG2 3.41Å; T233-V237 PolarHBondContact O-N 3.38Å; V237-H239 VanDerWaalsContact C-N 3.29Å; V237-H239 PolarHBondContact O-N 3.24Å; V237-T240 PolarHBondContact O-N 2.83Å; V237-I241 HydrophobicContact CG1-CD1 4.02Å; V237-I241 WeakPolarHBondContact O-CG1 3.44Å; V237-I241 PolarHBondContact O-N 2.96Å
238P83.1Confident84.4Confident65 Ų6591.7 Ų91.742%0.42249%0.485SS..Hα-helixtrans-60.5-41.3178.4-21.132.6000111.9I242P238-I242 WeakPolarHBondContact O-CB 3.31Å; P238-I242 WeakPolarHBondContact O-CD1 3.41Å; P238-I242 WeakPolarHBondContact O-CG1 3.44Å; P238-I242 PolarHBondContact O-N 3Å; P238-I242 VanDerWaalsContact O-N 3.09Å
239H85.4Confident84.2Confident91 Ų9184.5 Ų84.542%0.42145%0.452SS..Hα-helixtrans-70.5-35.9-179.6-64.5-59000112.3L227 A235 S236 V237 I242 N243L227-H239 HydrophobicContact CD1-CB 3.69Å; L227-H239 HydrophobicContact CD2-CB 3.76Å; L227-H239 HydrophobicContact CG-CB 4.25Å; A235-H239 PolarHBondContact O-CD2 3.49Å; A235-H239 VanDerWaalsContact O-CD2 3.27Å; S236-H239 PolarHBondContact O-N 3.31Å; V237-H239 VanDerWaalsContact C-N 3.29Å; V237-H239 PolarHBondContact O-N 3.24Å; H239-I242 PolarHBondContact O-N 3.4Å; H239-N243 VanDerWaalsContact O-CB 3.26Å; H239-N243 WeakPolarHBondContact O-CB 3.4Å; H239-N243 PolarHBondContact O-N 3.26Å; H239-N243 PolarHBondContact O-ND2 3.07Å
240T85.8Confident83.9Confident67 Ų6780.9 Ų80.941%0.41144%0.44SS..Hα-helixtrans-62.9-45176.1-53.20000111.5L227 S236 V237 N243 G244L227-T240 VanDerWaalsContact CD2-OG1 3.28Å; L227-T240 WeakPolarHBondContact CD2-OG1 3.32Å; S236-T240 PolarHBondContact O-N 2.92Å; S236-T240 PolarHBondContact O-OG1 3.42Å; S236-T240 VanDerWaalsContact O-OG1 3.06Å; V237-T240 PolarHBondContact O-N 2.83Å; T240-N243 PolarHBondContact O-N 3.17Å; T240-G244 PolarHBondContact O-N 3.14Å
241I85.8Confident83.9Confident119 Ų11982.2 Ų82.261%0.6144%0.437SS*.Hα-helixtrans-65.6-45.7178.8-63.7168.8000110.4V237 N243 G244 Y245V237-I241 HydrophobicContact CG1-CD1 4.02Å; V237-I241 WeakPolarHBondContact O-CG1 3.44Å; V237-I241 PolarHBondContact O-N 2.96Å; I241-N243 PolarHBondContact O-N 2.86Å; I241-G244 PolarHBondContact O-N 3.09Å; I241-Y245 WeakPolarHBondContact O-CB 3.41Å; I241-Y245 PolarHBondContact O-N 3.18Å
242I86.1Confident83.8Confident82 Ų8275 Ų7542%0.42141%0.41SS..Hα-helixtrans-63.1-41.4178.2-68165.3000111.1P238 H239 Y245 K246P238-I242 WeakPolarHBondContact O-CB 3.31Å; P238-I242 WeakPolarHBondContact O-CD1 3.41Å; P238-I242 WeakPolarHBondContact O-CG1 3.44Å; P238-I242 PolarHBondContact O-N 3Å; P238-I242 VanDerWaalsContact O-N 3.09Å; H239-I242 PolarHBondContact O-N 3.4Å; I242-Y245 PolarHBondContact O-N 2.97Å; I242-K246 HydrophobicContact CG2-CD 4.2Å; I242-K246 HydrophobicContact CG2-CG 4.4Å; I242-K246 WeakPolarHBondContact O-CG 3.29Å; I242-K246 PolarHBondContact O-N 3.13Å
