A0A096MLJ2_PAPAN Loading...

Small ribosomal subunit protein eS19

Component of the small ribosomal subunit. The ribosome is a large ribonucleoprotein complex responsible for the synthesis of proteins in the cell. Required for pre-rRNA processing and maturation of 40S ribosomal subunits. Part of the small subunit (SSU) processome, first precursor of the small eukaryotic ribosomal subunit. During the assembly of the SSU processome in the nucleolus, many ribosome biogenesis factors, an RNA chaperone and ribosomal proteins associate with the nascent pre-rRNA and work in concert to generate RNA folding, modifications, rearrangements and cleavage as well as targeted degradation of pre-ribosomal RNA by the RNA exosome.

AlphaFold DB , UniProt , Accession A0A096MLJ2, Species PAPAN (Papio anubis, Olive baboon), Gene n/a, Length 146 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
1M56Low84.9Confident188 Ų18883.5 Ų83.593%0.92647%0.472SS*.  0142.80-65.2-157-172.200108
2P73.1Confident85.5Confident115 Ų11587.1 Ų87.175%0.74748%0.482SS*.PPolyproline II helixtrans-55.5148.8171.523.1-31000110.2V4P2-V4 PolarHBondContact O-N 3.21Å
3G79.7Confident86Confident75 Ų7585.5 Ų85.577%0.77347%0.469SS*.PPolyproline II helixtrans-60.5125179.600000110.6
4V88.3Confident86.6Confident42 Ų4279.4 Ų79.426%0.25544%0.435SS..PPolyproline II helixtrans-98.7126.7177.3178.80000108.3P2 D8 V9 A136 A140P2-V4 PolarHBondContact O-N 3.21Å; V4-D8 HydrophobicContact CG1-CB 4.07Å; V4-V9 HydrophobicContact CG1-CG1 3.81Å; V4-A136 HydrophobicContact CG1-CB 4.39Å; V4-A140 HydrophobicContact CB-CB 4.46Å; V4-A140 HydrophobicContact CG1-CB 3.78Å; V4-A140 HydrophobicContact CG2-CB 4.12Å
5T91.1Very high87.1Confident48 Ų4875.3 Ų75.329%0.29441%0.413SS..  trans-105.1170.1175.9720000111.1K7 D8T5-K7 PolarHBondContact O-N 3.47Å; T5-K7 PolarHBondContact OG1-N 3.38Å; T5-D8 WeakPolarHBondContact CA-OD2 3.5Å; T5-D8 WeakPolarHBondContact CB-OD2 3.47Å; T5-D8 PolarHBondContact N-OD2 2.99Å; T5-D8 PolarHBondContact O-N 3.36Å; T5-D8 PolarHBondContact OG1-OD2 3.17Å
6V90.5Very high87.5Confident0 Ų081.4 Ų81.40%043%0.428CS..THydrogen-bonded Turntrans-57.3-22175.3-178.30000113.1D8 V9 F14 R63 Y66 L132 A136V6-D8 VanDerWaalsContact C-N 3.33Å; V6-V9 WeakPolarHBondContact O-CG2 3.36Å; V6-F14 HydrophobicContact CB-CZ 4.43Å; V6-F14 HydrophobicContact CG1-CD1 4.11Å; V6-F14 HydrophobicContact CG1-CE1 3.76Å; V6-F14 HydrophobicContact CG1-CE2 4.35Å; V6-F14 HydrophobicContact CG1-CZ 3.89Å; V6-F14 HydrophobicContact CG2-CE1 4.42Å; V6-F14 HydrophobicContact CG2-CE2 4.05Å; V6-F14 HydrophobicContact CG2-CZ 3.74Å; V6-R63 HydrophobicContact CG1-CG 4.05Å; V6-Y66 HydrophobicContact CB-CD1 3.92Å; V6-Y66 HydrophobicContact CB-CE1 3.76Å; V6-Y66 HydrophobicContact CB-CE2 4.31Å; V6-Y66 HydrophobicContact CB-CG 4.31Å; V6-Y66 HydrophobicContact CG1-CD1 4.3Å; V6-Y66 HydrophobicContact CG2-CD1 4.25Å; V6-Y66 HydrophobicContact CG2-CD2 3.95Å; V6-Y66 HydrophobicContact CG2-CE1 4.11Å; V6-Y66 HydrophobicContact CG2-CE2 3.72Å; V6-Y66 HydrophobicContact CG2-CG 4.19Å; V6-L132 HydrophobicContact CG2-CB 3.87Å; V6-A136 HydrophobicContact CG2-CB 4.36Å
7K91.1Very high87.9Confident150 Ų15078.6 Ų78.665%0.65242%0.42SS*.THydrogen-bonded Turntrans-78.5-18.9178.7-67.4-176.8179-179.70113.3T5 L67T5-K7 PolarHBondContact O-N 3.47Å; T5-K7 PolarHBondContact OG1-N 3.38Å; K7-L67 HydrophobicContact CD-CD2 4.48Å; K7-L67 HydrophobicContact CG-CD2 3.89Å
8D89.8Confident88.1Confident103 Ų10374.3 Ų74.355%0.55140%0.397SS*.SBendtrans-95.50.7-171.8-50.2-45.9000112.7V4 T5 V6V4-D8 HydrophobicContact CG1-CB 4.07Å; T5-D8 WeakPolarHBondContact CA-OD2 3.5Å; T5-D8 WeakPolarHBondContact CB-OD2 3.47Å; T5-D8 PolarHBondContact N-OD2 2.99Å; T5-D8 PolarHBondContact O-N 3.36Å; T5-D8 PolarHBondContact OG1-OD2 3.17Å; V6-D8 VanDerWaalsContact C-N 3.33Å
9V91Very high88.4Confident16 Ų1670.8 Ų70.810%0.09738%0.379CS..SBendtrans-118.4154.3-177-66.30000112.2V4 V6 Q11 F14 A136 V139 A140V4-V9 HydrophobicContact CG1-CG1 3.81Å; V6-V9 WeakPolarHBondContact O-CG2 3.36Å; V9-Q11 PolarHBondContact O-N 3.39Å; V9-F14 HydrophobicContact CG2-CB 3.94Å; V9-F14 HydrophobicContact CG2-CD2 3.88Å; V9-F14 HydrophobicContact CG2-CG 4.12Å; V9-A136 HydrophobicContact CG1-CB 4.19Å; V9-A136 WeakPolarHBondContact CG1-O 3.5Å; V9-A136 HydrophobicContact CG2-CB 4.03Å; V9-V139 HydrophobicContact CB-CG1 4.33Å; V9-V139 HydrophobicContact CG1-CB 4.48Å; V9-V139 HydrophobicContact CG1-CG1 4.42Å; V9-A140 HydrophobicContact CG1-CB 4Å
10N92.3Very high88.6Confident74 Ų7470.3 Ų70.340%0.39639%0.385SS..  trans-57.9125.6173.9-175.7-14.9000110.2Q12 E13 F14N10-Q12 VanDerWaalsContact C-N 3.31Å; N10-Q12 PolarHBondContact O-N 3Å; N10-Q12 PolarHBondContact OD1-N 2.97Å; N10-E13 HydrophobicContact CB-CB 4.25Å; N10-E13 HydrophobicContact CB-CG 4.3Å; N10-E13 WeakPolarHBondContact CB-OE2 3.4Å; N10-E13 PolarHBondContact ND2-OE1 3.35Å; N10-E13 PolarHBondContact O-N 2.98Å; N10-F14 WeakPolarHBondContact O-CB 3.42Å; N10-F14 PolarHBondContact O-N 2.91Å
11Q91.2Very high88.7Confident107 Ų10771.1 Ų71.150%0.539%0.385SS..Hα-helixtrans-56.5-42.7-178.1170.9167.9-27.800112.9V9 V15V9-Q11 PolarHBondContact O-N 3.39Å; Q11-V15 VanDerWaalsContact O-CG2 3.32Å; Q11-V15 WeakPolarHBondContact O-CG2 3.45Å; Q11-V15 PolarHBondContact O-N 3.37Å; Q11-V15 VanDerWaalsContact O-N 3.16Å
12Q92.3Very high90.4Very high127 Ų12762.3 Ų62.359%0.59334%0.342SS*.Hα-helixtrans-72.3-45.1-173.3-63.4-1727.400111.2N10 V15 R16N10-Q12 VanDerWaalsContact C-N 3.31Å; N10-Q12 PolarHBondContact O-N 3Å; N10-Q12 PolarHBondContact OD1-N 2.97Å; Q12-V15 PolarHBondContact O-N 3.21Å; Q12-R16 WeakPolarHBondContact O-CG 3.44Å; Q12-R16 PolarHBondContact O-N 3.29Å; Q12-R16 VanDerWaalsContact O-N 3.1Å
13E92Very high91.2Very high66 Ų6661.4 Ų61.431%0.30833%0.327SS..Hα-helixtrans-63.5-42.4177.6-70.1160-153.400111.3N10 V15 R16 A17 V139 N143N10-E13 HydrophobicContact CB-CB 4.25Å; N10-E13 HydrophobicContact CB-CG 4.3Å; N10-E13 WeakPolarHBondContact CB-OE2 3.4Å; N10-E13 PolarHBondContact ND2-OE1 3.35Å; N10-E13 PolarHBondContact O-N 2.98Å; E13-V15 PolarHBondContact O-N 3.3Å; E13-R16 PolarHBondContact O-N 3.15Å; E13-A17 WeakPolarHBondContact O-CB 3Å; E13-A17 PolarHBondContact O-N 3.15Å; E13-V139 HydrophobicContact CB-CG1 4.13Å; E13-N143 PolarHBondContact OE2-ND2 3.17Å; E13-N143 PolarHBondContact OE2-OD1 3.33Å
14F94.1Very high91.7Very high0 Ų066.6 Ų66.60%033%0.328CS..Hα-helixtrans-59.2-45.2175.6179.8-95.7000112.5V6 V9 N10 R16 A17 L18 R63 L132 I135 A136V6-F14 HydrophobicContact CB-CZ 4.43Å; V6-F14 HydrophobicContact CG1-CD1 4.11Å; V6-F14 HydrophobicContact CG1-CE1 3.76Å; V6-F14 HydrophobicContact CG1-CE2 4.35Å; V6-F14 HydrophobicContact CG1-CZ 3.89Å; V6-F14 HydrophobicContact CG2-CE1 4.42Å; V6-F14 HydrophobicContact CG2-CE2 4.05Å; V6-F14 HydrophobicContact CG2-CZ 3.74Å; V9-F14 HydrophobicContact CG2-CB 3.94Å; V9-F14 HydrophobicContact CG2-CD2 3.88Å; V9-F14 HydrophobicContact CG2-CG 4.12Å; N10-F14 WeakPolarHBondContact O-CB 3.42Å; N10-F14 PolarHBondContact O-N 2.91Å; F14-R16 VanDerWaalsContact C-N 3.33Å; F14-R16 PolarHBondContact O-N 3.21Å; F14-A17 PolarHBondContact O-N 3.38Å; F14-L18 HydrophobicContact CE1-CD2 3.88Å; F14-L18 HydrophobicContact CZ-CD2 4.25Å; F14-L18 VanDerWaalsContact O-CB 3.27Å; F14-L18 WeakPolarHBondContact O-CB 3.27Å; F14-L18 PolarHBondContact O-N 3.44Å; F14-R63 HydrophobicContact CD1-CG 4.36Å; F14-R63 HydrophobicContact CE1-CB 4.23Å; F14-R63 HydrophobicContact CE1-CG 4.29Å; F14-L132 HydrophobicContact CE1-CD2 4.19Å; F14-L132 WeakPolarHBondContact CE2-O 3.15Å; F14-L132 HydrophobicContact CZ-CB 4.28Å; F14-L132 HydrophobicContact CZ-CD2 3.78Å; F14-I135 HydrophobicContact CD2-CG2 4.28Å; F14-I135 HydrophobicContact CE2-CB 4.19Å; F14-I135 HydrophobicContact CE2-CG2 3.93Å; F14-A136 HydrophobicContact CD2-CB 4.19Å; F14-A136 HydrophobicContact CE2-CB 3.94Å
15V94.8Very high91.5Very high18 Ų1866.6 Ų66.611%0.10933%0.33CS..Hα-helixtrans-63.9-40178.7170.70000111.1Q11 Q12 E13 A19 T56 A59Q11-V15 VanDerWaalsContact O-CG2 3.32Å; Q11-V15 WeakPolarHBondContact O-CG2 3.45Å; Q11-V15 PolarHBondContact O-N 3.37Å; Q11-V15 VanDerWaalsContact O-N 3.16Å; Q12-V15 PolarHBondContact O-N 3.21Å; E13-V15 PolarHBondContact O-N 3.3Å; V15-A19 VanDerWaalsContact O-CB 3.28Å; V15-A19 WeakPolarHBondContact O-CB 3.43Å; V15-A19 PolarHBondContact O-N 2.96Å; V15-T56 HydrophobicContact CG1-CG2 4.14Å; V15-A59 HydrophobicContact CG1-CB 4.08Å
16R92.9Very high91Very high173 Ų17374.7 Ų74.765%0.65336%0.355SS*.Hα-helixtrans-63.8-46.8175.9-69.7175.2-176.5171.83111.6Q12 E13 F14 A19 A20Q12-R16 WeakPolarHBondContact O-CG 3.44Å; Q12-R16 PolarHBondContact O-N 3.29Å; Q12-R16 VanDerWaalsContact O-N 3.1Å; E13-R16 PolarHBondContact O-N 3.15Å; F14-R16 VanDerWaalsContact C-N 3.33Å; F14-R16 PolarHBondContact O-N 3.21Å; R16-A19 PolarHBondContact O-N 3.38Å; R16-A20 PolarHBondContact O-N 3.49Å
17A93.5Very high90.7Very high35 Ų3582.2 Ų82.229%0.28939%0.387SS..Hα-helixtrans-63.1-43.8178.500000112.2E13 F14 A20 F21 I135 V139E13-A17 WeakPolarHBondContact O-CB 3Å; E13-A17 PolarHBondContact O-N 3.15Å; F14-A17 PolarHBondContact O-N 3.38Å; A17-A20 PolarHBondContact O-N 3.32Å; A17-F21 PolarHBondContact O-N 3.39Å; A17-I135 HydrophobicContact CB-CG2 4.27Å; A17-V139 HydrophobicContact CB-CG2 3.51Å
