A0A2K5LDU2_CERAT Loading...

Family with sequence similarity 163 member B

AlphaFold DB , UniProt , Accession A0A2K5LDU2, Species CERAT (Cercocebus atys, Sooty mangabey), Gene FAM163B, Length 166 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
1M60.1Low81.6Confident233 Ų23392.2 Ų92.2100%1.14859%0.587SS**  058.60-65.5164.773.100110.3
2T74.8Confident82.7Confident110 Ų11092.5 Ų92.568%0.67558%0.579SS**  trans-130.7-13.2-170.445.50000113.8T5T2-T5 PolarHBondContact O-OG1 3.37Å
3A72.5Confident83.6Confident80 Ų8093.8 Ų93.866%0.66158%0.578SS**Hα-helixtrans-73-31.2178.900000113.1V7A3-V7 WeakPolarHBondContact O-CG2 3.01Å
4G79.1Confident84.4Confident45 Ų4591.2 Ų91.246%0.46457%0.571SS.*Hα-helixtrans-73-38.5-178.100000113.5V7 I8G4-V7 PolarHBondContact O-N 3.36Å; G4-I8 WeakPolarHBondContact O-CD1 3.29Å; G4-I8 WeakPolarHBondContact O-CG1 3.48Å; G4-I8 PolarHBondContact O-N 3.07Å; G4-I8 VanDerWaalsContact O-N 3.08Å
5T80Confident85.1Confident84 Ų8490.3 Ų90.352%0.51557%0.565SS.*Hα-helixtrans-69.4-40-176.648.60000112.1T2 V7 I8 T9T2-T5 PolarHBondContact O-OG1 3.37Å; T5-V7 VanDerWaalsContact C-N 3.31Å; T5-V7 PolarHBondContact O-N 3.21Å; T5-I8 PolarHBondContact O-N 2.93Å; T5-T9 WeakPolarHBondContact O-CG2 3.19Å; T5-T9 PolarHBondContact O-N 3.11Å; T5-T9 PolarHBondContact O-OG1 3.08Å
6V84.8Confident85.8Confident98 Ų9889.3 Ų89.359%0.59456%0.558SS**Hα-helixtrans-63.3-37.2177.4179.70000111.8T9 G10V6-T9 PolarHBondContact O-OG1 2.83Å; V6-G10 WeakPolarHBondContact O-CA 3.36Å; V6-G10 PolarHBondContact O-N 3.31Å
7V86.3Confident86.4Confident108 Ų10890.1 Ų90.166%0.65556%0.556SS**Hα-helixtrans-69.8-40.6176.1176.30000110.9A3 G4 T5 G11A3-V7 WeakPolarHBondContact O-CG2 3.01Å; G4-V7 PolarHBondContact O-N 3.36Å; T5-V7 VanDerWaalsContact C-N 3.31Å; T5-V7 PolarHBondContact O-N 3.21Å; V7-G11 PolarHBondContact O-N 3.23Å
8I87.6Confident86.9Confident108 Ų10890.7 Ų90.755%0.55456%0.555SS**Hα-helixtrans-67.1-50.6178.6-65.4162.6000110.5G4 T5 G11 I12G4-I8 WeakPolarHBondContact O-CD1 3.29Å; G4-I8 WeakPolarHBondContact O-CG1 3.48Å; G4-I8 PolarHBondContact O-N 3.07Å; G4-I8 VanDerWaalsContact O-N 3.08Å; T5-I8 PolarHBondContact O-N 2.93Å; I8-G11 PolarHBondContact O-N 3.4Å; I8-I12 HydrophobicContact CG2-CD1 4.01Å; I8-I12 WeakPolarHBondContact O-CD1 3.45Å; I8-I12 VanDerWaalsContact O-CG1 3.29Å; I8-I12 WeakPolarHBondContact O-CG1 3.42Å; I8-I12 PolarHBondContact O-N 2.9Å
9T88.9Confident87.3Confident80 Ų8091.9 Ų91.949%0.49156%0.557SS.*Hα-helixtrans-66.7-40.5178.855.10000111.9T5 V6 G11 I12 L13T5-T9 WeakPolarHBondContact O-CG2 3.19Å; T5-T9 PolarHBondContact O-N 3.11Å; T5-T9 PolarHBondContact O-OG1 3.08Å; V6-T9 PolarHBondContact O-OG1 2.83Å; T9-G11 VanDerWaalsContact C-N 3.34Å; T9-G11 PolarHBondContact O-N 3.42Å; T9-I12 PolarHBondContact O-N 3.35Å; T9-L13 WeakPolarHBondContact O-CB 2.77Å; T9-L13 VanDerWaalsContact O-CG 3.29Å; T9-L13 WeakPolarHBondContact O-CG 3.21Å; T9-L13 PolarHBondContact O-N 3.09Å
10G91Very high87.7Confident34 Ų3491.1 Ų91.135%0.35155%0.554SS.*Hα-helixtrans-64.1-38.8175.900000112.5V6 L13 A14V6-G10 WeakPolarHBondContact O-CA 3.36Å; V6-G10 PolarHBondContact O-N 3.31Å; G10-L13 PolarHBondContact O-N 2.95Å; G10-A14 VanDerWaalsContact O-CB 3.29Å; G10-A14 WeakPolarHBondContact O-CB 3.35Å; G10-A14 PolarHBondContact O-N 2.9Å
11G92.2Very high88.1Confident34 Ų3491 Ų9135%0.35155%0.55SS..Hα-helixtrans-63.9-45.217500000112.6V7 I8 T9 A14 T15V7-G11 PolarHBondContact O-N 3.23Å; I8-G11 PolarHBondContact O-N 3.4Å; T9-G11 VanDerWaalsContact C-N 3.34Å; T9-G11 PolarHBondContact O-N 3.42Å; G11-A14 PolarHBondContact O-N 2.92Å; G11-T15 WeakPolarHBondContact O-CG2 3.3Å; G11-T15 PolarHBondContact O-N 3.32Å; G11-T15 PolarHBondContact O-OG1 3.29Å
12I95.1Very high89.7Confident96 Ų9684.2 Ų84.249%0.49252%0.517SS..Hα-helixtrans-63.6-44.3176.9-64.2162.7000110.7I8 T9 A14 T15 V16I8-I12 HydrophobicContact CG2-CD1 4.01Å; I8-I12 WeakPolarHBondContact O-CD1 3.45Å; I8-I12 VanDerWaalsContact O-CG1 3.29Å; I8-I12 WeakPolarHBondContact O-CG1 3.42Å; I8-I12 PolarHBondContact O-N 2.9Å; T9-I12 PolarHBondContact O-N 3.35Å; I12-A14 VanDerWaalsContact C-N 3.32Å; I12-A14 PolarHBondContact O-N 2.86Å; I12-T15 PolarHBondContact O-N 3.16Å; I12-T15 PolarHBondContact O-OG1 3.25Å; I12-V16 HydrophobicContact CG2-CG2 4.35Å; I12-V16 WeakPolarHBondContact O-CB 3.44Å; I12-V16 VanDerWaalsContact O-CG2 3.23Å; I12-V16 WeakPolarHBondContact O-CG2 3.33Å; I12-V16 PolarHBondContact O-N 2.74Å