243N86.3Confident83.5Confident64 Ų6473.3 Ų73.334%0.34240%0.398SS..Hα-helixtrans-67-38.9178.1-74.5-16000111.9H239 T240 I241 Y245 K246 R247H239-N243 VanDerWaalsContact O-CB 3.26Å; H239-N243 WeakPolarHBondContact O-CB 3.4Å; H239-N243 PolarHBondContact O-N 3.26Å; H239-N243 PolarHBondContact O-ND2 3.07Å; T240-N243 PolarHBondContact O-N 3.17Å; I241-N243 PolarHBondContact O-N 2.86Å; N243-Y245 VanDerWaalsContact C-N 3.34Å; N243-K246 PolarHBondContact O-N 3.25Å; N243-R247 WeakPolarHBondContact O-CG 3.31Å; N243-R247 PolarHBondContact O-N 3.41Å
244G84.9Confident83.3Confident36 Ų3679.2 Ų79.237%0.37142%0.423SS..Hα-helixtrans-58.6-46.9171.300000111.7T240 I241 K246 R247 V248T240-G244 PolarHBondContact O-N 3.14Å; I241-G244 PolarHBondContact O-N 3.09Å; G244-K246 PolarHBondContact O-N 3.01Å; G244-R247 PolarHBondContact O-N 3.11Å; G244-V248 PolarHBondContact O-N 3.15Å
245Y85.3Confident83.2Confident86 Ų8675.3 Ų75.334%0.33741%0.406SS..Hα-helixtrans-61.9-43.2176.2-176.6-110.4000112.7I241 I242 N243 R247 V248 L249 F259 L261I241-Y245 WeakPolarHBondContact O-CB 3.41Å; I241-Y245 PolarHBondContact O-N 3.18Å; I242-Y245 PolarHBondContact O-N 2.97Å; N243-Y245 VanDerWaalsContact C-N 3.34Å; Y245-R247 VanDerWaalsContact C-N 3.35Å; Y245-R247 PolarHBondContact O-N 3.36Å; Y245-V248 PolarHBondContact O-N 2.96Å; Y245-L249 HydrophobicContact CD1-CD1 3.63Å; Y245-L249 HydrophobicContact CD1-CG 4.3Å; Y245-L249 HydrophobicContact CE1-CD1 3.18Å; Y245-L249 HydrophobicContact CE1-CG 3.93Å; Y245-L249 HydrophobicContact CE2-CD1 4.44Å; Y245-L249 HydrophobicContact CE2-CG 4.31Å; Y245-L249 HydrophobicContact CG-CD1 4.42Å; Y245-L249 WeakPolarHBondContact O-CB 3.41Å; Y245-L249 WeakPolarHBondContact O-CG 3.41Å; Y245-L249 PolarHBondContact O-N 3.09Å; Y245-F259 HydrophobicContact CE2-CE2 4.37Å; Y245-F259 HydrophobicContact CE2-CZ 4.11Å; Y245-L261 HydrophobicContact CE2-CB 4.29Å; Y245-L261 HydrophobicContact CE2-CD1 3.98Å; Y245-L261 WeakPolarHBondContact OH-CB 3.03Å; Y245-L261 PolarHBondContact OH-O 2.93Å
246K85.3Confident82.8Confident125 Ų12580 Ų8054%0.54343%0.426SS..Hα-helixtrans-60.6-39175.1-76.2177.8178.5-178.50112.9I242 N243 G244 L249 A250I242-K246 HydrophobicContact CG2-CD 4.2Å; I242-K246 HydrophobicContact CG2-CG 4.4Å; I242-K246 WeakPolarHBondContact O-CG 3.29Å; I242-K246 PolarHBondContact O-N 3.13Å; N243-K246 PolarHBondContact O-N 3.25Å; G244-K246 PolarHBondContact O-N 3.01Å; K246-L249 PolarHBondContact O-N 3.34Å; K246-A250 WeakPolarHBondContact O-CB 2.88Å; K246-A250 PolarHBondContact O-N 3.22Å
247R85.5Confident82.2Confident196 Ų19688 Ų8874%0.7446%0.458SS*.Hα-helixtrans-65.1-42.8177.4-73.8176.2179.6178.50.7112N243 G244 Y245 A250 V251N243-R247 WeakPolarHBondContact O-CG 3.31Å; N243-R247 PolarHBondContact O-N 3.41Å; G244-R247 PolarHBondContact O-N 3.11Å; Y245-R247 VanDerWaalsContact C-N 3.35Å; Y245-R247 PolarHBondContact O-N 3.36Å; R247-A250 PolarHBondContact O-N 3.17Å; R247-V251 PolarHBondContact O-N 3.42Å
248V84.2Confident81.3Confident91 Ų9189 Ų8955%0.55247%0.468SS*.Hα-helixtrans-66.8-41.4176176.90000111G244 Y245 V251 A252G244-V248 PolarHBondContact O-N 3.15Å; Y245-V248 PolarHBondContact O-N 2.96Å; V248-V251 PolarHBondContact O-N 2.85Å; V248-A252 WeakPolarHBondContact O-CB 3.18Å; V248-A252 PolarHBondContact O-N 2.98Å