18L92.8Very high90.3Very high0 Ų075.4 Ų75.40%036%0.358CS..Hα-helixtrans-65.7-39.6177179.961.3000111.8F14 A20 F21 L22 A59 A62 L132 I135F14-L18 HydrophobicContact CE1-CD2 3.88Å; F14-L18 HydrophobicContact CZ-CD2 4.25Å; F14-L18 VanDerWaalsContact O-CB 3.27Å; F14-L18 WeakPolarHBondContact O-CB 3.27Å; F14-L18 PolarHBondContact O-N 3.44Å; L18-A20 VanDerWaalsContact C-N 3.34Å; L18-F21 HydrophobicContact CD1-CD1 4.49Å; L18-F21 PolarHBondContact O-N 2.71Å; L18-L22 HydrophobicContact CD1-CG 4.41Å; L18-L22 HydrophobicContact CG-CD1 4.32Å; L18-L22 WeakPolarHBondContact O-CG 3.44Å; L18-L22 PolarHBondContact O-N 3.43Å; L18-A59 HydrophobicContact CB-CB 3.91Å; L18-A59 HydrophobicContact CD2-CB 3.75Å; L18-A59 HydrophobicContact CG-CB 3.7Å; L18-A62 HydrophobicContact CD2-CB 4.31Å; L18-L132 HydrophobicContact CD1-CD2 3.98Å; L18-L132 HydrophobicContact CD2-CD2 3.46Å; L18-L132 VanDerWaalsContact CD2-CD2 3.46Å; L18-L132 HydrophobicContact CG-CD2 4.39Å; L18-I135 HydrophobicContact CD1-CD1 3.46Å; L18-I135 VanDerWaalsContact CD1-CD1 3.46Å
19A93Very high90Very high8 Ų879 Ų797%0.06637%0.369CS..Hα-helixtrans-61.7-43.4174.700000111.4V15 R16 F21 L22 K23 A59V15-A19 VanDerWaalsContact O-CB 3.28Å; V15-A19 WeakPolarHBondContact O-CB 3.43Å; V15-A19 PolarHBondContact O-N 2.96Å; R16-A19 PolarHBondContact O-N 3.38Å; A19-F21 VanDerWaalsContact C-N 3.35Å; A19-F21 PolarHBondContact O-N 3.48Å; A19-L22 PolarHBondContact O-N 2.81Å; A19-K23 WeakPolarHBondContact O-CB 3.4Å; A19-K23 PolarHBondContact O-N 2.89Å; A19-A59 HydrophobicContact CB-CB 4.14Å
20A92.6Very high89.7Confident60 Ų6080.2 Ų80.250%0.49638%0.376SS..Hα-helixtrans-62-41175.400000112.1R16 A17 L18 K23 K24R16-A20 PolarHBondContact O-N 3.49Å; A17-A20 PolarHBondContact O-N 3.32Å; L18-A20 VanDerWaalsContact C-N 3.34Å; A20-K23 PolarHBondContact O-N 3.5Å; A20-K24 WeakPolarHBondContact O-CB 3.43Å; A20-K24 PolarHBondContact O-N 3.21Å
21F91.3Very high89.2Confident88 Ų8877.6 Ų77.639%0.38636%0.363SS..Hα-helixtrans-61.8-47174.8176.2-99.4000112.2A17 L18 A19 K23 K24 S25 I135A17-F21 PolarHBondContact O-N 3.39Å; L18-F21 HydrophobicContact CD1-CD1 4.49Å; L18-F21 PolarHBondContact O-N 2.71Å; A19-F21 VanDerWaalsContact C-N 3.35Å; A19-F21 PolarHBondContact O-N 3.48Å; F21-K23 VanDerWaalsContact C-N 3.32Å; F21-K23 PolarHBondContact O-N 2.87Å; F21-K24 PolarHBondContact O-N 2.8Å; F21-S25 WeakPolarHBondContact O-CB 3.46Å; F21-S25 PolarHBondContact O-N 3.24Å; F21-I135 HydrophobicContact CB-CD1 4.06Å; F21-I135 HydrophobicContact CD1-CD1 3.69Å; F21-I135 HydrophobicContact CD2-CD1 4.37Å; F21-I135 HydrophobicContact CE1-CD1 4.21Å; F21-I135 HydrophobicContact CG-CD1 3.78Å
22L90.4Very high88.6Confident4 Ų481.3 Ų81.32%0.02138%0.381CS..Hα-helixtrans-63.3-38.5178-69.3173.4000112L18 A19 S25 R26 L28 Y55 A58 A59 L111 M113L18-L22 HydrophobicContact CD1-CG 4.41Å; L18-L22 HydrophobicContact CG-CD1 4.32Å; L18-L22 WeakPolarHBondContact O-CG 3.44Å; L18-L22 PolarHBondContact O-N 3.43Å; A19-L22 PolarHBondContact O-N 2.81Å; L22-S25 PolarHBondContact O-N 3.31Å; L22-R26 PolarHBondContact O-N 3.34Å; L22-L28 HydrophobicContact CB-CD1 4.23Å; L22-L28 HydrophobicContact CD1-CD1 4.08Å; L22-L28 HydrophobicContact CD2-CD1 4.11Å; L22-L28 HydrophobicContact CG-CD1 4.38Å; L22-Y55 HydrophobicContact CB-CD1 4.02Å; L22-A58 HydrophobicContact CD1-CB 4Å; L22-A59 HydrophobicContact CD1-CB 4.39Å; L22-L111 HydrophobicContact CD2-CD1 3.93Å; L22-M113 HydrophobicContact CD2-SD 4.08Å
23K90.5Very high87.8Confident96 Ų9679 Ų7942%0.41737%0.366SS..Hα-helixtrans-64.3-46.8174.6-173178.6-174.6177.50111.4A19 A20 F21 S25 R26 N52 Y55A19-K23 WeakPolarHBondContact O-CB 3.4Å; A19-K23 PolarHBondContact O-N 2.89Å; A20-K23 PolarHBondContact O-N 3.5Å; F21-K23 VanDerWaalsContact C-N 3.32Å; F21-K23 PolarHBondContact O-N 2.87Å; K23-S25 VanDerWaalsContact C-N 3.29Å; K23-S25 PolarHBondContact O-N 2.91Å; K23-R26 WeakPolarHBondContact O-CG 3.42Å; K23-R26 PolarHBondContact O-N 3.35Å; K23-N52 WeakPolarHBondContact CD-OD1 3.47Å; K23-N52 WeakPolarHBondContact CE-OD1 3.3Å; K23-N52 PolarHBondContact NZ-ND2 2.92Å; K23-N52 VanDerWaalsContact NZ-ND2 3.12Å; K23-N52 PolarHBondContact NZ-OD1 3.12Å; K23-Y55 HydrophobicContact CB-CD1 4.23Å; K23-Y55 HydrophobicContact CB-CD2 4.36Å; K23-Y55 HydrophobicContact CB-CE1 4.38Å; K23-Y55 HydrophobicContact CB-CG 4.21Å; K23-Y55 HydrophobicContact CG-CD2 4.44Å; K23-Y55 HydrophobicContact CG-CE2 4.27Å
24K90.4Very high86.3Confident184 Ų18475.9 Ų75.980%0.835%0.352SS*.Hα-helixtrans-62.8-35.9178.8-171.2174.8-176.8176.40112.3A20 F21 R26A20-K24 WeakPolarHBondContact O-CB 3.43Å; A20-K24 PolarHBondContact O-N 3.21Å; F21-K24 PolarHBondContact O-N 2.8Å; K24-R26 VanDerWaalsContact C-N 3.27Å; K24-R26 PolarHBondContact O-N 2.93Å
25S84Confident84.7Confident42 Ų4280.6 Ų80.629%0.29438%0.377SS..Hα-helixtrans-64.5-29.2178.5-175.20000112.9F21 L22 K23 K27F21-S25 WeakPolarHBondContact O-CB 3.46Å; F21-S25 PolarHBondContact O-N 3.24Å; L22-S25 PolarHBondContact O-N 3.31Å; K23-S25 VanDerWaalsContact C-N 3.29Å; K23-S25 PolarHBondContact O-N 2.91Å; S25-K27 WeakPolarHBondContact O-CG 3.41Å; S25-K27 PolarHBondContact O-N 3Å
26R80.4Confident83.1Confident218 Ų21886.6 Ų86.682%0.82341%0.409SS*.  trans52.23.6-176.6-63.5-171.7-179.7-175.2-0.2116.3L22 K23 K24 L28L22-R26 PolarHBondContact O-N 3.34Å; K23-R26 WeakPolarHBondContact O-CG 3.42Å; K23-R26 PolarHBondContact O-N 3.35Å; K24-R26 VanDerWaalsContact C-N 3.27Å; K24-R26 PolarHBondContact O-N 2.93Å; R26-L28 VanDerWaalsContact C-N 3.32Å
27K83.9Confident82.1Confident157 Ų15784.1 Ų84.168%0.68341%0.413SS*.  trans-81.3-12178.7-69.3173.1-173.6-1770113.3S25 K29 L111S25-K27 WeakPolarHBondContact O-CG 3.41Å; S25-K27 PolarHBondContact O-N 3Å; K27-K29 PolarHBondContact O-N 2.88Å; K27-L111 HydrophobicContact CB-CD2 3.44Å; K27-L111 VanDerWaalsContact CB-CD2 3.44Å
28L83.9Confident81.4Confident8 Ų884.2 Ų84.24%0.04241%0.41CS..SBendtrans-77.5113.6-177.6-165.4142.5000109.4L22 R26 V30 F54 Y55 A58 A107 L111L22-L28 HydrophobicContact CB-CD1 4.23Å; L22-L28 HydrophobicContact CD1-CD1 4.08Å; L22-L28 HydrophobicContact CD2-CD1 4.11Å; L22-L28 HydrophobicContact CG-CD1 4.38Å; R26-L28 VanDerWaalsContact C-N 3.32Å; L28-V30 HydrophobicContact CD2-CG2 4.14Å; L28-V30 PolarHBondContact O-N 2.96Å; L28-F54 HydrophobicContact CD2-CD1 3.43Å; L28-F54 VanDerWaalsContact CD2-CD1 3.43Å; L28-F54 HydrophobicContact CD2-CE1 3.34Å; L28-Y55 HydrophobicContact CB-CE1 4.08Å; L28-Y55 HydrophobicContact CD1-CD1 4.47Å; L28-Y55 HydrophobicContact CD2-CD1 4.23Å; L28-Y55 HydrophobicContact CD2-CE1 4.09Å; L28-A58 HydrophobicContact CD1-CB 3.87Å; L28-A107 HydrophobicContact CD2-CB 4.34Å; L28-A107 HydrophobicContact CG-CB 4.25Å; L28-L111 HydrophobicContact CB-CD1 3.98Å; L28-L111 HydrophobicContact CD1-CD1 3.77Å; L28-L111 HydrophobicContact CG-CD1 4.04Å
29K82.8Confident80.9Confident178 Ų17889.6 Ų89.677%0.77443%0.433SS*.  trans-68.5100.5177.8-67.3-174.1177.2-175.70109.9K27K27-K29 PolarHBondContact O-N 2.88Å
30V84.3Confident80.5Confident41 Ų4190.5 Ų90.525%0.24844%0.437CS..  trans-78129.3171.8-173.50000107.9L28 L35 F54 Y55L28-V30 HydrophobicContact CD2-CG2 4.14Å; L28-V30 PolarHBondContact O-N 2.96Å; V30-L35 HydrophobicContact CG1-CD2 4.4Å; V30-L35 HydrophobicContact CG1-CG 4.33Å; V30-F54 HydrophobicContact CB-CD1 4.31Å; V30-F54 HydrophobicContact CG1-CB 4.4Å; V30-F54 HydrophobicContact CG1-CD1 4.08Å; V30-F54 HydrophobicContact CG1-CG 4.23Å; V30-F54 HydrophobicContact CG2-CD1 3.97Å; V30-F54 HydrophobicContact CG2-CE1 4.5Å; V30-Y55 HydrophobicContact CG2-CE1 4.36Å; V30-Y55 HydrophobicContact CG2-CE2 4.35Å
31P82.3Confident80.3Confident19 Ų1988.3 Ų88.312%0.12342%0.417CS..  trans-65143.617525.1-30.9000110.5W33 G34 F54 R103P31-W33 VanDerWaalsContact C-N 3.32Å; P31-W33 HydrophobicContact CB-CD2 4.21Å; P31-W33 HydrophobicContact CB-CZ2 4.05Å; P31-W33 HydrophobicContact CG-CD2 4.44Å; P31-W33 HydrophobicContact CG-CH2 4.18Å; P31-W33 HydrophobicContact CG-CZ2 4.06Å; P31-W33 HydrophobicContact CG-CZ3 4.41Å; P31-W33 PolarHBondContact O-N 3.37Å; P31-G34 WeakPolarHBondContact O-CA 3.49Å; P31-G34 PolarHBondContact O-N 3.45Å; P31-F54 HydrophobicContact CG-CD2 4.43Å; P31-F54 HydrophobicContact CG-CE2 3.84Å; P31-F54 HydrophobicContact CG-CZ 4.03Å; P31-R103 HydrophobicContact CB-CG 4.41Å; P31-R103 HydrophobicContact CG-CB 4.29Å; P31-R103 HydrophobicContact CG-CG 4.41Å
32E78.6Confident80.2Confident186 Ų18690.9 Ų90.987%0.86943%0.428SS*.G310 helixtrans-55.2-42.3-175.1-169.9177.6179.300113.4G34E32-G34 PolarHBondContact O-N 2.96Å
33W74.8Confident80.2Confident77 Ų7791.7 Ų91.729%0.29243%0.432SS..G310 helixtrans-73.2-8.4175.653.3-101.1000114.6P31 L35 V38 V100 R103P31-W33 VanDerWaalsContact C-N 3.32Å; P31-W33 HydrophobicContact CB-CD2 4.21Å; P31-W33 HydrophobicContact CB-CZ2 4.05Å; P31-W33 HydrophobicContact CG-CD2 4.44Å; P31-W33 HydrophobicContact CG-CH2 4.18Å; P31-W33 HydrophobicContact CG-CZ2 4.06Å; P31-W33 HydrophobicContact CG-CZ3 4.41Å; P31-W33 PolarHBondContact O-N 3.37Å; W33-L35 VanDerWaalsContact C-N 3.33Å; W33-L35 PolarHBondContact O-N 3.21Å; W33-V38 HydrophobicContact CB-CG1 4.48Å; W33-V38 HydrophobicContact CD2-CG1 4.38Å; W33-V38 HydrophobicContact CE3-CB 4.2Å; W33-V38 HydrophobicContact CE3-CG1 3.64Å; W33-V38 HydrophobicContact CE3-CG2 3.58Å; W33-V38 HydrophobicContact CZ3-CB 4.5Å; W33-V38 HydrophobicContact CZ3-CG1 4.3Å; W33-V38 HydrophobicContact CZ3-CG2 3.74Å; W33-V100 HydrophobicContact CH2-CG2 3.84Å; W33-V100 HydrophobicContact CZ3-CG2 3.93Å; W33-R103 HydrophobicContact CH2-CG 4.34Å; W33-R103 HydrophobicContact CZ2-CG 3.71Å