13L94.4Very high90.3Very high109 Ų10981.8 Ų81.857%0.57151%0.508SS*.Hα-helixtrans-62.3-41.9176.3-70.3170.9000111.4T9 G10 V16 I17T9-L13 WeakPolarHBondContact O-CB 2.77Å; T9-L13 VanDerWaalsContact O-CG 3.29Å; T9-L13 WeakPolarHBondContact O-CG 3.21Å; T9-L13 PolarHBondContact O-N 3.09Å; G10-L13 PolarHBondContact O-N 2.95Å; L13-V16 PolarHBondContact O-N 3.17Å; L13-I17 WeakPolarHBondContact O-CB 2.93Å; L13-I17 WeakPolarHBondContact O-CD1 3.25Å; L13-I17 WeakPolarHBondContact O-CG1 3.25Å; L13-I17 PolarHBondContact O-N 2.76Å
14A94.8Very high91.1Very high58 Ų5882.1 Ų82.148%0.47950%0.502SS..Hα-helixtrans-63.1-42.2177.400000112.5G10 G11 I12 L18G10-A14 VanDerWaalsContact O-CB 3.29Å; G10-A14 WeakPolarHBondContact O-CB 3.35Å; G10-A14 PolarHBondContact O-N 2.9Å; G11-A14 PolarHBondContact O-N 2.92Å; I12-A14 VanDerWaalsContact C-N 3.32Å; I12-A14 PolarHBondContact O-N 2.86Å; A14-L18 WeakPolarHBondContact O-CB 3.41Å; A14-L18 PolarHBondContact O-N 3.42Å
15T95.1Very high91.5Very high77 Ų7785 Ų8547%0.47251%0.506SS..Hα-helixtrans-68.1-41.3177.455.80000111.8G11 I12 L18 L19G11-T15 WeakPolarHBondContact O-CG2 3.3Å; G11-T15 PolarHBondContact O-N 3.32Å; G11-T15 PolarHBondContact O-OG1 3.29Å; I12-T15 PolarHBondContact O-N 3.16Å; I12-T15 PolarHBondContact O-OG1 3.25Å; T15-L18 PolarHBondContact O-N 3.49Å; T15-L19 WeakPolarHBondContact O-CB 3.31Å; T15-L19 VanDerWaalsContact O-CG 3.26Å; T15-L19 WeakPolarHBondContact O-CG 3.18Å; T15-L19 PolarHBondContact O-N 3.38Å
16V96.7Very high91.9Very high75 Ų7584.8 Ų84.846%0.45551%0.507SS..Hα-helixtrans-62.2-45.7176.4171.70000111.1I12 L13 L18 L19 C20I12-V16 HydrophobicContact CG2-CG2 4.35Å; I12-V16 WeakPolarHBondContact O-CB 3.44Å; I12-V16 VanDerWaalsContact O-CG2 3.23Å; I12-V16 WeakPolarHBondContact O-CG2 3.33Å; I12-V16 PolarHBondContact O-N 2.74Å; L13-V16 PolarHBondContact O-N 3.17Å; V16-L18 PolarHBondContact O-N 2.7Å; V16-L19 PolarHBondContact O-N 2.77Å; V16-C20 WeakPolarHBondContact O-CB 3.46Å; V16-C20 PolarHBondContact O-N 2.86Å
17I96Very high91.8Very high102 Ų10284 Ų8452%0.52349%0.494SS..Hα-helixtrans-61.6-45.7177.3-67.8163.8000110.6L13 L19 C20 I21L13-I17 WeakPolarHBondContact O-CB 2.93Å; L13-I17 WeakPolarHBondContact O-CD1 3.25Å; L13-I17 WeakPolarHBondContact O-CG1 3.25Å; L13-I17 PolarHBondContact O-N 2.76Å; I17-L19 PolarHBondContact O-N 3.01Å; I17-C20 WeakPolarHBondContact O-CB 3.3Å; I17-C20 PolarHBondContact O-N 3.5Å; I17-I21 HydrophobicContact CG2-CD1 3.95Å; I17-I21 WeakPolarHBondContact O-CG1 3.47Å; I17-I21 PolarHBondContact O-N 3.34Å
18L95.5Very high91.5Very high102 Ų10282 Ų8253%0.53448%0.484SS..Hα-helixtrans-61.3-45.5178.1-178.265.9000111.7A14 T15 V16 C20 I21 I22A14-L18 WeakPolarHBondContact O-CB 3.41Å; A14-L18 PolarHBondContact O-N 3.42Å; T15-L18 PolarHBondContact O-N 3.49Å; V16-L18 PolarHBondContact O-N 2.7Å; L18-C20 VanDerWaalsContact C-N 3.35Å; L18-I21 PolarHBondContact O-N 3.29Å; L18-I22 HydrophobicContact CD1-CD1 4.22Å; L18-I22 HydrophobicContact CG-CD1 3.94Å; L18-I22 WeakPolarHBondContact O-CG1 3.38Å; L18-I22 PolarHBondContact O-N 3.3Å
19L94.8Very high91.3Very high114 Ų11483.9 Ų83.960%0.59748%0.484SS*.Hα-helixtrans-62.6-41.2177-73.5174.2000111.7T15 V16 I17 I22 A23T15-L19 WeakPolarHBondContact O-CB 3.31Å; T15-L19 VanDerWaalsContact O-CG 3.26Å; T15-L19 WeakPolarHBondContact O-CG 3.18Å; T15-L19 PolarHBondContact O-N 3.38Å; V16-L19 PolarHBondContact O-N 2.77Å; I17-L19 PolarHBondContact O-N 3.01Å; L19-I22 PolarHBondContact O-N 3.5Å; L19-A23 VanDerWaalsContact O-CB 3.24Å; L19-A23 WeakPolarHBondContact O-CB 3Å; L19-A23 PolarHBondContact O-N 3.17Å