249L81Confident81Confident18 Ų1888.1 Ų88.19%0.09446%0.457CS..Hα-helixtrans-61.1-43.4174.6-79.8176.1000112.6Y245 K246 V251 A252 V253 F259 A262 V265Y245-L249 HydrophobicContact CD1-CD1 3.63Å; Y245-L249 HydrophobicContact CD1-CG 4.3Å; Y245-L249 HydrophobicContact CE1-CD1 3.18Å; Y245-L249 HydrophobicContact CE1-CG 3.93Å; Y245-L249 HydrophobicContact CE2-CD1 4.44Å; Y245-L249 HydrophobicContact CE2-CG 4.31Å; Y245-L249 HydrophobicContact CG-CD1 4.42Å; Y245-L249 WeakPolarHBondContact O-CB 3.41Å; Y245-L249 WeakPolarHBondContact O-CG 3.41Å; Y245-L249 PolarHBondContact O-N 3.09Å; K246-L249 PolarHBondContact O-N 3.34Å; L249-V251 VanDerWaalsContact C-N 3.31Å; L249-V251 PolarHBondContact O-N 3.41Å; L249-A252 PolarHBondContact O-N 3.06Å; L249-V253 VanDerWaalsContact O-CG2 3.31Å; L249-V253 WeakPolarHBondContact O-CG2 3.38Å; L249-V253 PolarHBondContact O-N 3.28Å; L249-F259 HydrophobicContact CD2-CE1 3.75Å; L249-F259 HydrophobicContact CD2-CZ 3.58Å; L249-F259 HydrophobicContact CG-CZ 4.39Å; L249-A262 HydrophobicContact CD2-CB 4.03Å; L249-V265 HydrophobicContact CD1-CG2 4.04Å; L249-V265 HydrophobicContact CD2-CB 4.32Å; L249-V265 HydrophobicContact CD2-CG2 4.2Å
250A82.3Confident80.4Confident49 Ų4988.6 Ų88.641%0.40547%0.468SS..Hα-helixtrans-57.1-46178.300000111.4K246 R247 A252 V253 E254K246-A250 WeakPolarHBondContact O-CB 2.88Å; K246-A250 PolarHBondContact O-N 3.22Å; R247-A250 PolarHBondContact O-N 3.17Å; A250-A252 PolarHBondContact O-N 3.36Å; A250-V253 PolarHBondContact O-N 3.16Å; A250-E254 PolarHBondContact O-N 2.94Å
251V82.3Confident79.6Confident85 Ų8589.6 Ų89.652%0.51547%0.471SS..Hα-helixtrans-63.7-42.7176.1177.20000111.6R247 V248 L249 V253 E254 T255R247-V251 PolarHBondContact O-N 3.42Å; V248-V251 PolarHBondContact O-N 2.85Å; L249-V251 VanDerWaalsContact C-N 3.31Å; L249-V251 PolarHBondContact O-N 3.41Å; V251-V253 VanDerWaalsContact C-N 3.3Å; V251-V253 PolarHBondContact O-N 3.1Å; V251-E254 PolarHBondContact O-N 3.39Å; V251-T255 HydrophobicContact CG1-CG2 4.28Å; V251-T255 WeakPolarHBondContact O-CB 3.34Å; V251-T255 WeakPolarHBondContact O-CG2 3.39Å; V251-T255 PolarHBondContact O-N 2.94Å; V251-T255 PolarHBondContact O-OG1 3.41Å
252A81Confident78.6Confident7 Ų784 Ų846%0.05844%0.442CS..Hα-helixtrans-67.1-30.3179.500000113.2V248 L249 A250 D256 Y257 F259 A262 K266V248-A252 WeakPolarHBondContact O-CB 3.18Å; V248-A252 PolarHBondContact O-N 2.98Å; L249-A252 PolarHBondContact O-N 3.06Å; A250-A252 PolarHBondContact O-N 3.36Å; A252-D256 PolarHBondContact O-N 3.25Å; A252-Y257 PolarHBondContact O-N 2.88Å; A252-F259 HydrophobicContact CB-CD1 4.11Å; A252-F259 HydrophobicContact CB-CE1 4.02Å; A252-A262 HydrophobicContact CB-CB 4.2Å; A252-K266 WeakPolarHBondContact O-CE 3.44Å; A252-K266 PolarHBondContact O-NZ 3.09Å