34G61.2Low80.2Confident1 Ų192.4 Ų92.41%0.0144%0.435CS..G310 helixtrans-77.3-14.4-169.700000114.8P31 E32 W53P31-G34 WeakPolarHBondContact O-CA 3.49Å; P31-G34 PolarHBondContact O-N 3.45Å; E32-G34 PolarHBondContact O-N 2.96Å; G34-W53 VanDerWaalsContact O-CE2 3.25Å; G34-W53 WeakPolarHBondContact O-CZ2 3.42Å; G34-W53 PolarHBondContact O-NE1 3.25Å
35L60.1Low80.1Confident100 Ų10091.8 Ų91.852%0.52444%0.435SS..THydrogen-bonded Turntrans-83.8-49.6-173.6-71163000111.9V30 W33V30-L35 HydrophobicContact CG1-CD2 4.4Å; V30-L35 HydrophobicContact CG1-CG 4.33Å; W33-L35 VanDerWaalsContact C-N 3.33Å; W33-L35 PolarHBondContact O-N 3.21Å
36D62.5Low80.3Confident144 Ų14495.9 Ų95.977%0.7745%0.453SS*.THydrogen-bonded Turntrans-133.5-10.3-171.5-72.8-42.1000117
37T70.5Confident80.6Confident120 Ų12088 Ų8874%0.73644%0.435SS*.THydrogen-bonded Turntrans-97.4-18-165.5-37.30000114.1
38V78.6Confident80.9Confident38 Ų3882.5 Ų82.523%0.2342%0.415CS..  trans-118.8138.4-161.8-61.60000115.1W33 W53W33-V38 HydrophobicContact CB-CG1 4.48Å; W33-V38 HydrophobicContact CD2-CG1 4.38Å; W33-V38 HydrophobicContact CE3-CB 4.2Å; W33-V38 HydrophobicContact CE3-CG1 3.64Å; W33-V38 HydrophobicContact CE3-CG2 3.58Å; W33-V38 HydrophobicContact CZ3-CB 4.5Å; W33-V38 HydrophobicContact CZ3-CG1 4.3Å; W33-V38 HydrophobicContact CZ3-CG2 3.74Å; V38-W53 HydrophobicContact CG2-CZ2 4.1Å
39K83.7Confident81.1Confident112 Ų11290.7 Ų90.749%0.48745%0.452SS..  trans-77.3143.3155.457.6-179.2170.5-171.60110.6V41 K44K39-V41 VanDerWaalsContact C-N 3.26Å; K39-V41 PolarHBondContact O-N 2.99Å; K39-K44 VanDerWaalsContact CD-O 3.27Å; K39-K44 WeakPolarHBondContact CD-O 3.4Å
40L84.4Confident81.2Confident28 Ų2885.7 Ų85.715%0.14743%0.434CS..SBendtrans-66.6-27.9-177.3-62.5-176.5000114P48 W53 R57 S97L40-P48 HydrophobicContact CD1-CG 3.49Å; L40-P48 VanDerWaalsContact CD1-CG 3.49Å; L40-P48 HydrophobicContact CD2-CG 3.81Å; L40-P48 HydrophobicContact CG-CG 3.44Å; L40-P48 VanDerWaalsContact CG-CG 3.44Å; L40-W53 HydrophobicContact CD1-CE3 4.43Å; L40-W53 HydrophobicContact CD2-CD2 3.67Å; L40-W53 HydrophobicContact CD2-CE3 3.27Å; L40-W53 HydrophobicContact CD2-CH2 3.38Å; L40-W53 HydrophobicContact CD2-CZ2 3.78Å; L40-W53 HydrophobicContact CD2-CZ3 3.13Å; L40-W53 HydrophobicContact CG-CE3 4.46Å; L40-R57 VanDerWaalsContact CD1-NH2 3.35Å; L40-S97 WeakPolarHBondContact O-CB 3.32Å
41V88.8Confident81.2Confident13 Ų1390.7 Ų90.78%0.07946%0.455CS..SBendtrans-156.5153.8-168.1-61.80000109.4K39 H43 K44 G96K39-V41 VanDerWaalsContact C-N 3.26Å; K39-V41 PolarHBondContact O-N 2.99Å; V41-H43 WeakPolarHBondContact CG2-CE1 3.31Å; V41-H43 WeakPolarHBondContact CG2-ND1 3.5Å; V41-H43 PolarHBondContact O-N 3.44Å; V41-K44 HydrophobicContact CG2-CB 3.74Å; V41-K44 HydrophobicContact CG2-CG 3.35Å; V41-K44 PolarHBondContact O-N 3.15Å; V41-G96 VanDerWaalsContact CG1-CA 3.48Å
42K88.7Confident81.5Confident142 Ų14291.7 Ų91.762%0.61746%0.459SS*.THydrogen-bonded Turntrans-65.7-25.7-179.767.3171.9-174.3170.80114.3K44 S94K42-K44 VanDerWaalsContact C-N 3.32Å; K42-S94 WeakPolarHBondContact CE-OG 3.39Å; K42-S94 VanDerWaalsContact CG-OG 3.22Å; K42-S94 WeakPolarHBondContact CG-OG 3.31Å
43H90.3Very high82Confident22 Ų2283.6 Ų83.610%0.10242%0.421CS..THydrogen-bonded Turntrans-88.62.4-17570.9-98.3000114.2V41 G82 Q84V41-H43 WeakPolarHBondContact CG2-CE1 3.31Å; V41-H43 WeakPolarHBondContact CG2-ND1 3.5Å; V41-H43 PolarHBondContact O-N 3.44Å; H43-G82 PolarHBondContact CE1-N 3.32Å; H43-Q84 HydrophobicContact CB-CB 3.51Å; H43-Q84 HydrophobicContact CB-CG 3.73Å
44K90.8Very high82.8Confident111 Ų11180.1 Ų80.148%0.48341%0.407SS..  trans-112139.8170.3-63.4-60.5177-155.80107.7K39 V41 K42K39-K44 VanDerWaalsContact CD-O 3.27Å; K39-K44 WeakPolarHBondContact CD-O 3.4Å; V41-K44 HydrophobicContact CG2-CB 3.74Å; V41-K44 HydrophobicContact CG2-CG 3.35Å; V41-K44 PolarHBondContact O-N 3.15Å; K42-K44 VanDerWaalsContact C-N 3.32Å
45E87.4Confident84.3Confident170 Ų17081.8 Ų81.879%0.79441%0.414SS*.SBendtrans-88.1-41-177.9-67.5170.8-172.400110.5
46L88.6Confident85.8Confident128 Ų12879.5 Ų79.567%0.6740%0.404SS*.SBendtrans-95.1154.6-178.1-57.5176.5000112.7
47A87.1Confident87.3Confident54 Ų5475.3 Ų75.345%0.44638%0.377SS..PPolyproline II helixtrans-69.9161.5168.300000111.1
48P89.2Confident88.4Confident41 Ų4169.6 Ų69.627%0.26634%0.342SS..PPolyproline II helixtrans-58.5138171.3-23.136.3000111.5L40 D50 W53L40-P48 HydrophobicContact CD1-CG 3.49Å; L40-P48 VanDerWaalsContact CD1-CG 3.49Å; L40-P48 HydrophobicContact CD2-CG 3.81Å; L40-P48 HydrophobicContact CG-CG 3.44Å; L40-P48 VanDerWaalsContact CG-CG 3.44Å; P48-D50 VanDerWaalsContact C-N 3.34Å; P48-W53 HydrophobicContact CB-CB 3.64Å; P48-W53 HydrophobicContact CB-CG 3.81Å; P48-W53 HydrophobicContact CG-CB 3.98Å; P48-W53 HydrophobicContact CG-CD2 4.12Å; P48-W53 HydrophobicContact CG-CG 3.72Å
49H87.6Confident89.1Confident179 Ų17967.8 Ų67.883%0.82933%0.331SS*.SBendtrans-71-28.7175.9-63.9-61.3000113.5
50D85.9Confident89.7Confident73 Ų7364.3 Ų64.339%0.3932%0.321SS..  trans-85.8117.3176.2176.419000109.8P48 N52 W53P48-D50 VanDerWaalsContact C-N 3.34Å; D50-N52 PolarHBondContact O-N 2.93Å; D50-N52 VanDerWaalsContact O-N 3.13Å; D50-N52 WeakPolarHBondContact OD1-CA 3.33Å; D50-N52 VanDerWaalsContact OD1-CB 3.3Å; D50-N52 WeakPolarHBondContact OD1-CB 3.32Å; D50-N52 PolarHBondContact OD1-N 3.47Å; D50-N52 PolarHBondContact OD1-ND2 3.49Å; D50-W53 VanDerWaalsContact O-CB 3.24Å; D50-W53 WeakPolarHBondContact O-CB 3.41Å; D50-W53 PolarHBondContact O-N 3.33Å
51E84.4Confident90.1Very high146 Ų14663.1 Ų63.168%0.68232%0.315SS*.THydrogen-bonded Turntrans-55.5-28173-63.6171.9-17000111.9W53E51-W53 PolarHBondContact O-N 2.92Å
52N87.3Confident90.3Very high40 Ų4062.7 Ų62.721%0.21431%0.313CS..THydrogen-bonded Turntrans-88.916.1-179.9-53.6-76.1000113.2K23 D50 F54 Y55 T56K23-N52 WeakPolarHBondContact CD-OD1 3.47Å; K23-N52 WeakPolarHBondContact CE-OD1 3.3Å; K23-N52 PolarHBondContact NZ-ND2 2.92Å; K23-N52 VanDerWaalsContact NZ-ND2 3.12Å; K23-N52 PolarHBondContact NZ-OD1 3.12Å; D50-N52 PolarHBondContact O-N 2.93Å; D50-N52 VanDerWaalsContact O-N 3.13Å; D50-N52 WeakPolarHBondContact OD1-CA 3.33Å; D50-N52 VanDerWaalsContact OD1-CB 3.3Å; D50-N52 WeakPolarHBondContact OD1-CB 3.32Å; D50-N52 PolarHBondContact OD1-N 3.47Å; D50-N52 PolarHBondContact OD1-ND2 3.49Å; N52-F54 PolarHBondContact O-N 3.05Å; N52-Y55 HydrophobicContact CB-CD2 4.01Å; N52-Y55 PolarHBondContact O-N 2.95Å; N52-T56 PolarHBondContact O-N 3.29Å
53W90.1Very high90.6Very high17 Ų1757.5 Ų57.56%0.06429%0.289CS..Hα-helixtrans-53.2-31.3-177.470-94.5000113G34 V38 L40 P48 D50 E51 T56 R57 V100G34-W53 VanDerWaalsContact O-CE2 3.25Å; G34-W53 WeakPolarHBondContact O-CZ2 3.42Å; G34-W53 PolarHBondContact O-NE1 3.25Å; V38-W53 HydrophobicContact CG2-CZ2 4.1Å; L40-W53 HydrophobicContact CD1-CE3 4.43Å; L40-W53 HydrophobicContact CD2-CD2 3.67Å; L40-W53 HydrophobicContact CD2-CE3 3.27Å; L40-W53 HydrophobicContact CD2-CH2 3.38Å; L40-W53 HydrophobicContact CD2-CZ2 3.78Å; L40-W53 HydrophobicContact CD2-CZ3 3.13Å; L40-W53 HydrophobicContact CG-CE3 4.46Å; P48-W53 HydrophobicContact CB-CB 3.64Å; P48-W53 HydrophobicContact CB-CG 3.81Å; P48-W53 HydrophobicContact CG-CB 3.98Å; P48-W53 HydrophobicContact CG-CD2 4.12Å; P48-W53 HydrophobicContact CG-CG 3.72Å; D50-W53 VanDerWaalsContact O-CB 3.24Å; D50-W53 WeakPolarHBondContact O-CB 3.41Å; D50-W53 PolarHBondContact O-N 3.33Å; E51-W53 PolarHBondContact O-N 2.92Å; W53-T56 PolarHBondContact O-N 3.33Å; W53-R57 HydrophobicContact CE3-CB 4.24Å; W53-R57 HydrophobicContact CZ3-CB 4.41Å; W53-R57 VanDerWaalsContact O-CB 3.29Å; W53-R57 WeakPolarHBondContact O-CB 3.47Å; W53-R57 PolarHBondContact O-N 3.1Å; W53-V100 HydrophobicContact CH2-CG1 3.92Å; W53-V100 HydrophobicContact CH2-CG2 4.26Å; W53-V100 HydrophobicContact CZ3-CG1 3.7Å
54F91.2Very high90.8Very high3 Ų358.6 Ų58.61%0.01329%0.294CS..Hα-helixtrans-66.1-38.7-179.3-165.8-103.3000111.8L28 V30 P31 N52 R57 A58 R103 V104 A107L28-F54 HydrophobicContact CD2-CD1 3.43Å; L28-F54 VanDerWaalsContact CD2-CD1 3.43Å; L28-F54 HydrophobicContact CD2-CE1 3.34Å; V30-F54 HydrophobicContact CB-CD1 4.31Å; V30-F54 HydrophobicContact CG1-CB 4.4Å; V30-F54 HydrophobicContact CG1-CD1 4.08Å; V30-F54 HydrophobicContact CG1-CG 4.23Å; V30-F54 HydrophobicContact CG2-CD1 3.97Å; V30-F54 HydrophobicContact CG2-CE1 4.5Å; P31-F54 HydrophobicContact CG-CD2 4.43Å; P31-F54 HydrophobicContact CG-CE2 3.84Å; P31-F54 HydrophobicContact CG-CZ 4.03Å; N52-F54 PolarHBondContact O-N 3.05Å; F54-R57 PolarHBondContact O-N 3.01Å; F54-A58 WeakPolarHBondContact O-CB 3.24Å; F54-A58 PolarHBondContact O-N 2.98Å; F54-R103 HydrophobicContact CE2-CB 4.49Å; F54-R103 HydrophobicContact CZ-CB 4.4Å; F54-V104 HydrophobicContact CD2-CG2 4.1Å; F54-V104 HydrophobicContact CE2-CG2 3.47Å; F54-V104 VanDerWaalsContact CE2-CG2 3.47Å; F54-V104 HydrophobicContact CZ-CG2 3.79Å; F54-A107 HydrophobicContact CE1-CB 4.33Å; F54-A107 HydrophobicContact CZ-CB 4.5Å
