A0A077Z099_TRITR Loading...

Large ribosomal subunit protein eL38

AlphaFold DB , UniProt , Accession A0A077Z099, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 69 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
1M88.9Confident95.7Very high168 Ų168103.1 Ų103.183%0.82848%0.484SS*.  0130.70-72.6-173.917200110F41 L42M1-F41 HydrophobicContact CB-CD1 3.96Å; M1-F41 HydrophobicContact CB-CE1 4.12Å; M1-F41 WeakPolarHBondContact O-CA 3.37Å; M1-L42 PolarHBondContact O-N 3.05Å; M1-L42 VanDerWaalsContact O-N 3.11Å
2P96Very high95.7Very high108 Ų10898.1 Ų98.170%0.70146%0.462SS*.EExtended strand (participates in β ladder)trans-70.5146.5173.9-16.631.8000111.8L42P2-L42 CarbonylContact C-O 3.6Å; P2-L42 WeakPolarHBondContact CA-O 3.24Å
3R97.3Very high95.7Very high138 Ų13899.1 Ų99.152%0.52147%0.471SS..EExtended strand (participates in β ladder)trans-136.6144.1166.7-73.8-168.5173.7-146.2-2.8109F41 L42 Y43 T44R3-F41 HydrophobicContact CG-CB 4.46Å; R3-F41 HydrophobicContact CG-CD1 3.98Å; R3-F41 HydrophobicContact CG-CG 4.24Å; R3-L42 PolarHBondContact N-O 3.13Å; R3-Y43 HydrophobicContact CB-CD1 3.81Å; R3-Y43 HydrophobicContact CB-CE1 3.95Å; R3-Y43 CarbonylContact O-C 3.57Å; R3-Y43 VanDerWaalsContact O-CA 3.3Å; R3-Y43 WeakPolarHBondContact O-CA 3.22Å; R3-T44 PolarHBondContact O-N 2.82Å
4E97Very high95.8Very high127 Ų12792.7 Ų92.759%0.59344%0.442SS*.EExtended strand (participates in β ladder)trans-94137.7173.5-174.9173.8-144.300109.8T44E4-T44 WeakPolarHBondContact CA-O 3.25Å
5I97.2Very high95.8Very high3 Ų386.8 Ų86.82%0.01542%0.415CS..EExtended strand (participates in β ladder)trans-110.7126.4167.6-63.7-178.7000106.8E7 E10 F11 T14 Y43 T44 L45I5-E7 WeakPolarHBondContact CG2-O 3.44Å; I5-E10 HydrophobicContact CG2-CB 3.88Å; I5-E10 HydrophobicContact CG2-CG 4.07Å; I5-F11 HydrophobicContact CD1-CD2 4.46Å; I5-F11 HydrophobicContact CG2-CB 4.01Å; I5-T14 HydrophobicContact CD1-CG2 4.4Å; I5-Y43 HydrophobicContact CD1-CD1 3.63Å; I5-Y43 HydrophobicContact CD1-CE1 4.46Å; I5-Y43 HydrophobicContact CD1-CG 3.81Å; I5-Y43 HydrophobicContact CG1-CD1 3.67Å; I5-Y43 HydrophobicContact CG1-CG 4.24Å; I5-T44 PolarHBondContact N-O 2.86Å; I5-L45 WeakPolarHBondContact O-CD1 3.29Å
6K95.6Very high95.8Very high177 Ų17792.5 Ų92.577%0.7743%0.431SS*.  trans-92-31.6-179.6-64.6-174.7178.1-177.40112.6
7E96.5Very high95.7Very high127 Ų12793.7 Ų93.759%0.59343%0.431SS*.  trans-96.9133.2-177-65.8-167.8-174.600112.8I5 K9 E10 F11I5-E7 WeakPolarHBondContact CG2-O 3.44Å; E7-K9 VanDerWaalsContact C-N 3.28Å; E7-K9 PolarHBondContact O-N 3.33Å; E7-E10 HydrophobicContact CB-CB 4.17Å; E7-E10 PolarHBondContact O-N 3.32Å; E7-F11 PolarHBondContact O-N 3.33Å
8I95.6Very high95.7Very high35 Ų35102.8 Ų102.818%0.17946%0.461CS..Hα-helixtrans-63.2-37.5177.8-61.7168.8000111.1F11 L12 L45 I47 R52 I56I8-F11 WeakPolarHBondContact O-CB 3.48Å; I8-F11 PolarHBondContact O-N 3.41Å; I8-L12 HydrophobicContact CG2-CD1 4.1Å; I8-L12 HydrophobicContact CG2-CG 4.3Å; I8-L12 WeakPolarHBondContact O-CG 3.49Å; I8-L12 PolarHBondContact O-N 3.07Å; I8-L45 HydrophobicContact CG1-CD2 4.25Å; I8-I47 HydrophobicContact CD1-CD1 4.14Å; I8-I47 HydrophobicContact CG1-CD1 4.07Å; I8-R52 HydrophobicContact CD1-CG 4.48Å; I8-R52 VanDerWaalsContact CD1-CZ 3.44Å; I8-R52 VanDerWaalsContact CD1-NH2 3.29Å; I8-I56 HydrophobicContact CD1-CD1 3.83Å; I8-I56 HydrophobicContact CD1-CG1 4.48Å; I8-I56 HydrophobicContact CG1-CD1 4.04Å; I8-I56 HydrophobicContact CG2-CD1 4.22Å; I8-I56 HydrophobicContact CG2-CG1 4.06Å
9K95.5Very high95.7Very high159 Ų15999.4 Ų99.469%0.69145%0.447SS*.Hα-helixtrans-62.5-46.1179.7-172.7177.1179.8-176.60111.2E7 F11 L12 L13E7-K9 VanDerWaalsContact C-N 3.28Å; E7-K9 PolarHBondContact O-N 3.33Å; K9-F11 VanDerWaalsContact C-N 3.31Å; K9-F11 PolarHBondContact O-N 3.06Å; K9-L12 PolarHBondContact O-N 3.44Å; K9-L13 HydrophobicContact CG-CD1 4.49Å; K9-L13 WeakPolarHBondContact O-CG 3.45Å; K9-L13 PolarHBondContact O-N 3.42Å
10E96.5Very high95.7Very high92 Ų9295.3 Ų95.343%0.4343%0.432SS..Hα-helixtrans-61.1-41174.8-172-171.7173.500111.4I5 E7 L13 T14I5-E10 HydrophobicContact CG2-CB 3.88Å; I5-E10 HydrophobicContact CG2-CG 4.07Å; E7-E10 HydrophobicContact CB-CB 4.17Å; E7-E10 PolarHBondContact O-N 3.32Å; E10-L13 PolarHBondContact O-N 3.45Å; E10-T14 WeakPolarHBondContact O-CB 3.41Å; E10-T14 PolarHBondContact O-N 2.92Å; E10-T14 PolarHBondContact O-OG1 2.82Å
