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Eukaryotic translation initiation factor 5A

Translation factor that promotes translation elongation and termination, particularly upon ribosome stalling at specific amino acid sequence contexts. Binds between the exit (E) and peptidyl (P) site of the ribosome and promotes rescue of stalled ribosome: specifically required for efficient translation of polyproline-containing peptides as well as other motifs that stall the ribosome. Acts as ribosome quality control (RQC) cofactor by joining the RQC complex to facilitate peptidyl transfer during CAT tailing step.

AlphaFold DB (A0A674EFW0), UniProt , Accession A0A060W577, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110531820, Length 155 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
1M50.4Low47.3Very low251 Ų251137.3 Ų137.3100%1.23680%0.795SS**  0115.60-74.5-168.1164.400107.2
2A44.3Very low47.3Very low104 Ų104138.8 Ų138.886%0.8680%0.798SS**  trans-145.596.3166.200000104.6A4A2-A4 PolarHBondContact O-N 3.31Å
3D45.5Very low47.4Very low159 Ų159135.2 Ų135.285%0.8580%0.795SS**  trans-68.5116.4178-139.9-93.9000107.5D5D3-D5 PolarHBondContact O-N 3.41Å
4A49.7Very low47.4Very low80 Ų80130.6 Ų130.666%0.66179%0.791SS**  trans-84.896.4173.900000107.3A2 V6A2-A4 PolarHBondContact O-N 3.31Å; A4-V6 VanDerWaalsContact C-N 3.33Å; A4-V6 PolarHBondContact O-N 2.93Å
5D48.4Very low48.2Very low144 Ų144126.7 Ų126.777%0.7778%0.778SS**  trans-61.395.7168.8-163.8-103.8000108.2D3 D7D3-D5 PolarHBondContact O-N 3.41Å; D5-D7 PolarHBondContact O-N 2.87Å
6V51.7Low49.9Very low106 Ų106123.8 Ų123.864%0.64276%0.764SS**  trans-84.791.2172.5-85.10000107.5A4 F8A4-V6 VanDerWaalsContact C-N 3.33Å; A4-V6 PolarHBondContact O-N 2.93Å; V6-F8 VanDerWaalsContact C-N 3.27Å; V6-F8 HydrophobicContact CB-CD2 4.11Å; V6-F8 HydrophobicContact CB-CE2 3.94Å; V6-F8 HydrophobicContact CG2-CD2 4.16Å; V6-F8 HydrophobicContact CG2-CE2 3.85Å; V6-F8 WeakPolarHBondContact O-CD2 3.14Å; V6-F8 PolarHBondContact O-N 3.32Å
7D45.8Very low52Low116 Ų116118.8 Ų118.862%0.6274%0.738SS**  trans-62.688.7167.4-166.5-124.3000108.5D5 Q9D5-D7 PolarHBondContact O-N 2.87Å; D7-Q9 PolarHBondContact O-N 2.93Å; D7-Q9 WeakPolarHBondContact OD1-CG 3.49Å; D7-Q9 PolarHBondContact OD1-NE2 2.75Å
8F50.1Low54.3Low177 Ų177113.6 Ų113.678%0.77671%0.705SS**  trans-71.685.3168.2-83.8-89.7000107.8V6 T10V6-F8 VanDerWaalsContact C-N 3.27Å; V6-F8 HydrophobicContact CB-CD2 4.11Å; V6-F8 HydrophobicContact CB-CE2 3.94Å; V6-F8 HydrophobicContact CG2-CD2 4.16Å; V6-F8 HydrophobicContact CG2-CE2 3.85Å; V6-F8 WeakPolarHBondContact O-CD2 3.14Å; V6-F8 PolarHBondContact O-N 3.32Å; F8-T10 VanDerWaalsContact C-N 3.32Å; F8-T10 PolarHBondContact O-N 3.22Å
9Q45.1Very low56.3Low164 Ų164111.8 Ų111.877%0.76669%0.687SS**  trans-64.998.4161.8-66-175.9-20.900107.3D7 G11D7-Q9 PolarHBondContact O-N 2.93Å; D7-Q9 WeakPolarHBondContact OD1-CG 3.49Å; D7-Q9 PolarHBondContact OD1-NE2 2.75Å; Q9-G11 VanDerWaalsContact C-N 3.25Å; Q9-G11 PolarHBondContact O-N 2.83Å
10T47.8Very low58.2Low142 Ų142110.8 Ų110.887%0.87168%0.682SS**  trans-58.296165.4-14.30000106.6F8 D12F8-T10 VanDerWaalsContact C-N 3.32Å; F8-T10 PolarHBondContact O-N 3.22Å; T10-D12 PolarHBondContact O-N 2.82Å
11G41.4Very low59.9Low67 Ų67108.4 Ų108.469%0.69166%0.663SS**  trans-64.7101.5177.500000108.7Q9 A13Q9-G11 VanDerWaalsContact C-N 3.25Å; Q9-G11 PolarHBondContact O-N 2.83Å; G11-A13 PolarHBondContact O-N 2.95Å
12D47.2Very low62Low155 Ų155100.3 Ų100.383%0.82962%0.622SS**  trans-60.795.1158-164.2-97.4000105.7T10 G14T10-D12 PolarHBondContact O-N 2.82Å; D12-G14 VanDerWaalsContact C-N 3.31Å; D12-G14 PolarHBondContact O-N 2.84Å
13A48.4Very low64.3Low92 Ų9295.4 Ų95.476%0.7658%0.582SS**  trans-61.898.6-178.500000107G11 A15G11-A13 PolarHBondContact O-N 2.95Å; A13-A15 VanDerWaalsContact C-N 3.26Å; A13-A15 PolarHBondContact O-N 3Å
14G48.4Very low66.4Low72 Ų7290.2 Ų90.274%0.74256%0.558SS**  trans-56.279-168.500000113.8D12 S16D12-G14 VanDerWaalsContact C-N 3.31Å; D12-G14 PolarHBondContact O-N 2.84Å; G14-S16 PolarHBondContact O-N 2.92Å; G14-S16 VanDerWaalsContact O-N 3.12Å
15A58.2Low68.5Low72 Ų7288.2 Ų88.260%0.59554%0.541SS*.  trans-63.9112.6162.300000106.3A13 A17A13-A15 VanDerWaalsContact C-N 3.26Å; A13-A15 PolarHBondContact O-N 3Å; A15-A17 PolarHBondContact O-N 3.33Å
16S75.6Confident70.7Confident80 Ų8081.6 Ų81.656%0.55951%0.506SS*.  trans-47.3130.8176-177.80000109.6G14 T18 N84G14-S16 PolarHBondContact O-N 2.92Å; G14-S16 VanDerWaalsContact O-N 3.12Å; S16-T18 VanDerWaalsContact CB-O 3.28Å; S16-T18 WeakPolarHBondContact CB-O 3.49Å; S16-T18 PolarHBondContact O-N 3.37Å; S16-T18 PolarHBondContact OG-O 2.82Å; S16-N84 PolarHBondContact O-ND2 2.89Å
17A85.9Confident72.7Confident38 Ų3884 Ų8431%0.31450%0.503SS..SBendtrans-57.3-24.7-178.500000112.8A15 N84 M142A15-A17 PolarHBondContact O-N 3.33Å; A17-N84 PolarHBondContact O-N 2.94Å; A17-M142 HydrophobicContact CB-CG 4.47Å
18T92.7Very high74.9Confident25 Ų2585 Ų8515%0.15350%0.502CS..EExtended strand (participates in β ladder)trans-135.2162.6178.363.20000111S16 V33 D81 V82 M142S16-T18 VanDerWaalsContact CB-O 3.28Å; S16-T18 WeakPolarHBondContact CB-O 3.49Å; S16-T18 PolarHBondContact O-N 3.37Å; S16-T18 PolarHBondContact OG-O 2.82Å; T18-V33 HydrophobicContact CG2-CG2 3.73Å; T18-D81 HydrophobicContact CG2-CB 4.24Å; T18-D81 PolarHBondContact OG1-OD1 2.9Å; T18-V82 CarbonylContact C-O 3.55Å; T18-V82 WeakPolarHBondContact CA-O 3.49Å; T18-V82 WeakPolarHBondContact CB-O 3.17Å; T18-M142 HydrophobicContact CG2-CE 3.84Å; T18-M142 HydrophobicContact CG2-CG 4.1Å; T18-M142 HydrophobicContact CG2-SD 3.98Å
19F92.8Very high77Confident80 Ų8081.2 Ų81.235%0.35149%0.49SS..EExtended strand (participates in β ladder)trans-130.1145.9166.162.3-86.4000110.4Q21 V82 N84F19-Q21 HydrophobicContact CE2-CB 4.33Å; F19-V82 HydrophobicContact CD1-CB 4.26Å; F19-V82 HydrophobicContact CD1-CG1 4.43Å; F19-V82 WeakPolarHBondContact CD1-O 3.36Å; F19-V82 HydrophobicContact CD2-CB 4.14Å; F19-V82 HydrophobicContact CE1-CB 3.85Å; F19-V82 HydrophobicContact CE1-CG1 3.57Å; F19-V82 HydrophobicContact CE2-CB 3.72Å; F19-V82 HydrophobicContact CE2-CG1 3.9Å; F19-V82 HydrophobicContact CE2-CG2 4.24Å; F19-V82 HydrophobicContact CG-CB 4.41Å; F19-V82 HydrophobicContact CZ-CB 3.57Å; F19-V82 HydrophobicContact CZ-CG1 3.27Å; F19-V82 HydrophobicContact CZ-CG2 4.43Å; F19-V82 PolarHBondContact N-O 2.85Å; F19-V82 PolarHBondContact O-N 2.73Å; F19-N84 VanDerWaalsContact CD1-OD1 3.3Å; F19-N84 WeakPolarHBondContact CD1-OD1 3.38Å; F19-N84 WeakPolarHBondContact CE1-OD1 3.49Å
20P94.8Very high79.3Confident91 Ų9174.5 Ų74.559%0.59147%0.465SS*.EExtended strand (participates in β ladder)trans-74.9135.917829.7-33.8000110.9N79P20-N79 HydrophobicContact CB-CB 4.31Å
21Q94.4Very high81.6Confident61 Ų6170.2 Ų70.229%0.28543%0.434SS..EExtended strand (participates in β ladder)trans-138.4140.2171.9-173.7169.8-5.400110.7F19 C23 A25 L26 N79 M80 V82F19-Q21 HydrophobicContact CE2-CB 4.33Å; Q21-C23 PolarHBondContact O-N 2.87Å; Q21-A25 HydrophobicContact CG-CB 4Å; Q21-A25 PolarHBondContact NE2-O 3.44Å; Q21-L26 HydrophobicContact CG-CD2 4.43Å; Q21-N79 WeakPolarHBondContact O-CA 3.12Å; Q21-M80 PolarHBondContact N-O 2.94Å; Q21-M80 PolarHBondContact O-N 3.34Å; Q21-V82 HydrophobicContact CB-CG2 3.62Å
22Q94.4Very high84.3Confident82 Ų8267 Ų6738%0.38340%0.401SS..EExtended strand (participates in β ladder)trans-61.8134.4178.7-167.6176.541.300111.3S24 A25 L26 S76 N79Q22-S24 VanDerWaalsContact CD-OG 3.28Å; Q22-S24 WeakPolarHBondContact CG-OG 3.49Å; Q22-S24 PolarHBondContact O-N 2.86Å; Q22-S24 VanDerWaalsContact O-N 3.14Å; Q22-S24 PolarHBondContact OE1-OG 3.06Å; Q22-S24 VanDerWaalsContact OE1-OG 3.13Å; Q22-A25 HydrophobicContact CB-CB 4.42Å; Q22-A25 WeakPolarHBondContact O-CA 3.41Å; Q22-A25 WeakPolarHBondContact O-CB 3.49Å; Q22-A25 PolarHBondContact O-N 2.78Å; Q22-L26 PolarHBondContact O-N 2.81Å; Q22-S76 WeakPolarHBondContact CG-O 3.21Å; Q22-N79 PolarHBondContact N-OD1 3.24Å
23C91.4Very high86.6Confident0 Ų060.5 Ų60.50%037%0.367CS..G310 helixtrans-53.2-36.2-178.3175.60000111.8Q21 A25 L26 M44 V57 C74 H78 M80Q21-C23 PolarHBondContact O-N 2.87Å; C23-A25 VanDerWaalsContact C-N 3.33Å; C23-A25 PolarHBondContact O-N 3.39Å; C23-L26 WeakPolarHBondContact O-CB 3.36Å; C23-L26 PolarHBondContact O-N 2.95Å; C23-M44 VanDerWaalsContact O-CE 3.3Å; C23-M44 WeakPolarHBondContact O-CE 3.43Å; C23-V57 VanDerWaalsContact SG-CB 3.55Å; C23-C74 HydrophobicContact CB-CB 4.18Å; C23-C74 WeakPolarHBondContact CB-SG 3.48Å; C23-C74 WeakPolarHBondContact SG-CB 3.36Å; C23-C74 CovalentContact SG-SG 2.08Å; C23-C74 PolarHBondContact SG-SG 2.84Å; C23-H78 VanDerWaalsContact CB-O 3.25Å; C23-H78 WeakPolarHBondContact CB-O 3.49Å; C23-H78 PolarHBondContact N-O 3Å; C23-M80 HydrophobicContact CB-CG 3.92Å
24S90.4Very high88.8Confident51 Ų5156.1 Ų56.136%0.35733%0.331SS..G310 helixtrans-70.2-19.6173.754.60000115.6Q22 R27 S76Q22-S24 VanDerWaalsContact CD-OG 3.28Å; Q22-S24 WeakPolarHBondContact CG-OG 3.49Å; Q22-S24 PolarHBondContact O-N 2.86Å; Q22-S24 VanDerWaalsContact O-N 3.14Å; Q22-S24 PolarHBondContact OE1-OG 3.06Å; Q22-S24 VanDerWaalsContact OE1-OG 3.13Å; S24-R27 PolarHBondContact O-NH1 2.84Å; S24-S76 WeakPolarHBondContact CB-O 3.28Å; S24-S76 PolarHBondContact N-O 2.86Å; S24-S76 PolarHBondContact OG-O 2.75Å
25A93.3Very high90.9Very high37 Ų3759.8 Ų59.831%0.30633%0.327SS..G310 helixtrans-86.1-15.6177.400000112.4Q21 Q22 C23 R27Q21-A25 HydrophobicContact CG-CB 4Å; Q21-A25 PolarHBondContact NE2-O 3.44Å; Q22-A25 HydrophobicContact CB-CB 4.42Å; Q22-A25 WeakPolarHBondContact O-CA 3.41Å; Q22-A25 WeakPolarHBondContact O-CB 3.49Å; Q22-A25 PolarHBondContact O-N 2.78Å; C23-A25 VanDerWaalsContact C-N 3.33Å; C23-A25 PolarHBondContact O-N 3.39Å; A25-R27 PolarHBondContact O-NH1 3.48Å