253V77.7Confident77.6Confident53 Ų5383.4 Ų83.432%0.32144%0.44SS..Hα-helixtrans-72.1-44.7173.71720000110.9L249 A250 V251 K266 L269L249-V253 VanDerWaalsContact O-CG2 3.31Å; L249-V253 WeakPolarHBondContact O-CG2 3.38Å; L249-V253 PolarHBondContact O-N 3.28Å; A250-V253 PolarHBondContact O-N 3.16Å; V251-V253 VanDerWaalsContact C-N 3.3Å; V251-V253 PolarHBondContact O-N 3.1Å; V253-K266 HydrophobicContact CG2-CG 4.28Å; V253-L269 HydrophobicContact CG2-CD1 4.3Å
254E79.9Confident76.7Confident163 Ų16386.9 Ų86.976%0.76245%0.452SS*.Hα-helixtrans-71.2-29.3-179.8-71.9176.917800113.9A250 V251A250-E254 PolarHBondContact O-N 2.94Å; V251-E254 PolarHBondContact O-N 3.39Å
255T78.4Confident75.8Confident87 Ų8787.2 Ų87.253%0.53445%0.446SS..THydrogen-bonded Turntrans-99.16-17758.60000113.8V251 Y257V251-T255 HydrophobicContact CG1-CG2 4.28Å; V251-T255 WeakPolarHBondContact O-CB 3.34Å; V251-T255 WeakPolarHBondContact O-CG2 3.39Å; V251-T255 PolarHBondContact O-N 2.94Å; V251-T255 PolarHBondContact O-OG1 3.41Å; T255-Y257 PolarHBondContact O-N 3.4Å
256D69.6Low74.8Confident136 Ų13685.4 Ų85.473%0.72744%0.44SS*.  trans53.814-175.5-70-39.8000115.6A252 S258 K266A252-D256 PolarHBondContact O-N 3.25Å; D256-S258 PolarHBondContact O-N 3.49Å; D256-K266 PolarHBondContact O-NZ 3.39Å
257Y72.8Confident73.9Confident168 Ų16881.9 Ų81.966%0.65943%0.434SS*.  trans-68.5127.6179.7-161.5-96.9000111.4A252 T255 K266A252-Y257 PolarHBondContact O-N 2.88Å; T255-Y257 PolarHBondContact O-N 3.4Å; Y257-K266 PolarHBondContact O-NZ 3.44Å
258S65.8Low72.9Confident82 Ų8278.4 Ų78.457%0.57342%0.422SS*.  trans-89.7130.5-177.460.50000111.5D256 D263D256-S258 PolarHBondContact O-N 3.49Å; S258-D263 WeakPolarHBondContact CA-OD1 3.4Å; S258-D263 WeakPolarHBondContact CB-OD1 3.36Å
259F75.1Confident71.9Confident45 Ų4579.6 Ų79.620%0.19743%0.425CS..  trans-146.3152.4167.285.6-98.8000109.9Y245 L249 A252 L261 A262 D263Y245-F259 HydrophobicContact CE2-CE2 4.37Å; Y245-F259 HydrophobicContact CE2-CZ 4.11Å; L249-F259 HydrophobicContact CD2-CE1 3.75Å; L249-F259 HydrophobicContact CD2-CZ 3.58Å; L249-F259 HydrophobicContact CG-CZ 4.39Å; A252-F259 HydrophobicContact CB-CD1 4.11Å; A252-F259 HydrophobicContact CB-CE1 4.02Å; F259-L261 HydrophobicContact CD2-CB 4Å; F259-L261 HydrophobicContact CD2-CG 4.35Å; F259-L261 VanDerWaalsContact CD2-N 3.28Å; F259-L261 HydrophobicContact CE2-CB 3.32Å; F259-L261 HydrophobicContact CE2-CD1 4.06Å; F259-L261 HydrophobicContact CE2-CG 3.86Å; F259-L261 HydrophobicContact CZ-CB 4.04Å; F259-L261 PolarHBondContact O-N 2.89Å; F259-A262 HydrophobicContact CD1-CB 3.08Å; F259-A262 HydrophobicContact CD2-CB 4.45Å; F259-A262 HydrophobicContact CE1-CB 3.11Å; F259-A262 HydrophobicContact CE2-CB 4.49Å; F259-A262 VanDerWaalsContact CE2-N 3.29Å; F259-A262 HydrophobicContact CG-CB 3.8Å; F259-A262 HydrophobicContact CZ-CB 3.85Å; F259-A262 WeakPolarHBondContact O-CA 3.34Å; F259-A262 PolarHBondContact O-N 3.01Å; F259-D263 PolarHBondContact N-OD1 3.01Å; F259-D263 PolarHBondContact O-N 3.29Å
260P73.2Confident71.3Confident101 Ų10182.1 Ų82.166%0.65645%0.448SS*.THydrogen-bonded Turntrans-55.8-24.9-167.3-26.232.3000116.1