20C94.9Very high90.5Very high74 Ų7484.9 Ų84.950%0.549%0.486SS..Hα-helixtrans-58.9-46.7173.5-85.80000111.8V16 I17 L18 A23 V24V16-C20 WeakPolarHBondContact O-CB 3.46Å; V16-C20 PolarHBondContact O-N 2.86Å; I17-C20 WeakPolarHBondContact O-CB 3.3Å; I17-C20 PolarHBondContact O-N 3.5Å; L18-C20 VanDerWaalsContact C-N 3.35Å; C20-A23 PolarHBondContact O-N 3.21Å; C20-V24 WeakPolarHBondContact O-CB 3.38Å; C20-V24 VanDerWaalsContact O-CG2 3.28Å; C20-V24 WeakPolarHBondContact O-CG2 3.32Å; C20-V24 PolarHBondContact O-N 2.73Å
21I94.9Very high89.3Confident91 Ų9185.6 Ų85.647%0.46748%0.48SS..Hα-helixtrans-62.4-46.3178.4-65.9165.7000110.4I17 L18 A23 V24 L25I17-I21 HydrophobicContact CG2-CD1 3.95Å; I17-I21 WeakPolarHBondContact O-CG1 3.47Å; I17-I21 PolarHBondContact O-N 3.34Å; L18-I21 PolarHBondContact O-N 3.29Å; I21-A23 PolarHBondContact O-N 3.02Å; I21-V24 PolarHBondContact O-N 2.69Å; I21-L25 HydrophobicContact CG2-CD1 3.81Å; I21-L25 HydrophobicContact CG2-CG 4.24Å; I21-L25 WeakPolarHBondContact O-CB 3.3Å; I21-L25 VanDerWaalsContact O-CG 3.25Å; I21-L25 WeakPolarHBondContact O-CG 3.36Å; I21-L25 PolarHBondContact O-N 3.16Å
22I93.8Very high88.2Confident90 Ų9090.2 Ų90.246%0.46249%0.488SS..Hα-helixtrans-62.5-44178.2-66.7167.5000110.8L18 L19 L25 C26L18-I22 HydrophobicContact CD1-CD1 4.22Å; L18-I22 HydrophobicContact CG-CD1 3.94Å; L18-I22 WeakPolarHBondContact O-CG1 3.38Å; L18-I22 PolarHBondContact O-N 3.3Å; L19-I22 PolarHBondContact O-N 3.5Å; I22-L25 PolarHBondContact O-N 3.32Å; I22-C26 WeakPolarHBondContact O-CB 3.13Å; I22-C26 PolarHBondContact O-N 2.86Å
23A87.3Confident86.6Confident59 Ų5991.9 Ų91.949%0.48849%0.489SS..Hα-helixtrans-60.7-46.4177.900000111.2L19 C20 I21 C26 Y27L19-A23 VanDerWaalsContact O-CB 3.24Å; L19-A23 WeakPolarHBondContact O-CB 3Å; L19-A23 PolarHBondContact O-N 3.17Å; C20-A23 PolarHBondContact O-N 3.21Å; I21-A23 PolarHBondContact O-N 3.02Å; A23-C26 PolarHBondContact O-N 3.17Å; A23-Y27 WeakPolarHBondContact O-CB 3.28Å; A23-Y27 PolarHBondContact O-N 2.87Å
24V89.9Confident85.1Confident86 Ų8688.7 Ų88.752%0.52148%0.476SS..Hα-helixtrans-63-46.2176172.50000111C20 I21 C26 Y27 C28C20-V24 WeakPolarHBondContact O-CB 3.38Å; C20-V24 VanDerWaalsContact O-CG2 3.28Å; C20-V24 WeakPolarHBondContact O-CG2 3.32Å; C20-V24 PolarHBondContact O-N 2.73Å; I21-V24 PolarHBondContact O-N 2.69Å; V24-C26 PolarHBondContact O-N 2.96Å; V24-Y27 PolarHBondContact O-N 2.86Å; V24-C28 WeakPolarHBondContact O-CB 3.48Å; V24-C28 PolarHBondContact O-N 3.49Å; V24-C28 PolarHBondContact O-SG 2.75Å
25L88Confident83.2Confident105 Ų10588.3 Ų88.355%0.5547%0.468SS..Hα-helixtrans-65.1-40.8178.9-70.8176.6000112.5I21 I22 Y27 C28 R29I21-L25 HydrophobicContact CG2-CD1 3.81Å; I21-L25 HydrophobicContact CG2-CG 4.24Å; I21-L25 WeakPolarHBondContact O-CB 3.3Å; I21-L25 VanDerWaalsContact O-CG 3.25Å; I21-L25 WeakPolarHBondContact O-CG 3.36Å; I21-L25 PolarHBondContact O-N 3.16Å; I22-L25 PolarHBondContact O-N 3.32Å; L25-Y27 VanDerWaalsContact C-N 3.35Å; L25-C28 PolarHBondContact O-N 2.75Å; L25-R29 WeakPolarHBondContact O-CB 3.29Å; L25-R29 WeakPolarHBondContact O-CG 2.87Å; L25-R29 PolarHBondContact O-N 3.33Å
26C87.8Confident81.1Confident81 Ų8189.4 Ų89.455%0.54747%0.467SS..Hα-helixtrans-63.6-43.9175.3-175.40000110.4I22 A23 V24 R29 L30I22-C26 WeakPolarHBondContact O-CB 3.13Å; I22-C26 PolarHBondContact O-N 2.86Å; A23-C26 PolarHBondContact O-N 3.17Å; V24-C26 PolarHBondContact O-N 2.96Å; C26-R29 PolarHBondContact O-N 2.83Å; C26-L30 VanDerWaalsContact O-CB 3.29Å; C26-L30 WeakPolarHBondContact O-CB 3.49Å; C26-L30 PolarHBondContact O-N 3.48Å
27Y82.9Confident78.9Confident81 Ų8191.3 Ų91.332%0.31847%0.469SS..Hα-helixtrans-68.3-40.9177.5-176.7-112.9000112.2A23 V24 L25 R29 L30 Q31 C94A23-Y27 WeakPolarHBondContact O-CB 3.28Å; A23-Y27 PolarHBondContact O-N 2.87Å; V24-Y27 PolarHBondContact O-N 2.86Å; L25-Y27 VanDerWaalsContact C-N 3.35Å; Y27-R29 VanDerWaalsContact C-N 3.33Å; Y27-R29 PolarHBondContact O-N 3.07Å; Y27-L30 PolarHBondContact O-N 3.34Å; Y27-Q31 HydrophobicContact CD1-CG 4.48Å; Y27-Q31 VanDerWaalsContact CD1-NE2 3.28Å; Y27-Q31 HydrophobicContact CE1-CG 4.37Å; Y27-Q31 VanDerWaalsContact CZ-NE2 3.32Å; Y27-Q31 VanDerWaalsContact O-CB 3.3Å; Y27-Q31 WeakPolarHBondContact O-CB 3.45Å; Y27-Q31 VanDerWaalsContact O-CG 3.31Å; Y27-Q31 WeakPolarHBondContact O-CG 3.25Å; Y27-Q31 PolarHBondContact O-N 3.16Å; Y27-C94 WeakPolarHBondContact OH-CB 3.29Å; Y27-C94 PolarHBondContact OH-O 3.35Å