26L94.3Very high92.5Very high5 Ų559 Ų593%0.02633%0.325CS..  trans-63.7153.5173.5-62.2175.8000111.2Q21 Q22 C23 V32 I41 M44 M59 M80 V82Q21-L26 HydrophobicContact CG-CD2 4.43Å; Q22-L26 PolarHBondContact O-N 2.81Å; C23-L26 WeakPolarHBondContact O-CB 3.36Å; C23-L26 PolarHBondContact O-N 2.95Å; L26-V32 HydrophobicContact CD1-CB 4.18Å; L26-V32 HydrophobicContact CD1-CG2 3.78Å; L26-I41 HydrophobicContact CB-CD1 4.02Å; L26-I41 HydrophobicContact CD1-CD1 4.39Å; L26-I41 HydrophobicContact CD2-CD1 4.49Å; L26-M44 HydrophobicContact CB-CE 3.92Å; L26-M44 HydrophobicContact CB-SD 4.47Å; L26-M44 WeakPolarHBondContact O-CE 3.41Å; L26-M59 HydrophobicContact CB-SD 4.43Å; L26-M59 HydrophobicContact CD1-CE 3.96Å; L26-M59 HydrophobicContact CD1-SD 3.53Å; L26-M59 VanDerWaalsContact CD1-SD 3.53Å; L26-M80 HydrophobicContact CD1-CB 4.18Å; L26-M80 HydrophobicContact CD1-CG 4.26Å; L26-V82 HydrophobicContact CD2-CG2 3.71Å
27R93.4Very high93.4Very high158 Ų15858.4 Ų58.460%0.59631%0.311SS*.  trans-139153.7-177.3-63.3-66.9-179.1-92.11110.1S24 A25 G30S24-R27 PolarHBondContact O-NH1 2.84Å; A25-R27 PolarHBondContact O-NH1 3.48Å; R27-G30 WeakPolarHBondContact O-CA 3.38Å; R27-G30 PolarHBondContact O-N 3Å
28K92.9Very high93.8Very high136 Ų13656.8 Ų56.859%0.59130%0.297SS*.THydrogen-bonded Turntrans-55142.2169.1-176.2172.7176167.40109.9G30 V42K28-G30 PolarHBondContact O-N 3.28Å; K28-V42 WeakPolarHBondContact CE-O 3.18Å
29N93.4Very high94Very high97 Ų9755.6 Ų55.652%0.51929%0.29SS..THydrogen-bonded Turntrans66.20-169.2-60.4-66.3000115.9K40 I41N29-K40 WeakPolarHBondContact OD1-CE 3.37Å; N29-I41 WeakPolarHBondContact CA-O 3.29Å; N29-I41 PolarHBondContact N-O 2.79Å
30G95Very high94.2Very high24 Ų2455.8 Ų55.825%0.24729%0.29CS..  trans-74.2-179.8167.600000112.3R27 K28 K40 I41R27-G30 WeakPolarHBondContact O-CA 3.38Å; R27-G30 PolarHBondContact O-N 3Å; K28-G30 PolarHBondContact O-N 3.28Å; G30-K40 WeakPolarHBondContact O-CA 3.42Å; G30-I41 PolarHBondContact O-N 3.21Å
31F96.1Very high94.3Very high51 Ų5151.4 Ų51.422%0.22426%0.262CS..EExtended strand (participates in β ladder)trans-113.7149.6177-57.8-81.4000110.7C39 K40 I64 V82 P83 I85F31-C39 CarbonylContact C-O 3.52Å; F31-C39 VanDerWaalsContact CA-O 3.29Å; F31-C39 WeakPolarHBondContact CA-O 3.16Å; F31-K40 HydrophobicContact CD1-CB 4.14Å; F31-K40 HydrophobicContact CE1-CB 4.03Å; F31-K40 HydrophobicContact CE1-CG 4.24Å; F31-I64 HydrophobicContact CD1-CG2 4.21Å; F31-I64 HydrophobicContact CE1-CG2 4.05Å; F31-V82 WeakPolarHBondContact O-CG1 3.2Å; F31-P83 HydrophobicContact CB-CG 3.9Å; F31-I85 HydrophobicContact CB-CG1 4.37Å; F31-I85 HydrophobicContact CD1-CD1 4.41Å; F31-I85 HydrophobicContact CD1-CG1 4.08Å; F31-I85 HydrophobicContact CD2-CG1 3.93Å; F31-I85 HydrophobicContact CE1-CG1 4.36Å; F31-I85 HydrophobicContact CE2-CG1 4.23Å; F31-I85 HydrophobicContact CG-CG1 3.86Å; F31-I85 HydrophobicContact CZ-CG1 4.43Å
32V96.4Very high94.4Very high0 Ų051 Ų510%026%0.263CS..EExtended strand (participates in β ladder)trans-157.2149.7175.764.20000108.7L26 L34 C39 I41 M80 D81L26-V32 HydrophobicContact CD1-CB 4.18Å; L26-V32 HydrophobicContact CD1-CG2 3.78Å; V32-L34 HydrophobicContact CG1-CD1 4.32Å; V32-L34 HydrophobicContact CG1-CD2 3.86Å; V32-L34 HydrophobicContact CG1-CG 3.88Å; V32-L34 HydrophobicContact CG2-CD2 4.37Å; V32-C39 PolarHBondContact N-O 3.4Å; V32-C39 PolarHBondContact O-N 2.77Å; V32-I41 HydrophobicContact CB-CD1 4.12Å; V32-I41 HydrophobicContact CB-CG1 4.29Å; V32-I41 HydrophobicContact CG1-CD1 3.8Å; V32-I41 HydrophobicContact CG1-CG1 3.51Å; V32-M80 HydrophobicContact CG2-CB 3.95Å; V32-M80 HydrophobicContact CG2-CE 4.34Å; V32-D81 WeakPolarHBondContact CG2-O 3.34Å
33V95.9Very high94.4Very high18 Ų1851.8 Ų51.811%0.10927%0.267CS..EExtended strand (participates in β ladder)trans-83.2117.4172.2-174.80000108.5T18 R37 D81 P83 M142T18-V33 HydrophobicContact CG2-CG2 3.73Å; V33-R37 WeakPolarHBondContact CA-O 3.46Å; V33-D81 HydrophobicContact CB-CB 3.92Å; V33-D81 HydrophobicContact CG2-CB 3.82Å; V33-D81 PolarHBondContact N-O 2.87Å; V33-P83 HydrophobicContact CG2-CB 4.21Å; V33-P83 HydrophobicContact CG2-CG 4.35Å; V33-M142 HydrophobicContact CB-SD 4.44Å; V33-M142 HydrophobicContact CG1-CE 4.02Å; V33-M142 HydrophobicContact CG1-SD 4.08Å; V33-M142 HydrophobicContact CG2-CE 4.1Å; V33-M142 HydrophobicContact CG2-SD 3.5Å; V33-M142 VanDerWaalsContact CG2-SD 3.5Å
34L94.9Very high94.6Very high1 Ų154.2 Ų54.21%0.00528%0.279CS..EExtended strand (participates in β ladder)trans-114.2123.8173.6-58.8178.7000108.5V32 G36 R37 C39 M59 D72 M80V32-L34 HydrophobicContact CG1-CD1 4.32Å; V32-L34 HydrophobicContact CG1-CD2 3.86Å; V32-L34 HydrophobicContact CG1-CG 3.88Å; V32-L34 HydrophobicContact CG2-CD2 4.37Å; L34-G36 PolarHBondContact O-N 3.43Å; L34-G36 VanDerWaalsContact O-N 3.16Å; L34-R37 PolarHBondContact N-O 3.35Å; L34-R37 PolarHBondContact O-N 3.31Å; L34-C39 HydrophobicContact CD1-CB 4.1Å; L34-C39 HydrophobicContact CG-CB 4.22Å; L34-M59 HydrophobicContact CD2-CE 4.43Å; L34-D72 HydrophobicContact CD2-CB 3.94Å; L34-M80 HydrophobicContact CD2-CE 4.41Å
35K92.3Very high94.7Very high149 Ų14954.3 Ų54.365%0.64828%0.28SS*.THydrogen-bonded Turntrans50.539.9179.9-54.2-174.4-174.3174.90113R37 Y70K35-R37 VanDerWaalsContact C-N 3.31Å; K35-R37 PolarHBondContact O-N 2.93Å; K35-Y70 HydrophobicContact CB-CD1 4.47Å; K35-Y70 HydrophobicContact CD-CD1 4.15Å
36G91.3Very high94.6Very high55 Ų5557 Ų5757%0.56729%0.293SS*.THydrogen-bonded Turntrans77.56.8-179.900000115.4L34L34-G36 PolarHBondContact O-N 3.43Å; L34-G36 VanDerWaalsContact O-N 3.16Å
37R94.6Very high94.4Very high67 Ų6759.8 Ų59.825%0.25331%0.312SS..EExtended strand (participates in β ladder)trans-113.3135.6-179.2-61.1-67.1-62.7-163.712.6111.4V33 L34 K35 C39 D63 N66 Y70 E144V33-R37 WeakPolarHBondContact CA-O 3.46Å; L34-R37 PolarHBondContact N-O 3.35Å; L34-R37 PolarHBondContact O-N 3.31Å; K35-R37 VanDerWaalsContact C-N 3.31Å; K35-R37 PolarHBondContact O-N 2.93Å; R37-C39 PolarHBondContact O-N 3.4Å; R37-C39 PolarHBondContact O-SG 2.92Å; R37-D63 IonicContact CZ-OD2 3.57Å; R37-D63 IonicContact NE-OD2 3.68Å; R37-D63 PolarHBondContact NE-OD2 3.38Å; R37-D63 IonicContact NH2-OD1 3.24Å; R37-D63 PolarHBondContact NH2-OD1 2.72Å; R37-D63 IonicContact NH2-OD2 3.48Å; R37-D63 PolarHBondContact NH2-OD2 2.89Å; R37-N66 VanDerWaalsContact CZ-ND2 3.34Å; R37-N66 PolarHBondContact NH2-ND2 3.05Å; R37-Y70 HydrophobicContact CB-CE2 4.25Å; R37-Y70 HydrophobicContact CG-CE2 4.23Å; R37-E144 IonicContact CZ-OE2 2.73Å; R37-E144 IonicContact NH2-OE1 2.63Å; R37-E144 IonicContact NH2-OE2 2.69Å; R37-E144 PolarHBondContact NH2-OE2 2.98Å
38P96Very high94.1Very high4 Ų460.6 Ų60.63%0.02632%0.32CS..EExtended strand (participates in β ladder)trans-71.1116.6175.628.9-32.4000110.2I64 F65 P83 A141 M142P38-I64 HydrophobicContact CB-CD1 3.91Å; P38-I64 HydrophobicContact CB-CG1 4.34Å; P38-I64 HydrophobicContact CG-CD1 4.13Å; P38-I64 HydrophobicContact CG-CG1 4.2Å; P38-I64 PolarHBondContact O-N 2.9Å; P38-F65 HydrophobicContact CG-CD2 3.94Å; P38-F65 HydrophobicContact CG-CE2 3.69Å; P38-P83 HydrophobicContact CB-CB 3.93Å; P38-P83 HydrophobicContact CB-CG 3.91Å; P38-A141 HydrophobicContact CB-CB 4.25Å; P38-A141 HydrophobicContact CG-CB 4.29Å; P38-M142 HydrophobicContact CB-CG 4.48Å; P38-M142 HydrophobicContact CB-SD 4.02Å; P38-M142 HydrophobicContact CG-SD 4.31Å
39C96.8Very high93.6Very high0 Ų057.4 Ų57.40%031%0.312CS..EExtended strand (participates in β ladder)trans-122.1144.5-174.6-62.60000111.7F31 V32 L34 R37 I62F31-C39 CarbonylContact C-O 3.52Å; F31-C39 VanDerWaalsContact CA-O 3.29Å; F31-C39 WeakPolarHBondContact CA-O 3.16Å; V32-C39 PolarHBondContact N-O 3.4Å; V32-C39 PolarHBondContact O-N 2.77Å; L34-C39 HydrophobicContact CD1-CB 4.1Å; L34-C39 HydrophobicContact CG-CB 4.22Å; R37-C39 PolarHBondContact O-N 3.4Å; R37-C39 PolarHBondContact O-SG 2.92Å; C39-I62 CarbonylContact C-O 3.57Å; C39-I62 VanDerWaalsContact CA-O 3.31Å; C39-I62 WeakPolarHBondContact CA-O 3.34Å
40K96.4Very high93.1Very high84 Ų8455.3 Ų55.337%0.36531%0.314SS..EExtended strand (participates in β ladder)trans-87.7126.3165.6-176.4-178.6178-176.40109.6N29 G30 F31 V42 G61 I62 I64N29-K40 WeakPolarHBondContact OD1-CE 3.37Å; G30-K40 WeakPolarHBondContact O-CA 3.42Å; F31-K40 HydrophobicContact CD1-CB 4.14Å; F31-K40 HydrophobicContact CE1-CB 4.03Å; F31-K40 HydrophobicContact CE1-CG 4.24Å; K40-V42 PolarHBondContact O-N 2.94Å; K40-G61 CarbonylContact O-C 3.58Å; K40-G61 WeakPolarHBondContact O-CA 3.46Å; K40-I62 PolarHBondContact N-O 3.22Å; K40-I62 PolarHBondContact O-N 3.45Å; K40-I64 HydrophobicContact CB-CG2 4.06Å
41I96.4Very high92.4Very high0 Ų063.5 Ų63.50%034%0.342CS..EExtended strand (participates in β ladder)trans-71113.3-179.8-57.1170.2000109.5L26 N29 G30 V32 E43 M44 M59L26-I41 HydrophobicContact CB-CD1 4.02Å; L26-I41 HydrophobicContact CD1-CD1 4.39Å; L26-I41 HydrophobicContact CD2-CD1 4.49Å; N29-I41 WeakPolarHBondContact CA-O 3.29Å; N29-I41 PolarHBondContact N-O 2.79Å; G30-I41 PolarHBondContact O-N 3.21Å; V32-I41 HydrophobicContact CB-CD1 4.12Å; V32-I41 HydrophobicContact CB-CG1 4.29Å; V32-I41 HydrophobicContact CG1-CD1 3.8Å; V32-I41 HydrophobicContact CG1-CG1 3.51Å; I41-E43 WeakPolarHBondContact CG2-O 3.48Å; I41-M44 HydrophobicContact CG2-CB 4.18Å; I41-M59 HydrophobicContact CD1-SD 4.46Å
42V97.1Very high91.9Very high51 Ų5169.1 Ų69.131%0.30937%0.369SS..EExtended strand (participates in β ladder)trans-97.7-28.3177.1-65.80000112.5K28 K40 V60 I62K28-V42 WeakPolarHBondContact CE-O 3.18Å; K40-V42 PolarHBondContact O-N 2.94Å; V42-V60 HydrophobicContact CG2-CB 4.28Å; V42-V60 HydrophobicContact CG2-CG1 3.84Å; V42-V60 VanDerWaalsContact CG2-O 3.3Å; V42-V60 WeakPolarHBondContact CG2-O 3.49Å; V42-V60 PolarHBondContact N-O 3.01Å; V42-I62 HydrophobicContact CG1-CB 4.34Å; V42-I62 HydrophobicContact CG1-CD1 3.71Å; V42-I62 HydrophobicContact CG1-CG1 3.79Å; V42-I62 HydrophobicContact CG2-CD1 4.27Å; V42-I62 HydrophobicContact CG2-CG1 3.97Å