261L68.6Low70Confident89 Ų8984.6 Ų84.647%0.46646%0.455SS..THydrogen-bonded Turntrans-99.9-19.8175-36162.2000113.6Y245 F259 V265Y245-L261 HydrophobicContact CE2-CB 4.29Å; Y245-L261 HydrophobicContact CE2-CD1 3.98Å; Y245-L261 WeakPolarHBondContact OH-CB 3.03Å; Y245-L261 PolarHBondContact OH-O 2.93Å; F259-L261 HydrophobicContact CD2-CB 4Å; F259-L261 HydrophobicContact CD2-CG 4.35Å; F259-L261 VanDerWaalsContact CD2-N 3.28Å; F259-L261 HydrophobicContact CE2-CB 3.32Å; F259-L261 HydrophobicContact CE2-CD1 4.06Å; F259-L261 HydrophobicContact CE2-CG 3.86Å; F259-L261 HydrophobicContact CZ-CB 4.04Å; F259-L261 PolarHBondContact O-N 2.89Å; L261-V265 WeakPolarHBondContact O-CG2 3.13Å
262A65.4Low68.7Low0 Ų085.2 Ų85.20%046%0.461CS..Hα-helixtrans-71.4-39165.800000111.3L249 A252 F259 K264 V265 K266L249-A262 HydrophobicContact CD2-CB 4.03Å; A252-A262 HydrophobicContact CB-CB 4.2Å; F259-A262 HydrophobicContact CD1-CB 3.08Å; F259-A262 HydrophobicContact CD2-CB 4.45Å; F259-A262 HydrophobicContact CE1-CB 3.11Å; F259-A262 HydrophobicContact CE2-CB 4.49Å; F259-A262 VanDerWaalsContact CE2-N 3.29Å; F259-A262 HydrophobicContact CG-CB 3.8Å; F259-A262 HydrophobicContact CZ-CB 3.85Å; F259-A262 WeakPolarHBondContact O-CA 3.34Å; F259-A262 PolarHBondContact O-N 3.01Å; A262-K264 PolarHBondContact O-N 2.93Å; A262-V265 CarbonylContact O-C 3.53Å; A262-V265 WeakPolarHBondContact O-CA 3.37Å; A262-V265 PolarHBondContact O-N 3.28Å; A262-K266 WeakPolarHBondContact O-CB 3.36Å; A262-K266 WeakPolarHBondContact O-CG 3.12Å; A262-K266 PolarHBondContact O-N 3.2Å
263D64.8Low67.5Low71 Ų7190.4 Ų90.438%0.3849%0.492SS..Hα-helixtrans-63.9-34.6-174.1-57-23.8000110.7S258 F259 A267S258-D263 WeakPolarHBondContact CA-OD1 3.4Å; S258-D263 WeakPolarHBondContact CB-OD1 3.36Å; F259-D263 PolarHBondContact N-OD1 3.01Å; F259-D263 PolarHBondContact O-N 3.29Å; D263-A267 WeakPolarHBondContact O-CB 3.34Å; D263-A267 PolarHBondContact O-N 3.22Å
264K68.8Low66.5Low137 Ų13790.9 Ų90.960%0.59650%0.501SS*.Hα-helixtrans-62.3-44.7170.3-66.4-177.4-178.5-177.60111.8A262 A267 Y268A262-K264 PolarHBondContact O-N 2.93Å; K264-A267 PolarHBondContact O-N 3.46Å; K264-Y268 WeakPolarHBondContact O-CD2 3.48Å; K264-Y268 PolarHBondContact O-N 3.4Å
265V65.3Low65.1Low42 Ų4289.3 Ų89.326%0.25549%0.492SS..Hα-helixtrans-73.4-35.4-179.2178.90000111.9L249 L261 A262 A267 Y268 L269L249-V265 HydrophobicContact CD1-CG2 4.04Å; L249-V265 HydrophobicContact CD2-CB 4.32Å; L249-V265 HydrophobicContact CD2-CG2 4.2Å; L261-V265 WeakPolarHBondContact O-CG2 3.13Å; A262-V265 CarbonylContact O-C 3.53Å; A262-V265 WeakPolarHBondContact O-CA 3.37Å; A262-V265 PolarHBondContact O-N 3.28Å; V265-A267 VanDerWaalsContact C-N 3.33Å; V265-Y268 WeakPolarHBondContact O-CB 3.4Å; V265-Y268 PolarHBondContact O-N 3.23Å; V265-L269 HydrophobicContact CG1-CD1 4.18Å; V265-L269 HydrophobicContact CG1-CG 4.46Å; V265-L269 WeakPolarHBondContact O-CG 3.41Å; V265-L269 PolarHBondContact O-N 3.18Å