11F97Very high95.7Very high0 Ų098.4 Ų98.40%044%0.44CS..Hα-helixtrans-61.6-46.8176.7175.5-98000112.3I5 E7 I8 K9 L13 T14 A15 V23 F34 L36 L45 I56 L60I5-F11 HydrophobicContact CD1-CD2 4.46Å; I5-F11 HydrophobicContact CG2-CB 4.01Å; E7-F11 PolarHBondContact O-N 3.33Å; I8-F11 WeakPolarHBondContact O-CB 3.48Å; I8-F11 PolarHBondContact O-N 3.41Å; K9-F11 VanDerWaalsContact C-N 3.31Å; K9-F11 PolarHBondContact O-N 3.06Å; F11-L13 PolarHBondContact O-N 3.22Å; F11-T14 PolarHBondContact O-N 3.4Å; F11-T14 VanDerWaalsContact O-N 3.17Å; F11-A15 WeakPolarHBondContact O-CB 3.41Å; F11-A15 PolarHBondContact O-N 3.19Å; F11-V23 HydrophobicContact CZ-CG2 4.37Å; F11-F34 HydrophobicContact CE1-CB 4.25Å; F11-F34 HydrophobicContact CE2-CB 3.83Å; F11-F34 HydrophobicContact CZ-CB 3.53Å; F11-F34 HydrophobicContact CZ-CD1 4.37Å; F11-F34 HydrophobicContact CZ-CG 4.2Å; F11-L36 HydrophobicContact CE2-CB 3.88Å; F11-L45 HydrophobicContact CB-CB 4.31Å; F11-L45 HydrophobicContact CB-CD2 3.84Å; F11-L45 HydrophobicContact CB-CG 4.49Å; F11-L45 HydrophobicContact CD1-CD2 3.69Å; F11-L45 HydrophobicContact CD2-CB 3.63Å; F11-L45 HydrophobicContact CD2-CD2 4.17Å; F11-L45 HydrophobicContact CE1-CD2 4.31Å; F11-L45 HydrophobicContact CE2-CB 4.09Å; F11-L45 HydrophobicContact CG-CB 3.94Å; F11-L45 HydrophobicContact CG-CD2 3.62Å; F11-L45 HydrophobicContact CG-CG 4.37Å; F11-I56 HydrophobicContact CD1-CG2 4.35Å; F11-I56 HydrophobicContact CE1-CG2 4.1Å; F11-L60 HydrophobicContact CE1-CD2 3.79Å; F11-L60 HydrophobicContact CZ-CD2 4.21Å
12L95.6Very high96Very high43 Ų4391.4 Ų91.423%0.22541%0.408CS..Hα-helixtrans-65.9-37.5179.4-69.9175.7000112.3I8 K9 T14 A15 R16I8-L12 HydrophobicContact CG2-CD1 4.1Å; I8-L12 HydrophobicContact CG2-CG 4.3Å; I8-L12 WeakPolarHBondContact O-CG 3.49Å; I8-L12 PolarHBondContact O-N 3.07Å; K9-L12 PolarHBondContact O-N 3.44Å; L12-T14 VanDerWaalsContact C-N 3.33Å; L12-A15 PolarHBondContact O-N 3.1Å; L12-R16 WeakPolarHBondContact O-CG 3.43Å; L12-R16 PolarHBondContact O-N 3.05Å
13L96Very high96.1Very high111 Ų11186.2 Ų86.258%0.58137%0.374SS*.Hα-helixtrans-62.9-42.8171.8-71.8172.3000110.9K9 E10 F11 A15 R16K9-L13 HydrophobicContact CG-CD1 4.49Å; K9-L13 WeakPolarHBondContact O-CG 3.45Å; K9-L13 PolarHBondContact O-N 3.42Å; E10-L13 PolarHBondContact O-N 3.45Å; F11-L13 PolarHBondContact O-N 3.22Å; L13-A15 VanDerWaalsContact C-N 3.35Å; L13-A15 PolarHBondContact O-N 3.03Å; L13-R16 PolarHBondContact O-N 3.47Å
14T96.1Very high96.1Very high10 Ų1084.2 Ų84.26%0.06137%0.369CS..Hα-helixtrans-66.3-38179.3-52.60000111.8I5 E10 F11 L12 R16 R17 L36 Y43I5-T14 HydrophobicContact CD1-CG2 4.4Å; E10-T14 WeakPolarHBondContact O-CB 3.41Å; E10-T14 PolarHBondContact O-N 2.92Å; E10-T14 PolarHBondContact O-OG1 2.82Å; F11-T14 PolarHBondContact O-N 3.4Å; F11-T14 VanDerWaalsContact O-N 3.17Å; L12-T14 VanDerWaalsContact C-N 3.33Å; T14-R16 PolarHBondContact O-N 3.44Å; T14-R17 WeakPolarHBondContact O-CB 3.39Å; T14-R17 PolarHBondContact O-N 3Å; T14-L36 HydrophobicContact CG2-CD2 3.59Å; T14-Y43 HydrophobicContact CG2-CD2 3.86Å; T14-Y43 HydrophobicContact CG2-CE2 4.02Å; T14-Y43 HydrophobicContact CG2-CG 4.31Å
15A96.4Very high96.1Very high4 Ų478.3 Ų78.33%0.03334%0.342CS..Hα-helixtrans-65.9-24.6177.600000113.5F11 L12 L13 L36 L60 P61 L64F11-A15 WeakPolarHBondContact O-CB 3.41Å; F11-A15 PolarHBondContact O-N 3.19Å; L12-A15 PolarHBondContact O-N 3.1Å; L13-A15 VanDerWaalsContact C-N 3.35Å; L13-A15 PolarHBondContact O-N 3.03Å; A15-L36 HydrophobicContact CB-CD1 4.38Å; A15-L36 HydrophobicContact CB-CD2 4.2Å; A15-L60 HydrophobicContact CB-CD2 4.39Å; A15-P61 HydrophobicContact CB-CG 4.34Å; A15-L64 HydrophobicContact CB-CD2 4.02Å
16R95Very high96.1Very high178 Ų17880.9 Ų80.967%0.67235%0.353SS*.THydrogen-bonded Turntrans-86.6-7.5176.7-69.9176-174.3-96.2-2.2113.9L12 L13 T14 P61L12-R16 WeakPolarHBondContact O-CG 3.43Å; L12-R16 PolarHBondContact O-N 3.05Å; L13-R16 PolarHBondContact O-N 3.47Å; T14-R16 PolarHBondContact O-N 3.44Å; R16-P61 HydrophobicContact CG-CG 3.88Å
17R95.5Very high96.2Very high113 Ų11377.8 Ų77.843%0.42634%0.339SS..SBendtrans-67.5147.7178.8-68.6167.549.5159.8-3.8111T14 D19 A20T14-R17 WeakPolarHBondContact O-CB 3.39Å; T14-R17 PolarHBondContact O-N 3Å; R17-D19 WeakPolarHBondContact CB-OD1 3.5Å; R17-D19 IonicContact CZ-OD1 3.38Å; R17-D19 IonicContact CZ-OD2 3.72Å; R17-D19 IonicContact NE-OD1 2.8Å; R17-D19 PolarHBondContact NE-OD1 2.96Å; R17-D19 IonicContact NE-OD2 3.9Å; R17-D19 VanDerWaalsContact NH2-CG 3.34Å; R17-D19 IonicContact NH2-OD1 3.12Å; R17-D19 PolarHBondContact NH2-OD1 3.22Å; R17-D19 VanDerWaalsContact NH2-OD1 3.12Å; R17-D19 IonicContact NH2-OD2 2.87Å; R17-D19 PolarHBondContact NH2-OD2 3.45Å; R17-D19 PolarHBondContact O-N 3.25Å; R17-D19 VanDerWaalsContact O-N 3.12Å; R17-A20 VanDerWaalsContact O-CB 3.28Å; R17-A20 WeakPolarHBondContact O-CB 3.5Å; R17-A20 PolarHBondContact O-N 3Å
18R94.9Very high96.1Very high258 Ų25874 Ų7497%0.97432%0.323SS*.THydrogen-bonded Turntrans-59.4-25.5178.5-168.9178.2-176.9-175.62.2113.9