43E94.9Very high91.1Very high99 Ų9970.4 Ų70.446%0.46338%0.383SS..EExtended strand (participates in β ladder)trans-140.1142.5177.3-154-176.4123.500110.5I41 V60I41-E43 WeakPolarHBondContact CG2-O 3.48Å; E43-V60 HydrophobicContact CB-CB 3.79Å; E43-V60 HydrophobicContact CB-CG2 4.08Å; E43-V60 PolarHBondContact N-O 3.5Å; E43-V60 VanDerWaalsContact N-O 3.14Å; E43-V60 PolarHBondContact O-N 2.97Å
44M93.9Very high90.5Very high52 Ų5276 Ų7626%0.25641%0.407SS..EExtended strand (participates in β ladder)trans-147.8124.6177.1-174.5179.9-168.600108.2C23 L26 I41 V57 H58 M59C23-M44 VanDerWaalsContact O-CE 3.3Å; C23-M44 WeakPolarHBondContact O-CE 3.43Å; L26-M44 HydrophobicContact CB-CE 3.92Å; L26-M44 HydrophobicContact CB-SD 4.47Å; L26-M44 WeakPolarHBondContact O-CE 3.41Å; I41-M44 HydrophobicContact CG2-CB 4.18Å; M44-V57 HydrophobicContact CE-CG1 3.45Å; M44-V57 VanDerWaalsContact CE-CG1 3.45Å; M44-V57 HydrophobicContact CE-CG2 4.48Å; M44-V57 HydrophobicContact CG-CG1 3.68Å; M44-V57 HydrophobicContact SD-CG1 4.43Å; M44-H58 WeakPolarHBondContact CA-O 3.34Å; M44-M59 HydrophobicContact CE-SD 4.35Å; M44-M59 HydrophobicContact CG-CG 4.09Å
45S92.9Very high90.3Very high52 Ų5277 Ų7736%0.36442%0.416SS..EExtended strand (participates in β ladder)trans-133.8140.617961.90000110.1V57 H58S45-V57 CarbonylContact O-C 3.52Å; S45-V57 WeakPolarHBondContact O-CA 3.44Å; S45-H58 PolarHBondContact N-O 3.26Å; S45-H58 PolarHBondContact O-N 2.95Å
46T91.1Very high90.3Very high94 Ų9474.2 Ų74.258%0.57740%0.404SS*.EExtended strand (participates in β ladder)trans-114.2126.7-179.4-55.50000109.4A55 K56 V57T46-A55 HydrophobicContact CG2-CB 3.81Å; T46-K56 CarbonylContact C-O 3.57Å; T46-K56 WeakPolarHBondContact CA-O 3.4Å; T46-V57 HydrophobicContact CG2-CG2 4.44Å
47S90.1Very high90.4Very high63 Ų6371.7 Ų71.744%0.44138%0.377SS..EExtended strand (participates in β ladder)trans-116.9144.7177.962.10000110.3A55 K56S47-A55 CarbonylContact O-C 3.59Å; S47-A55 VanDerWaalsContact O-CA 3.3Å; S47-A55 WeakPolarHBondContact O-CA 3.43Å; S47-K56 PolarHBondContact N-O 3.38Å; S47-K56 PolarHBondContact O-N 3.45Å; S47-K56 PolarHBondContact OG-O 3.46Å
48K87.3Confident90.5Very high175 Ų17571 Ų7176%0.76138%0.377SS*.EExtended strand (participates in β ladder)trans-99.8131.9170.9-70.6-172.6179.4-177.60109.3G50K48-G50 VanDerWaalsContact C-N 3.31Å; K48-G50 PolarHBondContact O-N 2.69Å; K48-G50 VanDerWaalsContact O-N 3.11Å
49T82.4Confident90.4Very high69 Ų6970.8 Ų70.842%0.42338%0.375SS..  trans-87.269.3176.848.40000110.8G53 H54 K56T49-G53 VanDerWaalsContact O-CA 3.25Å; T49-G53 WeakPolarHBondContact O-CA 3.46Å; T49-G53 PolarHBondContact O-N 3.12Å; T49-H54 PolarHBondContact OG1-O 2.8Å; T49-H54 VanDerWaalsContact OG1-O 3.05Å; T49-K56 HydrophobicContact CG2-CD 3.71Å; T49-K56 HydrophobicContact CG2-CG 4.17Å
50G83.5Confident90.4Very high53 Ų5371 Ų7155%0.54638%0.376SS..SBendtrans82.8-167.3179.900000114.8K48 H52K48-G50 VanDerWaalsContact C-N 3.31Å; K48-G50 PolarHBondContact O-N 2.69Å; K48-G50 VanDerWaalsContact O-N 3.11Å; G50-H52 PolarHBondContact O-N 3.37Å
51K80.8Confident90.4Very high196 Ų19667 Ų6785%0.85236%0.359SS*.SBendtrans-66.7-36.2-170.8-171.4179.4179.3-176.60114
52H85.8Confident90.4Very high169 Ų16970.1 Ų70.178%0.78238%0.375SS*.SBendtrans-1172.1-177.6-61.7-73.8000113.4G50G50-H52 PolarHBondContact O-N 3.37Å
53G78.2Confident90.3Very high28 Ų2867.8 Ų67.829%0.28936%0.361SS..PPolyproline II helixtrans-76147.2-176.900000112.9T49T49-G53 VanDerWaalsContact O-CA 3.25Å; T49-G53 WeakPolarHBondContact O-CA 3.46Å; T49-G53 PolarHBondContact O-N 3.12Å
54H84.2Confident90.2Very high135 Ų13564.8 Ų64.863%0.62535%0.348SS*.PPolyproline II helixtrans-62.2147.8171.6-65.2-86000110.4T49T49-H54 PolarHBondContact OG1-O 2.8Å; T49-H54 VanDerWaalsContact OG1-O 3.05Å
55A90.7Very high90.1Very high22 Ų2264.2 Ų64.218%0.18234%0.344CS..EExtended strand (participates in β ladder)trans-68.2135.9173.400000109.5T46 S47 S76T46-A55 HydrophobicContact CG2-CB 3.81Å; S47-A55 CarbonylContact O-C 3.59Å; S47-A55 VanDerWaalsContact O-CA 3.3Å; S47-A55 WeakPolarHBondContact O-CA 3.43Å; A55-S76 WeakPolarHBondContact O-CB 3.43Å; A55-S76 PolarHBondContact O-N 2.83Å; A55-S76 PolarHBondContact O-OG 2.78Å
56K91.9Very high89.9Confident91 Ų9164.7 Ų64.740%0.39634%0.342SS..EExtended strand (participates in β ladder)trans-110.8132.3172.1-65-175.1178.4-178.60108.1T46 S47 T49 I73T46-K56 CarbonylContact C-O 3.57Å; T46-K56 WeakPolarHBondContact CA-O 3.4Å; S47-K56 PolarHBondContact N-O 3.38Å; S47-K56 PolarHBondContact O-N 3.45Å; S47-K56 PolarHBondContact OG-O 3.46Å; T49-K56 HydrophobicContact CG2-CD 3.71Å; T49-K56 HydrophobicContact CG2-CG 4.17Å; K56-I73 HydrophobicContact CB-CG2 4.11Å; K56-I73 HydrophobicContact CD-CG2 4.42Å
57V94.2Very high89.9Confident2 Ų262.7 Ų62.71%0.01234%0.341CS..EExtended strand (participates in β ladder)trans-101.2122.3175.9-172.90000107.6C23 M44 S45 T46 M59 I73 C74C23-V57 VanDerWaalsContact SG-CB 3.55Å; M44-V57 HydrophobicContact CE-CG1 3.45Å; M44-V57 VanDerWaalsContact CE-CG1 3.45Å; M44-V57 HydrophobicContact CE-CG2 4.48Å; M44-V57 HydrophobicContact CG-CG1 3.68Å; M44-V57 HydrophobicContact SD-CG1 4.43Å; S45-V57 CarbonylContact O-C 3.52Å; S45-V57 WeakPolarHBondContact O-CA 3.44Å; T46-V57 HydrophobicContact CG2-CG2 4.44Å; V57-M59 HydrophobicContact CG1-CG 3.62Å; V57-M59 HydrophobicContact CG1-SD 4.22Å; V57-I73 CarbonylContact O-C 3.58Å; V57-I73 VanDerWaalsContact O-CA 3.31Å; V57-I73 WeakPolarHBondContact O-CA 3.41Å; V57-C74 PolarHBondContact N-O 2.83Å; V57-C74 PolarHBondContact O-N 2.88Å
58H94.8Very high90.1Very high52 Ų5265.9 Ų65.924%0.24135%0.346CS..EExtended strand (participates in β ladder)trans-94.3122.1166.3172.1-118.9000108.3M44 S45 I73M44-H58 WeakPolarHBondContact CA-O 3.34Å; S45-H58 PolarHBondContact N-O 3.26Å; S45-H58 PolarHBondContact O-N 2.95Å; H58-I73 HydrophobicContact CB-CG1 4.08Å
59M94.8Very high90.5Very high0 Ų064 Ų640%034%0.339CS..EExtended strand (participates in β ladder)trans-120.7141.6-178.7-63.6-177.2-60.200110.1L26 L34 I41 M44 V57 E71 D72 C74 M80L26-M59 HydrophobicContact CB-SD 4.43Å; L26-M59 HydrophobicContact CD1-CE 3.96Å; L26-M59 HydrophobicContact CD1-SD 3.53Å; L26-M59 VanDerWaalsContact CD1-SD 3.53Å; L34-M59 HydrophobicContact CD2-CE 4.43Å; I41-M59 HydrophobicContact CD1-SD 4.46Å; M44-M59 HydrophobicContact CE-SD 4.35Å; M44-M59 HydrophobicContact CG-CG 4.09Å; V57-M59 HydrophobicContact CG1-CG 3.62Å; V57-M59 HydrophobicContact CG1-SD 4.22Å; M59-E71 VanDerWaalsContact O-CA 3.31Å; M59-E71 WeakPolarHBondContact O-CA 3.46Å; M59-D72 PolarHBondContact N-O 2.96Å; M59-D72 PolarHBondContact O-N 3.12Å; M59-C74 WeakPolarHBondContact CE-SG 3.43Å; M59-M80 HydrophobicContact CE-CE 3.98Å; M59-M80 HydrophobicContact CE-CG 4.45Å
60V96.6Very high91.2Very high3 Ų363 Ų632%0.01833%0.327CS..EExtended strand (participates in β ladder)trans-123.7121.5173.8-179.10000107.5V42 E43 K69 Y70 E71V42-V60 HydrophobicContact CG2-CB 4.28Å; V42-V60 HydrophobicContact CG2-CG1 3.84Å; V42-V60 VanDerWaalsContact CG2-O 3.3Å; V42-V60 WeakPolarHBondContact CG2-O 3.49Å; V42-V60 PolarHBondContact N-O 3.01Å; E43-V60 HydrophobicContact CB-CB 3.79Å; E43-V60 HydrophobicContact CB-CG2 4.08Å; E43-V60 PolarHBondContact N-O 3.5Å; E43-V60 VanDerWaalsContact N-O 3.14Å; E43-V60 PolarHBondContact O-N 2.97Å; V60-K69 HydrophobicContact CG1-CD 4.06Å; V60-K69 HydrophobicContact CG1-CG 3.83Å; V60-Y70 WeakPolarHBondContact CA-O 3.41Å; V60-E71 HydrophobicContact CG2-CB 4.3Å
61G97.1Very high91.8Very high0 Ų065.6 Ų65.60%033%0.325CS..EExtended strand (participates in β ladder)trans-116.1154.2176.700000112.1K40 K69 Y70K40-G61 CarbonylContact O-C 3.58Å; K40-G61 WeakPolarHBondContact O-CA 3.46Å; G61-K69 WeakPolarHBondContact O-CA 3.42Å; G61-Y70 PolarHBondContact N-O 3.38Å; G61-Y70 PolarHBondContact O-N 3.05Å; G61-Y70 VanDerWaalsContact O-O 3.08Å
62I96.6Very high92.4Very high67 Ų6759.2 Ų59.234%0.34430%0.3SS..EExtended strand (participates in β ladder)trans-111.2127.5166.6-61.3-178.5000107.1C39 K40 V42 I64 G67C39-I62 CarbonylContact C-O 3.57Å; C39-I62 VanDerWaalsContact CA-O 3.31Å; C39-I62 WeakPolarHBondContact CA-O 3.34Å; K40-I62 PolarHBondContact N-O 3.22Å; K40-I62 PolarHBondContact O-N 3.45Å; V42-I62 HydrophobicContact CG1-CB 4.34Å; V42-I62 HydrophobicContact CG1-CD1 3.71Å; V42-I62 HydrophobicContact CG1-CG1 3.79Å; V42-I62 HydrophobicContact CG2-CD1 4.27Å; V42-I62 HydrophobicContact CG2-CG1 3.97Å; I62-I64 PolarHBondContact O-N 3.44Å; I62-G67 WeakPolarHBondContact CG2-O 3.34Å
63D95.4Very high92.7Very high2 Ų255.9 Ų55.91%0.01129%0.287CS..EExtended strand (participates in β ladder)trans-59.8130.5174.5-178.9-49.2000110.4R37 F65 N66 G67 K68 Y70R37-D63 IonicContact CZ-OD2 3.57Å; R37-D63 IonicContact NE-OD2 3.68Å; R37-D63 PolarHBondContact NE-OD2 3.38Å; R37-D63 IonicContact NH2-OD1 3.24Å; R37-D63 PolarHBondContact NH2-OD1 2.72Å; R37-D63 IonicContact NH2-OD2 3.48Å; R37-D63 PolarHBondContact NH2-OD2 2.89Å; D63-F65 PolarHBondContact O-N 2.96Å; D63-F65 WeakPolarHBondContact OD1-CA 3.45Å; D63-F65 PolarHBondContact OD1-N 2.73Å; D63-N66 WeakPolarHBondContact CB-OD1 3.39Å; D63-N66 VanDerWaalsContact CG-ND2 3.31Å; D63-N66 PolarHBondContact OD1-N 3.45Å; D63-N66 PolarHBondContact OD2-ND2 3.48Å; D63-N66 PolarHBondContact OD2-OD1 2.67Å; D63-G67 WeakPolarHBondContact O-CA 3.25Å; D63-G67 PolarHBondContact O-N 3.39Å; D63-G67 VanDerWaalsContact O-N 3.09Å; D63-K68 WeakPolarHBondContact CB-O 3.27Å; D63-K68 PolarHBondContact N-O 2.92Å; D63-Y70 HydrophobicContact CB-CD2 4.01Å; D63-Y70 HydrophobicContact CB-CE2 3.69Å