266K64.8Low63.4Low48 Ų4888.7 Ų88.721%0.20950%0.496CS..Hα-helixtrans-62.7-40.1171.4-73.5177.7173179.70111A252 V253 D256 Y257 A262 L269 A270A252-K266 WeakPolarHBondContact O-CE 3.44Å; A252-K266 PolarHBondContact O-NZ 3.09Å; V253-K266 HydrophobicContact CG2-CG 4.28Å; D256-K266 PolarHBondContact O-NZ 3.39Å; Y257-K266 PolarHBondContact O-NZ 3.44Å; A262-K266 WeakPolarHBondContact O-CB 3.36Å; A262-K266 WeakPolarHBondContact O-CG 3.12Å; A262-K266 PolarHBondContact O-N 3.2Å; K266-L269 PolarHBondContact O-N 3.36Å; K266-A270 WeakPolarHBondContact O-CB 3.05Å; K266-A270 PolarHBondContact O-N 3.17Å
267A65.9Low62.2Low51 Ų5189 Ų8942%0.42150%0.502SS..Hα-helixtrans-64.8-39.7171.300000112.6D263 K264 V265 L269 A270 D271D263-A267 WeakPolarHBondContact O-CB 3.34Å; D263-A267 PolarHBondContact O-N 3.22Å; K264-A267 PolarHBondContact O-N 3.46Å; V265-A267 VanDerWaalsContact C-N 3.33Å; A267-L269 PolarHBondContact O-N 3.23Å; A267-A270 PolarHBondContact O-N 3.1Å; A267-D271 PolarHBondContact O-N 3.31Å; A267-D271 VanDerWaalsContact O-N 3.11Å
268Y64.6Low60.6Low123 Ų12385.7 Ų85.748%0.48251%0.51SS..Hα-helixtrans-64.5-35.3173.4-83.9-70.6000113.7K264 V265 F275K264-Y268 WeakPolarHBondContact O-CD2 3.48Å; K264-Y268 PolarHBondContact O-N 3.4Å; V265-Y268 WeakPolarHBondContact O-CB 3.4Å; V265-Y268 PolarHBondContact O-N 3.23Å; Y268-F275 HydrophobicContact CD1-CB 4.42Å; Y268-F275 AromaticContact CD1-CD2 3.82Å; Y268-F275 HydrophobicContact CD1-CD2 3.82Å; Y268-F275 HydrophobicContact CD1-CE2 4.43Å; Y268-F275 HydrophobicContact CD1-CG 4.26Å; Y268-F275 HydrophobicContact CE1-CB 3.79Å; Y268-F275 HydrophobicContact CE1-CD1 4.2Å; Y268-F275 AromaticContact CE1-CD2 3.49Å; Y268-F275 HydrophobicContact CE1-CD2 3.49Å; Y268-F275 VanDerWaalsContact CE1-CD2 3.49Å; Y268-F275 HydrophobicContact CE1-CE2 4.1Å; Y268-F275 AromaticContact CE1-CG 3.55Å; Y268-F275 HydrophobicContact CE1-CG 3.55Å
269L63.5Low58.8Low117 Ų11785.4 Ų85.461%0.61351%0.512SS*.Hα-helixtrans-79.1-30178.7-70.9171.6000112.5V253 V265 K266 A267V253-L269 HydrophobicContact CG2-CD1 4.3Å; V265-L269 HydrophobicContact CG1-CD1 4.18Å; V265-L269 HydrophobicContact CG1-CG 4.46Å; V265-L269 WeakPolarHBondContact O-CG 3.41Å; V265-L269 PolarHBondContact O-N 3.18Å; K266-L269 PolarHBondContact O-N 3.36Å; A267-L269 PolarHBondContact O-N 3.23Å
270A67.9Low56.8Low71 Ų7189.4 Ų89.459%0.58754%0.543SS*.Hα-helixtrans-73.5-38.917600000112.4K266 A267K266-A270 WeakPolarHBondContact O-CB 3.05Å; K266-A270 PolarHBondContact O-N 3.17Å; A267-A270 PolarHBondContact O-N 3.1Å
271D54.3Low54.7Low100 Ų10091 Ų9154%0.53555%0.55SS.*  trans-129.781.7-178-71.3-42.7000112.7A267 T273 A274A267-D271 PolarHBondContact O-N 3.31Å; A267-D271 VanDerWaalsContact O-N 3.11Å; D271-T273 PolarHBondContact O-N 3.24Å; D271-A274 HydrophobicContact CB-CB 4.37Å
272P55.8Low52.7Low99 Ų9991.1 Ų91.164%0.64356%0.564SS**THydrogen-bonded Turntrans-69.7-12.7-179.125.5-32.8000114.5