19D95.3Very high96.1Very high37 Ų3777.9 Ų77.920%0.19835%0.351CS..THydrogen-bonded Turntrans-87.8-5.518070.3-49.3000114.3R17 R21 C38 S39R17-D19 WeakPolarHBondContact CB-OD1 3.5Å; R17-D19 IonicContact CZ-OD1 3.38Å; R17-D19 IonicContact CZ-OD2 3.72Å; R17-D19 IonicContact NE-OD1 2.8Å; R17-D19 PolarHBondContact NE-OD1 2.96Å; R17-D19 IonicContact NE-OD2 3.9Å; R17-D19 VanDerWaalsContact NH2-CG 3.34Å; R17-D19 IonicContact NH2-OD1 3.12Å; R17-D19 PolarHBondContact NH2-OD1 3.22Å; R17-D19 VanDerWaalsContact NH2-OD1 3.12Å; R17-D19 IonicContact NH2-OD2 2.87Å; R17-D19 PolarHBondContact NH2-OD2 3.45Å; R17-D19 PolarHBondContact O-N 3.25Å; R17-D19 VanDerWaalsContact O-N 3.12Å; D19-R21 PolarHBondContact O-N 2.78Å; D19-C38 CarbonylContact O-C 3.56Å; D19-C38 VanDerWaalsContact O-CA 3.32Å; D19-C38 WeakPolarHBondContact O-CA 3.36Å; D19-S39 WeakPolarHBondContact CB-OG 3.25Å; D19-S39 PolarHBondContact O-N 2.77Å
20A96.4Very high96.1Very high17 Ų1778.8 Ų78.814%0.1436%0.355CS..  trans-71.7119.6172.200000110.2R17 L36 L64R17-A20 VanDerWaalsContact O-CB 3.28Å; R17-A20 WeakPolarHBondContact O-CB 3.5Å; R17-A20 PolarHBondContact O-N 3Å; A20-L36 HydrophobicContact CB-CD1 4.03Å; A20-L64 HydrophobicContact CB-CD1 4.08Å
21R95.5Very high96.1Very high161 Ų16176.1 Ų76.161%0.60834%0.344SS*.  trans-102.2-43.6-174.1-60.6-175.2-175-173.6-0.7113.2D19 R37D19-R21 PolarHBondContact O-N 2.78Å; R21-R37 PolarHBondContact N-O 3.07Å
22S95.9Very high96.1Very high21 Ų2176.2 Ų76.215%0.14734%0.344CS..EExtended strand (participates in β ladder)trans-159.8149.4-175.764.70000111.6R37 Q65S22-R37 PolarHBondContact O-N 3.3Å; S22-Q65 CarbonylContact C-O 3.48Å; S22-Q65 VanDerWaalsContact CA-O 3.25Å; S22-Q65 WeakPolarHBondContact CA-O 3.4Å; S22-Q65 WeakPolarHBondContact CB-O 3.49Å
23V97.4Very high96.2Very high0 Ų077.6 Ų77.60%035%0.348CS..EExtended strand (participates in β ladder)trans-107.7128.6166.9168.60000109.4F11 I25 F34 K35 L36 L60 L64 Q65 V66 K67F11-V23 HydrophobicContact CZ-CG2 4.37Å; V23-I25 HydrophobicContact CG1-CG1 3.83Å; V23-F34 HydrophobicContact CG1-CD1 4.12Å; V23-K35 WeakPolarHBondContact CA-O 3.3Å; V23-L36 HydrophobicContact CG2-CB 4.15Å; V23-L36 HydrophobicContact CG2-CD1 3.31Å; V23-L36 HydrophobicContact CG2-CG 4.34Å; V23-L60 HydrophobicContact CB-CD1 4.41Å; V23-L60 HydrophobicContact CG1-CD1 4.12Å; V23-L60 HydrophobicContact CG2-CD2 4.36Å; V23-L64 HydrophobicContact CB-CD2 4.47Å; V23-L64 HydrophobicContact CG2-CD2 3.55Å; V23-L64 HydrophobicContact CG2-CG 4.27Å; V23-Q65 PolarHBondContact N-O 2.8Å; V23-V66 WeakPolarHBondContact O-CA 3.3Å; V23-K67 PolarHBondContact O-N 3.01Å
24K97.5Very high96.3Very high96 Ų9672.3 Ų72.342%0.41732%0.321SS..EExtended strand (participates in β ladder)trans-102.5117.1169-83.9177.2178.6-168.50109K35 K67 L69K24-K35 HydrophobicContact CB-CB 4.06Å; K24-K35 PolarHBondContact N-O 2.72Å; K24-K35 WeakPolarHBondContact O-CB 3.42Å; K24-K35 PolarHBondContact O-N 3.31Å; K24-K67 CarbonylContact C-O 3.5Å; K24-K67 VanDerWaalsContact CA-O 3.29Å; K24-K67 WeakPolarHBondContact CA-O 3.4Å; K24-K67 HydrophobicContact CG-CB 4.33Å; K24-L69 HydrophobicContact CB-CD1 3.9Å; K24-L69 HydrophobicContact CD-CD1 3.74Å; K24-L69 HydrophobicContact CG-CD1 4Å
25I97.4Very high96.4Very high2 Ų274.8 Ų74.81%0.0133%0.33CS..EExtended strand (participates in β ladder)trans-96.8111.4178.9-54.7178.4000107.8V23 T32 F34 R57 V66 K67 L69V23-I25 HydrophobicContact CG1-CG1 3.83Å; I25-T32 HydrophobicContact CG2-CG2 3.61Å; I25-F34 HydrophobicContact CD1-CD1 4.13Å; I25-F34 HydrophobicContact CD1-CE1 3.69Å; I25-F34 HydrophobicContact CG1-CD1 3.84Å; I25-F34 HydrophobicContact CG1-CE1 3.87Å; I25-F34 HydrophobicContact CG2-CE1 4.24Å; I25-F34 HydrophobicContact CG2-CZ 4.45Å; I25-R57 HydrophobicContact CD1-CB 4.33Å; I25-R57 HydrophobicContact CD1-CG 3.82Å; I25-V66 HydrophobicContact CD1-CG1 3.56Å; I25-V66 HydrophobicContact CG1-CG1 4.12Å; I25-K67 PolarHBondContact N-O 2.86Å; I25-L69 WeakPolarHBondContact O-CB 3.46Å; I25-L69 PolarHBondContact O-N 2.85Å
26K97Very high96.4Very high57 Ų5774.6 Ų74.625%0.24833%0.329CS..EExtended strand (participates in β ladder)trans-102.1112174-179.578.4-158.5100.20108.8N28 T32 K33 L69K26-N28 WeakPolarHBondContact CG-OD1 3.45Å; K26-T32 CarbonylContact O-C 3.5Å; K26-T32 WeakPolarHBondContact O-CA 3.44Å; K26-K33 HydrophobicContact CB-CB 4.39Å; K26-K33 PolarHBondContact N-O 3.45Å; K26-K33 PolarHBondContact O-N 3.42Å; K26-L69 HydrophobicContact CB-CB 4.45Å; K26-L69 HydrophobicContact CD-CB 4.09Å; K26-L69 HydrophobicContact CD-CD2 4.39Å; K26-L69 WeakPolarHBondContact CD-O 3.38Å; K26-L69 PolarHBondContact NZ-O 2.86Å; K26-L69 PolarHBondContact NZ-OXT 3.11Å
27K96.2Very high96.5Very high112 Ų11270.6 Ų70.649%0.48731%0.314SS..EExtended strand (participates in β ladder)trans-83.5125.7169.3-62.4-175.5178.5-172.50108.9T32K27-T32 HydrophobicContact CG-CG2 4.31Å