55Y92.1Very high90.8Very high37 Ų3753.3 Ų53.315%0.14527%0.272CS..Hα-helixtrans-68-43.3175.1-61-77.1000111.1L22 K23 L28 V30 N52 R57 A58 A59L22-Y55 HydrophobicContact CB-CD1 4.02Å; K23-Y55 HydrophobicContact CB-CD1 4.23Å; K23-Y55 HydrophobicContact CB-CD2 4.36Å; K23-Y55 HydrophobicContact CB-CE1 4.38Å; K23-Y55 HydrophobicContact CB-CG 4.21Å; K23-Y55 HydrophobicContact CG-CD2 4.44Å; K23-Y55 HydrophobicContact CG-CE2 4.27Å; L28-Y55 HydrophobicContact CB-CE1 4.08Å; L28-Y55 HydrophobicContact CD1-CD1 4.47Å; L28-Y55 HydrophobicContact CD2-CD1 4.23Å; L28-Y55 HydrophobicContact CD2-CE1 4.09Å; V30-Y55 HydrophobicContact CG2-CE1 4.36Å; V30-Y55 HydrophobicContact CG2-CE2 4.35Å; N52-Y55 HydrophobicContact CB-CD2 4.01Å; N52-Y55 PolarHBondContact O-N 2.95Å; Y55-R57 VanDerWaalsContact C-N 3.29Å; Y55-R57 PolarHBondContact O-N 3.13Å; Y55-A58 PolarHBondContact O-N 3.19Å; Y55-A59 WeakPolarHBondContact O-CB 3.28Å; Y55-A59 PolarHBondContact O-N 3.3Å
56T93.3Very high91.1Very high52 Ų5246 Ų4632%0.31924%0.237SC..Hα-helixtrans-61.2-39.8174.7-56.50000111.2V15 N52 W53 A59 S60V15-T56 HydrophobicContact CG1-CG2 4.14Å; N52-T56 PolarHBondContact O-N 3.29Å; W53-T56 PolarHBondContact O-N 3.33Å; T56-A59 PolarHBondContact O-N 3.11Å; T56-S60 WeakPolarHBondContact O-CB 3.41Å; T56-S60 PolarHBondContact O-N 3.06Å
57R92.8Very high91.2Very high55 Ų5543.6 Ų43.621%0.20823%0.225CC..Hα-helixtrans-66.2-41.6175.5-173.761.456.9162-2.5112.1L40 W53 F54 Y55 T61 Y80 V100 V104L40-R57 VanDerWaalsContact CD1-NH2 3.35Å; W53-R57 HydrophobicContact CE3-CB 4.24Å; W53-R57 HydrophobicContact CZ3-CB 4.41Å; W53-R57 VanDerWaalsContact O-CB 3.29Å; W53-R57 WeakPolarHBondContact O-CB 3.47Å; W53-R57 PolarHBondContact O-N 3.1Å; F54-R57 PolarHBondContact O-N 3.01Å; Y55-R57 VanDerWaalsContact C-N 3.29Å; Y55-R57 PolarHBondContact O-N 3.13Å; R57-T61 WeakPolarHBondContact O-CB 3.44Å; R57-T61 PolarHBondContact O-N 3.16Å; R57-T61 PolarHBondContact O-OG1 3Å; R57-Y80 VanDerWaalsContact NH1-CB 3.3Å; R57-Y80 VanDerWaalsContact NH1-CE1 3.35Å; R57-V100 HydrophobicContact CG-CG1 4.45Å; R57-V104 HydrophobicContact CB-CG2 4.43Å; R57-V104 HydrophobicContact CG-CG2 3.81Å
58A93.4Very high91.3Very high0 Ų048.6 Ų48.60%023%0.232CC..Hα-helixtrans-63.9-45.7176.100000111.3L22 L28 F54 Y55 T61 A62 V104 L108L22-A58 HydrophobicContact CD1-CB 4Å; L28-A58 HydrophobicContact CD1-CB 3.87Å; F54-A58 WeakPolarHBondContact O-CB 3.24Å; F54-A58 PolarHBondContact O-N 2.98Å; Y55-A58 PolarHBondContact O-N 3.19Å; A58-T61 PolarHBondContact O-N 3.22Å; A58-A62 WeakPolarHBondContact O-CB 3.48Å; A58-A62 PolarHBondContact O-N 3.46Å; A58-V104 HydrophobicContact CB-CG1 4.09Å; A58-L108 HydrophobicContact CB-CD2 4.3Å
59A94.5Very high91.1Very high0 Ų048.3 Ų48.30%024%0.237CC..Hα-helixtrans-58.9-48.9176.100000112.4V15 L18 A19 L22 Y55 T56 T61 A62 R63V15-A59 HydrophobicContact CG1-CB 4.08Å; L18-A59 HydrophobicContact CB-CB 3.91Å; L18-A59 HydrophobicContact CD2-CB 3.75Å; L18-A59 HydrophobicContact CG-CB 3.7Å; A19-A59 HydrophobicContact CB-CB 4.14Å; L22-A59 HydrophobicContact CD1-CB 4.39Å; Y55-A59 WeakPolarHBondContact O-CB 3.28Å; Y55-A59 PolarHBondContact O-N 3.3Å; T56-A59 PolarHBondContact O-N 3.11Å; A59-T61 VanDerWaalsContact C-N 3.29Å; A59-T61 PolarHBondContact O-N 2.68Å; A59-A62 PolarHBondContact O-N 3.49Å; A59-R63 PolarHBondContact O-N 3.33Å
60S94.8Very high91.1Very high40 Ų4041.6 Ų41.628%0.2822%0.216SC..Hα-helixtrans-58.7-40.8175.3175.60000112.1T56 H64 Y80T56-S60 WeakPolarHBondContact O-CB 3.41Å; T56-S60 PolarHBondContact O-N 3.06Å; S60-H64 WeakPolarHBondContact O-CB 3.27Å; S60-H64 PolarHBondContact O-N 3Å; S60-Y80 WeakPolarHBondContact CB-OH 3.41Å; S60-Y80 PolarHBondContact OG-OH 3.32Å
61T94.4Very high91.3Very high3 Ų338.2 Ų38.22%0.01820%0.198CC..Hα-helixtrans-69.9-42.4-179.2-55.90000111.6R57 A58 A59 H64 L65 M76 Y80 V104 L105 L108R57-T61 WeakPolarHBondContact O-CB 3.44Å; R57-T61 PolarHBondContact O-N 3.16Å; R57-T61 PolarHBondContact O-OG1 3Å; A58-T61 PolarHBondContact O-N 3.22Å; A59-T61 VanDerWaalsContact C-N 3.29Å; A59-T61 PolarHBondContact O-N 2.68Å; T61-H64 PolarHBondContact O-N 3.29Å; T61-L65 HydrophobicContact CG2-CD1 4.45Å; T61-L65 WeakPolarHBondContact O-CG 3.15Å; T61-L65 PolarHBondContact O-N 3.01Å; T61-M76 HydrophobicContact CG2-CE 3.8Å; T61-M76 HydrophobicContact CG2-CG 4.48Å; T61-M76 HydrophobicContact CG2-SD 3.88Å; T61-Y80 WeakPolarHBondContact CA-OH 3.41Å; T61-Y80 PolarHBondContact N-OH 2.78Å; T61-Y80 VanDerWaalsContact N-OH 3.13Å; T61-Y80 PolarHBondContact OG1-OH 3.13Å; T61-V104 HydrophobicContact CG2-CG1 4.15Å; T61-L105 HydrophobicContact CG2-CD2 3.59Å; T61-L105 HydrophobicContact CG2-CG 4.35Å; T61-L108 HydrophobicContact CG2-CD1 4.23Å
62A93.1Very high91.6Very high4 Ų432.3 Ų32.33%0.03318%0.176CC..Hα-helixtrans-62.1-44.1175.500000111.4L18 A58 A59 H64 L65 Y66 L108 L132L18-A62 HydrophobicContact CD2-CB 4.31Å; A58-A62 WeakPolarHBondContact O-CB 3.48Å; A58-A62 PolarHBondContact O-N 3.46Å; A59-A62 PolarHBondContact O-N 3.49Å; A62-H64 VanDerWaalsContact C-N 3.34Å; A62-H64 PolarHBondContact O-N 2.99Å; A62-L65 PolarHBondContact O-N 3.35Å; A62-Y66 PolarHBondContact O-N 2.86Å; A62-L108 HydrophobicContact CB-CD1 4.21Å; A62-L108 HydrophobicContact CB-CD2 4.4Å; A62-L132 HydrophobicContact CB-CD2 4.41Å
63R94.4Very high91.8Very high32 Ų3231.7 Ų31.712%0.12117%0.174CC..Hα-helixtrans-60.5-43.1173.6-175.3-179178.2-86.53.3111.9V6 F14 A59 L65 Y66 L67V6-R63 HydrophobicContact CG1-CG 4.05Å; F14-R63 HydrophobicContact CD1-CG 4.36Å; F14-R63 HydrophobicContact CE1-CB 4.23Å; F14-R63 HydrophobicContact CE1-CG 4.29Å; A59-R63 PolarHBondContact O-N 3.33Å; R63-L65 VanDerWaalsContact C-N 3.31Å; R63-L65 PolarHBondContact O-N 3.38Å; R63-Y66 WeakPolarHBondContact O-CA 3.42Å; R63-Y66 VanDerWaalsContact O-CB 3.29Å; R63-Y66 WeakPolarHBondContact O-CB 3.31Å; R63-Y66 PolarHBondContact O-N 3.05Å; R63-Y66 VanDerWaalsContact O-N 3.11Å; R63-L67 PolarHBondContact O-N 3.01Å; R63-L67 VanDerWaalsContact O-N 3.1Å
64H93.7Very high92Very high45 Ų4533 Ų3321%0.20819%0.192CC..Hα-helixtrans-62.1-40.7178.1-170.3-68.5000111.7S60 T61 A62 Y66 L67 R68 M76 I79S60-H64 WeakPolarHBondContact O-CB 3.27Å; S60-H64 PolarHBondContact O-N 3Å; T61-H64 PolarHBondContact O-N 3.29Å; A62-H64 VanDerWaalsContact C-N 3.34Å; A62-H64 PolarHBondContact O-N 2.99Å; H64-Y66 VanDerWaalsContact C-N 3.26Å; H64-Y66 PolarHBondContact O-N 3.22Å; H64-L67 PolarHBondContact O-N 3.41Å; H64-R68 CarbonylContact O-C 3.57Å; H64-R68 PolarHBondContact O-N 3.37Å; H64-M76 HydrophobicContact CB-CE 4.37Å; H64-I79 WeakPolarHBondContact CE1-CD1 3.39Å; H64-I79 WeakPolarHBondContact NE2-CD1 3.41Å
65L92.4Very high92.1Very high1 Ų134.4 Ų34.41%0.00520%0.203CC..Hα-helixtrans-67.1-26.1174.9-71.3169.8000113T61 A62 R63 A71 M76 L105 V114 R122 R124T61-L65 HydrophobicContact CG2-CD1 4.45Å; T61-L65 WeakPolarHBondContact O-CG 3.15Å; T61-L65 PolarHBondContact O-N 3.01Å; A62-L65 PolarHBondContact O-N 3.35Å; R63-L65 VanDerWaalsContact C-N 3.31Å; R63-L65 PolarHBondContact O-N 3.38Å; L65-A71 HydrophobicContact CD2-CB 3.87Å; L65-M76 HydrophobicContact CD2-CE 3.96Å; L65-M76 HydrophobicContact CG-CE 3.91Å; L65-L105 HydrophobicContact CD1-CD2 3.88Å; L65-V114 HydrophobicContact CD1-CB 4.44Å; L65-V114 HydrophobicContact CD1-CG1 3.82Å; L65-V114 HydrophobicContact CD1-CG2 3.64Å; L65-R122 HydrophobicContact CD2-CB 4.19Å; L65-R122 WeakPolarHBondContact CD2-O 3.33Å; L65-R124 PolarHBondContact O-NH1 2.84Å
66Y92.6Very high92.1Very high15 Ų1532.7 Ų32.76%0.05920%0.196CC..Hα-helixtrans-67.2-41.3169.9-170.5-77.7000112.4V6 A62 R63 H64 R124 Q129 L132 D133V6-Y66 HydrophobicContact CB-CD1 3.92Å; V6-Y66 HydrophobicContact CB-CE1 3.76Å; V6-Y66 HydrophobicContact CB-CE2 4.31Å; V6-Y66 HydrophobicContact CB-CG 4.31Å; V6-Y66 HydrophobicContact CG1-CD1 4.3Å; V6-Y66 HydrophobicContact CG2-CD1 4.25Å; V6-Y66 HydrophobicContact CG2-CD2 3.95Å; V6-Y66 HydrophobicContact CG2-CE1 4.11Å; V6-Y66 HydrophobicContact CG2-CE2 3.72Å; V6-Y66 HydrophobicContact CG2-CG 4.19Å; A62-Y66 PolarHBondContact O-N 2.86Å; R63-Y66 WeakPolarHBondContact O-CA 3.42Å; R63-Y66 VanDerWaalsContact O-CB 3.29Å; R63-Y66 WeakPolarHBondContact O-CB 3.31Å; R63-Y66 PolarHBondContact O-N 3.05Å; R63-Y66 VanDerWaalsContact O-N 3.11Å; H64-Y66 VanDerWaalsContact C-N 3.26Å; H64-Y66 PolarHBondContact O-N 3.22Å; Y66-R124 VanDerWaalsContact C-NH1 3.28Å; Y66-R124 VanDerWaalsContact O-CZ 3.25Å; Y66-R124 PolarHBondContact O-NH1 2.68Å; Y66-Q129 HydrophobicContact CE2-CG 3.95Å; Y66-L132 HydrophobicContact CD2-CB 4.22Å; Y66-L132 HydrophobicContact CD2-CD1 3.75Å; Y66-L132 HydrophobicContact CE2-CB 4.45Å; Y66-L132 HydrophobicContact CG-CD1 4.39Å; Y66-D133 VanDerWaalsContact CE2-OD1 3.31Å; Y66-D133 WeakPolarHBondContact CE2-OD1 3.39Å; Y66-D133 VanDerWaalsContact CZ-OD1 3.28Å; Y66-D133 PolarHBondContact OH-OD1 3.4Å