64I92.6Very high93.4Very high36 Ų3654.9 Ų54.919%0.18528%0.276CS..THydrogen-bonded Turntrans-75.1-13.1-171.366.2-174.1000113.5F31 P38 K40 I62 I85 L139 A141F31-I64 HydrophobicContact CD1-CG2 4.21Å; F31-I64 HydrophobicContact CE1-CG2 4.05Å; P38-I64 HydrophobicContact CB-CD1 3.91Å; P38-I64 HydrophobicContact CB-CG1 4.34Å; P38-I64 HydrophobicContact CG-CD1 4.13Å; P38-I64 HydrophobicContact CG-CG1 4.2Å; P38-I64 PolarHBondContact O-N 2.9Å; K40-I64 HydrophobicContact CB-CG2 4.06Å; I62-I64 PolarHBondContact O-N 3.44Å; I64-I85 HydrophobicContact CD1-CD1 3.62Å; I64-L139 HydrophobicContact CD1-CD1 4.47Å; I64-L139 HydrophobicContact CD1-CD2 3.47Å; I64-L139 VanDerWaalsContact CD1-CD2 3.47Å; I64-L139 HydrophobicContact CG1-CD2 4.19Å; I64-A141 HydrophobicContact CD1-CB 3.86Å
65F90.9Very high93.8Very high40 Ų4050.3 Ų50.318%0.17526%0.258CS..THydrogen-bonded Turntrans-106.4-48.2-178.9-63.2-64.1000112.4P38 D63 L139 A141 E144 A146P38-F65 HydrophobicContact CG-CD2 3.94Å; P38-F65 HydrophobicContact CG-CE2 3.69Å; D63-F65 PolarHBondContact O-N 2.96Å; D63-F65 WeakPolarHBondContact OD1-CA 3.45Å; D63-F65 PolarHBondContact OD1-N 2.73Å; F65-L139 HydrophobicContact CE1-CD2 3.81Å; F65-L139 HydrophobicContact CZ-CD2 3.68Å; F65-A141 HydrophobicContact CE2-CB 3.96Å; F65-A141 HydrophobicContact CZ-CB 3.89Å; F65-E144 WeakPolarHBondContact CB-OE1 3.3Å; F65-E144 HydrophobicContact CD1-CG 4.08Å; F65-E144 HydrophobicContact CD2-CB 4.07Å; F65-E144 HydrophobicContact CD2-CG 3.7Å; F65-E144 VanDerWaalsContact CD2-OE2 3.25Å; F65-E144 WeakPolarHBondContact CD2-OE2 3.47Å; F65-E144 HydrophobicContact CE1-CG 4.1Å; F65-E144 HydrophobicContact CE2-CB 3.62Å; F65-E144 HydrophobicContact CE2-CG 3.71Å; F65-E144 VanDerWaalsContact CG-CD 3.49Å; F65-E144 HydrophobicContact CG-CG 3.88Å; F65-E144 WeakPolarHBondContact CG-OE1 3.42Å; F65-E144 HydrophobicContact CZ-CB 3.87Å; F65-E144 HydrophobicContact CZ-CG 3.92Å; F65-E144 VanDerWaalsContact CZ-O 3.23Å; F65-E144 WeakPolarHBondContact CZ-O 3.41Å; F65-A146 HydrophobicContact CD1-CB 3.59Å; F65-A146 HydrophobicContact CE1-CB 3.83Å
66N89.4Confident93.8Very high61 Ų6150.3 Ų50.333%0.32626%0.257SS..THydrogen-bonded Turntrans-102.8-4.4-174.867.239000114.3R37 D63 K68R37-N66 VanDerWaalsContact CZ-ND2 3.34Å; R37-N66 PolarHBondContact NH2-ND2 3.05Å; D63-N66 WeakPolarHBondContact CB-OD1 3.39Å; D63-N66 VanDerWaalsContact CG-ND2 3.31Å; D63-N66 PolarHBondContact OD1-N 3.45Å; D63-N66 PolarHBondContact OD2-ND2 3.48Å; D63-N66 PolarHBondContact OD2-OD1 2.67Å; N66-K68 PolarHBondContact O-N 2.97Å; N66-K68 VanDerWaalsContact O-N 3.11Å; N66-K68 WeakPolarHBondContact OD1-CA 3.5Å; N66-K68 WeakPolarHBondContact OD1-CB 3.47Å; N66-K68 VanDerWaalsContact OD1-CG 3.26Å; N66-K68 WeakPolarHBondContact OD1-CG 3.23Å; N66-K68 PolarHBondContact OD1-N 3.47Å
67G90Very high93.8Very high53 Ų5349.5 Ų49.555%0.54626%0.26SS..  trans68.16.217900000115.3I62 D63I62-G67 WeakPolarHBondContact CG2-O 3.34Å; D63-G67 WeakPolarHBondContact O-CA 3.25Å; D63-G67 PolarHBondContact O-N 3.39Å; D63-G67 VanDerWaalsContact O-N 3.09Å
68K94.6Very high93.8Very high129 Ų12954.5 Ų54.556%0.56128%0.282SS*.  trans-73142.7177.7-64.9176.7-180175.80110.5D63 N66 Y70D63-K68 WeakPolarHBondContact CB-O 3.27Å; D63-K68 PolarHBondContact N-O 2.92Å; N66-K68 PolarHBondContact O-N 2.97Å; N66-K68 VanDerWaalsContact O-N 3.11Å; N66-K68 WeakPolarHBondContact OD1-CA 3.5Å; N66-K68 WeakPolarHBondContact OD1-CB 3.47Å; N66-K68 VanDerWaalsContact OD1-CG 3.26Å; N66-K68 WeakPolarHBondContact OD1-CG 3.23Å; N66-K68 PolarHBondContact OD1-N 3.47Å; K68-Y70 HydrophobicContact CB-CE2 3.84Å; K68-Y70 WeakPolarHBondContact O-CD2 3.43Å
69K96.6Very high93.7Very high137 Ų13757.3 Ų57.360%0.59630%0.299SS*.EExtended strand (participates in β ladder)trans-83.9131.3177.8-168.5-177.8-178.2-173.40110.1V60 G61V60-K69 HydrophobicContact CG1-CD 4.06Å; V60-K69 HydrophobicContact CG1-CG 3.83Å; G61-K69 WeakPolarHBondContact O-CA 3.42Å
70Y96.7Very high93.6Very high48 Ų4858.5 Ų58.519%0.18831%0.305CS..EExtended strand (participates in β ladder)trans-125.3143.2174-65.8-81.7000109.7K35 R37 V60 G61 D63 K68K35-Y70 HydrophobicContact CB-CD1 4.47Å; K35-Y70 HydrophobicContact CD-CD1 4.15Å; R37-Y70 HydrophobicContact CB-CE2 4.25Å; R37-Y70 HydrophobicContact CG-CE2 4.23Å; V60-Y70 WeakPolarHBondContact CA-O 3.41Å; G61-Y70 PolarHBondContact N-O 3.38Å; G61-Y70 PolarHBondContact O-N 3.05Å; G61-Y70 VanDerWaalsContact O-O 3.08Å; D63-Y70 HydrophobicContact CB-CD2 4.01Å; D63-Y70 HydrophobicContact CB-CE2 3.69Å; K68-Y70 HydrophobicContact CB-CE2 3.84Å; K68-Y70 WeakPolarHBondContact O-CD2 3.43Å
71E95.1Very high93.6Very high106 Ų10662.2 Ų62.250%0.49533%0.325SS..EExtended strand (participates in β ladder)trans-132.6147.8177.964.1-172.8-150.600110.5M59 V60M59-E71 VanDerWaalsContact O-CA 3.31Å; M59-E71 WeakPolarHBondContact O-CA 3.46Å; V60-E71 HydrophobicContact CG2-CB 4.3Å
72D94.2Very high93.5Very high63 Ų6362.7 Ų62.734%0.33733%0.328SS..EExtended strand (participates in β ladder)trans-153.5158177.5-162.314.1000111.7L34 M59L34-D72 HydrophobicContact CD2-CB 3.94Å; M59-D72 PolarHBondContact N-O 2.96Å; M59-D72 PolarHBondContact O-N 3.12Å
73I93.2Very high93.4Very high99 Ų9959.7 Ų59.751%0.50831%0.313SS..EExtended strand (participates in β ladder)trans-124.9108.7177.4-58.4174.9000109.4K56 V57 H58K56-I73 HydrophobicContact CB-CG2 4.11Å; K56-I73 HydrophobicContact CD-CG2 4.42Å; V57-I73 CarbonylContact O-C 3.58Å; V57-I73 VanDerWaalsContact O-CA 3.31Å; V57-I73 WeakPolarHBondContact O-CA 3.41Å; H58-I73 HydrophobicContact CB-CG1 4.08Å
74C91.3Very high93.3Very high6 Ų662.6 Ų62.64%0.04133%0.328CS..EExtended strand (participates in β ladder)trans-108143.3174.348.50000112.5C23 V57 M59 S76 M80C23-C74 HydrophobicContact CB-CB 4.18Å; C23-C74 WeakPolarHBondContact CB-SG 3.48Å; C23-C74 WeakPolarHBondContact SG-CB 3.36Å; C23-C74 CovalentContact SG-SG 2.08Å; C23-C74 PolarHBondContact SG-SG 2.84Å; V57-C74 PolarHBondContact N-O 2.83Å; V57-C74 PolarHBondContact O-N 2.88Å; M59-C74 WeakPolarHBondContact CE-SG 3.43Å; C74-S76 PolarHBondContact O-N 2.89Å; C74-M80 HydrophobicContact CB-CE 4.49Å; C74-M80 HydrophobicContact CB-CG 4.43Å; C74-M80 HydrophobicContact CB-SD 3.71Å; C74-M80 VanDerWaalsContact SG-SD 3.68Å
75P93.7Very high93.2Very high40 Ų4062.9 Ų62.926%0.2633%0.33SS..EExtended strand (participates in β ladder)trans-53.9137.7159.1-25.636.7000110.6T77 H78P75-T77 PolarHBondContact O-N 3.48Å; P75-H78 WeakPolarHBondContact CD-ND1 3.43Å; P75-H78 WeakPolarHBondContact CG-ND1 3.26Å; P75-H78 PolarHBondContact O-N 3.44Å
76S91.3Very high93.2Very high22 Ų2267.2 Ų67.215%0.15435%0.348CS..THydrogen-bonded Turntrans-59.6-25.5-174.2660000113.6Q22 S24 A55 C74Q22-S76 WeakPolarHBondContact CG-O 3.21Å; S24-S76 WeakPolarHBondContact CB-O 3.28Å; S24-S76 PolarHBondContact N-O 2.86Å; S24-S76 PolarHBondContact OG-O 2.75Å; A55-S76 WeakPolarHBondContact O-CB 3.43Å; A55-S76 PolarHBondContact O-N 2.83Å; A55-S76 PolarHBondContact O-OG 2.78Å; C74-S76 PolarHBondContact O-N 2.89Å
77T91.3Very high93.3Very high74 Ų7471.7 Ų71.745%0.45436%0.361SS..THydrogen-bonded Turntrans-88.5-12.6-178.852.90000114.1P75P75-T77 PolarHBondContact O-N 3.48Å
78H92.8Very high93.4Very high106 Ų10673.5 Ų73.549%0.49136%0.357SS..SBendtrans-71147.3177.4-75.4-178000111.1C23 P75C23-H78 VanDerWaalsContact CB-O 3.25Å; C23-H78 WeakPolarHBondContact CB-O 3.49Å; C23-H78 PolarHBondContact N-O 3Å; P75-H78 WeakPolarHBondContact CD-ND1 3.43Å; P75-H78 WeakPolarHBondContact CG-ND1 3.26Å; P75-H78 PolarHBondContact O-N 3.44Å
79N92.9Very high93.3Very high112 Ų11270.3 Ų70.360%0.59935%0.346SS*.EExtended strand (participates in β ladder)trans-80.6138.6168.8-70.2-31.3000109.4P20 Q21 Q22P20-N79 HydrophobicContact CB-CB 4.31Å; Q21-N79 WeakPolarHBondContact O-CA 3.12Å; Q22-N79 PolarHBondContact N-OD1 3.24Å
80M94Very high93.2Very high25 Ų2564.1 Ų64.112%0.12332%0.319CS..EExtended strand (participates in β ladder)trans-117.1148.4172.7-62-65.2-71.400108.3Q21 C23 L26 V32 L34 M59 C74Q21-M80 PolarHBondContact N-O 2.94Å; Q21-M80 PolarHBondContact O-N 3.34Å; C23-M80 HydrophobicContact CB-CG 3.92Å; L26-M80 HydrophobicContact CD1-CB 4.18Å; L26-M80 HydrophobicContact CD1-CG 4.26Å; V32-M80 HydrophobicContact CG2-CB 3.95Å; V32-M80 HydrophobicContact CG2-CE 4.34Å; L34-M80 HydrophobicContact CD2-CE 4.41Å; M59-M80 HydrophobicContact CE-CE 3.98Å; M59-M80 HydrophobicContact CE-CG 4.45Å; C74-M80 HydrophobicContact CB-CE 4.49Å; C74-M80 HydrophobicContact CB-CG 4.43Å; C74-M80 HydrophobicContact CB-SD 3.71Å; C74-M80 VanDerWaalsContact SG-SD 3.68Å
81D95.1Very high93Very high81 Ų8164.4 Ų64.443%0.43332%0.323SS..EExtended strand (participates in β ladder)trans-73.7132.1172.4-72.2-64.6000110.6T18 V32 V33T18-D81 HydrophobicContact CG2-CB 4.24Å; T18-D81 PolarHBondContact OG1-OD1 2.9Å; V32-D81 WeakPolarHBondContact CG2-O 3.34Å; V33-D81 HydrophobicContact CB-CB 3.92Å; V33-D81 HydrophobicContact CG2-CB 3.82Å; V33-D81 PolarHBondContact N-O 2.87Å
82V95.3Very high92.9Very high9 Ų959.9 Ų59.96%0.05530%0.302CS..EExtended strand (participates in β ladder)trans-112125.4172.2179.20000108.1T18 F19 Q21 L26 F31T18-V82 CarbonylContact C-O 3.55Å; T18-V82 WeakPolarHBondContact CA-O 3.49Å; T18-V82 WeakPolarHBondContact CB-O 3.17Å; F19-V82 HydrophobicContact CD1-CB 4.26Å; F19-V82 HydrophobicContact CD1-CG1 4.43Å; F19-V82 WeakPolarHBondContact CD1-O 3.36Å; F19-V82 HydrophobicContact CD2-CB 4.14Å; F19-V82 HydrophobicContact CE1-CB 3.85Å; F19-V82 HydrophobicContact CE1-CG1 3.57Å; F19-V82 HydrophobicContact CE2-CB 3.72Å; F19-V82 HydrophobicContact CE2-CG1 3.9Å; F19-V82 HydrophobicContact CE2-CG2 4.24Å; F19-V82 HydrophobicContact CG-CB 4.41Å; F19-V82 HydrophobicContact CZ-CB 3.57Å; F19-V82 HydrophobicContact CZ-CG1 3.27Å; F19-V82 HydrophobicContact CZ-CG2 4.43Å; F19-V82 PolarHBondContact N-O 2.85Å; F19-V82 PolarHBondContact O-N 2.73Å; Q21-V82 HydrophobicContact CB-CG2 3.62Å; L26-V82 HydrophobicContact CD2-CG2 3.71Å; F31-V82 WeakPolarHBondContact O-CG1 3.2Å