28C80.1Confident76.7Confident65 Ų6589.7 Ų89.744%0.43946%0.461SS..Hα-helixtrans-64.9-37173.5-70.30000111.8V24 L25 Y32V24-C28 WeakPolarHBondContact O-CB 3.48Å; V24-C28 PolarHBondContact O-N 3.49Å; V24-C28 PolarHBondContact O-SG 2.75Å; L25-C28 PolarHBondContact O-N 2.75Å; C28-Y32 VanDerWaalsContact O-CB 3.3Å; C28-Y32 WeakPolarHBondContact O-CB 3.41Å; C28-Y32 PolarHBondContact O-N 2.87Å
29R83.5Confident74.3Confident148 Ų14890.5 Ų90.556%0.55846%0.462SS*.Hα-helixtrans-67.2-47.3172.3-82.7-70.1-170.1176.80.5111L25 C26 Y27 Q31 Y32 Y33L25-R29 WeakPolarHBondContact O-CB 3.29Å; L25-R29 WeakPolarHBondContact O-CG 2.87Å; L25-R29 PolarHBondContact O-N 3.33Å; C26-R29 PolarHBondContact O-N 2.83Å; Y27-R29 VanDerWaalsContact C-N 3.33Å; Y27-R29 PolarHBondContact O-N 3.07Å; R29-Q31 VanDerWaalsContact C-N 3.3Å; R29-Q31 PolarHBondContact O-N 2.82Å; R29-Y32 CarbonylContact O-C 3.56Å; R29-Y32 WeakPolarHBondContact O-CA 3.39Å; R29-Y32 WeakPolarHBondContact O-CB 3.36Å; R29-Y32 PolarHBondContact O-N 3.43Å; R29-Y32 VanDerWaalsContact O-N 3.07Å; R29-Y33 HydrophobicContact CB-CD2 4.48Å; R29-Y33 HydrophobicContact CB-CE2 4.17Å; R29-Y33 WeakPolarHBondContact O-CD2 3.24Å; R29-Y33 PolarHBondContact O-N 2.98Å
30L72.2Confident72Confident101 Ų10188.4 Ų88.453%0.52946%0.457SS..Hα-helixtrans-60.7-42.9177.7-169.565.8000110.3C26 Y27 Y33 C34C26-L30 VanDerWaalsContact O-CB 3.29Å; C26-L30 WeakPolarHBondContact O-CB 3.49Å; C26-L30 PolarHBondContact O-N 3.48Å; Y27-L30 PolarHBondContact O-N 3.34Å; L30-Y33 CarbonylContact O-C 3.48Å; L30-Y33 PolarHBondContact O-N 3.27Å; L30-Y33 VanDerWaalsContact O-N 3.12Å; L30-C34 WeakPolarHBondContact O-CB 3.11Å; L30-C34 PolarHBondContact O-N 3.36Å; L30-C34 PolarHBondContact O-SG 2.91Å
31Q66.4Low69.6Low50 Ų5090.5 Ų90.523%0.23446%0.459CS..Hα-helixtrans-62-41.1170.7-78.1-15958.400112.7Y27 R29 Y33 C34 C35 C94Y27-Q31 HydrophobicContact CD1-CG 4.48Å; Y27-Q31 VanDerWaalsContact CD1-NE2 3.28Å; Y27-Q31 HydrophobicContact CE1-CG 4.37Å; Y27-Q31 VanDerWaalsContact CZ-NE2 3.32Å; Y27-Q31 VanDerWaalsContact O-CB 3.3Å; Y27-Q31 WeakPolarHBondContact O-CB 3.45Å; Y27-Q31 VanDerWaalsContact O-CG 3.31Å; Y27-Q31 WeakPolarHBondContact O-CG 3.25Å; Y27-Q31 PolarHBondContact O-N 3.16Å; R29-Q31 VanDerWaalsContact C-N 3.3Å; R29-Q31 PolarHBondContact O-N 2.82Å; Q31-Y33 PolarHBondContact O-N 2.77Å; Q31-C34 PolarHBondContact O-N 3.12Å; Q31-C35 WeakPolarHBondContact O-CB 3.38Å; Q31-C35 PolarHBondContact O-N 3.31Å; Q31-C35 PolarHBondContact O-SG 2.86Å; Q31-C94 WeakPolarHBondContact CG-SG 3.34Å
32Y68.4Low67Low131 Ų13194.3 Ų94.351%0.51448%0.476SS..Hα-helixtrans-60.5-35.4173.6177.3-95.7000111.3C28 R29 K36C28-Y32 VanDerWaalsContact O-CB 3.3Å; C28-Y32 WeakPolarHBondContact O-CB 3.41Å; C28-Y32 PolarHBondContact O-N 2.87Å; R29-Y32 CarbonylContact O-C 3.56Å; R29-Y32 WeakPolarHBondContact O-CA 3.39Å; R29-Y32 WeakPolarHBondContact O-CB 3.36Å; R29-Y32 PolarHBondContact O-N 3.43Å; R29-Y32 VanDerWaalsContact O-N 3.07Å; Y32-K36 HydrophobicContact CE1-CD 4.29Å; Y32-K36 WeakPolarHBondContact O-CB 3.5Å; Y32-K36 PolarHBondContact O-N 3.35Å
33Y61.9Low64.9Low130 Ų13096.9 Ų96.951%0.5149%0.49SS..Hα-helixtrans-80.3-33.5175-65.2-65.3000113.3R29 L30 Q31 K37R29-Y33 HydrophobicContact CB-CD2 4.48Å; R29-Y33 HydrophobicContact CB-CE2 4.17Å; R29-Y33 WeakPolarHBondContact O-CD2 3.24Å; R29-Y33 PolarHBondContact O-N 2.98Å; L30-Y33 CarbonylContact O-C 3.48Å; L30-Y33 PolarHBondContact O-N 3.27Å; L30-Y33 VanDerWaalsContact O-N 3.12Å; Q31-Y33 PolarHBondContact O-N 2.77Å; Y33-K37 WeakPolarHBondContact O-CB 3.46Å; Y33-K37 PolarHBondContact O-N 3.49Å
34C61.4Low62.9Low43 Ų43102.3 Ų102.329%0.29151%0.505SS..Hα-helixtrans-68.9-55.4175.1-69.70000109.2L30 Q31 K36 K37 D38L30-C34 WeakPolarHBondContact O-CB 3.11Å; L30-C34 PolarHBondContact O-N 3.36Å; L30-C34 PolarHBondContact O-SG 2.91Å; Q31-C34 PolarHBondContact O-N 3.12Å; C34-K36 VanDerWaalsContact C-N 3.29Å; C34-K36 PolarHBondContact O-N 3.37Å; C34-K37 CarbonylContact O-C 3.51Å; C34-K37 WeakPolarHBondContact O-CA 3.17Å; C34-K37 PolarHBondContact O-N 3.49Å; C34-D38 VanDerWaalsContact C-OD2 3.26Å; C34-D38 WeakPolarHBondContact O-CB 3.26Å; C34-D38 PolarHBondContact O-N 2.78Å