67L91.2Very high92.2Very high79 Ų7930.4 Ų30.441%0.41418%0.182SC..Hα-helixtrans-80.9-44.4-179.8-64.4177.2000112.4K7 R63 H64K7-L67 HydrophobicContact CD-CD2 4.48Å; K7-L67 HydrophobicContact CG-CD2 3.89Å; R63-L67 PolarHBondContact O-N 3.01Å; R63-L67 VanDerWaalsContact O-N 3.1Å; H64-L67 PolarHBondContact O-N 3.41Å
68R88.6Confident92.3Very high158 Ų15834.7 Ų34.760%0.59620%0.202SC*.SBendtrans-133.694.4-176.9-167.9174.6-172-95.9-0.6109.7H64H64-R68 CarbonylContact O-C 3.57Å; H64-R68 PolarHBondContact O-N 3.37Å
69G85.8Confident92.3Very high36 Ų3637.9 Ų37.937%0.37122%0.218SC..  trans-65.7175.3172.400000112.7A71G69-A71 VanDerWaalsContact C-N 3.26Å; G69-A71 PolarHBondContact O-N 2.87Å
70G87.3Confident92.3Very high38 Ų3839.5 Ų39.539%0.39223%0.225SC..SBendtrans71.517.6179.600000113.8R122G70-R122 WeakPolarHBondContact CA-O 3.43Å; G70-R122 PolarHBondContact N-O 2.93Å
71A89.1Confident92.2Very high1 Ų138.9 Ų38.91%0.00822%0.224CC..  trans-89.1120.1-17600000111.9L65 G69 M76 R122L65-A71 HydrophobicContact CD2-CB 3.87Å; G69-A71 VanDerWaalsContact C-N 3.26Å; G69-A71 PolarHBondContact O-N 2.87Å; A71-M76 HydrophobicContact CB-CE 3.71Å; A71-R122 PolarHBondContact N-O 3.23Å; A71-R122 PolarHBondContact O-N 2.9Å
72G91Very high92.3Very high22 Ų2239.7 Ų39.723%0.22723%0.234CC..  trans-88.6-177.617300000114.2G74 S75 M76G72-G74 VanDerWaalsContact C-N 3.31Å; G72-G74 PolarHBondContact O-N 3.38Å; G72-S75 WeakPolarHBondContact O-CB 3.42Å; G72-S75 PolarHBondContact O-N 3.39Å; G72-M76 PolarHBondContact O-N 3.27Å; G72-M76 VanDerWaalsContact O-N 3.15Å
73V93.1Very high92.3Very high28 Ų2848.1 Ų48.117%0.1727%0.265CS..Hα-helixtrans-57.4-43.6177.9-176.40000111.2S75 M76 T77 K98 A101 R102 L105 R122V73-S75 VanDerWaalsContact C-N 3.34Å; V73-S75 PolarHBondContact O-N 2.66Å; V73-M76 PolarHBondContact O-N 2.84Å; V73-T77 WeakPolarHBondContact O-CG2 3.49Å; V73-T77 PolarHBondContact O-N 3.1Å; V73-K98 HydrophobicContact CG1-CB 4.33Å; V73-A101 HydrophobicContact CG1-CB 3.95Å; V73-R102 HydrophobicContact CG1-CB 4.41Å; V73-R102 HydrophobicContact CG2-CB 4.28Å; V73-L105 HydrophobicContact CG2-CD1 4.12Å; V73-R122 VanDerWaalsContact CG2-NH1 3.28Å
74G92.9Very high92.4Very high43 Ų4348.9 Ų48.944%0.44327%0.269SS..Hα-helixtrans-61.2-40179.900000113.3G72 T77 K78G72-G74 VanDerWaalsContact C-N 3.31Å; G72-G74 PolarHBondContact O-N 3.38Å; G74-T77 PolarHBondContact O-N 3.3Å; G74-T77 PolarHBondContact O-OG1 3.12Å; G74-K78 PolarHBondContact O-N 2.93Å
75S92.9Very high92.4Very high34 Ų3456 Ų5624%0.23829%0.294CS..Hα-helixtrans-62.3-47.1174.8-174.40000110.9G72 V73 T77 K78 I79G72-S75 WeakPolarHBondContact O-CB 3.42Å; G72-S75 PolarHBondContact O-N 3.39Å; V73-S75 VanDerWaalsContact C-N 3.34Å; V73-S75 PolarHBondContact O-N 2.66Å; S75-T77 VanDerWaalsContact C-N 3.29Å; S75-T77 PolarHBondContact O-N 2.93Å; S75-K78 WeakPolarHBondContact O-CA 3.49Å; S75-K78 VanDerWaalsContact O-CB 3.27Å; S75-K78 WeakPolarHBondContact O-CB 3.42Å; S75-K78 PolarHBondContact O-N 3.46Å; S75-I79 WeakPolarHBondContact O-CD1 3.29Å; S75-I79 WeakPolarHBondContact O-CG1 3.14Å; S75-I79 PolarHBondContact O-N 3.28Å
76M93.8Very high92.4Very high1 Ų158.5 Ų58.51%0.00531%0.308CS..Hα-helixtrans-59.5-38.3176.9-66.6-61.4169.400112.4T61 H64 L65 A71 G72 V73 K78 I79 Y80 A101 L105T61-M76 HydrophobicContact CG2-CE 3.8Å; T61-M76 HydrophobicContact CG2-CG 4.48Å; T61-M76 HydrophobicContact CG2-SD 3.88Å; H64-M76 HydrophobicContact CB-CE 4.37Å; L65-M76 HydrophobicContact CD2-CE 3.96Å; L65-M76 HydrophobicContact CG-CE 3.91Å; A71-M76 HydrophobicContact CB-CE 3.71Å; G72-M76 PolarHBondContact O-N 3.27Å; G72-M76 VanDerWaalsContact O-N 3.15Å; V73-M76 PolarHBondContact O-N 2.84Å; M76-K78 PolarHBondContact O-N 3.28Å; M76-I79 PolarHBondContact O-N 3.25Å; M76-I79 HydrophobicContact SD-CD1 3.9Å; M76-Y80 HydrophobicContact CB-CD2 4.31Å; M76-Y80 HydrophobicContact CB-CE2 4.39Å; M76-Y80 WeakPolarHBondContact O-CB 3.29Å; M76-Y80 WeakPolarHBondContact O-CD2 3.35Å; M76-Y80 PolarHBondContact O-N 3.35Å; M76-Y80 HydrophobicContact SD-CE2 4.1Å; M76-A101 HydrophobicContact CB-CB 4.01Å; M76-L105 HydrophobicContact CG-CD1 4.24Å
77T94.5Very high92.5Very high4 Ų460.3 Ų60.33%0.02533%0.331CS..Hα-helixtrans-69.4-19.8174.366.30000114.2V73 G74 S75 G81 G96 K98 A101V73-T77 WeakPolarHBondContact O-CG2 3.49Å; V73-T77 PolarHBondContact O-N 3.1Å; G74-T77 PolarHBondContact O-N 3.3Å; G74-T77 PolarHBondContact O-OG1 3.12Å; S75-T77 VanDerWaalsContact C-N 3.29Å; S75-T77 PolarHBondContact O-N 2.93Å; T77-G81 PolarHBondContact O-N 3.31Å; T77-G96 WeakPolarHBondContact CG2-O 3.34Å; T77-G96 PolarHBondContact O-N 3.11Å; T77-K98 HydrophobicContact CG2-CB 4.36Å; T77-K98 HydrophobicContact CG2-CG 3.77Å; T77-A101 HydrophobicContact CG2-CB 4.27Å
78K94.3Very high92.7Very high145 Ų14563.7 Ų63.763%0.6336%0.355SS*.Hα-helixtrans-77.2-48171.9-159.1176.3179.2-177.90110.4G74 S75 M76 Y80 G81 R95G74-K78 PolarHBondContact O-N 2.93Å; S75-K78 WeakPolarHBondContact O-CA 3.49Å; S75-K78 VanDerWaalsContact O-CB 3.27Å; S75-K78 WeakPolarHBondContact O-CB 3.42Å; S75-K78 PolarHBondContact O-N 3.46Å; M76-K78 PolarHBondContact O-N 3.28Å; K78-Y80 VanDerWaalsContact C-N 3.32Å; K78-Y80 PolarHBondContact O-N 3.19Å; K78-G81 PolarHBondContact O-N 2.94Å; K78-G81 VanDerWaalsContact O-N 3.08Å; K78-R95 VanDerWaalsContact CB-NH1 3.29Å
79I93.7Very high93.1Very high67 Ų6762.4 Ų62.434%0.34436%0.357SS..Hα-helixtrans-60-45.3179.9-64.8152000110.6H64 S75 M76 G81H64-I79 WeakPolarHBondContact CE1-CD1 3.39Å; H64-I79 WeakPolarHBondContact NE2-CD1 3.41Å; S75-I79 WeakPolarHBondContact O-CD1 3.29Å; S75-I79 WeakPolarHBondContact O-CG1 3.14Å; S75-I79 PolarHBondContact O-N 3.28Å; M76-I79 PolarHBondContact O-N 3.25Å; M76-I79 HydrophobicContact SD-CD1 3.9Å; I79-G81 VanDerWaalsContact C-N 3.26Å; I79-G81 PolarHBondContact O-N 2.92Å
80Y94.2Very high93.6Very high34 Ų3465.4 Ų65.413%0.13337%0.37CS..THydrogen-bonded Turntrans-92.417.2178.4-55.9-50000113.3R57 S60 T61 M76 K78R57-Y80 VanDerWaalsContact NH1-CB 3.3Å; R57-Y80 VanDerWaalsContact NH1-CE1 3.35Å; S60-Y80 WeakPolarHBondContact CB-OH 3.41Å; S60-Y80 PolarHBondContact OG-OH 3.32Å; T61-Y80 WeakPolarHBondContact CA-OH 3.41Å; T61-Y80 PolarHBondContact N-OH 2.78Å; T61-Y80 VanDerWaalsContact N-OH 3.13Å; T61-Y80 PolarHBondContact OG1-OH 3.13Å; M76-Y80 HydrophobicContact CB-CD2 4.31Å; M76-Y80 HydrophobicContact CB-CE2 4.39Å; M76-Y80 WeakPolarHBondContact O-CB 3.29Å; M76-Y80 WeakPolarHBondContact O-CD2 3.35Å; M76-Y80 PolarHBondContact O-N 3.35Å; M76-Y80 HydrophobicContact SD-CE2 4.1Å; K78-Y80 VanDerWaalsContact C-N 3.32Å; K78-Y80 PolarHBondContact O-N 3.19Å
81G93.9Very high94Very high26 Ų2666.1 Ų66.127%0.26837%0.369SS..  trans-73.8175.7167.700000111.3T77 K78 I79 S94T77-G81 PolarHBondContact O-N 3.31Å; K78-G81 PolarHBondContact O-N 2.94Å; K78-G81 VanDerWaalsContact O-N 3.08Å; I79-G81 VanDerWaalsContact C-N 3.26Å; I79-G81 PolarHBondContact O-N 2.92Å; G81-S94 CarbonylContact C-O 3.53Å; G81-S94 WeakPolarHBondContact CA-O 3.37Å
82G95.1Very high94.3Very high21 Ų2171.9 Ų71.922%0.21640%0.395CS..EExtended strand (participates in β ladder)trans-172.3179.6-179.800000112.7H43 S94H43-G82 PolarHBondContact CE1-N 3.32Å; G82-S94 PolarHBondContact N-O 3.1Å; G82-S94 PolarHBondContact O-N 3.21Å
83R94.6Very high94.6Very high181 Ų18177 Ų7768%0.68342%0.422SS*.EExtended strand (participates in β ladder)trans-75.3127.5175.8-172.117674.2132-4.7110.2
84Q94.9Very high94.6Very high47 Ų4775.9 Ų75.922%0.2242%0.415CS..EExtended strand (participates in β ladder)trans-101.5124.6171.7-173172.4-29.300109.5H43 N86 S91 H92H43-Q84 HydrophobicContact CB-CB 3.51Å; H43-Q84 HydrophobicContact CB-CG 3.73Å; Q84-N86 PolarHBondContact NE2-OD1 2.66Å; Q84-N86 VanDerWaalsContact NE2-OD1 3.14Å; Q84-S91 VanDerWaalsContact O-CA 3.25Å; Q84-S91 WeakPolarHBondContact O-CA 3.44Å; Q84-S91 WeakPolarHBondContact O-CB 3.44Å; Q84-H92 PolarHBondContact N-O 3.4Å; Q84-H92 PolarHBondContact O-N 3.42Å; Q84-H92 VanDerWaalsContact O-N 3.16Å
85R94.2Very high94.7Very high194 Ų19480 Ų8073%0.73242%0.418SS*.EExtended strand (participates in β ladder)trans-82.4130.6167.9-175.8178.3173.5170.7-3.4108
86N93.4Very high94.7Very high54 Ų5478.9 Ų78.929%0.28941%0.411SS..EExtended strand (participates in β ladder)trans-109.743.2-178.6-66-40.7000111Q84 V88 M89 P90Q84-N86 PolarHBondContact NE2-OD1 2.66Å; Q84-N86 VanDerWaalsContact NE2-OD1 3.14Å; N86-V88 PolarHBondContact O-N 3.48Å; N86-V88 VanDerWaalsContact O-N 3.07Å; N86-M89 HydrophobicContact CB-CB 3.9Å; N86-M89 PolarHBondContact O-N 2.97Å; N86-M89 VanDerWaalsContact O-N 3.12Å; N86-P90 PolarHBondContact ND2-O 2.93Å; N86-P90 VanDerWaalsContact ND2-O 3.17Å
87G93.9Very high94.7Very high53 Ų5380.7 Ų80.755%0.54642%0.424SS..THydrogen-bonded Turntrans64.1-108.9-175.500000111.9
88V96.1Very high94.6Very high150 Ų15087 Ų8791%0.90945%0.451SS*.THydrogen-bonded Turntrans-85.9-15.3-179.9-60.60000113.6N86N86-V88 PolarHBondContact O-N 3.48Å; N86-V88 VanDerWaalsContact O-N 3.07Å
89M95.8Very high94.4Very high132 Ų13283 Ų8365%0.6544%0.441SS*.EExtended strand (participates in β ladder)trans-86.2157.5178.8-65.4180-178.700112N86N86-M89 HydrophobicContact CB-CB 3.9Å; N86-M89 PolarHBondContact O-N 2.97Å; N86-M89 VanDerWaalsContact O-N 3.12Å