83P95.1Very high92.9Very high4 Ų460.4 Ų60.43%0.02630%0.304CS..EExtended strand (participates in β ladder)trans-71.4141.1-179.830.7-34.9000110.7F31 V33 P38 I85 M142F31-P83 HydrophobicContact CB-CG 3.9Å; V33-P83 HydrophobicContact CG2-CB 4.21Å; V33-P83 HydrophobicContact CG2-CG 4.35Å; P38-P83 HydrophobicContact CB-CB 3.93Å; P38-P83 HydrophobicContact CB-CG 3.91Å; P83-I85 HydrophobicContact CB-CD1 3.93Å; P83-I85 HydrophobicContact CG-CD1 3.8Å; P83-I85 HydrophobicContact CG-CG1 4.35Å; P83-I85 PolarHBondContact O-N 3.02Å; P83-M142 HydrophobicContact CB-CG 3.89Å; P83-M142 HydrophobicContact CB-SD 4.05Å
84N92.8Very high92.8Very high63 Ų6356.1 Ų56.134%0.33728%0.284SS..  trans-75.4107.9166.7-80.2-46000108.9S16 A17 F19S16-N84 PolarHBondContact O-ND2 2.89Å; A17-N84 PolarHBondContact O-N 2.94Å; F19-N84 VanDerWaalsContact CD1-OD1 3.3Å; F19-N84 WeakPolarHBondContact CD1-OD1 3.38Å; F19-N84 WeakPolarHBondContact CE1-OD1 3.49Å
85I91.4Very high92.8Very high43 Ų4358 Ų5822%0.22129%0.293CS..EExtended strand (participates in β ladder)trans-95121.1178.5-52.4-58.4000109F31 I64 P83 R87 L139 A141F31-I85 HydrophobicContact CB-CG1 4.37Å; F31-I85 HydrophobicContact CD1-CD1 4.41Å; F31-I85 HydrophobicContact CD1-CG1 4.08Å; F31-I85 HydrophobicContact CD2-CG1 3.93Å; F31-I85 HydrophobicContact CE1-CG1 4.36Å; F31-I85 HydrophobicContact CE2-CG1 4.23Å; F31-I85 HydrophobicContact CG-CG1 3.86Å; F31-I85 HydrophobicContact CZ-CG1 4.43Å; I64-I85 HydrophobicContact CD1-CD1 3.62Å; P83-I85 HydrophobicContact CB-CD1 3.93Å; P83-I85 HydrophobicContact CG-CD1 3.8Å; P83-I85 HydrophobicContact CG-CG1 4.35Å; P83-I85 PolarHBondContact O-N 3.02Å; I85-R87 HydrophobicContact CG2-CG 4.43Å; I85-L139 HydrophobicContact CG2-CD1 3.9Å; I85-L139 HydrophobicContact CG2-CD2 4.09Å; I85-L139 HydrophobicContact CG2-CG 3.84Å; I85-A141 HydrophobicContact CD1-CB 3.35Å
86K90.9Very high92.7Very high130 Ų13059.7 Ų59.757%0.56530%0.303SS*.EExtended strand (participates in β ladder)trans-108.6138.4169.9-64.4178.5-177.3175.70108.9L139 S140K86-L139 WeakPolarHBondContact O-CA 3.17Å; K86-S140 PolarHBondContact N-O 3.03Å; K86-S140 PolarHBondContact O-N 3.04Å
87R91.9Very high92.5Very high155 Ų15566 Ų6659%0.58534%0.335SS*.EExtended strand (participates in β ladder)trans-127.1125.4172.7-68.8-179.5-177.6173.6-4.6108.1I85 T137 V138 L139I85-R87 HydrophobicContact CG2-CG 4.43Å; R87-T137 HydrophobicContact CB-CG2 4.21Å; R87-V138 WeakPolarHBondContact CA-O 3.33Å; R87-L139 HydrophobicContact CG-CB 4.4Å; R87-L139 HydrophobicContact CG-CD1 4.24Å; R87-L139 HydrophobicContact CG-CG 4.2Å
88L91.5Very high92.3Very high91 Ų9163.8 Ų63.848%0.47633%0.326SS..EExtended strand (participates in β ladder)trans-129.1136.8179.6-67.8172.7000107.8Y90 T137 V138L88-Y90 HydrophobicContact CB-CD2 4.3Å; L88-Y90 HydrophobicContact CB-CE2 3.44Å; L88-Y90 VanDerWaalsContact CB-CE2 3.44Å; L88-Y90 WeakPolarHBondContact CD1-OH 3.29Å; L88-Y90 WeakPolarHBondContact O-CD2 3.39Å; L88-Y90 WeakPolarHBondContact O-CE2 3.41Å; L88-T137 CarbonylContact O-C 3.49Å; L88-T137 WeakPolarHBondContact O-CA 3.44Å; L88-V138 PolarHBondContact N-O 2.87Å; L88-V138 PolarHBondContact O-N 3.36Å
89D92.8Very high92.2Very high62 Ų6264.1 Ų64.133%0.33232%0.324SS..EExtended strand (participates in β ladder)trans-94.1135.8174.6-66.8-26.4000108.1T137 K151D89-T137 VanDerWaalsContact OD1-CB 3.29Å; D89-T137 WeakPolarHBondContact OD1-CB 3.49Å; D89-T137 WeakPolarHBondContact OD1-CG2 3.43Å; D89-T137 PolarHBondContact OD1-OG1 2.86Å; D89-K151 IonicContact OD1-NZ 3.27Å; D89-K151 PolarHBondContact OD1-NZ 2.79Å; D89-K151 IonicContact OD2-NZ 2.86Å; D89-K151 PolarHBondContact OD2-NZ 2.79Å
90Y93.5Very high92.1Very high7 Ų758.8 Ų58.83%0.02730%0.295CS..EExtended strand (participates in β ladder)trans-128.6142.3179.3-60.8-105.1000109.4L88 L102 L103 Q104 R110 L135 I136 V138L88-Y90 HydrophobicContact CB-CD2 4.3Å; L88-Y90 HydrophobicContact CB-CE2 3.44Å; L88-Y90 VanDerWaalsContact CB-CE2 3.44Å; L88-Y90 WeakPolarHBondContact CD1-OH 3.29Å; L88-Y90 WeakPolarHBondContact O-CD2 3.39Å; L88-Y90 WeakPolarHBondContact O-CE2 3.41Å; Y90-L102 HydrophobicContact CD1-CB 4.08Å; Y90-L102 HydrophobicContact CG-CB 4.12Å; Y90-L102 HydrophobicContact CG-CD1 4.39Å; Y90-L103 CarbonylContact C-O 3.59Å; Y90-L103 WeakPolarHBondContact CA-O 3.41Å; Y90-Q104 HydrophobicContact CD1-CB 4.43Å; Y90-Q104 HydrophobicContact CD1-CG 3.34Å; Y90-Q104 HydrophobicContact CE1-CG 3.12Å; Y90-R110 PolarHBondContact OH-NH1 3.44Å; Y90-L135 CarbonylContact O-C 3.53Å; Y90-L135 WeakPolarHBondContact O-CA 3.49Å; Y90-I136 PolarHBondContact N-O 3.47Å; Y90-I136 PolarHBondContact O-N 3.14Å; Y90-V138 HydrophobicContact CD2-CB 4.06Å; Y90-V138 HydrophobicContact CD2-CG2 3.57Å; Y90-V138 HydrophobicContact CE2-CB 3.7Å; Y90-V138 HydrophobicContact CE2-CG2 3.67Å
91Q93.8Very high92.1Very high55 Ų5558 Ų5826%0.25729%0.292SS..EExtended strand (participates in β ladder)trans-75.4127.6171.3-1781772.400110I93 L102 L103 L135 M153Q91-I93 HydrophobicContact CG-CG2 4.24Å; Q91-I93 PolarHBondContact O-N 2.85Å; Q91-L102 CarbonylContact O-C 3.59Å; Q91-L102 WeakPolarHBondContact O-CA 3.46Å; Q91-L103 HydrophobicContact CB-CB 4.29Å; Q91-L103 PolarHBondContact N-O 2.9Å; Q91-L103 PolarHBondContact O-N 3.01Å; Q91-L135 HydrophobicContact CB-CD2 4.11Å; Q91-M153 HydrophobicContact CG-CE 4.04Å
92L93.2Very high92Very high11 Ų1154.1 Ų54.16%0.05827%0.271CS..EExtended strand (participates in β ladder)trans-74.2120.6170.9-175.768.8000109.2G94 I95 L100 L102 I124 Y128 I134 I136L92-G94 WeakPolarHBondContact CD1-O 3.43Å; L92-I95 HydrophobicContact CD1-CG1 4.36Å; L92-I95 HydrophobicContact CD2-CD1 4.4Å; L92-I95 HydrophobicContact CD2-CG1 4.38Å; L92-L100 HydrophobicContact CD1-CB 4.18Å; L92-L100 HydrophobicContact CD1-CD2 3.98Å; L92-L102 HydrophobicContact CB-CD2 4.47Å; L92-L102 HydrophobicContact CD1-CD2 3.81Å; L92-I124 HydrophobicContact CD2-CG2 3.63Å; L92-Y128 HydrophobicContact CD2-CD2 3.86Å; L92-Y128 HydrophobicContact CD2-CG 4.3Å; L92-Y128 HydrophobicContact CG-CD2 4.19Å; L92-I134 HydrophobicContact CB-CD1 4.41Å; L92-I134 HydrophobicContact CB-CG1 3.78Å; L92-I134 HydrophobicContact CD2-CD1 3.63Å; L92-I134 HydrophobicContact CD2-CG1 3.88Å; L92-I134 HydrophobicContact CG-CG1 4.5Å; L92-I134 PolarHBondContact N-O 3.41Å; L92-I136 HydrophobicContact CB-CG1 4.1Å
93I93.8Very high91.9Very high74 Ų7455.8 Ų55.838%0.37928%0.28SS..EExtended strand (participates in β ladder)trans-112.2-19.4177.959.8164.1000112.7Q91 S101 L103 V109 Y128Q91-I93 HydrophobicContact CG-CG2 4.24Å; Q91-I93 PolarHBondContact O-N 2.85Å; I93-S101 WeakPolarHBondContact CG1-O 3.48Å; I93-S101 PolarHBondContact N-O 3.11Å; I93-L103 HydrophobicContact CD1-CB 4.29Å; I93-L103 HydrophobicContact CG1-CB 4.44Å; I93-L103 HydrophobicContact CG2-CB 3.72Å; I93-L103 HydrophobicContact CG2-CD2 4.14Å; I93-V109 HydrophobicContact CD1-CG1 3.84Å; I93-V109 HydrophobicContact CD1-CG2 3.88Å; I93-Y128 PolarHBondContact O-OH 2.9Å
94G91.3Very high91.7Very high8 Ų858.2 Ų58.28%0.08229%0.291CS..EExtended strand (participates in β ladder)trans-167.3162.4-179.400000114L92 S101L92-G94 WeakPolarHBondContact CD1-O 3.43Å; G94-S101 PolarHBondContact N-O 3.36Å; G94-S101 PolarHBondContact O-N 2.82Å
95I91.4Very high91.4Very high47 Ų4763 Ų6324%0.24132%0.316CS..EExtended strand (participates in β ladder)trans-130.6118.3169.9-52.9175.7000107.1L92 Y99 L100 M115 I124 Y128L92-I95 HydrophobicContact CD1-CG1 4.36Å; L92-I95 HydrophobicContact CD2-CD1 4.4Å; L92-I95 HydrophobicContact CD2-CG1 4.38Å; I95-Y99 CarbonylContact C-O 3.59Å; I95-Y99 WeakPolarHBondContact CA-O 3.47Å; I95-L100 HydrophobicContact CG1-CD2 4.14Å; I95-M115 HydrophobicContact CG2-SD 4.44Å; I95-I124 HydrophobicContact CD1-CG2 3.99Å; I95-Y128 HydrophobicContact CD1-CD1 4.13Å; I95-Y128 HydrophobicContact CD1-CG 4.12Å; I95-Y128 HydrophobicContact CG1-CD1 4.39Å; I95-Y128 HydrophobicContact CG1-CG 4.44Å
96T90.1Very high91.2Very high75 Ų7564.6 Ų64.646%0.4633%0.331SS..EExtended strand (participates in β ladder)trans-130.3122.9-176.3-51.70000109.6G98 Y99T96-G98 PolarHBondContact O-N 3.25Å; T96-Y99 PolarHBondContact N-O 3.12Å; T96-Y99 WeakPolarHBondContact O-CA 3.42Å; T96-Y99 WeakPolarHBondContact O-CB 3.17Å; T96-Y99 PolarHBondContact O-N 2.74Å
97D87.6Confident91.1Very high155 Ų15560.9 Ų60.983%0.82933%0.33SS*.THydrogen-bonded Turntrans50.231.2178.2-62.4-40.6000114.8Y99D97-Y99 WeakPolarHBondContact O-CD2 3.42Å
98G86.3Confident91Very high26 Ų2659.4 Ų59.427%0.26833%0.33SS..THydrogen-bonded Turntrans81.510.3-177.900000115.1T96 K114 M115T96-G98 PolarHBondContact O-N 3.25Å; G98-K114 WeakPolarHBondContact O-CG 3.44Å; G98-M115 WeakPolarHBondContact O-CB 3.4Å; G98-M115 PolarHBondContact O-N 2.74Å
99Y90.8Very high91Very high114 Ų11458.6 Ų58.645%0.44733%0.328SS..EExtended strand (participates in β ladder)trans-104.1145.1170.5-67.2-95.3000110.6I95 T96 D97 L113 K114I95-Y99 CarbonylContact C-O 3.59Å; I95-Y99 WeakPolarHBondContact CA-O 3.47Å; T96-Y99 PolarHBondContact N-O 3.12Å; T96-Y99 WeakPolarHBondContact O-CA 3.42Å; T96-Y99 WeakPolarHBondContact O-CB 3.17Å; T96-Y99 PolarHBondContact O-N 2.74Å; D97-Y99 WeakPolarHBondContact O-CD2 3.42Å; Y99-L113 WeakPolarHBondContact CA-O 3.48Å; Y99-K114 HydrophobicContact CD1-CB 4.49Å; Y99-K114 HydrophobicContact CE1-CB 4.4Å
100L91.8Very high90.9Very high0 Ų057.5 Ų57.50%032%0.32CS..EExtended strand (participates in β ladder)trans-90.2124.5178.1-58.3177.1000109.3L92 I95 L102 L113 M115 I124 I136 A147L92-L100 HydrophobicContact CD1-CB 4.18Å; L92-L100 HydrophobicContact CD1-CD2 3.98Å; I95-L100 HydrophobicContact CG1-CD2 4.14Å; L100-L102 HydrophobicContact CB-CD1 4.3Å; L100-L102 HydrophobicContact CB-CD2 3.99Å; L100-L102 HydrophobicContact CB-CG 3.89Å; L100-L113 PolarHBondContact N-O 2.57Å; L100-M115 HydrophobicContact CD2-CB 4.1Å; L100-M115 HydrophobicContact CD2-CG 4.16Å; L100-M115 HydrophobicContact CG-CB 4.34Å; L100-I124 HydrophobicContact CD1-CD1 4.48Å; L100-I124 HydrophobicContact CD2-CG2 4.08Å; L100-I136 HydrophobicContact CD1-CG2 4.49Å; L100-A147 HydrophobicContact CD1-CB 4.48Å