35C55.4Low60.7Low49 Ų49106.6 Ų106.633%0.33152%0.52SS..Hα-helixtrans-59.7-38.1175.3-60.50000112.2Q31 K37 E39Q31-C35 WeakPolarHBondContact O-CB 3.38Å; Q31-C35 PolarHBondContact O-N 3.31Å; Q31-C35 PolarHBondContact O-SG 2.86Å; C35-K37 VanDerWaalsContact C-N 3.31Å; C35-K37 PolarHBondContact O-N 2.89Å; C35-E39 WeakPolarHBondContact O-CB 3.38Å; C35-E39 VanDerWaalsContact O-CG 3.25Å; C35-E39 WeakPolarHBondContact O-CG 3.29Å; C35-E39 PolarHBondContact O-N 2.97Å
36K51.8Low58.5Low100 Ų100110.4 Ų110.444%0.43554%0.535SS..Hα-helixtrans-69.2-27.6173.8-173170.1-176.465.20113.7Y32 C34 E39 S40Y32-K36 HydrophobicContact CE1-CD 4.29Å; Y32-K36 WeakPolarHBondContact O-CB 3.5Å; Y32-K36 PolarHBondContact O-N 3.35Å; C34-K36 VanDerWaalsContact C-N 3.29Å; C34-K36 PolarHBondContact O-N 3.37Å; K36-E39 WeakPolarHBondContact CA-OE1 3.46Å; K36-E39 IonicContact NZ-OE2 2.79Å; K36-E39 VanDerWaalsContact O-CG 3.25Å; K36-E39 WeakPolarHBondContact O-CG 3.32Å; K36-S40 WeakPolarHBondContact O-CB 3.29Å; K36-S40 PolarHBondContact O-N 2.94Å; K36-S40 PolarHBondContact O-OG 3.35Å
37K50.6Low56.4Low116 Ų116111 Ų11150%0.50454%0.538SS..Hα-helixtrans-83.7-42.2177.7-174.6171.1167173.10110.8Y33 C34 C35 S40 E41Y33-K37 WeakPolarHBondContact O-CB 3.46Å; Y33-K37 PolarHBondContact O-N 3.49Å; C34-K37 CarbonylContact O-C 3.51Å; C34-K37 WeakPolarHBondContact O-CA 3.17Å; C34-K37 PolarHBondContact O-N 3.49Å; C35-K37 VanDerWaalsContact C-N 3.31Å; C35-K37 PolarHBondContact O-N 2.89Å; K37-S40 VanDerWaalsContact CA-OG 3.3Å; K37-S40 WeakPolarHBondContact CA-OG 3.44Å; K37-S40 CarbonylContact O-C 3.43Å; K37-S40 WeakPolarHBondContact O-CA 3.34Å; K37-S40 PolarHBondContact O-N 3.3Å; K37-S40 PolarHBondContact O-OG 2.81Å; K37-E41 WeakPolarHBondContact CE-OE1 3.41Å; K37-E41 HydrophobicContact CG-CG 4.13Å; K37-E41 IonicContact NZ-OE1 3.7Å; K37-E41 PolarHBondContact NZ-OE1 3.48Å; K37-E41 WeakPolarHBondContact O-CB 3.49Å; K37-E41 WeakPolarHBondContact O-CG 3.23Å; K37-E41 PolarHBondContact O-N 3.45Å
38D49.1Very low54.4Low67 Ų67113.5 Ų113.536%0.35856%0.557SS.*Hα-helixtrans-59.8-44.3172.5-67-51.3000110.5C34 S40 E41 E42C34-D38 VanDerWaalsContact C-OD2 3.26Å; C34-D38 WeakPolarHBondContact O-CB 3.26Å; C34-D38 PolarHBondContact O-N 2.78Å; D38-S40 PolarHBondContact O-N 3.45Å; D38-E41 PolarHBondContact O-N 3.27Å; D38-E42 PolarHBondContact O-N 3.47Å
39E45.7Very low52.3Low120 Ų120119.6 Ų119.656%0.56158%0.576SS**Hα-helixtrans-67.3-20.1173.674.1-172.162.200113C35 K36C35-E39 WeakPolarHBondContact O-CB 3.38Å; C35-E39 VanDerWaalsContact O-CG 3.25Å; C35-E39 WeakPolarHBondContact O-CG 3.29Å; C35-E39 PolarHBondContact O-N 2.97Å; K36-E39 WeakPolarHBondContact CA-OE1 3.46Å; K36-E39 IonicContact NZ-OE2 2.79Å; K36-E39 VanDerWaalsContact O-CG 3.25Å; K36-E39 WeakPolarHBondContact O-CG 3.32Å
40S46Very low50.6Low69 Ų69116.1 Ų116.148%0.48358%0.579SS.*Hα-helixtrans-96.8-18.3177.670.10000114.2K36 K37 D38K36-S40 WeakPolarHBondContact O-CB 3.29Å; K36-S40 PolarHBondContact O-N 2.94Å; K36-S40 PolarHBondContact O-OG 3.35Å; K37-S40 VanDerWaalsContact CA-OG 3.3Å; K37-S40 WeakPolarHBondContact CA-OG 3.44Å; K37-S40 CarbonylContact O-C 3.43Å; K37-S40 WeakPolarHBondContact O-CA 3.34Å; K37-S40 PolarHBondContact O-N 3.3Å; K37-S40 PolarHBondContact O-OG 2.81Å; D38-S40 PolarHBondContact O-N 3.45Å
41E45.3Very low49.3Very low118 Ų118116.7 Ų116.755%0.55159%0.586SS**Hα-helixtrans-88.8-10175.4-72.4-178.5151.700111.6K37 D38K37-E41 WeakPolarHBondContact CE-OE1 3.41Å; K37-E41 HydrophobicContact CG-CG 4.13Å; K37-E41 IonicContact NZ-OE1 3.7Å; K37-E41 PolarHBondContact NZ-OE1 3.48Å; K37-E41 WeakPolarHBondContact O-CB 3.49Å; K37-E41 WeakPolarHBondContact O-CG 3.23Å; K37-E41 PolarHBondContact O-N 3.45Å; D38-E41 PolarHBondContact O-N 3.27Å
42E40.5Very low48.3Very low172 Ų172121.9 Ų121.980%0.80461%0.61SS**SBendtrans-86.1-6.8172-79.3-173.5143.200114.7D38D38-E42 PolarHBondContact O-N 3.47Å