273T56.3Low50.8Low116 Ų11695.6 Ų95.671%0.71260%0.601SS**THydrogen-bonded Turntrans-91.6-16.2-178.1490000114.4D271 F275D271-T273 PolarHBondContact O-N 3.24Å; T273-F275 VanDerWaalsContact C-N 3.27Å; T273-F275 PolarHBondContact O-N 3.46Å
274A55.8Low48.9Very low63 Ų6396.6 Ų96.652%0.52162%0.619SS.*THydrogen-bonded Turntrans-74-15-176.100000114D271D271-A274 HydrophobicContact CB-CB 4.37Å
275F50.4Low46.7Very low130 Ų13096.1 Ų96.157%0.5763%0.627SS**THydrogen-bonded Turntrans-127.69.3-175-63.9-80.1000114.5Y268 T273 V277Y268-F275 HydrophobicContact CD1-CB 4.42Å; Y268-F275 AromaticContact CD1-CD2 3.82Å; Y268-F275 HydrophobicContact CD1-CD2 3.82Å; Y268-F275 HydrophobicContact CD1-CE2 4.43Å; Y268-F275 HydrophobicContact CD1-CG 4.26Å; Y268-F275 HydrophobicContact CE1-CB 3.79Å; Y268-F275 HydrophobicContact CE1-CD1 4.2Å; Y268-F275 AromaticContact CE1-CD2 3.49Å; Y268-F275 HydrophobicContact CE1-CD2 3.49Å; Y268-F275 VanDerWaalsContact CE1-CD2 3.49Å; Y268-F275 HydrophobicContact CE1-CE2 4.1Å; Y268-F275 AromaticContact CE1-CG 3.55Å; Y268-F275 HydrophobicContact CE1-CG 3.55Å; T273-F275 VanDerWaalsContact C-N 3.27Å; T273-F275 PolarHBondContact O-N 3.46Å; F275-V277 PolarHBondContact O-N 3.4Å
276A42.6Very low44.7Very low74 Ų74100.4 Ų100.461%0.61265%0.654SS**G310 helixtrans-76.55.2179.500000114.9A278A276-A278 VanDerWaalsContact C-N 3.34Å; A276-A278 PolarHBondContact O-N 3.23Å
277V45.3Very low42.8Very low143 Ų143102.9 Ų102.987%0.86768%0.683SS**G310 helixtrans-87.58.6-173.3-174.60000113.8F275F275-V277 PolarHBondContact O-N 3.4Å
278A39.3Very low40.8Very low98 Ų98105.3 Ų105.381%0.8170%0.703SS**G310 helixtrans-12335.6-178.600000114.9A276A276-A278 VanDerWaalsContact C-N 3.34Å; A276-A278 PolarHBondContact O-N 3.23Å
279A28Very low39.1Very low75 Ų75104.1 Ų104.162%0.6272%0.719SS**SBendtrans-112.5121.8161.100000108.7V281A279-V281 PolarHBondContact O-N 3.18Å; A279-V281 VanDerWaalsContact O-N 3.12Å
280P31.7Very low37.3Very low130 Ų130104.8 Ų104.884%0.84473%0.73SS**  trans-75109.5-176.130.5-30.2000108.7A282P280-A282 PolarHBondContact O-N 3.31Å
281V28.7Very low35.2Very low135 Ų135105.9 Ų105.982%0.81874%0.74SS**  trans-77.599.1164.7-173.40000106.9A279A279-V281 PolarHBondContact O-N 3.18Å; A279-V281 VanDerWaalsContact O-N 3.12Å
282A28.2Very low33.9Very low90 Ų90106 Ų10674%0.74476%0.755SS**  trans-67.9135.3161.300000109.5P280P280-A282 PolarHBondContact O-N 3.31Å
283A24.7Very low32.4Very low95 Ų95105.7 Ų105.779%0.78576%0.76SS**  trans75.2104.2166.600000118.4
284A24.5Very low31Very low92 Ų92108.7 Ų108.776%0.7676%0.763SS**  178.7114.593.400000113
285V23.5Very low29.6Very low127 Ų127112.7 Ų112.777%0.7777%0.771SS**  trans38.6118.7135.3-146.60000119.5
286T23.1Very low28.5Very low131 Ų131116.4 Ų116.480%0.80479%0.79SS**  164.4122104.6370000112.9
287A25Very low27.8Very low100 Ų100117.2 Ų117.283%0.82680%0.797SS**  trans25.3135.4140.300000122.5
288A24.6Very low27Very low103 Ų103118.7 Ų118.785%0.85179%0.792SS**  trans114.7125132.900000116.7