101S93.9Very high90.8Very high7 Ų762.6 Ų62.65%0.04934%0.344CS..EExtended strand (participates in β ladder)trans-88.1109.7167.4-52.60000108.4I93 G94 R110 E111I93-S101 WeakPolarHBondContact CG1-O 3.48Å; I93-S101 PolarHBondContact N-O 3.11Å; G94-S101 PolarHBondContact N-O 3.36Å; G94-S101 PolarHBondContact O-N 2.82Å; S101-R110 CarbonylContact C-O 3.59Å; S101-R110 WeakPolarHBondContact CA-O 3.3Å; S101-E111 PolarHBondContact OG-OE1 2.83Å
102L93.3Very high90.5Very high1 Ų164.5 Ų64.51%0.00536%0.356CS..EExtended strand (participates in β ladder)trans-117.1123.4-169.6-64.8-178.5000110.4Y90 Q91 L92 L100 V109 R110 L113 I136 V138Y90-L102 HydrophobicContact CD1-CB 4.08Å; Y90-L102 HydrophobicContact CG-CB 4.12Å; Y90-L102 HydrophobicContact CG-CD1 4.39Å; Q91-L102 CarbonylContact O-C 3.59Å; Q91-L102 WeakPolarHBondContact O-CA 3.46Å; L92-L102 HydrophobicContact CB-CD2 4.47Å; L92-L102 HydrophobicContact CD1-CD2 3.81Å; L100-L102 HydrophobicContact CB-CD1 4.3Å; L100-L102 HydrophobicContact CB-CD2 3.99Å; L100-L102 HydrophobicContact CB-CG 3.89Å; L102-V109 CarbonylContact O-C 3.45Å; L102-V109 WeakPolarHBondContact O-CA 3.48Å; L102-R110 HydrophobicContact CB-CB 4.45Å; L102-R110 PolarHBondContact N-O 3.2Å; L102-R110 PolarHBondContact O-N 2.95Å; L102-L113 HydrophobicContact CD1-CB 4.37Å; L102-L113 HydrophobicContact CD1-CD1 3.63Å; L102-I136 HydrophobicContact CD2-CB 3.96Å; L102-I136 HydrophobicContact CD2-CG1 3.9Å; L102-V138 HydrophobicContact CD1-CG2 3.89Å
103L93.2Very high90.4Very high44 Ų4464.6 Ų64.623%0.2336%0.356CS..EExtended strand (participates in β ladder)trans-97.1128.4178178.567.9000110.5Y90 Q91 I93 V109Y90-L103 CarbonylContact C-O 3.59Å; Y90-L103 WeakPolarHBondContact CA-O 3.41Å; Q91-L103 HydrophobicContact CB-CB 4.29Å; Q91-L103 PolarHBondContact N-O 2.9Å; Q91-L103 PolarHBondContact O-N 3.01Å; I93-L103 HydrophobicContact CD1-CB 4.29Å; I93-L103 HydrophobicContact CG1-CB 4.44Å; I93-L103 HydrophobicContact CG2-CB 3.72Å; I93-L103 HydrophobicContact CG2-CD2 4.14Å; L103-V109 HydrophobicContact CD1-CG2 3.7Å
104Q90.8Very high90.1Very high54 Ų5467.4 Ų67.425%0.25237%0.366SS..  trans-84.4158.7169.1-70.1-171.640.300111.7Y90 S106 G107 E108Y90-Q104 HydrophobicContact CD1-CB 4.43Å; Y90-Q104 HydrophobicContact CD1-CG 3.34Å; Y90-Q104 HydrophobicContact CE1-CG 3.12Å; Q104-S106 WeakPolarHBondContact CB-OG 3.49Å; Q104-S106 PolarHBondContact O-N 3.09Å; Q104-S106 VanDerWaalsContact O-N 3.12Å; Q104-G107 PolarHBondContact O-N 3.16Å; Q104-E108 PolarHBondContact N-O 3.32Å
105D86.1Confident90Very high164 Ų16469.4 Ų69.488%0.87737%0.373SS*.THydrogen-bonded Turntrans-58.8-22.6170.6-60-42.2000113G107D105-G107 PolarHBondContact O-N 3.44Å
106S87.9Confident89.8Confident76 Ų7668.4 Ų68.453%0.53137%0.37SS..THydrogen-bonded Turntrans-70.8-13.3174.4630000113.6Q104 E108Q104-S106 WeakPolarHBondContact CB-OG 3.49Å; Q104-S106 PolarHBondContact O-N 3.09Å; Q104-S106 VanDerWaalsContact O-N 3.12Å; S106-E108 PolarHBondContact OG-N 2.94Å; S106-E108 PolarHBondContact OG-OE2 3.27Å; S106-E108 VanDerWaalsContact OG-OE2 3.06Å
107G87.5Confident89.6Confident53 Ų5372.9 Ų72.955%0.54639%0.386SS..SBendtrans89.7-1.1-171.300000114Q104 D105Q104-G107 PolarHBondContact O-N 3.16Å; D105-G107 PolarHBondContact O-N 3.44Å
108E90.9Very high89.5Confident123 Ų12367.7 Ų67.758%0.57537%0.369SS*.  trans-77.7135.2176-67.8176.710200111.4Q104 S106Q104-E108 PolarHBondContact N-O 3.32Å; S106-E108 PolarHBondContact OG-N 2.94Å; S106-E108 PolarHBondContact OG-OE2 3.27Å; S106-E108 VanDerWaalsContact OG-OE2 3.06Å
109V91.6Very high89.6Confident74 Ų7472.7 Ų72.745%0.44839%0.39SS..EExtended strand (participates in β ladder)trans-104.5135.1177.2178.50000109.6I93 L102 L103 E111I93-V109 HydrophobicContact CD1-CG1 3.84Å; I93-V109 HydrophobicContact CD1-CG2 3.88Å; L102-V109 CarbonylContact O-C 3.45Å; L102-V109 WeakPolarHBondContact O-CA 3.48Å; L103-V109 HydrophobicContact CD1-CG2 3.7Å; V109-E111 HydrophobicContact CG1-CG 4.09Å
110R89.8Confident89.5Confident40 Ų4070.1 Ų70.115%0.15138%0.382CS..EExtended strand (participates in β ladder)trans-118.8136.5176.6-81.2-173.354.8-177.5-1.2110.7Y90 S101 L102 D112 L113 E145Y90-R110 PolarHBondContact OH-NH1 3.44Å; S101-R110 CarbonylContact C-O 3.59Å; S101-R110 WeakPolarHBondContact CA-O 3.3Å; L102-R110 HydrophobicContact CB-CB 4.45Å; L102-R110 PolarHBondContact N-O 3.2Å; L102-R110 PolarHBondContact O-N 2.95Å; R110-D112 WeakPolarHBondContact CB-OD1 3.31Å; R110-D112 IonicContact CZ-OD1 3.87Å; R110-D112 IonicContact CZ-OD2 2.72Å; R110-D112 IonicContact NE-OD1 3.39Å; R110-D112 PolarHBondContact NE-OD1 3.34Å; R110-D112 IonicContact NE-OD2 3.2Å; R110-D112 IonicContact NH2-OD1 2.67Å; R110-D112 PolarHBondContact NH2-OD1 2.69Å; R110-D112 IonicContact NH2-OD2 2.89Å; R110-D112 PolarHBondContact NH2-OD2 3.36Å; R110-L113 VanDerWaalsContact NH2-CD1 3.3Å; R110-E145 IonicContact CZ-OE2 3.82Å; R110-E145 VanDerWaalsContact CZ-OE2 3.27Å; R110-E145 IonicContact NH1-OE2 3.47Å; R110-E145 PolarHBondContact NH1-OE2 2.8Å; R110-E145 IonicContact NH2-OE2 2.97Å; R110-E145 PolarHBondContact NH2-OE2 3.24Å
111E91.8Very high89.4Confident113 Ų11370.2 Ų70.253%0.52838%0.384SS..EExtended strand (participates in β ladder)trans-132.914.2-178.2-53.1-170100.400112S101 V109S101-E111 PolarHBondContact OG-OE1 2.83Å; V109-E111 HydrophobicContact CG1-CG 4.09Å
112D87.9Confident89.2Confident95 Ų9576 Ų7651%0.50841%0.408SS..EExtended strand (participates in β ladder)trans-86.4-16.6-175.761.3-57.8000113.3R110R110-D112 WeakPolarHBondContact CB-OD1 3.31Å; R110-D112 IonicContact CZ-OD1 3.87Å; R110-D112 IonicContact CZ-OD2 2.72Å; R110-D112 IonicContact NE-OD1 3.39Å; R110-D112 PolarHBondContact NE-OD1 3.34Å; R110-D112 IonicContact NE-OD2 3.2Å; R110-D112 IonicContact NH2-OD1 2.67Å; R110-D112 PolarHBondContact NH2-OD1 2.69Å; R110-D112 IonicContact NH2-OD2 2.89Å; R110-D112 PolarHBondContact NH2-OD2 3.36Å
113L89.8Confident89.1Confident14 Ų1480.1 Ų80.17%0.07343%0.427CS..EExtended strand (participates in β ladder)trans-88.1121.8-176.4-77166000111.8Y99 L100 L102 R110 V138 E145Y99-L113 WeakPolarHBondContact CA-O 3.48Å; L100-L113 PolarHBondContact N-O 2.57Å; L102-L113 HydrophobicContact CD1-CB 4.37Å; L102-L113 HydrophobicContact CD1-CD1 3.63Å; R110-L113 VanDerWaalsContact NH2-CD1 3.3Å; L113-V138 HydrophobicContact CD1-CB 4.25Å; L113-V138 HydrophobicContact CD1-CG1 3.69Å; L113-V138 HydrophobicContact CD1-CG2 3.52Å; L113-V138 HydrophobicContact CD2-CG1 4.42Å; L113-E145 HydrophobicContact CD2-CB 3.96Å
114K89.3Confident89.1Confident132 Ų13278 Ų7857%0.57442%0.416SS*.EExtended strand (participates in β ladder)trans-70.8143.7173.6-162.9178.2-178.3-172.10110.6G98 Y99G98-K114 WeakPolarHBondContact O-CG 3.44Å; Y99-K114 HydrophobicContact CD1-CB 4.49Å; Y99-K114 HydrophobicContact CE1-CB 4.4Å
115M88.1Confident89.1Confident50 Ų5080 Ų8025%0.24643%0.426CS..PPolyproline II helixtrans-57.2132.6172.1-173.7170.366.300110.5I95 G98 L100I95-M115 HydrophobicContact CG2-SD 4.44Å; G98-M115 WeakPolarHBondContact O-CB 3.4Å; G98-M115 PolarHBondContact O-N 2.74Å; L100-M115 HydrophobicContact CD2-CB 4.1Å; L100-M115 HydrophobicContact CD2-CG 4.16Å; L100-M115 HydrophobicContact CG-CB 4.34Å
116P87.1Confident89.3Confident26 Ų2676.7 Ų76.717%0.16941%0.411CS..PPolyproline II helixtrans-64144.617826-33.9000110.9M120 G121 I124 A147P116-M120 HydrophobicContact CB-CG 4.46Å; P116-M120 HydrophobicContact CB-SD 4.17Å; P116-M120 HydrophobicContact CG-CB 4.3Å; P116-M120 HydrophobicContact CG-CG 3.9Å; P116-M120 HydrophobicContact CG-SD 3.93Å; P116-G121 WeakPolarHBondContact O-CA 3.48Å; P116-G121 PolarHBondContact O-N 2.81Å; P116-I124 HydrophobicContact CG-CD1 3.62Å; P116-A147 HydrophobicContact CG-CB 4.16Å
117E85.6Confident89.5Confident169 Ų16975.3 Ų75.379%0.7940%0.396SS*.PPolyproline II helixtrans-78163.5176.7-61.6-174.6165.400111.8
118G86.9Confident89.6Confident47 Ų4777 Ų7749%0.48539%0.386SS..THydrogen-bonded Turntrans82.4-151.3174.600000114M120 G121 K122G118-M120 VanDerWaalsContact C-N 3.28Å; G118-M120 PolarHBondContact O-N 3.31Å; G118-G121 PolarHBondContact O-N 2.88Å; G118-K122 PolarHBondContact O-N 3.05Å
119D87.4Confident89.6Confident130 Ų13077.1 Ų77.170%0.69539%0.391SS*.Hα-helixtrans-67.8-29.4-172.7-62-33.8000112.6K122 E123D119-K122 PolarHBondContact O-N 3Å; D119-E123 WeakPolarHBondContact O-CB 3.29Å; D119-E123 PolarHBondContact O-N 3.17Å
120M87.9Confident89.5Confident60 Ų6076.7 Ų76.730%0.29640%0.395SS..Hα-helixtrans-65.7-45.4177.9-172.8179.5-71.900112P116 G118 K122 E123 I124 V148 I150P116-M120 HydrophobicContact CB-CG 4.46Å; P116-M120 HydrophobicContact CB-SD 4.17Å; P116-M120 HydrophobicContact CG-CB 4.3Å; P116-M120 HydrophobicContact CG-CG 3.9Å; P116-M120 HydrophobicContact CG-SD 3.93Å; G118-M120 VanDerWaalsContact C-N 3.28Å; G118-M120 PolarHBondContact O-N 3.31Å; M120-K122 VanDerWaalsContact C-N 3.32Å; M120-K122 PolarHBondContact O-N 3.24Å; M120-E123 PolarHBondContact O-N 3.32Å; M120-I124 HydrophobicContact CG-CD1 4.34Å; M120-I124 WeakPolarHBondContact O-CG1 3.31Å; M120-I124 PolarHBondContact O-N 2.89Å; M120-V148 WeakPolarHBondContact CE-O 3.3Å; M120-I150 HydrophobicContact CG-CD1 3.94Å; M120-I150 HydrophobicContact CG-CG1 4.25Å
121G89.9Confident89.4Confident3 Ų378 Ų783%0.03142%0.42CS..Hα-helixtrans-60.7-42.6177.100000112.2P116 G118 E123 I124 E125P116-G121 WeakPolarHBondContact O-CA 3.48Å; P116-G121 PolarHBondContact O-N 2.81Å; G118-G121 PolarHBondContact O-N 2.88Å; G121-E123 VanDerWaalsContact C-N 3.33Å; G121-E123 PolarHBondContact O-N 2.79Å; G121-I124 WeakPolarHBondContact O-CB 3.3Å; G121-I124 PolarHBondContact O-N 2.89Å; G121-E125 PolarHBondContact O-N 2.81Å
122K90.9Very high89.4Confident129 Ų12977.2 Ų77.256%0.56142%0.417SS*.Hα-helixtrans-63.3-38.9175.7-65.1176.3-175.6170.80112.4G118 D119 M120 E125 T126G118-K122 PolarHBondContact O-N 3.05Å; D119-K122 PolarHBondContact O-N 3Å; M120-K122 VanDerWaalsContact C-N 3.32Å; M120-K122 PolarHBondContact O-N 3.24Å; K122-E125 PolarHBondContact O-N 2.95Å; K122-T126 WeakPolarHBondContact O-CB 3.31Å; K122-T126 PolarHBondContact O-N 2.63Å; K122-T126 PolarHBondContact O-OG1 2.88Å