28N95.7Very high96.5Very high49 Ų4965.2 Ų65.226%0.26229%0.294SS..EExtended strand (participates in β ladder)trans-117.1165.8170-52.4-50.1000108.5K26 F30 N31K26-N28 WeakPolarHBondContact CG-OD1 3.45Å; N28-F30 VanDerWaalsContact C-N 3.25Å; N28-F30 PolarHBondContact O-N 2.89Å; N28-F30 VanDerWaalsContact O-N 3.16Å; N28-N31 CarbonylContact C-O 3.52Å; N28-N31 WeakPolarHBondContact CA-O 3.25Å; N28-N31 WeakPolarHBondContact CB-O 3.32Å; N28-N31 PolarHBondContact N-O 3.16Å; N28-N31 PolarHBondContact ND2-OD1 3.49Å; N28-N31 PolarHBondContact O-N 2.76Å; N28-N31 VanDerWaalsContact O-O 3.13Å
29P94.7Very high96.6Very high116 Ų11655.9 Ų55.975%0.75327%0.268SS*.THydrogen-bonded Turntrans-56.6-34.2-177.1-27.936.1000114.9
30F95.3Very high96.5Very high177 Ų17761.4 Ų61.478%0.77629%0.29SS*.THydrogen-bonded Turntrans-115.5-4.6-174.2-51.3-68.5000114.3N28N28-F30 VanDerWaalsContact C-N 3.25Å; N28-F30 PolarHBondContact O-N 2.89Å; N28-F30 VanDerWaalsContact O-N 3.16Å
31N96.3Very high96.6Very high37 Ų3762 Ų6220%0.19829%0.29CS..EExtended strand (participates in β ladder)trans-162.1154.2179.35571.6000111.9N28 K33 V46 I47N28-N31 CarbonylContact C-O 3.52Å; N28-N31 WeakPolarHBondContact CA-O 3.25Å; N28-N31 WeakPolarHBondContact CB-O 3.32Å; N28-N31 PolarHBondContact N-O 3.16Å; N28-N31 PolarHBondContact ND2-OD1 3.49Å; N28-N31 PolarHBondContact O-N 2.76Å; N28-N31 VanDerWaalsContact O-O 3.13Å; N31-K33 WeakPolarHBondContact OD1-CE 3.37Å; N31-V46 HydrophobicContact CB-CG1 3.87Å; N31-I47 CarbonylContact C-O 3.6Å; N31-I47 VanDerWaalsContact CA-O 3.24Å; N31-I47 WeakPolarHBondContact CA-O 3.47Å; N31-I47 WeakPolarHBondContact CB-O 3.4Å
32T97.2Very high96.7Very high2 Ų256.5 Ų56.51%0.01227%0.272CS..EExtended strand (participates in β ladder)trans-106.7131.5167.6-64.20000109.4I25 K26 K27 F34 I47 A53I25-T32 HydrophobicContact CG2-CG2 3.61Å; K26-T32 CarbonylContact O-C 3.5Å; K26-T32 WeakPolarHBondContact O-CA 3.44Å; K27-T32 HydrophobicContact CG-CG2 4.31Å; T32-F34 HydrophobicContact CG2-CD2 4.29Å; T32-F34 HydrophobicContact CG2-CE2 3.76Å; T32-F34 HydrophobicContact CG2-CZ 4.12Å; T32-I47 PolarHBondContact N-O 3.03Å; T32-I47 PolarHBondContact O-N 3.49Å; T32-A53 HydrophobicContact CG2-CB 4.14Å
33K97.9Very high96.8Very high71 Ų7156.8 Ų56.831%0.30927%0.27SS..EExtended strand (participates in β ladder)trans-108.4118.9177-58.2-169.6177.3-177.40110.2K26 N31 K35 T44 L45 V46K26-K33 HydrophobicContact CB-CB 4.39Å; K26-K33 PolarHBondContact N-O 3.45Å; K26-K33 PolarHBondContact O-N 3.42Å; N31-K33 WeakPolarHBondContact OD1-CE 3.37Å; K33-K35 HydrophobicContact CB-CG 4.45Å; K33-T44 HydrophobicContact CB-CG2 4.03Å; K33-T44 HydrophobicContact CD-CG2 4.37Å; K33-T44 HydrophobicContact CG-CG2 4.49Å; K33-L45 CarbonylContact C-O 3.47Å; K33-L45 WeakPolarHBondContact CA-O 3.44Å; K33-V46 HydrophobicContact CD-CG2 4.31Å; K33-V46 HydrophobicContact CG-CG1 4.33Å; K33-V46 HydrophobicContact CG-CG2 4.12Å
34F98Very high96.8Very high1 Ų157.9 Ų57.90%0.00428%0.277CS..EExtended strand (participates in β ladder)trans-91.6105.7170.7-67-95.9000109.3F11 V23 I25 T32 T44 L45 I47 A53 I56 R57F11-F34 HydrophobicContact CE1-CB 4.25Å; F11-F34 HydrophobicContact CE2-CB 3.83Å; F11-F34 HydrophobicContact CZ-CB 3.53Å; F11-F34 HydrophobicContact CZ-CD1 4.37Å; F11-F34 HydrophobicContact CZ-CG 4.2Å; V23-F34 HydrophobicContact CG1-CD1 4.12Å; I25-F34 HydrophobicContact CD1-CD1 4.13Å; I25-F34 HydrophobicContact CD1-CE1 3.69Å; I25-F34 HydrophobicContact CG1-CD1 3.84Å; I25-F34 HydrophobicContact CG1-CE1 3.87Å; I25-F34 HydrophobicContact CG2-CE1 4.24Å; I25-F34 HydrophobicContact CG2-CZ 4.45Å; T32-F34 HydrophobicContact CG2-CD2 4.29Å; T32-F34 HydrophobicContact CG2-CE2 3.76Å; T32-F34 HydrophobicContact CG2-CZ 4.12Å; F34-T44 VanDerWaalsContact O-CA 3.31Å; F34-T44 WeakPolarHBondContact O-CA 3.44Å; F34-L45 HydrophobicContact CB-CB 4.29Å; F34-L45 PolarHBondContact N-O 3.36Å; F34-L45 PolarHBondContact O-N 3.46Å; F34-I47 HydrophobicContact CD2-CG1 4.41Å; F34-I47 HydrophobicContact CE2-CG1 4.35Å; F34-A53 HydrophobicContact CE2-CB 4Å; F34-A53 HydrophobicContact CZ-CB 4.18Å; F34-A53 VanDerWaalsContact CZ-O 3.3Å; F34-A53 WeakPolarHBondContact CZ-O 3.31Å; F34-I56 HydrophobicContact CD1-CG2 4.38Å; F34-I56 HydrophobicContact CD2-CG2 4.5Å; F34-I56 HydrophobicContact CE1-CG2 4.11Å; F34-I56 HydrophobicContact CE2-CB 4.43Å; F34-I56 HydrophobicContact CE2-CG2 4.25Å; F34-I56 HydrophobicContact CZ-CB 4.17Å; F34-I56 HydrophobicContact CZ-CG2 4.06Å; F34-R57 HydrophobicContact CE1-CB 4.2Å; F34-R57 HydrophobicContact CZ-CB 4.44Å
35K97.8Very high96.8Very high61 Ų6153.3 Ų53.327%0.26526%0.257SS..EExtended strand (participates in β ladder)trans-100.396.2-177.1-58.4179.9-177.8-1790109.6V23 K24 K33 L42 Y43 T44V23-K35 WeakPolarHBondContact CA-O 3.3Å; K24-K35 HydrophobicContact CB-CB 4.06Å; K24-K35 PolarHBondContact N-O 2.72Å; K24-K35 WeakPolarHBondContact O-CB 3.42Å; K24-K35 PolarHBondContact O-N 3.31Å; K33-K35 HydrophobicContact CB-CG 4.45Å; K35-L42 HydrophobicContact CB-CD1 4.15Å; K35-Y43 CarbonylContact C-O 3.55Å; K35-Y43 WeakPolarHBondContact CA-O 3.47Å; K35-T44 HydrophobicContact CG-CG2 4.14Å