289A27.1Very low26.4Very low98 Ų98121.5 Ų121.581%0.8179%0.788SS**  trans-63.1173.4-174.900000115.2
290P27Very low26.3Very low130 Ų130126.4 Ų126.484%0.84480%0.798SS**  trans-124.5140134.833.5-21.9000112.8
291A23.8Very low26.1Very low95 Ų95126 Ų12679%0.78580%0.798SS**  trans-87.6143.916800000111.2
292A25.9Very low25.9Very low103 Ų103128.2 Ų128.285%0.85180%0.8SS**  trans53.6118.713800000122.2
293A25.7Very low25.9Very low92 Ų92133.2 Ų133.276%0.7681%0.808SS**  trans-164108.4130.500000107.4
294K27Very low25.9Very low178 Ų178131.9 Ų131.977%0.77480%0.803SS**  61.8136.896.9-90.3-166170.9-119.40113.3
295E25.1Very low26Very low148 Ų148133.4 Ų133.469%0.69281%0.808SS**  cis177.4129.2-5.1-146169-163.500102.6
296E27.6Very low26.2Very low208 Ų208134.6 Ų134.697%0.97281%0.81SS**  trans-156128.4154.4-118.9176.2-156.300108.9
297A28.6Very low26.5Very low90 Ų90135.7 Ų135.774%0.74481%0.811SS**  trans-115.9149.2-164.600000111.1
298K27.3Very low26.9Very low175 Ų175137.2 Ų137.276%0.76181%0.805SS**  trans164.7116.5132.6-95.3-176.5168.6-172.80109.7
299E26.9Very low27.6Very low157 Ų157140.4 Ų140.473%0.73481%0.805SS**  66.2125.1101.1-74.8173.7168.500110.9
300E25.9Very low28Very low178 Ų178138.8 Ų138.883%0.83280%0.798SS**  cis-175.1150.940.8-130.4171.9-168.200108.2
301S27.2Very low28.3Very low121 Ų121140.9 Ų140.985%0.84679%0.794SS**  trans148.4134.8133.673.80000113.2
302E25.8Very low29.1Very low181 Ų181140 Ų14085%0.84680%0.795SS**  trans-94.2-174.2-156.8-59.5176.2124.200115
303E26.8Very low30Very low196 Ų196142.1 Ų142.192%0.91679%0.791SS**  trans81.8127.8163.7-57.1-178.1161.500116.3
304G24.4Very low30.7Very low67 Ų67148 Ų14869%0.69180%0.8SS**  cis166.21605.600000109.1
305S26.8Very low31.6Very low124 Ų124150.6 Ų150.687%0.86782%0.822SS**  trans72107165.969.70000120.9
306D27.6Very low31.9Very low152 Ų152150.8 Ų150.881%0.81383%0.829SS**  trans-33.9137.6136.1-94.9-37.1000113.4
307D30.5Very low32.1Very low154 Ų154147.7 Ų147.782%0.82482%0.821SS**  -175.9117.5116.3-95.6-24.1000111.5
308D33.1Very low32.3Very low131 Ų131150.9 Ų150.970%0.70183%0.825SS**  42103.9128.8-162.423.2000119.3
309M38.5Very low32.6Very low170 Ų170149.5 Ų149.584%0.83783%0.829SS**  trans-154.184.6141.9-82.6-51.7155.300110.2
310G37.2Very low33Very low65 Ų65149.1 Ų149.167%0.6784%0.835SS**  trans-66.5126.8158.100000110.9
311F32.7Very low33.4Very low173 Ų173147.1 Ų147.176%0.75984%0.835SS**  trans-138.787.4163.2-113.7-89.6000109.7
312G40.2Very low33.9Very low78 Ų78149 Ų14980%0.80484%0.835SS**  trans-81.2125.1152.300000108.1
313L44.4Very low34.5Very low147 Ų147146.5 Ų146.577%0.7783%0.834SS**  trans-140111.3169-159.769.3000108.7D315L313-D315 PolarHBondContact O-N 3.45Å
314F42.2Very low35.1Very low216 Ų216142.4 Ų142.495%0.94783%0.827SS**  trans-53.1116.2162.3-98.5-102.8000109.9
315D44.3Very low36.1Very low232 Ų232149.3 Ų149.3100%1.24184%0.839SS**  -145.70120.7-164.825.7000107.7L313L313-D315 PolarHBondContact O-N 3.45Å

Retrieved 315 of 315 residues in 176.6 ms (Link to these results)