123E91.4Very high89.4Confident86 Ų8678.2 Ų78.240%0.40242%0.419SS..Hα-helixtrans-66-39.9176.8-170.1-176.7161.100111.4D119 M120 G121 T126 K127 I150D119-E123 WeakPolarHBondContact O-CB 3.29Å; D119-E123 PolarHBondContact O-N 3.17Å; M120-E123 PolarHBondContact O-N 3.32Å; G121-E123 VanDerWaalsContact C-N 3.33Å; G121-E123 PolarHBondContact O-N 2.79Å; E123-T126 PolarHBondContact O-N 2.82Å; E123-K127 HydrophobicContact CG-CD 4.24Å; E123-K127 WeakPolarHBondContact O-CB 3.19Å; E123-K127 WeakPolarHBondContact O-CG 3.45Å; E123-K127 PolarHBondContact O-N 2.89Å; E123-K127 WeakPolarHBondContact OE1-CE 3.4Å; E123-K127 IonicContact OE1-NZ 2.88Å; E123-K127 PolarHBondContact OE1-NZ 2.8Å; E123-I150 HydrophobicContact CB-CD1 3.84Å; E123-I150 HydrophobicContact CG-CD1 3.85Å
124I91.6Very high89.6Confident0 Ų077.6 Ų77.60%042%0.415CS..Hα-helixtrans-59.6-51.5174-69.3171.1000110.3L92 I95 L100 P116 M120 G121 T126 K127 Y128 I134 I136 I150L92-I124 HydrophobicContact CD2-CG2 3.63Å; I95-I124 HydrophobicContact CD1-CG2 3.99Å; L100-I124 HydrophobicContact CD1-CD1 4.48Å; L100-I124 HydrophobicContact CD2-CG2 4.08Å; P116-I124 HydrophobicContact CG-CD1 3.62Å; M120-I124 HydrophobicContact CG-CD1 4.34Å; M120-I124 WeakPolarHBondContact O-CG1 3.31Å; M120-I124 PolarHBondContact O-N 2.89Å; G121-I124 WeakPolarHBondContact O-CB 3.3Å; G121-I124 PolarHBondContact O-N 2.89Å; I124-T126 PolarHBondContact O-N 3.01Å; I124-K127 PolarHBondContact O-N 2.9Å; I124-Y128 VanDerWaalsContact O-CB 3.29Å; I124-Y128 WeakPolarHBondContact O-CB 3.34Å; I124-Y128 PolarHBondContact O-N 2.86Å; I124-I134 HydrophobicContact CG2-CD1 4.35Å; I124-I136 HydrophobicContact CD1-CD1 3.91Å; I124-I136 HydrophobicContact CG1-CD1 3.88Å; I124-I150 HydrophobicContact CD1-CD1 4.34Å; I124-I150 HydrophobicContact CD1-CG1 4.32Å; I124-I150 HydrophobicContact CG1-CD1 3.49Å; I124-I150 VanDerWaalsContact CG1-CD1 3.49Å; I124-I150 HydrophobicContact CG1-CG1 3.78Å
125E90.9Very high89.7Confident97 Ų9773 Ų7345%0.45340%0.397SS..Hα-helixtrans-60.4-46.2179.8-170.6174.7-153.200111.3G121 K122 K127 Y128 D129G121-E125 PolarHBondContact O-N 2.81Å; K122-E125 PolarHBondContact O-N 2.95Å; E125-K127 PolarHBondContact O-N 2.84Å; E125-Y128 PolarHBondContact O-N 2.81Å; E125-D129 WeakPolarHBondContact O-CB 3.35Å; E125-D129 PolarHBondContact O-N 2.82Å
126T91.9Very high89.9Confident94 Ų9470.7 Ų70.758%0.57739%0.385SS*.Hα-helixtrans-60.7-44.6179.3-57.20000112.2K122 E123 I124 A130K122-T126 WeakPolarHBondContact O-CB 3.31Å; K122-T126 PolarHBondContact O-N 2.63Å; K122-T126 PolarHBondContact O-OG1 2.88Å; E123-T126 PolarHBondContact O-N 2.82Å; I124-T126 PolarHBondContact O-N 3.01Å; T126-A130 WeakPolarHBondContact O-CB 3.48Å; T126-A130 PolarHBondContact O-N 2.97Å
127K90.9Very high90.2Very high46 Ų4669.8 Ų69.820%0.238%0.38CS..Hα-helixtrans-70.7-36.8179.6-74.8179.7172.2171.50112E123 I124 E125 A130 G131 E132 I134 I150E123-K127 HydrophobicContact CG-CD 4.24Å; E123-K127 WeakPolarHBondContact O-CB 3.19Å; E123-K127 WeakPolarHBondContact O-CG 3.45Å; E123-K127 PolarHBondContact O-N 2.89Å; E123-K127 WeakPolarHBondContact OE1-CE 3.4Å; E123-K127 IonicContact OE1-NZ 2.88Å; E123-K127 PolarHBondContact OE1-NZ 2.8Å; I124-K127 PolarHBondContact O-N 2.9Å; E125-K127 PolarHBondContact O-N 2.84Å; K127-A130 PolarHBondContact O-N 3.25Å; K127-G131 PolarHBondContact O-N 2.82Å; K127-E132 HydrophobicContact CB-CB 4.49Å; K127-E132 WeakPolarHBondContact O-CB 3.22Å; K127-E132 PolarHBondContact O-N 3.14Å; K127-I134 HydrophobicContact CB-CD1 4.05Å; K127-I134 HydrophobicContact CB-CG2 3.89Å; K127-I134 HydrophobicContact CD-CG2 3.92Å; K127-I134 HydrophobicContact CG-CG2 4.46Å; K127-I150 HydrophobicContact CD-CG2 4.21Å
128Y90.1Very high90.5Very high89 Ų8962 Ų6235%0.34934%0.343SS..Hα-helixtrans-63.5-47174.5-175.6-102.5000111.6L92 I93 I95 I124 E125 A130 G131L92-Y128 HydrophobicContact CD2-CD2 3.86Å; L92-Y128 HydrophobicContact CD2-CG 4.3Å; L92-Y128 HydrophobicContact CG-CD2 4.19Å; I93-Y128 PolarHBondContact O-OH 2.9Å; I95-Y128 HydrophobicContact CD1-CD1 4.13Å; I95-Y128 HydrophobicContact CD1-CG 4.12Å; I95-Y128 HydrophobicContact CG1-CD1 4.39Å; I95-Y128 HydrophobicContact CG1-CG 4.44Å; I124-Y128 VanDerWaalsContact O-CB 3.29Å; I124-Y128 WeakPolarHBondContact O-CB 3.34Å; I124-Y128 PolarHBondContact O-N 2.86Å; E125-Y128 PolarHBondContact O-N 2.81Å; Y128-A130 VanDerWaalsContact C-N 3.27Å; Y128-A130 PolarHBondContact O-N 2.82Å; Y128-G131 WeakPolarHBondContact O-CA 3.32Å; Y128-G131 PolarHBondContact O-N 2.08Å
129D90.2Very high90.8Very high125 Ų12560 Ų6067%0.66832%0.321SS*.Hα-helixtrans-65.2-29.5177.2-75.9-16.4000113E125 G131E125-D129 WeakPolarHBondContact O-CB 3.35Å; E125-D129 PolarHBondContact O-N 2.82Å; D129-G131 PolarHBondContact O-N 3.28Å
130A90.9Very high91Very high66 Ų6655 Ų5555%0.54530%0.297SS..THydrogen-bonded Turntrans-71.1-8.517200000113.3T126 K127 Y128 E132T126-A130 WeakPolarHBondContact O-CB 3.48Å; T126-A130 PolarHBondContact O-N 2.97Å; K127-A130 PolarHBondContact O-N 3.25Å; Y128-A130 VanDerWaalsContact C-N 3.27Å; Y128-A130 PolarHBondContact O-N 2.82Å; A130-E132 VanDerWaalsContact C-N 3.28Å; A130-E132 HydrophobicContact CB-CG 4.13Å
131G87.6Confident91.2Very high66 Ų6652.2 Ų52.268%0.6828%0.284SS*.THydrogen-bonded Turntrans7122.9-175.200000113.1K127 Y128 D129K127-G131 PolarHBondContact O-N 2.82Å; Y128-G131 WeakPolarHBondContact O-CA 3.32Å; Y128-G131 PolarHBondContact O-N 2.08Å; D129-G131 PolarHBondContact O-N 3.28Å
132E90.3Very high91.1Very high97 Ų9754.7 Ų54.745%0.45330%0.295SS..  trans-79.2136.8175.8-66.8-177.7-15600110.7K127 A130 I134K127-E132 HydrophobicContact CB-CB 4.49Å; K127-E132 WeakPolarHBondContact O-CB 3.22Å; K127-E132 PolarHBondContact O-N 3.14Å; A130-E132 VanDerWaalsContact C-N 3.28Å; A130-E132 HydrophobicContact CB-CG 4.13Å; E132-I134 HydrophobicContact CB-CG2 4.28Å; E132-I134 PolarHBondContact O-N 2.82Å
133E89.3Confident90.8Very high116 Ų11656.1 Ų56.154%0.54231%0.309SS..  trans-78.1114.3171.8-66.2-177.8151.800109.6M153E133-M153 HydrophobicContact CB-CB 3.99Å; E133-M153 HydrophobicContact CB-CE 3.89Å; E133-M153 HydrophobicContact CB-CG 4.49Å; E133-M153 HydrophobicContact CG-CE 4.41Å; E133-M153 PolarHBondContact O-N 2.93Å
134I92.5Very high90.7Very high1 Ų155.4 Ų55.41%0.00531%0.306CS..EExtended strand (participates in β ladder)trans-120.8145-17967.2179000111.9L92 I124 K127 E132 I136 I150 K151L92-I134 HydrophobicContact CB-CD1 4.41Å; L92-I134 HydrophobicContact CB-CG1 3.78Å; L92-I134 HydrophobicContact CD2-CD1 3.63Å; L92-I134 HydrophobicContact CD2-CG1 3.88Å; L92-I134 HydrophobicContact CG-CG1 4.5Å; L92-I134 PolarHBondContact N-O 3.41Å; I124-I134 HydrophobicContact CG2-CD1 4.35Å; K127-I134 HydrophobicContact CB-CD1 4.05Å; K127-I134 HydrophobicContact CB-CG2 3.89Å; K127-I134 HydrophobicContact CD-CG2 3.92Å; K127-I134 HydrophobicContact CG-CG2 4.46Å; E132-I134 HydrophobicContact CB-CG2 4.28Å; E132-I134 PolarHBondContact O-N 2.82Å; I134-I136 HydrophobicContact CD1-CD1 4.03Å; I134-I136 HydrophobicContact CG1-CD1 4.31Å; I134-I150 HydrophobicContact CB-CG2 4.2Å; I134-I150 HydrophobicContact CD1-CG2 4.12Å; I134-I150 HydrophobicContact CG2-CG2 4.47Å; I134-K151 CarbonylContact C-O 3.52Å; I134-K151 WeakPolarHBondContact CA-O 3.25Å
135L92.3Very high90.7Very high37 Ų3759 Ų5919%0.19432%0.322CS..EExtended strand (participates in β ladder)trans-101130.1169.6-64.2167.9000109.3Y90 Q91 K151 M153Y90-L135 CarbonylContact O-C 3.53Å; Y90-L135 WeakPolarHBondContact O-CA 3.49Å; Q91-L135 HydrophobicContact CB-CD2 4.11Å; L135-K151 HydrophobicContact CB-CB 4.19Å; L135-K151 PolarHBondContact N-O 2.8Å; L135-K151 PolarHBondContact O-N 3.29Å; L135-M153 HydrophobicContact CD1-CG 3.84Å; L135-M153 HydrophobicContact CD1-SD 4.47Å; L135-M153 HydrophobicContact CD2-CG 4.01Å; L135-M153 HydrophobicContact CD2-SD 4.12Å; L135-M153 HydrophobicContact CG-CG 3.55Å; L135-M153 HydrophobicContact CG-SD 4.28Å
136I93.3Very high90.6Very high0 Ų055.8 Ų55.80%031%0.312CS..EExtended strand (participates in β ladder)trans-100118.7173.4-54.8-57.2000108.3Y90 L92 L100 L102 I124 I134 V138 A147 I150Y90-I136 PolarHBondContact N-O 3.47Å; Y90-I136 PolarHBondContact O-N 3.14Å; L92-I136 HydrophobicContact CB-CG1 4.1Å; L100-I136 HydrophobicContact CD1-CG2 4.49Å; L102-I136 HydrophobicContact CD2-CB 3.96Å; L102-I136 HydrophobicContact CD2-CG1 3.9Å; I124-I136 HydrophobicContact CD1-CD1 3.91Å; I124-I136 HydrophobicContact CG1-CD1 3.88Å; I134-I136 HydrophobicContact CD1-CD1 4.03Å; I134-I136 HydrophobicContact CG1-CD1 4.31Å; I136-V138 HydrophobicContact CG2-CG2 4.42Å; I136-V138 PolarHBondContact O-N 3.5Å; I136-A147 HydrophobicContact CG2-CB 3.67Å; I136-I150 HydrophobicContact CD1-CG1 4.17Å; I136-I150 HydrophobicContact CD1-CG2 4.3Å
137T92.3Very high90.5Very high8 Ų852 Ų525%0.04929%0.29CS..EExtended strand (participates in β ladder)trans-81.7114.1171.2-54.60000108.9R87 L88 D89 V148 A149 K151R87-T137 HydrophobicContact CB-CG2 4.21Å; L88-T137 CarbonylContact O-C 3.49Å; L88-T137 WeakPolarHBondContact O-CA 3.44Å; D89-T137 VanDerWaalsContact OD1-CB 3.29Å; D89-T137 WeakPolarHBondContact OD1-CB 3.49Å; D89-T137 WeakPolarHBondContact OD1-CG2 3.43Å; D89-T137 PolarHBondContact OD1-OG1 2.86Å; T137-V148 HydrophobicContact CG2-CG2 4.14Å; T137-V148 WeakPolarHBondContact O-CG2 3.34Å; T137-V148 PolarHBondContact O-N 2.77Å; T137-A149 PolarHBondContact N-O 3.5Å; T137-K151 WeakPolarHBondContact OG1-CE 3.45Å; T137-K151 PolarHBondContact OG1-NZ 2.79Å