90P96.8Very high94.3Very high98 Ų9880.3 Ų80.364%0.63643%0.428SS*.EExtended strand (participates in β ladder)trans-52.7148.3175.3-27.535.5000113.8N86 H92N86-P90 PolarHBondContact ND2-O 2.93Å; N86-P90 VanDerWaalsContact ND2-O 3.17Å; P90-H92 PolarHBondContact O-CD2 2.96Å
91S96.8Very high94.3Very high53 Ų5379.1 Ų79.137%0.37143%0.425SS..EExtended strand (participates in β ladder)trans-77.6135.9178.764.60000111.6Q84Q84-S91 VanDerWaalsContact O-CA 3.25Å; Q84-S91 WeakPolarHBondContact O-CA 3.44Å; Q84-S91 WeakPolarHBondContact O-CB 3.44Å
92H95.4Very high94.2Very high122 Ų12282.8 Ų82.857%0.56543%0.431SS*.EExtended strand (participates in β ladder)trans-124.3161.5178.5-69.4-73.9000112Q84 P90Q84-H92 PolarHBondContact N-O 3.4Å; Q84-H92 PolarHBondContact O-N 3.42Å; Q84-H92 VanDerWaalsContact O-N 3.16Å; P90-H92 PolarHBondContact O-CD2 2.96Å
93V95.5Very high94.1Very high130 Ų13087.6 Ų87.679%0.78844%0.442SS*.EExtended strand (participates in β ladder)trans-77128175.5178.20000110.1
94S95Very high94Very high4 Ų479 Ų793%0.02841%0.41CS..EExtended strand (participates in β ladder)trans-112141.3172.4173.80000111.1K42 G81 G82K42-S94 WeakPolarHBondContact CE-OG 3.39Å; K42-S94 VanDerWaalsContact CG-OG 3.22Å; K42-S94 WeakPolarHBondContact CG-OG 3.31Å; G81-S94 CarbonylContact C-O 3.53Å; G81-S94 WeakPolarHBondContact CA-O 3.37Å; G82-S94 PolarHBondContact N-O 3.1Å; G82-S94 PolarHBondContact O-N 3.21Å
95R95Very high93.9Very high131 Ų13176.8 Ų76.849%0.49440%0.399SS..PPolyproline II helixtrans-68.7157.9168.2-60.7-64.1-179.41291.6111.7K78K78-R95 VanDerWaalsContact CB-NH1 3.29Å
96G92.6Very high93.8Very high9 Ų971.3 Ų71.39%0.09338%0.382CS..PPolyproline II helixtrans-78.2172.6171.200000113.6V41 T77 K98V41-G96 VanDerWaalsContact CG1-CA 3.48Å; T77-G96 WeakPolarHBondContact CG2-O 3.34Å; T77-G96 PolarHBondContact O-N 3.11Å; G96-K98 PolarHBondContact O-N 2.93Å
97S92.3Very high93.8Very high40 Ų4069.1 Ų69.128%0.2837%0.372SS..PPolyproline II helixtrans-68.7125.8179.71780000112L40 S99 V100 A101L40-S97 WeakPolarHBondContact O-CB 3.32Å; S97-S99 VanDerWaalsContact C-N 3.35Å; S97-S99 PolarHBondContact OG-N 2.8Å; S97-V100 PolarHBondContact OG-N 3.36Å; S97-A101 WeakPolarHBondContact O-CB 3.39Å; S97-A101 PolarHBondContact O-N 3Å
98K93.3Very high93.7Very high137 Ų13766.6 Ų66.660%0.59635%0.346SS*.Hα-helixtrans-69-35174.6-65.5178.1-176.4177.10111.5V73 T77 G96 R102V73-K98 HydrophobicContact CG1-CB 4.33Å; T77-K98 HydrophobicContact CG2-CB 4.36Å; T77-K98 HydrophobicContact CG2-CG 3.77Å; G96-K98 PolarHBondContact O-N 2.93Å; K98-R102 VanDerWaalsContact O-CB 3.27Å; K98-R102 WeakPolarHBondContact O-CB 3.44Å; K98-R102 PolarHBondContact O-N 3.13Å
99S91.2Very high93.5Very high61 Ų6161.7 Ų61.743%0.42731%0.313SS..Hα-helixtrans-66.5-47.8-178.5-60.10000111.3S97 R102 R103S97-S99 VanDerWaalsContact C-N 3.35Å; S97-S99 PolarHBondContact OG-N 2.8Å; S99-R102 PolarHBondContact O-N 2.69Å; S99-R103 WeakPolarHBondContact O-CG 3.38Å; S99-R103 PolarHBondContact O-N 2.86Å
100V91.3Very high93.2Very high9 Ų958.5 Ų58.56%0.05531%0.314CS..Hα-helixtrans-60-51.7175.31770000110.6W33 W53 R57 S97 R102 R103 V104W33-V100 HydrophobicContact CH2-CG2 3.84Å; W33-V100 HydrophobicContact CZ3-CG2 3.93Å; W53-V100 HydrophobicContact CH2-CG1 3.92Å; W53-V100 HydrophobicContact CH2-CG2 4.26Å; W53-V100 HydrophobicContact CZ3-CG1 3.7Å; R57-V100 HydrophobicContact CG-CG1 4.45Å; S97-V100 PolarHBondContact OG-N 3.36Å; V100-R102 VanDerWaalsContact C-N 3.29Å; V100-R102 PolarHBondContact O-N 2.97Å; V100-R103 PolarHBondContact O-N 3.18Å; V100-V104 HydrophobicContact CG1-CG2 4.29Å; V100-V104 VanDerWaalsContact O-CG2 3.31Å; V100-V104 WeakPolarHBondContact O-CG2 2.91Å; V100-V104 PolarHBondContact O-N 2.87Å
101A92.6Very high92.8Very high9 Ų955.4 Ų55.47%0.07429%0.292CS..Hα-helixtrans-58.5-39.8-179.800000112.6V73 M76 T77 S97 L105V73-A101 HydrophobicContact CG1-CB 3.95Å; M76-A101 HydrophobicContact CB-CB 4.01Å; T77-A101 HydrophobicContact CG2-CB 4.27Å; S97-A101 WeakPolarHBondContact O-CB 3.39Å; S97-A101 PolarHBondContact O-N 3Å; A101-L105 WeakPolarHBondContact O-CD1 3.14Å; A101-L105 VanDerWaalsContact O-CG 3.29Å; A101-L105 WeakPolarHBondContact O-CG 3.02Å; A101-L105 PolarHBondContact O-N 3.25Å
102R93.1Very high92.5Very high104 Ų10459.9 Ų59.939%0.39231%0.305SS..Hα-helixtrans-65.4-47.4176.9-172.7-174.5-60.3106.9-5.2111.9V73 K98 S99 V100 L105 Q106V73-R102 HydrophobicContact CG1-CB 4.41Å; V73-R102 HydrophobicContact CG2-CB 4.28Å; K98-R102 VanDerWaalsContact O-CB 3.27Å; K98-R102 WeakPolarHBondContact O-CB 3.44Å; K98-R102 PolarHBondContact O-N 3.13Å; S99-R102 PolarHBondContact O-N 2.69Å; V100-R102 VanDerWaalsContact C-N 3.29Å; V100-R102 PolarHBondContact O-N 2.97Å; R102-L105 PolarHBondContact O-N 2.98Å; R102-Q106 WeakPolarHBondContact O-CG 3.17Å; R102-Q106 PolarHBondContact O-N 2.64Å
103R92.6Very high92.2Very high122 Ų12254.6 Ų54.646%0.4628%0.28SS..Hα-helixtrans-64.3-40.5-179.1-69-53.5-176.5171.13.4112.2P31 W33 F54 S99 V100 L105 Q106 A107P31-R103 HydrophobicContact CB-CG 4.41Å; P31-R103 HydrophobicContact CG-CB 4.29Å; P31-R103 HydrophobicContact CG-CG 4.41Å; W33-R103 HydrophobicContact CH2-CG 4.34Å; W33-R103 HydrophobicContact CZ2-CG 3.71Å; F54-R103 HydrophobicContact CE2-CB 4.49Å; F54-R103 HydrophobicContact CZ-CB 4.4Å; S99-R103 WeakPolarHBondContact O-CG 3.38Å; S99-R103 PolarHBondContact O-N 2.86Å; V100-R103 PolarHBondContact O-N 3.18Å; R103-L105 PolarHBondContact O-N 3Å; R103-Q106 PolarHBondContact O-N 3.36Å; R103-A107 WeakPolarHBondContact O-CB 3.32Å; R103-A107 PolarHBondContact O-N 3.06Å
104V93.2Very high92.1Very high0 Ų048.7 Ų48.70%025%0.245CC..Hα-helixtrans-60.9-45.5176.1171.80000111.2F54 R57 A58 T61 V100 A107 L108F54-V104 HydrophobicContact CD2-CG2 4.1Å; F54-V104 HydrophobicContact CE2-CG2 3.47Å; F54-V104 VanDerWaalsContact CE2-CG2 3.47Å; F54-V104 HydrophobicContact CZ-CG2 3.79Å; R57-V104 HydrophobicContact CB-CG2 4.43Å; R57-V104 HydrophobicContact CG-CG2 3.81Å; A58-V104 HydrophobicContact CB-CG1 4.09Å; T61-V104 HydrophobicContact CG2-CG1 4.15Å; V100-V104 HydrophobicContact CG1-CG2 4.29Å; V100-V104 VanDerWaalsContact O-CG2 3.31Å; V100-V104 WeakPolarHBondContact O-CG2 2.91Å; V100-V104 PolarHBondContact O-N 2.87Å; V104-A107 PolarHBondContact O-N 3.45Å; V104-L108 HydrophobicContact CG1-CD1 4.19Å; V104-L108 WeakPolarHBondContact O-CG 3.39Å; V104-L108 PolarHBondContact O-N 3.25Å
105L92.8Very high91.9Very high0 Ų052.2 Ų52.20%026%0.26CS..Hα-helixtrans-66.6-40.4178.9-68168.1000112.1T61 L65 V73 M76 A101 R102 R103 A107 L108 E109 R122T61-L105 HydrophobicContact CG2-CD2 3.59Å; T61-L105 HydrophobicContact CG2-CG 4.35Å; L65-L105 HydrophobicContact CD1-CD2 3.88Å; V73-L105 HydrophobicContact CG2-CD1 4.12Å; M76-L105 HydrophobicContact CG-CD1 4.24Å; A101-L105 WeakPolarHBondContact O-CD1 3.14Å; A101-L105 VanDerWaalsContact O-CG 3.29Å; A101-L105 WeakPolarHBondContact O-CG 3.02Å; A101-L105 PolarHBondContact O-N 3.25Å; R102-L105 PolarHBondContact O-N 2.98Å; R103-L105 PolarHBondContact O-N 3Å; L105-A107 VanDerWaalsContact C-N 3.34Å; L105-L108 PolarHBondContact O-N 3.21Å; L105-E109 WeakPolarHBondContact O-CG 3.29Å; L105-E109 PolarHBondContact O-N 3.21Å; L105-R122 VanDerWaalsContact CD1-NH1 3.32Å
106Q92.5Very high91.8Very high79 Ų7953 Ų5337%0.36927%0.268SS..Hα-helixtrans-63.7-38.2173.9-73.1171.9-23.700112.4R102 R103 E109 G110R102-Q106 WeakPolarHBondContact O-CG 3.17Å; R102-Q106 PolarHBondContact O-N 2.64Å; R103-Q106 PolarHBondContact O-N 3.36Å; Q106-E109 PolarHBondContact O-N 3.34Å; Q106-G110 PolarHBondContact O-N 3Å
107A92Very high91.6Very high9 Ų955.1 Ų55.17%0.07428%0.277CS..Hα-helixtrans-66.3-40.5176.700000111.6L28 F54 R103 V104 L105 G110 L111L28-A107 HydrophobicContact CD2-CB 4.34Å; L28-A107 HydrophobicContact CG-CB 4.25Å; F54-A107 HydrophobicContact CE1-CB 4.33Å; F54-A107 HydrophobicContact CZ-CB 4.5Å; R103-A107 WeakPolarHBondContact O-CB 3.32Å; R103-A107 PolarHBondContact O-N 3.06Å; V104-A107 PolarHBondContact O-N 3.45Å; L105-A107 VanDerWaalsContact C-N 3.34Å; A107-G110 PolarHBondContact O-N 3.31Å; A107-L111 PolarHBondContact O-N 2.85Å
108L91.6Very high91.1Very high0 Ų062.4 Ų62.40%031%0.306CS..Hα-helixtrans-68.5-34.1174.7-70.2172.9000112.9A58 T61 A62 V104 L105 L111 K112 M113 V114A58-L108 HydrophobicContact CB-CD2 4.3Å; T61-L108 HydrophobicContact CG2-CD1 4.23Å; A62-L108 HydrophobicContact CB-CD1 4.21Å; A62-L108 HydrophobicContact CB-CD2 4.4Å; V104-L108 HydrophobicContact CG1-CD1 4.19Å; V104-L108 WeakPolarHBondContact O-CG 3.39Å; V104-L108 PolarHBondContact O-N 3.25Å; L105-L108 PolarHBondContact O-N 3.21Å; L108-L111 PolarHBondContact O-N 3.36Å; L108-K112 PolarHBondContact O-N 3.42Å; L108-M113 HydrophobicContact CD2-SD 4.48Å; L108-M113 PolarHBondContact O-N 2.98Å; L108-V114 HydrophobicContact CB-CB 4.11Å; L108-V114 HydrophobicContact CB-CG2 3.82Å; L108-V114 HydrophobicContact CD1-CG2 4.25Å
109E92Very high90.4Very high47 Ų4759.6 Ų59.622%0.2232%0.317CS..Hα-helixtrans-63.4-43.4170.1-76168.9-157.500111.2L105 Q106 L111 K112 V114 R122L105-E109 WeakPolarHBondContact O-CG 3.29Å; L105-E109 PolarHBondContact O-N 3.21Å; Q106-E109 PolarHBondContact O-N 3.34Å; E109-L111 PolarHBondContact O-N 3.39Å; E109-K112 PolarHBondContact O-N 3.48Å; E109-V114 WeakPolarHBondContact CA-O 3.48Å; E109-V114 HydrophobicContact CG-CG1 4.46Å; E109-R122 IonicContact OE1-CZ 3.2Å; E109-R122 IonicContact OE1-NE 2.68Å; E109-R122 PolarHBondContact OE1-NE 3.21Å; E109-R122 IonicContact OE1-NH2 2.84Å; E109-R122 PolarHBondContact OE1-NH2 2.92Å; E109-R122 IonicContact OE2-NH2 3.97Å