43D48Very low46.9Very low143 Ų143121.4 Ų121.477%0.76563%0.626SS**SBendtrans-98.27.1-176.9-147.420000113.8
44E46.9Very low46.2Very low173 Ų173123.1 Ų123.181%0.80864%0.638SS**  trans-119.548-176.7-65.2-81.7148.700112.4
45E43Very low45.3Very low177 Ų177129.2 Ų129.283%0.82767%0.667SS**  trans-12086.9161.1-153.5173.3127.100109.2P47E45-P47 WeakPolarHBondContact O-CD 3.35Å
46E40.8Very low44.7Very low185 Ų185132.1 Ų132.186%0.86469%0.685SS**  trans-74.9111.5160.8-112.4-177.493.500108.5
47P45.3Very low44.5Very low94 Ų94133.1 Ų133.161%0.6170%0.702SS**  trans-94.196.3155.232-31.7000108.9E45 F49E45-P47 WeakPolarHBondContact O-CD 3.35Å; P47-F49 HydrophobicContact CB-CD2 4.17Å; P47-F49 PolarHBondContact O-N 3.42Å
48D39.8Very low43.8Very low133 Ų133136.1 Ų136.171%0.71172%0.723SS**  trans-65.787.9156.5-177.225.7000108.8
49F37Very low43.3Very low193 Ų193140.2 Ų140.285%0.84674%0.739SS**  trans-116.188.8153.9-74.5-78.1000107.6P47P47-F49 HydrophobicContact CB-CD2 4.17Å; P47-F49 PolarHBondContact O-N 3.42Å
50A46.5Very low43.4Very low75 Ų75139.3 Ų139.362%0.6275%0.746SS**  trans-50.2147.9164.200000111.5
51V45.7Very low42.8Very low113 Ų113143 Ų14369%0.68576%0.761SS**  trans101.495.3155.5-170.80000116.6
52H45.3Very low42.8Very low158 Ų158147.2 Ų147.273%0.73177%0.771SS**  trans87.587.3148.7-57.6-27.7000120
53S39.2Very low42.9Very low121 Ų121145.1 Ų145.185%0.84677%0.766SS**  -150.8101.1123.5560000110.7L55S53-L55 PolarHBondContact O-N 3Å
54H47.9Very low42.7Very low167 Ų167145.3 Ų145.377%0.77377%0.766SS**  trans-55.8110.9167.7-72.8-97.1000110.5
55L42.2Very low42.2Very low170 Ų170144 Ų14489%0.8977%0.769SS**  trans-152140.1146-77.3-172.4000110.3S53S53-L55 PolarHBondContact O-N 3Å
56P43Very low42.4Very low110 Ų110141.8 Ų141.871%0.71476%0.762SS**  trans-91.9168.1-148.421.5-7.3000114.7L58P56-L58 PolarHBondContact O-N 3.36Å
57P47.4Very low42.6Very low121 Ų121139.5 Ų139.579%0.78676%0.762SS**  trans-77.1116-175.24.311.5000110.6H59P57-H59 PolarHBondContact O-N 3.5Å; P57-H59 VanDerWaalsContact O-N 3.08Å
58L36Very low42.6Very low180 Ų180142.2 Ų142.294%0.94277%0.771SS**  trans-86.978.6164.6-87.1178000110.9P56P56-L58 PolarHBondContact O-N 3.36Å
59H37.4Very low42.7Very low153 Ų153139 Ų13971%0.70877%0.769SS**  trans-13.3124.5146.7-161.5-86.9000115.4P57 N61P57-H59 PolarHBondContact O-N 3.5Å; P57-H59 VanDerWaalsContact O-N 3.08Å; H59-N61 PolarHBondContact O-N 2.94Å
60S47.8Very low43.1Very low101 Ų101136.4 Ų136.471%0.70677%0.771SS**  trans-34.5121.2155.5175.20000113.1
61N34.7Very low42.7Very low146 Ų146136.9 Ų136.978%0.78178%0.775SS**  trans-146118.8149-139.6-94000114H59H59-N61 PolarHBondContact O-N 2.94Å
62R44Very low42.4Very low206 Ų206139.7 Ų139.778%0.77779%0.786SS**  trans-61.9130.8166.7176.6172.597.3170.46.4110.9
63N42.5Very low42.2Very low129 Ų129142.8 Ų142.869%0.6979%0.793SS**  trans77.4141.6150.1-85.6-59.7000121.3
64L43.7Very low42.6Very low146 Ų146142.1 Ų142.176%0.76479%0.785SS**  trans88.898.2153.8-64.8140.6000118.2
65V37.3Very low42Very low145 Ų145141 Ų14188%0.87979%0.79SS**  -136.5128.7127.8175.10000109.2
66L48.3Very low41.5Very low131 Ų131136.7 Ų136.769%0.68678%0.78SS**  trans-57.2134.8-173.6-75.964000113.5
67T44.4Very low41.3Very low138 Ų138136.8 Ų136.885%0.84778%0.783SS**  trans-126.1118146.6156.50000107.9G69T67-G69 PolarHBondContact O-N 3.36Å
68N44Very low40.8Very low150 Ų150137.8 Ų137.880%0.80279%0.787SS**  trans-63.3123-175.8-67-82.3000111.8
69G43.2Very low40.7Very low65 Ų65134.3 Ų134.367%0.6778%0.778SS**  trans-158.4138.9164.400000110.3T67T67-G69 PolarHBondContact O-N 3.36Å
70P45.6Very low40.6Very low139 Ų139136.3 Ų136.390%0.90378%0.784SS**  trans-77135.7-161.8-10.527.8000113.9
71A37.7Very low40.2Very low85 Ų85136.1 Ų136.170%0.70278%0.783SS**  trans-14.6133.8167.100000119.8
72L39.4Very low40.4Very low173 Ų173138.2 Ų138.291%0.90679%0.789SS**  -153.3150117.1-75.9-172.1000109.7
73Y40Very low40.2Very low223 Ų223137.2 Ų137.288%0.87579%0.79SS**  trans-65.8171.2-162.2-89.1-99.9000118.2
74P48.4Very low40Very low106 Ų106135.6 Ų135.669%0.68879%0.789SS**  trans-99.7145-161.937.6-29.9000113.5