36L97.5Very high96.8Very high0 Ų055.6 Ų55.60%027%0.271CS..EExtended strand (participates in β ladder)trans-86116.9179-18070.1000111F11 T14 A15 A20 V23 L42 Y43 L64F11-L36 HydrophobicContact CE2-CB 3.88Å; T14-L36 HydrophobicContact CG2-CD2 3.59Å; A15-L36 HydrophobicContact CB-CD1 4.38Å; A15-L36 HydrophobicContact CB-CD2 4.2Å; A20-L36 HydrophobicContact CB-CD1 4.03Å; V23-L36 HydrophobicContact CG2-CB 4.15Å; V23-L36 HydrophobicContact CG2-CD1 3.31Å; V23-L36 HydrophobicContact CG2-CG 4.34Å; L36-L42 CarbonylContact O-C 3.6Å; L36-L42 WeakPolarHBondContact O-CA 3.46Å; L36-Y43 PolarHBondContact N-O 2.93Å; L36-Y43 PolarHBondContact O-N 3.22Å; L36-L64 HydrophobicContact CD1-CD1 4.43Å; L36-L64 HydrophobicContact CD1-CD2 3.91Å
37R97.2Very high96.8Very high94 Ų9453.6 Ų53.636%0.35526%0.263SS..EExtended strand (participates in β ladder)trans-86.3112.7174.9-176.767.3-132.5-166.3-2.7109.9R21 S22 S39 L42R21-R37 PolarHBondContact N-O 3.07Å; S22-R37 PolarHBondContact O-N 3.3Å; R37-S39 PolarHBondContact NH2-O 3.37Å; R37-L42 HydrophobicContact CB-CD1 4.3Å
38C96.3Very high96.8Very high1 Ų156 Ų561%0.00728%0.276CS..  trans-102-176.4167.8-63.10000110.7D19 F41 Y43D19-C38 CarbonylContact O-C 3.56Å; D19-C38 VanDerWaalsContact O-CA 3.32Å; D19-C38 WeakPolarHBondContact O-CA 3.36Å; C38-F41 PolarHBondContact N-O 3.35Å; C38-Y43 HydrophobicContact CB-CD2 4.21Å; C38-Y43 HydrophobicContact CB-CE2 4.07Å
39S95Very high96.8Very high62 Ų6257.7 Ų57.743%0.43429%0.285SS..SBendtrans-59.2-53.2178.7-69.50000112.4D19 R37D19-S39 WeakPolarHBondContact CB-OG 3.25Å; D19-S39 PolarHBondContact O-N 2.77Å; R37-S39 PolarHBondContact NH2-O 3.37Å
40K95.2Very high96.7Very high152 Ų15257 Ų5766%0.66128%0.275SS*.SBendtrans-95.9-44-175.9-171.9171.1-179.3174.50113.9
41F96.9Very high96.7Very high29 Ų2954.4 Ų54.413%0.12727%0.269CS..  trans-112.4152.4-170.9-58.7-69.1000112.3M1 R3 C38 Y43M1-F41 HydrophobicContact CB-CD1 3.96Å; M1-F41 HydrophobicContact CB-CE1 4.12Å; M1-F41 WeakPolarHBondContact O-CA 3.37Å; R3-F41 HydrophobicContact CG-CB 4.46Å; R3-F41 HydrophobicContact CG-CD1 3.98Å; R3-F41 HydrophobicContact CG-CG 4.24Å; C38-F41 PolarHBondContact N-O 3.35Å; F41-Y43 HydrophobicContact CB-CD2 4.18Å; F41-Y43 HydrophobicContact CB-CE1 4.4Å; F41-Y43 HydrophobicContact CB-CE2 3.72Å; F41-Y43 HydrophobicContact CD2-CE2 4.47Å; F41-Y43 WeakPolarHBondContact CD2-OH 3.5Å
42L97.7Very high96.6Very high47 Ų4759.5 Ų59.525%0.24629%0.285CS..EExtended strand (participates in β ladder)trans-99.3107.4162.318073.9000106.8M1 P2 R3 K35 L36 R37M1-L42 PolarHBondContact O-N 3.05Å; M1-L42 VanDerWaalsContact O-N 3.11Å; P2-L42 CarbonylContact C-O 3.6Å; P2-L42 WeakPolarHBondContact CA-O 3.24Å; R3-L42 PolarHBondContact N-O 3.13Å; K35-L42 HydrophobicContact CB-CD1 4.15Å; L36-L42 CarbonylContact O-C 3.6Å; L36-L42 WeakPolarHBondContact O-CA 3.46Å; R37-L42 HydrophobicContact CB-CD1 4.3Å
43Y98.1Very high96.6Very high27 Ų2759.6 Ų59.611%0.10629%0.287CS..EExtended strand (participates in β ladder)trans-85.6133.8176.2-66.9-81.2000109.5R3 I5 T14 K35 L36 C38 F41R3-Y43 HydrophobicContact CB-CD1 3.81Å; R3-Y43 HydrophobicContact CB-CE1 3.95Å; R3-Y43 CarbonylContact O-C 3.57Å; R3-Y43 VanDerWaalsContact O-CA 3.3Å; R3-Y43 WeakPolarHBondContact O-CA 3.22Å; I5-Y43 HydrophobicContact CD1-CD1 3.63Å; I5-Y43 HydrophobicContact CD1-CE1 4.46Å; I5-Y43 HydrophobicContact CD1-CG 3.81Å; I5-Y43 HydrophobicContact CG1-CD1 3.67Å; I5-Y43 HydrophobicContact CG1-CG 4.24Å; T14-Y43 HydrophobicContact CG2-CD2 3.86Å; T14-Y43 HydrophobicContact CG2-CE2 4.02Å; T14-Y43 HydrophobicContact CG2-CG 4.31Å; K35-Y43 CarbonylContact C-O 3.55Å; K35-Y43 WeakPolarHBondContact CA-O 3.47Å; L36-Y43 PolarHBondContact N-O 2.93Å; L36-Y43 PolarHBondContact O-N 3.22Å; C38-Y43 HydrophobicContact CB-CD2 4.21Å; C38-Y43 HydrophobicContact CB-CE2 4.07Å; F41-Y43 HydrophobicContact CB-CD2 4.18Å; F41-Y43 HydrophobicContact CB-CE1 4.4Å; F41-Y43 HydrophobicContact CB-CE2 3.72Å; F41-Y43 HydrophobicContact CD2-CE2 4.47Å; F41-Y43 WeakPolarHBondContact CD2-OH 3.5Å
44T98.3Very high96.4Very high22 Ų2259.7 Ų59.714%0.13529%0.288CS..EExtended strand (participates in β ladder)trans-121.4124.4177.1-54.40000109.5R3 E4 I5 K33 F34 K35 V46R3-T44 PolarHBondContact O-N 2.82Å; E4-T44 WeakPolarHBondContact CA-O 3.25Å; I5-T44 PolarHBondContact N-O 2.86Å; K33-T44 HydrophobicContact CB-CG2 4.03Å; K33-T44 HydrophobicContact CD-CG2 4.37Å; K33-T44 HydrophobicContact CG-CG2 4.49Å; F34-T44 VanDerWaalsContact O-CA 3.31Å; F34-T44 WeakPolarHBondContact O-CA 3.44Å; K35-T44 HydrophobicContact CG-CG2 4.14Å; T44-V46 HydrophobicContact CG2-CG2 4.15Å