110G89.8Confident90Very high65 Ų6558.6 Ų58.667%0.6732%0.315SS*.Hα-helixtrans-61.5-27.9175.900000113.8Q106 A107 K112Q106-G110 PolarHBondContact O-N 3Å; A107-G110 PolarHBondContact O-N 3.31Å; G110-K112 VanDerWaalsContact C-N 3.3Å
111L88.5Confident89.9Confident32 Ų3259.5 Ų59.517%0.16833%0.327CS..THydrogen-bonded Turntrans-84.61173.6-69.4177.6000113.8L22 K27 L28 A107 L108 E109 M113L22-L111 HydrophobicContact CD2-CD1 3.93Å; K27-L111 HydrophobicContact CB-CD2 3.44Å; K27-L111 VanDerWaalsContact CB-CD2 3.44Å; L28-L111 HydrophobicContact CB-CD1 3.98Å; L28-L111 HydrophobicContact CD1-CD1 3.77Å; L28-L111 HydrophobicContact CG-CD1 4.04Å; A107-L111 PolarHBondContact O-N 2.85Å; L108-L111 PolarHBondContact O-N 3.36Å; E109-L111 PolarHBondContact O-N 3.39Å; L111-M113 HydrophobicContact CB-CG 4.1Å; L111-M113 PolarHBondContact O-N 2.93Å; L111-M113 VanDerWaalsContact O-N 3.11Å
112K90.7Very high89.8Confident148 Ų14860.4 Ų60.464%0.64333%0.328SS*.THydrogen-bonded Turntrans56.320.9-175.4-56.8-176.3177-176.20114.3L108 E109 G110 T125L108-K112 PolarHBondContact O-N 3.42Å; E109-K112 PolarHBondContact O-N 3.48Å; G110-K112 VanDerWaalsContact C-N 3.3Å; K112-T125 WeakPolarHBondContact O-CG2 3.45Å; K112-T125 PolarHBondContact O-OG1 3.36Å
113M89.3Confident89.7Confident10 Ų1058.6 Ų58.65%0.04932%0.323CS..SBendtrans-83.4-24.3174.4-64.5-169.980.500112.2L22 L108 L111 T125 D131 L132L22-M113 HydrophobicContact CD2-SD 4.08Å; L108-M113 HydrophobicContact CD2-SD 4.48Å; L108-M113 PolarHBondContact O-N 2.98Å; L111-M113 HydrophobicContact CB-CG 4.1Å; L111-M113 PolarHBondContact O-N 2.93Å; L111-M113 VanDerWaalsContact O-N 3.11Å; M113-T125 PolarHBondContact O-N 2.98Å; M113-T125 VanDerWaalsContact O-N 3.1Å; M113-T125 PolarHBondContact O-OG1 2.81Å; M113-D131 HydrophobicContact CE-CB 4.05Å; M113-L132 HydrophobicContact CE-CD2 4.35Å; M113-L132 HydrophobicContact CE-CG 4.31Å
114V92.3Very high89.7Confident7 Ų756.3 Ų56.34%0.04232%0.315CS..EExtended strand (participates in β ladder)trans-132.2143.2-176.6175.30000108.8L65 L108 E109 R122 K123L65-V114 HydrophobicContact CD1-CB 4.44Å; L65-V114 HydrophobicContact CD1-CG1 3.82Å; L65-V114 HydrophobicContact CD1-CG2 3.64Å; L108-V114 HydrophobicContact CB-CB 4.11Å; L108-V114 HydrophobicContact CB-CG2 3.82Å; L108-V114 HydrophobicContact CD1-CG2 4.25Å; E109-V114 WeakPolarHBondContact CA-O 3.48Å; E109-V114 HydrophobicContact CG-CG1 4.46Å; V114-R122 HydrophobicContact CG1-CB 3.65Å; V114-R122 HydrophobicContact CG1-CG 3.84Å; V114-K123 CarbonylContact C-O 3.6Å; V114-K123 WeakPolarHBondContact CA-O 3.35Å; V114-K123 WeakPolarHBondContact CG1-O 3.42Å
115E92.1Very high89.7Confident77 Ų7757 Ų5736%0.3632%0.319SS..EExtended strand (participates in β ladder)trans-129.2163.7174.763.4-175176.500111.1R122 K123 T125E115-R122 CarbonylContact O-C 3.58Å; E115-R122 VanDerWaalsContact O-CA 3.28Å; E115-R122 WeakPolarHBondContact O-CA 3.28Å; E115-K123 HydrophobicContact CG-CD 4.42Å; E115-K123 HydrophobicContact CG-CG 3.64Å; E115-K123 PolarHBondContact N-O 3.29Å; E115-K123 PolarHBondContact O-N 2.82Å; E115-K123 VanDerWaalsContact O-O 3.12Å; E115-K123 WeakPolarHBondContact OE1-CE 3.33Å; E115-T125 HydrophobicContact CB-CG2 3.74Å; E115-T125 HydrophobicContact CG-CG2 3.82Å
116K91.6Very high89.7Confident149 Ų14961.1 Ų61.165%0.64835%0.346SS*.EExtended strand (participates in β ladder)trans-75138172.7-65.3179.7-176173.90108.9
117D88.4Confident89.6Confident53 Ų5362.2 Ų62.228%0.28335%0.351SS..  trans-90.9151175.1-160.113.1000111.2G119 G120 G121 K123D117-G119 VanDerWaalsContact C-N 3.32Å; D117-G119 PolarHBondContact O-N 3.45Å; D117-G120 PolarHBondContact O-N 3.01Å; D117-G120 VanDerWaalsContact O-N 3.11Å; D117-G121 PolarHBondContact N-O 3.28Å; D117-K123 HydrophobicContact CB-CB 4.43Å; D117-K123 HydrophobicContact CB-CD 4.12Å; D117-K123 HydrophobicContact CB-CG 4.16Å; D117-K123 WeakPolarHBondContact OD1-CD 3.41Å; D117-K123 WeakPolarHBondContact OD1-CE 3.27Å; D117-K123 IonicContact OD1-NZ 2.83Å; D117-K123 PolarHBondContact OD1-NZ 3.3Å
118Q82.1Confident89.5Confident192 Ų19261.8 Ų61.890%0.89735%0.347SS*.THydrogen-bonded Turntrans-65.9-36.7-179.4-68.6176.4-6.300111.4G120Q118-G120 PolarHBondContact O-N 3.36Å
119G78.8Confident89.6Confident79 Ų7965.2 Ų65.281%0.81436%0.363SS*.THydrogen-bonded Turntrans-77.89.1173.900000114.6D117D117-G119 VanDerWaalsContact C-N 3.32Å; D117-G119 PolarHBondContact O-N 3.45Å
120G83.6Confident89.6Confident39 Ų3972 Ų7240%0.40239%0.387SS..SBendtrans89.3161-176.900000114.1D117 Q118D117-G120 PolarHBondContact O-N 3.01Å; D117-G120 VanDerWaalsContact O-N 3.11Å; Q118-G120 PolarHBondContact O-N 3.36Å
121G87.7Confident89.7Confident29 Ų2971 Ų7130%0.29937%0.366SS..SBendtrans79.1-149.2-174.400000112.7D117D117-G121 PolarHBondContact N-O 3.28Å
122R91.1Very high89.8Confident28 Ų2869.6 Ų69.611%0.10636%0.359CS..EExtended strand (participates in β ladder)trans-136.8147.6-178.4-79.7119.4167.6158.53.1111.7L65 G70 A71 V73 L105 E109 V114 E115L65-R122 HydrophobicContact CD2-CB 4.19Å; L65-R122 WeakPolarHBondContact CD2-O 3.33Å; G70-R122 WeakPolarHBondContact CA-O 3.43Å; G70-R122 PolarHBondContact N-O 2.93Å; A71-R122 PolarHBondContact N-O 3.23Å; A71-R122 PolarHBondContact O-N 2.9Å; V73-R122 VanDerWaalsContact CG2-NH1 3.28Å; L105-R122 VanDerWaalsContact CD1-NH1 3.32Å; E109-R122 IonicContact OE1-CZ 3.2Å; E109-R122 IonicContact OE1-NE 2.68Å; E109-R122 PolarHBondContact OE1-NE 3.21Å; E109-R122 IonicContact OE1-NH2 2.84Å; E109-R122 PolarHBondContact OE1-NH2 2.92Å; E109-R122 IonicContact OE2-NH2 3.97Å; V114-R122 HydrophobicContact CG1-CB 3.65Å; V114-R122 HydrophobicContact CG1-CG 3.84Å; E115-R122 CarbonylContact O-C 3.58Å; E115-R122 VanDerWaalsContact O-CA 3.28Å; E115-R122 WeakPolarHBondContact O-CA 3.28Å
123K90.9Very high90Very high65 Ų6564.3 Ų64.328%0.28334%0.337SS..EExtended strand (participates in β ladder)trans-129.9160.3171.966-179.4175.7-1580110.2V114 E115 D117V114-K123 CarbonylContact C-O 3.6Å; V114-K123 WeakPolarHBondContact CA-O 3.35Å; V114-K123 WeakPolarHBondContact CG1-O 3.42Å; E115-K123 HydrophobicContact CG-CD 4.42Å; E115-K123 HydrophobicContact CG-CG 3.64Å; E115-K123 PolarHBondContact N-O 3.29Å; E115-K123 PolarHBondContact O-N 2.82Å; E115-K123 VanDerWaalsContact O-O 3.12Å; E115-K123 WeakPolarHBondContact OE1-CE 3.33Å; D117-K123 HydrophobicContact CB-CB 4.43Å; D117-K123 HydrophobicContact CB-CD 4.12Å; D117-K123 HydrophobicContact CB-CG 4.16Å; D117-K123 WeakPolarHBondContact OD1-CD 3.41Å; D117-K123 WeakPolarHBondContact OD1-CE 3.27Å; D117-K123 IonicContact OD1-NZ 2.83Å; D117-K123 PolarHBondContact OD1-NZ 3.3Å
124R91.9Very high90.1Very high74 Ų7472.2 Ų72.228%0.27937%0.367SS..EExtended strand (participates in β ladder)trans-71.3146.4172.266.9-155.2176.7-117.212.4110L65 Y66L65-R124 PolarHBondContact O-NH1 2.84Å; Y66-R124 VanDerWaalsContact C-NH1 3.28Å; Y66-R124 VanDerWaalsContact O-CZ 3.25Å; Y66-R124 PolarHBondContact O-NH1 2.68Å
125T93.9Very high90.1Very high15 Ų1572.1 Ų72.19%0.09237%0.366CS..  trans-79.7160.8170.259.80000110K112 M113 E115 Q127 G128 Q129K112-T125 WeakPolarHBondContact O-CG2 3.45Å; K112-T125 PolarHBondContact O-OG1 3.36Å; M113-T125 PolarHBondContact O-N 2.98Å; M113-T125 VanDerWaalsContact O-N 3.1Å; M113-T125 PolarHBondContact O-OG1 2.81Å; E115-T125 HydrophobicContact CB-CG2 3.74Å; E115-T125 HydrophobicContact CG-CG2 3.82Å; T125-Q127 PolarHBondContact O-N 3.35Å; T125-G128 PolarHBondContact O-N 2.83Å; T125-G128 VanDerWaalsContact O-N 3.12Å; T125-G128 PolarHBondContact OG1-N 3.42Å; T125-Q129 PolarHBondContact O-N 3.29Å
126P92.4Very high90.1Very high86 Ų8668.5 Ų68.556%0.55835%0.349SS*.Hα-helixtrans-56.8-35.5171.1-26.135.2000112.7R130P126-R130 WeakPolarHBondContact O-CG 3.27Å; P126-R130 PolarHBondContact O-N 3.25Å
127Q91.1Very high90.1Very high103 Ų10362.8 Ų62.848%0.48133%0.332SS..Hα-helixtrans-65.2-48.4173.5-178.6178.6-6.900111.4T125 Q129 R130 D131T125-Q127 PolarHBondContact O-N 3.35Å; Q127-Q129 PolarHBondContact O-N 2.89Å; Q127-R130 PolarHBondContact O-N 3.08Å; Q127-R130 VanDerWaalsContact O-N 3.13Å; Q127-D131 PolarHBondContact O-N 3.47Å
128G90.8Very high90.2Very high0 Ų065.3 Ų65.30%034%0.343CS..Hα-helixtrans-60.1-35177.900000112.6T125 L132T125-G128 PolarHBondContact O-N 2.83Å; T125-G128 VanDerWaalsContact O-N 3.12Å; T125-G128 PolarHBondContact OG1-N 3.42Å; G128-L132 WeakPolarHBondContact O-CB 3.43Å; G128-L132 WeakPolarHBondContact O-CD1 3.46Å; G128-L132 WeakPolarHBondContact O-CG 3.41Å; G128-L132 PolarHBondContact O-N 3.46Å
129Q92.2Very high90.6Very high71 Ų7156.7 Ų56.733%0.33230%0.303SS..Hα-helixtrans-64.1-48173.3179.1159.7-10.600112.1Y66 T125 Q127 D131 L132 D133Y66-Q129 HydrophobicContact CE2-CG 3.95Å; T125-Q129 PolarHBondContact O-N 3.29Å; Q127-Q129 PolarHBondContact O-N 2.89Å; Q129-D131 VanDerWaalsContact C-N 3.31Å; Q129-D131 PolarHBondContact O-N 3.45Å; Q129-L132 PolarHBondContact O-N 2.95Å; Q129-D133 WeakPolarHBondContact CG-OD2 3.41Å; Q129-D133 PolarHBondContact O-N 3.38Å