75T34.3Very low39.9Very low144 Ų144134.5 Ų134.588%0.88379%0.79SS**  trans-156136.8160.9-30.70000112.6
76A31.8Very low40.2Very low80 Ų80135.3 Ų135.366%0.66178%0.784SS**  trans76.996155.200000119.5
77S39.4Very low40.1Very low111 Ų111134 Ų13478%0.77679%0.792SS**  44.2103.5111.8-38.30000118
78T36.5Very low40.1Very low142 Ų142138.8 Ų138.887%0.87180%0.795SS**  169.486.1125.343.90000109
79S35.2Very low40.1Very low108 Ų108136 Ų13676%0.75579%0.792SS**  trans-67.2139.3139.958.10000105.3
80F35.5Very low40.4Very low194 Ų194140.5 Ų140.585%0.85180%0.8SS**  -173.8146.764.3-171.8-108.8000108.9
81S37.4Very low40.4Very low98 Ų98135.1 Ų135.169%0.68577%0.765SS**  trans79.172.7164-140.50000117.9
82Q38.9Very low41.1Very low190 Ų190142.1 Ų142.189%0.88877%0.774SS**  trans-75129.4141.5-77.4-164.8-16.700109.5
83K40.8Very low41.5Very low185 Ų185138.4 Ų138.480%0.80476%0.762SS**  trans88.9111.7145.8-149.3171-174.2179.20117.8
84S37.8Very low41.9Very low95 Ų95128.6 Ų128.666%0.66473%0.726SS**  trans-142.2130.713282.20000111.2Q86S84-Q86 VanDerWaalsContact C-N 3.32Å; S84-Q86 PolarHBondContact O-N 3.35Å
85P42.8Very low41.8Very low122 Ų122128.3 Ų128.379%0.79273%0.727SS**  trans-93.264.216937-28.4000108.7
86Q43.3Very low42.2Very low163 Ų163129.7 Ų129.776%0.76272%0.723SS**  trans-123.222.9-176.6-114.3179.15.900113.7S84 R88S84-Q86 VanDerWaalsContact C-N 3.32Å; S84-Q86 PolarHBondContact O-N 3.35Å; Q86-R88 PolarHBondContact O-N 2.97Å
87A45.5Very low42.8Very low103 Ų103130.4 Ų130.485%0.85172%0.722SS**  trans-71.726.2172.200000114.1
88R45.5Very low43Very low239 Ų239133 Ų13390%0.90272%0.721SS**  trans-138.952.9-178.5-73-171.1179.8159.9-0.4112.9Q86Q86-R88 PolarHBondContact O-N 2.97Å
89A43.2Very low43.6Very low90 Ų90130.8 Ų130.874%0.74471%0.71SS**  trans-143.988.2152.200000106.3C91A89-C91 PolarHBondContact O-N 2.91Å
90L49.3Very low43.9Very low160 Ų160131 Ų13184%0.83871%0.709SS**  trans-52.8128.2164.4-85.775000106.8R92L90-R92 PolarHBondContact O-N 3.3Å; L90-R92 VanDerWaalsContact O-N 3.16Å
91C45.8Very low44.5Very low26 Ų26126.3 Ų126.318%0.17671%0.706CS.*  trans-46.5122.3175175.70000109.4A89 S93 C94A89-C91 PolarHBondContact O-N 2.91Å; C91-S93 PolarHBondContact O-N 2.88Å; C91-C94 HydrophobicContact CB-CB 4.13Å; C91-C94 VanDerWaalsContact O-CB 3.29Å; C91-C94 WeakPolarHBondContact O-CB 3.41Å; C91-C94 PolarHBondContact O-N 2.95Å; C91-C94 VanDerWaalsContact SG-SG 3.69Å
92R52.4Low45Very low232 Ų232129.9 Ų129.988%0.87571%0.709SS**G310 helixtrans-59.5-30.9-173.9-122.4178.1-179.7165.9-0.5111.9L90 C94 S95L90-R92 PolarHBondContact O-N 3.3Å; L90-R92 VanDerWaalsContact O-N 3.16Å; R92-C94 PolarHBondContact O-N 3.22Å; R92-S95 PolarHBondContact O-OG 3.22Å
93S47.2Very low45.3Very low95 Ų95130.8 Ų130.866%0.66471%0.711SS**G310 helixtrans-70.2-13.4176.2-65.50000114.5C91C91-S93 PolarHBondContact O-N 2.88Å
94C48.2Very low45.4Very low18 Ų18129.8 Ų129.812%0.12271%0.713CS.*G310 helixtrans-96-11.1-175.9-67.10000113.1Y27 Q31 C91 R92 H96Y27-C94 WeakPolarHBondContact OH-CB 3.29Å; Y27-C94 PolarHBondContact OH-O 3.35Å; Q31-C94 WeakPolarHBondContact CG-SG 3.34Å; C91-C94 HydrophobicContact CB-CB 4.13Å; C91-C94 VanDerWaalsContact O-CB 3.29Å; C91-C94 WeakPolarHBondContact O-CB 3.41Å; C91-C94 PolarHBondContact O-N 2.95Å; C91-C94 VanDerWaalsContact SG-SG 3.69Å; R92-C94 PolarHBondContact O-N 3.22Å; C94-H96 PolarHBondContact O-N 3.42Å; C94-H96 VanDerWaalsContact O-N 3.09Å
95S48Very low45.5Very low100 Ų100133.8 Ų133.870%0.69972%0.721SS**THydrogen-bonded Turntrans-67-5.3-179.763.60000114.9R92R92-S95 PolarHBondContact O-OG 3.22Å
96H42.4Very low45.3Very low173 Ų173135.8 Ų135.880%0.80172%0.72SS**THydrogen-bonded Turntrans-100.628.3-174.5-144.9-65.6000114.8C94C94-H96 PolarHBondContact O-N 3.42Å; C94-H96 VanDerWaalsContact O-N 3.09Å
97C43.9Very low45.3Very low94 Ų94132.6 Ų132.664%0.63571%0.714SS**  trans-115.161.3163.3-71.30000109.4P99C97-P99 WeakPolarHBondContact O-CD 3.19Å
98E43.7Very low45.1Very low165 Ų165133.2 Ų133.277%0.77171%0.709SS**  trans-70.9111.8159.2-17494.8114.900106.7