45L98Very high96.3Very high1 Ų166.3 Ų66.31%0.00532%0.317CS..EExtended strand (participates in β ladder)trans-102.1128.6165.3173.270.8000108.1I5 I8 F11 K33 F34 I47 I56I5-L45 WeakPolarHBondContact O-CD1 3.29Å; I8-L45 HydrophobicContact CG1-CD2 4.25Å; F11-L45 HydrophobicContact CB-CB 4.31Å; F11-L45 HydrophobicContact CB-CD2 3.84Å; F11-L45 HydrophobicContact CB-CG 4.49Å; F11-L45 HydrophobicContact CD1-CD2 3.69Å; F11-L45 HydrophobicContact CD2-CB 3.63Å; F11-L45 HydrophobicContact CD2-CD2 4.17Å; F11-L45 HydrophobicContact CE1-CD2 4.31Å; F11-L45 HydrophobicContact CE2-CB 4.09Å; F11-L45 HydrophobicContact CG-CB 3.94Å; F11-L45 HydrophobicContact CG-CD2 3.62Å; F11-L45 HydrophobicContact CG-CG 4.37Å; K33-L45 CarbonylContact C-O 3.47Å; K33-L45 WeakPolarHBondContact CA-O 3.44Å; F34-L45 HydrophobicContact CB-CB 4.29Å; F34-L45 PolarHBondContact N-O 3.36Å; F34-L45 PolarHBondContact O-N 3.46Å; L45-I47 HydrophobicContact CD1-CD1 4.08Å; L45-I47 HydrophobicContact CD2-CD1 4.05Å; L45-I47 HydrophobicContact CD2-CG1 4.11Å; L45-I47 HydrophobicContact CG-CD1 3.98Å; L45-I47 HydrophobicContact CG-CG1 4.02Å; L45-I56 HydrophobicContact CD2-CD1 4.26Å; L45-I56 HydrophobicContact CD2-CG2 4.5Å
46V97.4Very high96.2Very high49 Ų4963.8 Ų63.830%0.29731%0.306SS..EExtended strand (participates in β ladder)trans-107.4125.7177.6-173.30000108.7N31 K33 T44N31-V46 HydrophobicContact CB-CG1 3.87Å; K33-V46 HydrophobicContact CD-CG2 4.31Å; K33-V46 HydrophobicContact CG-CG1 4.33Å; K33-V46 HydrophobicContact CG-CG2 4.12Å; T44-V46 HydrophobicContact CG2-CG2 4.15Å
47I97.1Very high96Very high15 Ų1567.3 Ų67.38%0.07732%0.32CS..EExtended strand (participates in β ladder)trans-124.8127179-58.8-66.7000108.1I8 N31 T32 F34 L45 D49 R52 A53 I56I8-I47 HydrophobicContact CD1-CD1 4.14Å; I8-I47 HydrophobicContact CG1-CD1 4.07Å; N31-I47 CarbonylContact C-O 3.6Å; N31-I47 VanDerWaalsContact CA-O 3.24Å; N31-I47 WeakPolarHBondContact CA-O 3.47Å; N31-I47 WeakPolarHBondContact CB-O 3.4Å; T32-I47 PolarHBondContact N-O 3.03Å; T32-I47 PolarHBondContact O-N 3.49Å; F34-I47 HydrophobicContact CD2-CG1 4.41Å; F34-I47 HydrophobicContact CE2-CG1 4.35Å; L45-I47 HydrophobicContact CD1-CD1 4.08Å; L45-I47 HydrophobicContact CD2-CD1 4.05Å; L45-I47 HydrophobicContact CD2-CG1 4.11Å; L45-I47 HydrophobicContact CG-CD1 3.98Å; L45-I47 HydrophobicContact CG-CG1 4.02Å; I47-D49 VanDerWaalsContact CG2-O 3.25Å; I47-D49 WeakPolarHBondContact CG2-O 3.46Å; I47-R52 HydrophobicContact CG2-CB 4.16Å; I47-R52 HydrophobicContact CG2-CG 4.49Å; I47-A53 HydrophobicContact CB-CB 4.46Å; I47-A53 HydrophobicContact CG2-CB 4.15Å; I47-I56 HydrophobicContact CD1-CD1 3.69Å; I47-I56 HydrophobicContact CG1-CD1 3.65Å
48Q96.1Very high95.8Very high162 Ų16269.7 Ų69.776%0.75734%0.335SS*.  trans-83-35.2179-68.3174.6-20.500112.1
49D95.2Very high95.8Very high85 Ų8572.5 Ų72.546%0.45535%0.354SS..  trans-81.8123.3-177.5-175.4-65.8000112I47 D51 R52 A53I47-D49 VanDerWaalsContact CG2-O 3.25Å; I47-D49 WeakPolarHBondContact CG2-O 3.46Å; D49-D51 WeakPolarHBondContact OD1-CA 3.43Å; D49-D51 WeakPolarHBondContact OD1-CB 3.28Å; D49-D51 PolarHBondContact OD1-N 2.88Å; D49-R52 HydrophobicContact CB-CB 3.91Å; D49-R52 WeakPolarHBondContact OD1-CB 3.5Å; D49-R52 PolarHBondContact OD1-N 2.84Å; D49-A53 WeakPolarHBondContact O-CB 3.4Å; D49-A53 PolarHBondContact O-N 2.89Å
50N92.6Very high95.7Very high103 Ų10370.3 Ų70.355%0.55134%0.338SS*.Hα-helixtrans-69.6-38.4-176.6-75.5-36.4000113R52 A53 E54N50-R52 VanDerWaalsContact C-N 3.34Å; N50-A53 WeakPolarHBondContact O-CB 3.46Å; N50-A53 PolarHBondContact O-N 2.97Å; N50-E54 PolarHBondContact O-N 3.12Å
51D94.3Very high95.6Very high122 Ų12264.1 Ų64.165%0.65231%0.313SS*.Hα-helixtrans-66.8-40.5178.9-69.5-47.6000110.9D49 A53 E54 K55D49-D51 WeakPolarHBondContact OD1-CA 3.43Å; D49-D51 WeakPolarHBondContact OD1-CB 3.28Å; D49-D51 PolarHBondContact OD1-N 2.88Å; D51-A53 VanDerWaalsContact C-N 3.33Å; D51-E54 PolarHBondContact O-N 2.93Å; D51-K55 WeakPolarHBondContact O-CG 3.37Å; D51-K55 PolarHBondContact O-N 2.8Å
52R95.3Very high95.3Very high143 Ų14369.5 Ų69.554%0.5435%0.351SS..Hα-helixtrans-65.9-37.9174.9-162.8173.6-172.61781.2111.3I8 I47 D49 N50 K55 I56I8-R52 HydrophobicContact CD1-CG 4.48Å; I8-R52 VanDerWaalsContact CD1-CZ 3.44Å; I8-R52 VanDerWaalsContact CD1-NH2 3.29Å; I47-R52 HydrophobicContact CG2-CB 4.16Å; I47-R52 HydrophobicContact CG2-CG 4.49Å; D49-R52 HydrophobicContact CB-CB 3.91Å; D49-R52 WeakPolarHBondContact OD1-CB 3.5Å; D49-R52 PolarHBondContact OD1-N 2.84Å; N50-R52 VanDerWaalsContact C-N 3.34Å; R52-K55 PolarHBondContact O-N 3.21Å; R52-I56 HydrophobicContact CG-CD1 4.32Å; R52-I56 WeakPolarHBondContact O-CD1 3.16Å; R52-I56 VanDerWaalsContact O-CG1 3.25Å; R52-I56 WeakPolarHBondContact O-CG1 3.21Å; R52-I56 PolarHBondContact O-N 3.27Å