130R92.4Very high91.1Very high190 Ų19053.9 Ų53.972%0.71727%0.272SS*.Hα-helixtrans-58.8-42.9176.7-67.1176-158.7-176.84.5112.2P126 Q127 D133 R134P126-R130 WeakPolarHBondContact O-CG 3.27Å; P126-R130 PolarHBondContact O-N 3.25Å; Q127-R130 PolarHBondContact O-N 3.08Å; Q127-R130 VanDerWaalsContact O-N 3.13Å; R130-D133 PolarHBondContact O-N 3.04Å; R130-R134 VanDerWaalsContact O-CB 3.27Å; R130-R134 WeakPolarHBondContact O-CB 3.4Å; R130-R134 PolarHBondContact O-N 2.86Å
131D91.1Very high91.3Very high43 Ų4354.1 Ų54.123%0.2327%0.271CS..Hα-helixtrans-64.3-42.6179.3-70.7-24.9000111.5M113 Q127 Q129 I135M113-D131 HydrophobicContact CE-CB 4.05Å; Q127-D131 PolarHBondContact O-N 3.47Å; Q129-D131 VanDerWaalsContact C-N 3.31Å; Q129-D131 PolarHBondContact O-N 3.45Å; D131-I135 WeakPolarHBondContact O-CD1 3.43Å; D131-I135 VanDerWaalsContact O-CG1 3.31Å; D131-I135 WeakPolarHBondContact O-CG1 3.27Å; D131-I135 PolarHBondContact O-N 3.33Å; D131-I135 VanDerWaalsContact O-N 3.15Å
132L92.3Very high91.1Very high4 Ų455.3 Ų55.32%0.02128%0.278CS..Hα-helixtrans-66.3-44.7177.5-69.8169.8000112V6 F14 L18 A62 Y66 M113 G128 Q129 I135 A136V6-L132 HydrophobicContact CG2-CB 3.87Å; F14-L132 HydrophobicContact CE1-CD2 4.19Å; F14-L132 WeakPolarHBondContact CE2-O 3.15Å; F14-L132 HydrophobicContact CZ-CB 4.28Å; F14-L132 HydrophobicContact CZ-CD2 3.78Å; L18-L132 HydrophobicContact CD1-CD2 3.98Å; L18-L132 HydrophobicContact CD2-CD2 3.46Å; L18-L132 VanDerWaalsContact CD2-CD2 3.46Å; L18-L132 HydrophobicContact CG-CD2 4.39Å; A62-L132 HydrophobicContact CB-CD2 4.41Å; Y66-L132 HydrophobicContact CD2-CB 4.22Å; Y66-L132 HydrophobicContact CD2-CD1 3.75Å; Y66-L132 HydrophobicContact CE2-CB 4.45Å; Y66-L132 HydrophobicContact CG-CD1 4.39Å; M113-L132 HydrophobicContact CE-CD2 4.35Å; M113-L132 HydrophobicContact CE-CG 4.31Å; G128-L132 WeakPolarHBondContact O-CB 3.43Å; G128-L132 WeakPolarHBondContact O-CD1 3.46Å; G128-L132 WeakPolarHBondContact O-CG 3.41Å; G128-L132 PolarHBondContact O-N 3.46Å; Q129-L132 PolarHBondContact O-N 2.95Å; L132-I135 PolarHBondContact O-N 2.98Å; L132-A136 PolarHBondContact O-N 3.21Å
133D93.6Very high90.5Very high36 Ų3657.6 Ų57.619%0.19329%0.292CS..Hα-helixtrans-67.6-36.9179.4-68.1-28.9000111.4Y66 Q129 R130 I135 A136 G137Y66-D133 VanDerWaalsContact CE2-OD1 3.31Å; Y66-D133 WeakPolarHBondContact CE2-OD1 3.39Å; Y66-D133 VanDerWaalsContact CZ-OD1 3.28Å; Y66-D133 PolarHBondContact OH-OD1 3.4Å; Q129-D133 WeakPolarHBondContact CG-OD2 3.41Å; Q129-D133 PolarHBondContact O-N 3.38Å; R130-D133 PolarHBondContact O-N 3.04Å; D133-I135 VanDerWaalsContact C-N 3.35Å; D133-I135 PolarHBondContact O-N 3.35Å; D133-A136 WeakPolarHBondContact O-CB 3.46Å; D133-A136 PolarHBondContact O-N 3.15Å; D133-G137 PolarHBondContact O-N 3.39Å
134R92.4Very high89.4Confident177 Ų17761.2 Ų61.267%0.66831%0.307SS*.Hα-helixtrans-60.8-43173.5-179.1-179.4175-179.41.9112R130 A136 G137 Q138R130-R134 VanDerWaalsContact O-CB 3.27Å; R130-R134 WeakPolarHBondContact O-CB 3.4Å; R130-R134 PolarHBondContact O-N 2.86Å; R134-A136 VanDerWaalsContact C-N 3.33Å; R134-G137 PolarHBondContact O-N 3.3Å; R134-Q138 PolarHBondContact O-N 3.23Å; R134-Q138 VanDerWaalsContact O-N 3.15Å
135I92.1Very high87.9Confident5 Ų566.3 Ų66.33%0.02633%0.332CS..Hα-helixtrans-67.5-37.3177.1-67.7166.5000110.4F14 A17 L18 F21 D131 L132 D133 G137 Q138 V139F14-I135 HydrophobicContact CD2-CG2 4.28Å; F14-I135 HydrophobicContact CE2-CB 4.19Å; F14-I135 HydrophobicContact CE2-CG2 3.93Å; A17-I135 HydrophobicContact CB-CG2 4.27Å; L18-I135 HydrophobicContact CD1-CD1 3.46Å; L18-I135 VanDerWaalsContact CD1-CD1 3.46Å; F21-I135 HydrophobicContact CB-CD1 4.06Å; F21-I135 HydrophobicContact CD1-CD1 3.69Å; F21-I135 HydrophobicContact CD2-CD1 4.37Å; F21-I135 HydrophobicContact CE1-CD1 4.21Å; F21-I135 HydrophobicContact CG-CD1 3.78Å; D131-I135 WeakPolarHBondContact O-CD1 3.43Å; D131-I135 VanDerWaalsContact O-CG1 3.31Å; D131-I135 WeakPolarHBondContact O-CG1 3.27Å; D131-I135 PolarHBondContact O-N 3.33Å; D131-I135 VanDerWaalsContact O-N 3.15Å; L132-I135 PolarHBondContact O-N 2.98Å; D133-I135 VanDerWaalsContact C-N 3.35Å; D133-I135 PolarHBondContact O-N 3.35Å; I135-G137 VanDerWaalsContact C-N 3.33Å; I135-G137 PolarHBondContact O-N 3.41Å; I135-Q138 WeakPolarHBondContact O-CB 3.27Å; I135-Q138 PolarHBondContact O-N 3.34Å; I135-Q138 VanDerWaalsContact O-N 3.15Å; I135-V139 HydrophobicContact CG2-CG2 4.48Å; I135-V139 WeakPolarHBondContact O-CG2 2.85Å; I135-V139 PolarHBondContact O-N 3.34Å
136A91.9Very high85.5Confident0 Ų076.5 Ų76.50%038%0.378CS..Hα-helixtrans-60.1-43.7173.900000111.4V4 V6 V9 F14 L132 D133 R134 Q138 V139 A140V4-A136 HydrophobicContact CG1-CB 4.39Å; V6-A136 HydrophobicContact CG2-CB 4.36Å; V9-A136 HydrophobicContact CG1-CB 4.19Å; V9-A136 WeakPolarHBondContact CG1-O 3.5Å; V9-A136 HydrophobicContact CG2-CB 4.03Å; F14-A136 HydrophobicContact CD2-CB 4.19Å; F14-A136 HydrophobicContact CE2-CB 3.94Å; L132-A136 PolarHBondContact O-N 3.21Å; D133-A136 WeakPolarHBondContact O-CB 3.46Å; D133-A136 PolarHBondContact O-N 3.15Å; R134-A136 VanDerWaalsContact C-N 3.33Å; A136-Q138 VanDerWaalsContact C-N 3.3Å; A136-Q138 PolarHBondContact O-N 2.91Å; A136-V139 PolarHBondContact O-N 3.36Å; A136-A140 PolarHBondContact O-N 3.24Å
137G91.8Very high85.1Confident29 Ų2976.1 Ų76.130%0.29937%0.369SS..Hα-helixtrans-58.7-38.4173.300000113.6D133 R134 I135 A141D133-G137 PolarHBondContact O-N 3.39Å; R134-G137 PolarHBondContact O-N 3.3Å; I135-G137 VanDerWaalsContact C-N 3.33Å; I135-G137 PolarHBondContact O-N 3.41Å; G137-A141 WeakPolarHBondContact O-CB 3.36Å; G137-A141 PolarHBondContact O-N 3.11Å
138Q90.2Very high84.8Confident107 Ų10774.6 Ų74.650%0.536%0.363SS..Hα-helixtrans-66.7-42.3175.5-70178-16.200112.4R134 I135 A136 A141 A142R134-Q138 PolarHBondContact O-N 3.23Å; R134-Q138 VanDerWaalsContact O-N 3.15Å; I135-Q138 WeakPolarHBondContact O-CB 3.27Å; I135-Q138 PolarHBondContact O-N 3.34Å; I135-Q138 VanDerWaalsContact O-N 3.15Å; A136-Q138 VanDerWaalsContact C-N 3.3Å; A136-Q138 PolarHBondContact O-N 2.91Å; Q138-A141 PolarHBondContact O-N 3.48Å; Q138-A142 WeakPolarHBondContact O-CB 3.25Å; Q138-A142 PolarHBondContact O-N 2.81Å
139V90.8Very high84.5Confident10 Ų1078.8 Ų78.86%0.06138%0.383CS..Hα-helixtrans-64.4-45.6177.2173.50000110.5V9 E13 A17 I135 A136 A141 A142 N143V9-V139 HydrophobicContact CB-CG1 4.33Å; V9-V139 HydrophobicContact CG1-CB 4.48Å; V9-V139 HydrophobicContact CG1-CG1 4.42Å; E13-V139 HydrophobicContact CB-CG1 4.13Å; A17-V139 HydrophobicContact CB-CG2 3.51Å; I135-V139 HydrophobicContact CG2-CG2 4.48Å; I135-V139 WeakPolarHBondContact O-CG2 2.85Å; I135-V139 PolarHBondContact O-N 3.34Å; A136-V139 PolarHBondContact O-N 3.36Å; V139-A141 VanDerWaalsContact C-N 3.32Å; V139-A141 PolarHBondContact O-N 2.8Å; V139-A142 PolarHBondContact O-N 2.93Å; V139-N143 PolarHBondContact O-N 3.2Å; V139-N143 PolarHBondContact O-OD1 3.14Å
140A88.8Confident84Confident20 Ų2079.2 Ų79.217%0.16539%0.386CS..Hα-helixtrans-62.5-37.7176.600000112.8V4 V9 A136 K144V4-A140 HydrophobicContact CB-CB 4.46Å; V4-A140 HydrophobicContact CG1-CB 3.78Å; V4-A140 HydrophobicContact CG2-CB 4.12Å; V9-A140 HydrophobicContact CG1-CB 4Å; A136-A140 PolarHBondContact O-N 3.24Å; A140-K144 WeakPolarHBondContact O-CG 3.22Å; A140-K144 PolarHBondContact O-N 3.16Å
141A87Confident83.5Confident45 Ų4572.3 Ų72.337%0.37237%0.365SS..Hα-helixtrans-68.7-34.2175.500000112.6G137 Q138 V139G137-A141 WeakPolarHBondContact O-CB 3.36Å; G137-A141 PolarHBondContact O-N 3.11Å; Q138-A141 PolarHBondContact O-N 3.48Å; V139-A141 VanDerWaalsContact C-N 3.32Å; V139-A141 PolarHBondContact O-N 2.8Å
142A84.8Confident83Confident54 Ų5474.3 Ų74.345%0.44637%0.374SS..Hα-helixtrans-69.2-40.7175.700000111.8Q138 V139 K144 K145Q138-A142 WeakPolarHBondContact O-CB 3.25Å; Q138-A142 PolarHBondContact O-N 2.81Å; V139-A142 PolarHBondContact O-N 2.93Å; A142-K144 VanDerWaalsContact C-N 3.3Å; A142-K144 PolarHBondContact O-N 2.73Å; A142-K145 PolarHBondContact O-N 3.12Å
143N78.3Confident82.3Confident75 Ų7579.3 Ų79.340%0.40140%0.4SS..Hα-helixtrans-68.9-25.7-179-70.5-3.6000113.9E13 V139 K145E13-N143 PolarHBondContact OE2-ND2 3.17Å; E13-N143 PolarHBondContact OE2-OD1 3.33Å; V139-N143 PolarHBondContact O-N 3.2Å; V139-N143 PolarHBondContact O-OD1 3.14Å; N143-K145 VanDerWaalsContact C-N 3.27Å; N143-K145 PolarHBondContact O-N 3.07Å
144K68.3Low81.5Confident141 Ų14182.6 Ų82.661%0.61342%0.416SS*.THydrogen-bonded Turntrans-76.3-10.1175.4-74.3-178.5-179.7-177.10114.3A140 A142 H146A140-K144 WeakPolarHBondContact O-CG 3.22Å; A140-K144 PolarHBondContact O-N 3.16Å; A142-K144 VanDerWaalsContact C-N 3.3Å; A142-K144 PolarHBondContact O-N 2.73Å; K144-H146 VanDerWaalsContact C-N 3.3Å
145K58.8Low80.6Confident182 Ų18274.8 Ų74.879%0.79140%0.395SS*.THydrogen-bonded Turntrans-85.2-6.3-179.8-72.1-174.7174.9-170.90113.2A142 N143A142-K145 PolarHBondContact O-N 3.12Å; N143-K145 VanDerWaalsContact C-N 3.27Å; N143-K145 PolarHBondContact O-N 3.07Å
146H44Very low79.5Confident229 Ų22981.1 Ų81.1100%1.0643%0.428SS*.  trans-108.20168.9-76.9-68.4000109K144K144-H146 VanDerWaalsContact C-N 3.3Å

Retrieved 146 of 146 residues in 132.1 ms (Link to these results)