138V92.2Very high90.5Very high4 Ų452 Ų522%0.02429%0.294CS..EExtended strand (participates in β ladder)trans-94.6130.3171.5-177.20000108.8R87 L88 Y90 L102 L113 I136 E145 A146R87-V138 WeakPolarHBondContact CA-O 3.33Å; L88-V138 PolarHBondContact N-O 2.87Å; L88-V138 PolarHBondContact O-N 3.36Å; Y90-V138 HydrophobicContact CD2-CB 4.06Å; Y90-V138 HydrophobicContact CD2-CG2 3.57Å; Y90-V138 HydrophobicContact CE2-CB 3.7Å; Y90-V138 HydrophobicContact CE2-CG2 3.67Å; L102-V138 HydrophobicContact CD1-CG2 3.89Å; L113-V138 HydrophobicContact CD1-CB 4.25Å; L113-V138 HydrophobicContact CD1-CG1 3.69Å; L113-V138 HydrophobicContact CD1-CG2 3.52Å; L113-V138 HydrophobicContact CD2-CG1 4.42Å; I136-V138 HydrophobicContact CG2-CG2 4.42Å; I136-V138 PolarHBondContact O-N 3.5Å; V138-E145 HydrophobicContact CG1-CB 4.16Å; V138-A146 WeakPolarHBondContact CA-O 3.44Å
139L92.6Very high90.5Very high5 Ų549.4 Ų49.43%0.02629%0.291CS..EExtended strand (participates in β ladder)trans-101.8129.1171.9-172152.2000109.2I64 F65 I85 K86 R87 A141 E145 A146 V148I64-L139 HydrophobicContact CD1-CD1 4.47Å; I64-L139 HydrophobicContact CD1-CD2 3.47Å; I64-L139 VanDerWaalsContact CD1-CD2 3.47Å; I64-L139 HydrophobicContact CG1-CD2 4.19Å; F65-L139 HydrophobicContact CE1-CD2 3.81Å; F65-L139 HydrophobicContact CZ-CD2 3.68Å; I85-L139 HydrophobicContact CG2-CD1 3.9Å; I85-L139 HydrophobicContact CG2-CD2 4.09Å; I85-L139 HydrophobicContact CG2-CG 3.84Å; K86-L139 WeakPolarHBondContact O-CA 3.17Å; R87-L139 HydrophobicContact CG-CB 4.4Å; R87-L139 HydrophobicContact CG-CD1 4.24Å; R87-L139 HydrophobicContact CG-CG 4.2Å; L139-A141 HydrophobicContact CD2-CB 4.06Å; L139-E145 CarbonylContact O-C 3.57Å; L139-E145 VanDerWaalsContact O-CA 3.27Å; L139-E145 WeakPolarHBondContact O-CA 3.41Å; L139-A146 PolarHBondContact N-O 3.46Å; L139-A146 PolarHBondContact O-N 3.46Å; L139-V148 HydrophobicContact CB-CB 4.36Å; L139-V148 HydrophobicContact CB-CG1 3.67Å; L139-V148 HydrophobicContact CB-CG2 3.73Å; L139-V148 HydrophobicContact CD1-CG1 4.39Å; L139-V148 HydrophobicContact CD1-CG2 4.41Å
140S91.6Very high90.5Very high26 Ų2644.9 Ų44.918%0.18227%0.267CS..EExtended strand (participates in β ladder)trans-117.7129.2176.3-178.30000110.1K86 E144 E145K86-S140 PolarHBondContact N-O 3.03Å; K86-S140 PolarHBondContact O-N 3.04Å; S140-E144 WeakPolarHBondContact CA-O 3.48Å; S140-E145 WeakPolarHBondContact CB-OE1 3.25Å; S140-E145 WeakPolarHBondContact OG-CG 3.42Å; S140-E145 PolarHBondContact OG-OE1 3.13Å
141A92.3Very high90.5Very high2 Ų246 Ų462%0.01726%0.259CS..EExtended strand (participates in β ladder)trans-155.6131.7179.200000111.7P38 I64 F65 I85 L139 N143 E144P38-A141 HydrophobicContact CB-CB 4.25Å; P38-A141 HydrophobicContact CG-CB 4.29Å; I64-A141 HydrophobicContact CD1-CB 3.86Å; F65-A141 HydrophobicContact CE2-CB 3.96Å; F65-A141 HydrophobicContact CZ-CB 3.89Å; I85-A141 HydrophobicContact CD1-CB 3.35Å; L139-A141 HydrophobicContact CD2-CB 4.06Å; A141-N143 PolarHBondContact O-N 3.42Å; A141-N143 VanDerWaalsContact O-N 3.12Å; A141-E144 PolarHBondContact N-O 3.26Å; A141-E144 PolarHBondContact O-N 3.39Å
142M87.5Confident90.5Very high54 Ų5446 Ų4627%0.26625%0.253SS..THydrogen-bonded Turntrans49.537.8175-59-177.669.300114.8A17 T18 V33 P38 P83 E144A17-M142 HydrophobicContact CB-CG 4.47Å; T18-M142 HydrophobicContact CG2-CE 3.84Å; T18-M142 HydrophobicContact CG2-CG 4.1Å; T18-M142 HydrophobicContact CG2-SD 3.98Å; V33-M142 HydrophobicContact CB-SD 4.44Å; V33-M142 HydrophobicContact CG1-CE 4.02Å; V33-M142 HydrophobicContact CG1-SD 4.08Å; V33-M142 HydrophobicContact CG2-CE 4.1Å; V33-M142 HydrophobicContact CG2-SD 3.5Å; V33-M142 VanDerWaalsContact CG2-SD 3.5Å; P38-M142 HydrophobicContact CB-CG 4.48Å; P38-M142 HydrophobicContact CB-SD 4.02Å; P38-M142 HydrophobicContact CG-SD 4.31Å; P83-M142 HydrophobicContact CB-CG 3.89Å; P83-M142 HydrophobicContact CB-SD 4.05Å; M142-E144 VanDerWaalsContact C-N 3.32Å
143N85.6Confident90Very high159 Ų15944.5 Ų44.585%0.8525%0.247SC*.THydrogen-bonded Turntrans72.413.6-177.2-39.9-75.2000115.6A141A141-N143 PolarHBondContact O-N 3.42Å; A141-N143 VanDerWaalsContact O-N 3.12Å
144E89Confident89Confident72 Ų7243.8 Ų43.834%0.33626%0.261SS..EExtended strand (participates in β ladder)trans-111.5138.2170.1-173.7172-176.600108.8R37 F65 S140 A141 M142R37-E144 IonicContact CZ-OE2 2.73Å; R37-E144 IonicContact NH2-OE1 2.63Å; R37-E144 IonicContact NH2-OE2 2.69Å; R37-E144 PolarHBondContact NH2-OE2 2.98Å; F65-E144 WeakPolarHBondContact CB-OE1 3.3Å; F65-E144 HydrophobicContact CD1-CG 4.08Å; F65-E144 HydrophobicContact CD2-CB 4.07Å; F65-E144 HydrophobicContact CD2-CG 3.7Å; F65-E144 VanDerWaalsContact CD2-OE2 3.25Å; F65-E144 WeakPolarHBondContact CD2-OE2 3.47Å; F65-E144 HydrophobicContact CE1-CG 4.1Å; F65-E144 HydrophobicContact CE2-CB 3.62Å; F65-E144 HydrophobicContact CE2-CG 3.71Å; F65-E144 VanDerWaalsContact CG-CD 3.49Å; F65-E144 HydrophobicContact CG-CG 3.88Å; F65-E144 WeakPolarHBondContact CG-OE1 3.42Å; F65-E144 HydrophobicContact CZ-CB 3.87Å; F65-E144 HydrophobicContact CZ-CG 3.92Å; F65-E144 VanDerWaalsContact CZ-O 3.23Å; F65-E144 WeakPolarHBondContact CZ-O 3.41Å; S140-E144 WeakPolarHBondContact CA-O 3.48Å; A141-E144 PolarHBondContact N-O 3.26Å; A141-E144 PolarHBondContact O-N 3.39Å; M142-E144 VanDerWaalsContact C-N 3.32Å
145E90.9Very high87.1Confident75 Ų7556.5 Ų56.535%0.3532%0.316SS..EExtended strand (participates in β ladder)trans-128.9140.7178-55.6-156.815200110.8R110 L113 V138 L139 S140R110-E145 IonicContact CZ-OE2 3.82Å; R110-E145 VanDerWaalsContact CZ-OE2 3.27Å; R110-E145 IonicContact NH1-OE2 3.47Å; R110-E145 PolarHBondContact NH1-OE2 2.8Å; R110-E145 IonicContact NH2-OE2 2.97Å; R110-E145 PolarHBondContact NH2-OE2 3.24Å; L113-E145 HydrophobicContact CD2-CB 3.96Å; V138-E145 HydrophobicContact CG1-CB 4.16Å; L139-E145 CarbonylContact O-C 3.57Å; L139-E145 VanDerWaalsContact O-CA 3.27Å; L139-E145 WeakPolarHBondContact O-CA 3.41Å; S140-E145 WeakPolarHBondContact CB-OE1 3.25Å; S140-E145 WeakPolarHBondContact OG-CG 3.42Å; S140-E145 PolarHBondContact OG-OE1 3.13Å
146A89.4Confident86.9Confident29 Ų2957.5 Ų57.524%0.2432%0.322CS..EExtended strand (participates in β ladder)trans-150.9148.5175.400000112F65 V138 L139 V148F65-A146 HydrophobicContact CD1-CB 3.59Å; F65-A146 HydrophobicContact CE1-CB 3.83Å; V138-A146 WeakPolarHBondContact CA-O 3.44Å; L139-A146 PolarHBondContact N-O 3.46Å; L139-A146 PolarHBondContact O-N 3.46Å; A146-V148 PolarHBondContact O-N 3.05Å
147A90.1Very high86.5Confident14 Ų1460.5 Ų60.512%0.11634%0.339CS..EExtended strand (participates in β ladder)trans-68.9125.516600000109.6L100 P116 I136L100-A147 HydrophobicContact CD1-CB 4.48Å; P116-A147 HydrophobicContact CG-CB 4.16Å; I136-A147 HydrophobicContact CG2-CB 3.67Å
148V90.1Very high86.2Confident47 Ų4763.4 Ų63.429%0.28536%0.355SS..EExtended strand (participates in β ladder)trans-123.9-13.9-174.6-63.40000114.3M120 T137 L139 A146M120-V148 WeakPolarHBondContact CE-O 3.3Å; T137-V148 HydrophobicContact CG2-CG2 4.14Å; T137-V148 WeakPolarHBondContact O-CG2 3.34Å; T137-V148 PolarHBondContact O-N 2.77Å; L139-V148 HydrophobicContact CB-CB 4.36Å; L139-V148 HydrophobicContact CB-CG1 3.67Å; L139-V148 HydrophobicContact CB-CG2 3.73Å; L139-V148 HydrophobicContact CD1-CG1 4.39Å; L139-V148 HydrophobicContact CD1-CG2 4.41Å; A146-V148 PolarHBondContact O-N 3.05Å
149A89.8Confident85.9Confident34 Ų3466.9 Ų66.928%0.28138%0.375SS..EExtended strand (participates in β ladder)trans-154.7152.9176.500000112T137T137-A149 PolarHBondContact N-O 3.5Å
150I91.2Very high85.5Confident31 Ų3170.8 Ų70.816%0.15940%0.396CS..EExtended strand (participates in β ladder)trans-114130.9172.6-51.2164.1000106.9M120 E123 I124 K127 I134 I136M120-I150 HydrophobicContact CG-CD1 3.94Å; M120-I150 HydrophobicContact CG-CG1 4.25Å; E123-I150 HydrophobicContact CB-CD1 3.84Å; E123-I150 HydrophobicContact CG-CD1 3.85Å; I124-I150 HydrophobicContact CD1-CD1 4.34Å; I124-I150 HydrophobicContact CD1-CG1 4.32Å; I124-I150 HydrophobicContact CG1-CD1 3.49Å; I124-I150 VanDerWaalsContact CG1-CD1 3.49Å; I124-I150 HydrophobicContact CG1-CG1 3.78Å; K127-I150 HydrophobicContact CD-CG2 4.21Å; I134-I150 HydrophobicContact CB-CG2 4.2Å; I134-I150 HydrophobicContact CD1-CG2 4.12Å; I134-I150 HydrophobicContact CG2-CG2 4.47Å; I136-I150 HydrophobicContact CD1-CG1 4.17Å; I136-I150 HydrophobicContact CD1-CG2 4.3Å
151K91.2Very high85Confident89 Ų8973.8 Ų73.839%0.38741%0.411SS..EExtended strand (participates in β ladder)trans-122.6142173-62.7168.1-179163.40108.3D89 I134 L135 T137D89-K151 IonicContact OD1-NZ 3.27Å; D89-K151 PolarHBondContact OD1-NZ 2.79Å; D89-K151 IonicContact OD2-NZ 2.86Å; D89-K151 PolarHBondContact OD2-NZ 2.79Å; I134-K151 CarbonylContact C-O 3.52Å; I134-K151 WeakPolarHBondContact CA-O 3.25Å; L135-K151 HydrophobicContact CB-CB 4.19Å; L135-K151 PolarHBondContact N-O 2.8Å; L135-K151 PolarHBondContact O-N 3.29Å; T137-K151 WeakPolarHBondContact OG1-CE 3.45Å; T137-K151 PolarHBondContact OG1-NZ 2.79Å
152A87.3Confident84.5Confident67 Ų6778.9 Ų78.955%0.55444%0.439SS*.EExtended strand (participates in β ladder)trans-76.4138.2169.100000109.1A154A152-A154 PolarHBondContact O-N 3.48Å; A152-A154 VanDerWaalsContact O-N 3.17Å
153M80.6Confident84.3Confident64 Ų6480.8 Ų80.832%0.31545%0.452SS..  trans-70.9107.9161.7-80.1-138.5-7700107.7Q91 E133 L135 K155Q91-M153 HydrophobicContact CG-CE 4.04Å; E133-M153 HydrophobicContact CB-CB 3.99Å; E133-M153 HydrophobicContact CB-CE 3.89Å; E133-M153 HydrophobicContact CB-CG 4.49Å; E133-M153 HydrophobicContact CG-CE 4.41Å; E133-M153 PolarHBondContact O-N 2.93Å; L135-M153 HydrophobicContact CD1-CG 3.84Å; L135-M153 HydrophobicContact CD1-SD 4.47Å; L135-M153 HydrophobicContact CD2-CG 4.01Å; L135-M153 HydrophobicContact CD2-SD 4.12Å; L135-M153 HydrophobicContact CG-CG 3.55Å; L135-M153 HydrophobicContact CG-SD 4.28Å; M153-K155 PolarHBondContact O-N 3.11Å
154A67.1Low84.2Confident101 Ų10174.3 Ų74.384%0.83542%0.419SS*.  trans-67.9122.7169.500000108A152A152-A154 PolarHBondContact O-N 3.48Å; A152-A154 VanDerWaalsContact O-N 3.17Å
155K53.6Low83.8Confident269 Ų26974.5 Ų74.5100%1.1743%0.426SS*.  trans-71.90177.2-162.5176.7-173.5172.30112.2M153M153-K155 PolarHBondContact O-N 3.11Å

Retrieved 155 of 155 residues in 606.9 ms (Link to these results)