53A95.8Very high94.9Very high5 Ų571 Ų714%0.04138%0.378CS..Hα-helixtrans-61.9-43.9174.600000111.3T32 F34 I47 D49 N50 D51 K55 I56 R57T32-A53 HydrophobicContact CG2-CB 4.14Å; F34-A53 HydrophobicContact CE2-CB 4Å; F34-A53 HydrophobicContact CZ-CB 4.18Å; F34-A53 VanDerWaalsContact CZ-O 3.3Å; F34-A53 WeakPolarHBondContact CZ-O 3.31Å; I47-A53 HydrophobicContact CB-CB 4.46Å; I47-A53 HydrophobicContact CG2-CB 4.15Å; D49-A53 WeakPolarHBondContact O-CB 3.4Å; D49-A53 PolarHBondContact O-N 2.89Å; N50-A53 WeakPolarHBondContact O-CB 3.46Å; N50-A53 PolarHBondContact O-N 2.97Å; D51-A53 VanDerWaalsContact C-N 3.33Å; A53-K55 PolarHBondContact O-N 3.34Å; A53-I56 PolarHBondContact O-N 3.48Å; A53-R57 PolarHBondContact O-N 2.86Å
54E94.7Very high94.7Very high73 Ų7370.4 Ų70.434%0.34138%0.376SS..Hα-helixtrans-65-40.2179-160.957.8-143.900111.9N50 D51 I56 R57 Q58N50-E54 PolarHBondContact O-N 3.12Å; D51-E54 PolarHBondContact O-N 2.93Å; E54-I56 VanDerWaalsContact C-N 3.33Å; E54-I56 PolarHBondContact O-N 3.06Å; E54-R57 WeakPolarHBondContact O-CB 3.33Å; E54-R57 PolarHBondContact O-N 2.95Å; E54-R57 WeakPolarHBondContact OE1-CD 3.46Å; E54-Q58 WeakPolarHBondContact O-CG 3.46Å; E54-Q58 PolarHBondContact O-N 2.82Å
55K95.7Very high94.6Very high140 Ų14075.2 Ų75.261%0.60940%0.397SS*.Hα-helixtrans-60.4-39.9172.2-71.1176.1-177.8175.10112.8D51 R52 A53 Q58 S59D51-K55 WeakPolarHBondContact O-CG 3.37Å; D51-K55 PolarHBondContact O-N 2.8Å; R52-K55 PolarHBondContact O-N 3.21Å; A53-K55 PolarHBondContact O-N 3.34Å; K55-Q58 PolarHBondContact O-N 2.83Å; K55-S59 WeakPolarHBondContact O-CB 3.49Å; K55-S59 PolarHBondContact O-N 2.76Å; K55-S59 VanDerWaalsContact O-N 3.1Å; K55-S59 PolarHBondContact O-OG 2.88Å
56I95.4Very high94.5Very high7 Ų778 Ų784%0.03641%0.414CS..Hα-helixtrans-67.2-41.1176.8-67.6161.2000110.5I8 F11 F34 L45 I47 R52 A53 E54 Q58 S59 L60I8-I56 HydrophobicContact CD1-CD1 3.83Å; I8-I56 HydrophobicContact CD1-CG1 4.48Å; I8-I56 HydrophobicContact CG1-CD1 4.04Å; I8-I56 HydrophobicContact CG2-CD1 4.22Å; I8-I56 HydrophobicContact CG2-CG1 4.06Å; F11-I56 HydrophobicContact CD1-CG2 4.35Å; F11-I56 HydrophobicContact CE1-CG2 4.1Å; F34-I56 HydrophobicContact CD1-CG2 4.38Å; F34-I56 HydrophobicContact CD2-CG2 4.5Å; F34-I56 HydrophobicContact CE1-CG2 4.11Å; F34-I56 HydrophobicContact CE2-CB 4.43Å; F34-I56 HydrophobicContact CE2-CG2 4.25Å; F34-I56 HydrophobicContact CZ-CB 4.17Å; F34-I56 HydrophobicContact CZ-CG2 4.06Å; L45-I56 HydrophobicContact CD2-CD1 4.26Å; L45-I56 HydrophobicContact CD2-CG2 4.5Å; I47-I56 HydrophobicContact CD1-CD1 3.69Å; I47-I56 HydrophobicContact CG1-CD1 3.65Å; R52-I56 HydrophobicContact CG-CD1 4.32Å; R52-I56 WeakPolarHBondContact O-CD1 3.16Å; R52-I56 VanDerWaalsContact O-CG1 3.25Å; R52-I56 WeakPolarHBondContact O-CG1 3.21Å; R52-I56 PolarHBondContact O-N 3.27Å; A53-I56 PolarHBondContact O-N 3.48Å; E54-I56 VanDerWaalsContact C-N 3.33Å; E54-I56 PolarHBondContact O-N 3.06Å; I56-Q58 VanDerWaalsContact C-N 3.31Å; I56-Q58 PolarHBondContact O-N 2.86Å; I56-S59 WeakPolarHBondContact O-CB 3.32Å; I56-S59 PolarHBondContact O-N 3.17Å; I56-L60 PolarHBondContact O-N 3.29Å
57R94.2Very high94.3Very high75 Ų7581.1 Ų81.128%0.28342%0.424SS..Hα-helixtrans-56.7-45.8175.7179.5-173.5178.2126.55.1111.1I25 F34 A53 E54 S59 L60 D68I25-R57 HydrophobicContact CD1-CB 4.33Å; I25-R57 HydrophobicContact CD1-CG 3.82Å; F34-R57 HydrophobicContact CE1-CB 4.2Å; F34-R57 HydrophobicContact CZ-CB 4.44Å; A53-R57 PolarHBondContact O-N 2.86Å; E54-R57 WeakPolarHBondContact O-CB 3.33Å; E54-R57 PolarHBondContact O-N 2.95Å; E54-R57 WeakPolarHBondContact OE1-CD 3.46Å; R57-S59 VanDerWaalsContact C-N 3.27Å; R57-S59 PolarHBondContact O-N 2.91Å; R57-L60 WeakPolarHBondContact O-CB 3.42Å; R57-L60 PolarHBondContact O-N 2.86Å; R57-D68 IonicContact CZ-OD1 3.59Å; R57-D68 IonicContact CZ-OD2 3.47Å; R57-D68 IonicContact NH1-OD1 2.72Å; R57-D68 PolarHBondContact NH1-OD1 2.73Å; R57-D68 IonicContact NH1-OD2 3.3Å; R57-D68 PolarHBondContact NH1-OD2 2.85Å; R57-D68 IonicContact NH2-OD1 3.69Å; R57-D68 IonicContact NH2-OD2 2.78Å; R57-D68 PolarHBondContact NH2-OD2 2.82Å
58Q93.5Very high94.1Very high144 Ų14484.6 Ų84.667%0.67344%0.443SS*.Hα-helixtrans-66.5-27.8176.9-66.8172.16.300113.1E54 K55 I56 L60E54-Q58 WeakPolarHBondContact O-CG 3.46Å; E54-Q58 PolarHBondContact O-N 2.82Å; K55-Q58 PolarHBondContact O-N 2.83Å; I56-Q58 VanDerWaalsContact C-N 3.31Å; I56-Q58 PolarHBondContact O-N 2.86Å; Q58-L60 VanDerWaalsContact C-N 3.27Å; Q58-L60 PolarHBondContact O-N 3.45Å
59S94.7Very high93.8Very high59 Ų5982.3 Ų82.341%0.41344%0.435SS..THydrogen-bonded Turntrans-81.2-2.9179.3-580000113.9K55 I56 R57K55-S59 WeakPolarHBondContact O-CB 3.49Å; K55-S59 PolarHBondContact O-N 2.76Å; K55-S59 VanDerWaalsContact O-N 3.1Å; K55-S59 PolarHBondContact O-OG 2.88Å; I56-S59 WeakPolarHBondContact O-CB 3.32Å; I56-S59 PolarHBondContact O-N 3.17Å; R57-S59 VanDerWaalsContact C-N 3.27Å; R57-S59 PolarHBondContact O-N 2.91Å
60L94.3Very high93.7Very high16 Ų1682.2 Ų82.28%0.08443%0.434CS..SBendtrans-68.8149.1179.4-71.3175.1000111.4F11 A15 V23 I56 R57 Q58 V66F11-L60 HydrophobicContact CE1-CD2 3.79Å; F11-L60 HydrophobicContact CZ-CD2 4.21Å; A15-L60 HydrophobicContact CB-CD2 4.39Å; V23-L60 HydrophobicContact CB-CD1 4.41Å; V23-L60 HydrophobicContact CG1-CD1 4.12Å; V23-L60 HydrophobicContact CG2-CD2 4.36Å; I56-L60 PolarHBondContact O-N 3.29Å; R57-L60 WeakPolarHBondContact O-CB 3.42Å; R57-L60 PolarHBondContact O-N 2.86Å; Q58-L60 VanDerWaalsContact C-N 3.27Å; Q58-L60 PolarHBondContact O-N 3.45Å; L60-V66 HydrophobicContact CD1-CG2 3.95Å
61P92.7Very high93.8Very high22 Ų2281.1 Ų81.114%0.14343%0.427CS..  trans-63.3135.2176.9-15.228.5000110.8A15 R16 G63 L64A15-P61 HydrophobicContact CB-CG 4.34Å; R16-P61 HydrophobicContact CG-CG 3.88Å; P61-G63 VanDerWaalsContact C-N 3.26Å; P61-G63 PolarHBondContact O-N 2.87Å; P61-L64 HydrophobicContact CB-CB 4.33Å; P61-L64 HydrophobicContact CG-CD2 4.43Å; P61-L64 WeakPolarHBondContact O-CB 3.48Å; P61-L64 PolarHBondContact O-N 3.12Å
62P90.5Very high93.7Very high143 Ų14378.8 Ų78.893%0.92942%0.415SS*.THydrogen-bonded Turntrans-65-26.1-175.423.8-33.7000113.8L64P62-L64 VanDerWaalsContact C-N 3.27Å; P62-L64 PolarHBondContact O-N 2.82Å
63G90.2Very high93.6Very high78 Ų7875 Ų7580%0.80441%0.408SS*.THydrogen-bonded Turntrans-79.4-5176.200000114.6P61P61-G63 VanDerWaalsContact C-N 3.26Å; P61-G63 PolarHBondContact O-N 2.87Å
64L93.4Very high93.5Very high15 Ų1579.4 Ų79.48%0.07943%0.431CS..SBendtrans-88.8125.8-178.4-170.162.2000109.8A15 A20 V23 L36 P61 P62 V66A15-L64 HydrophobicContact CB-CD2 4.02Å; A20-L64 HydrophobicContact CB-CD1 4.08Å; V23-L64 HydrophobicContact CB-CD2 4.47Å; V23-L64 HydrophobicContact CG2-CD2 3.55Å; V23-L64 HydrophobicContact CG2-CG 4.27Å; L36-L64 HydrophobicContact CD1-CD1 4.43Å; L36-L64 HydrophobicContact CD1-CD2 3.91Å; P61-L64 HydrophobicContact CB-CB 4.33Å; P61-L64 HydrophobicContact CG-CD2 4.43Å; P61-L64 WeakPolarHBondContact O-CB 3.48Å; P61-L64 PolarHBondContact O-N 3.12Å; P62-L64 VanDerWaalsContact C-N 3.27Å; P62-L64 PolarHBondContact O-N 2.82Å; L64-V66 PolarHBondContact O-N 3.38Å; L64-V66 VanDerWaalsContact O-N 3.13Å
65Q95Very high93.4Very high122 Ų12279.8 Ų79.857%0.5744%0.437SS*.EExtended strand (participates in β ladder)trans-65.5117.5178.4-68.2-177.423.600110.6S22 V23S22-Q65 CarbonylContact C-O 3.48Å; S22-Q65 VanDerWaalsContact CA-O 3.25Å; S22-Q65 WeakPolarHBondContact CA-O 3.4Å; S22-Q65 WeakPolarHBondContact CB-O 3.49Å; V23-Q65 PolarHBondContact N-O 2.8Å
66V95.8Very high93.3Very high60 Ų6075.5 Ų75.536%0.36442%0.424SS..EExtended strand (participates in β ladder)trans-100.4126.9175-175.20000109V23 I25 L60 L64V23-V66 WeakPolarHBondContact O-CA 3.3Å; I25-V66 HydrophobicContact CD1-CG1 3.56Å; I25-V66 HydrophobicContact CG1-CG1 4.12Å; L60-V66 HydrophobicContact CD1-CG2 3.95Å; L64-V66 PolarHBondContact O-N 3.38Å; L64-V66 VanDerWaalsContact O-N 3.13Å
67K94.4Very high93.1Very high114 Ų11480.8 Ų80.850%0.49645%0.454SS..EExtended strand (participates in β ladder)trans-125.6124.6174.5-66.2-174.4179.4-175.10109.9V23 K24 I25V23-K67 PolarHBondContact O-N 3.01Å; K24-K67 CarbonylContact C-O 3.5Å; K24-K67 VanDerWaalsContact CA-O 3.29Å; K24-K67 WeakPolarHBondContact CA-O 3.4Å; K24-K67 HydrophobicContact CG-CB 4.33Å; I25-K67 PolarHBondContact N-O 2.86Å
68D92.7Very high93Very high89 Ų8981.3 Ų81.348%0.47647%0.468SS..EExtended strand (participates in β ladder)trans-79.5145.6171.3-70.4-69.9000110.7R57R57-D68 IonicContact CZ-OD1 3.59Å; R57-D68 IonicContact CZ-OD2 3.47Å; R57-D68 IonicContact NH1-OD1 2.72Å; R57-D68 PolarHBondContact NH1-OD1 2.73Å; R57-D68 IonicContact NH1-OD2 3.3Å; R57-D68 PolarHBondContact NH1-OD2 2.85Å; R57-D68 IonicContact NH2-OD1 3.69Å; R57-D68 IonicContact NH2-OD2 2.78Å; R57-D68 PolarHBondContact NH2-OD2 2.82Å
69L89Confident93Very high113 Ų11375.5 Ų75.559%0.59245%0.45SS*.  trans-139.90-168.5-130.6173.4000112.7K24 I25 K26K24-L69 HydrophobicContact CB-CD1 3.9Å; K24-L69 HydrophobicContact CD-CD1 3.74Å; K24-L69 HydrophobicContact CG-CD1 4Å; I25-L69 WeakPolarHBondContact O-CB 3.46Å; I25-L69 PolarHBondContact O-N 2.85Å; K26-L69 HydrophobicContact CB-CB 4.45Å; K26-L69 HydrophobicContact CD-CB 4.09Å; K26-L69 HydrophobicContact CD-CD2 4.39Å; K26-L69 WeakPolarHBondContact CD-O 3.38Å; K26-L69 PolarHBondContact NZ-O 2.86Å; K26-L69 PolarHBondContact NZ-OXT 3.11Å

Retrieved 69 of 69 residues in 58.1 ms (Link to these results)

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