99P48Very low44.8Very low97 Ų97128.7 Ų128.763%0.6370%0.698SS**  trans-64.6138.4165.928.2-30.5000107.6C97 A101C97-P99 WeakPolarHBondContact O-CD 3.19Å; P99-A101 PolarHBondContact O-N 2.84Å
100P41.8Very low44.6Very low112 Ų112132.9 Ų132.973%0.72770%0.702SS**  trans-58.1109.1179.8-1929.6000109.6F102P100-F102 HydrophobicContact CB-CD2 4.13Å; P100-F102 PolarHBondContact O-N 3.5Å
101A47.9Very low44.1Very low96 Ų96132.6 Ų132.679%0.79370%0.697SS**  trans-7376.8172.900000109.1P99P99-A101 PolarHBondContact O-N 2.84Å
102F47.6Very low43.6Very low172 Ų172139 Ų13975%0.75472%0.724SS**  trans-107.5135.3154.9-72.5-85.8000105.9P100P100-F102 HydrophobicContact CB-CD2 4.13Å; P100-F102 PolarHBondContact O-N 3.5Å
103F45.2Very low43.3Very low210 Ų210135.4 Ų135.492%0.92172%0.722SS**  trans96.436.2-174-52.6-72.5000117.9
104L44.7Very low43.5Very low164 Ų164136.8 Ų136.886%0.85973%0.726SS**  trans-115.371.3143.2-100.6167.8000108.2
105Q38.1Very low43.3Very low178 Ų178143.5 Ų143.583%0.83276%0.76SS**  trans-121.981.3162.8-16315510.400106.7
106E38.9Very low43Very low165 Ų165146 Ų14677%0.77177%0.765SS**  trans-63.3135.9157-122.1162.3102.200107.3P108E106-P108 WeakPolarHBondContact O-CD 3.35Å
107P44.7Very low43.6Very low96 Ų96141.8 Ų141.862%0.62377%0.769SS**  trans-76.1130.6-175.429.9-31.1000109.8E109P107-E109 PolarHBondContact O-N 2.87Å
108P40.6Very low43.9Very low116 Ų116140 Ų14075%0.75377%0.767SS**  trans-76113.5146.627.9-20.8000107E106E106-P108 WeakPolarHBondContact O-CD 3.35Å
109E40.1Very low44.4Very low143 Ų143141.3 Ų141.367%0.66877%0.773SS**  trans-20.3146.3144.8-33.6-74.7144.300112.5P107P107-E109 PolarHBondContact O-N 2.87Å
110E37.6Very low44.7Very low179 Ų179147.2 Ų147.284%0.83678%0.783SS**  trans57136.9156.170.1-142.3144.700118
111E38.5Very low44.9Very low153 Ų153147.5 Ų147.572%0.71578%0.782SS**  cis-178.5157.15.5163.1170.2164.400103.1
112E37Very low44.6Very low162 Ų162150.5 Ų150.576%0.75778%0.784SS**  trans70.7107.8162.4-77.4170.7118.300120.2V114E112-V114 PolarHBondContact O-N 3.36Å
113D45.2Very low44.1Very low156 Ų156152.5 Ų152.583%0.83479%0.788SS**  trans-28.7122.6138.4-63.2-85.1000112.1
114V51.5Low43.6Very low124 Ų124151.2 Ų151.275%0.75278%0.782SS**  178.2131.5107.6-156.30000106.4E112E112-V114 PolarHBondContact O-N 3.36Å
115L43Very low43.3Very low158 Ų158148.4 Ų148.483%0.82778%0.776SS**  trans166.8107.4131.9-84.3166.1000112.8
116N41.5Very low43.3Very low152 Ų152146.9 Ų146.981%0.81378%0.779SS**  trans23.3127.7141-79.6-63.1000122.4
117G57Low43.3Very low85 Ų85144.1 Ų144.188%0.87678%0.778SS**  87.194.3124.100000117.1
118G49Very low43Very low57 Ų57147.7 Ų147.759%0.58879%0.786SS**  trans-175.878.3169.200000112.8R120G118-R120 PolarHBondContact O-N 2.89Å; G118-R120 VanDerWaalsContact O-N 3.11Å
119E54.2Low42.9Very low193 Ų193150.8 Ų150.890%0.90279%0.79SS**  trans-52.6111167.8175.8175.9158.200110.9
120R53.5Low42.7Very low220 Ų220151 Ų15183%0.8380%0.796SS**  trans-149.5100.2162.2-65.9-164.6-99.3-83.34.7111.7G118G118-R120 PolarHBondContact O-N 2.89Å; G118-R120 VanDerWaalsContact O-N 3.11Å
121V47.8Very low42.9Very low119 Ų119147.6 Ų147.672%0.72179%0.787SS**  trans44.9103.3145-1680000117.8Y123V121-Y123 HydrophobicContact CG1-CD2 4.44Å; V121-Y123 PolarHBondContact O-N 2.85Å
122L40.4Very low42.7Very low158 Ų158148.8 Ų148.883%0.82779%0.793SS**  trans-64.298.7165.3-178.174.1000110.3K124L122-K124 PolarHBondContact O-N 3.29Å
123Y36.5Very low42.9Very low214 Ų214149.3 Ų149.384%0.83980%0.8SS**  trans-74.9105.6160.4-114.8-98000107.7V121 S125V121-Y123 HydrophobicContact CG1-CD2 4.44Å; V121-Y123 PolarHBondContact O-N 2.85Å; Y123-S125 VanDerWaalsContact C-N 3.32Å; Y123-S125 PolarHBondContact O-N 3.4Å
124K36.4Very low42.6Very low183 Ų183147.9 Ų147.980%0.79680%0.799SS**  trans-65.294.9172-133.4175.7-177168.40107.5L122 V126L122-K124 PolarHBondContact O-N 3.29Å; K124-V126 PolarHBondContact O-N 3.05Å
125S37Very low42.1Very low105 Ų105147 Ų14773%0.73481%0.805SS**  trans-66.1108.6162.440.80000106.9Y123 S127Y123-S125 VanDerWaalsContact C-N 3.32Å; Y123-S125 PolarHBondContact O-N 3.4Å; S125-S127 PolarHBondContact O-N 3.44Å
126V39.2Very low41.9Very low147 Ų147143.4 Ų143.489%0.89181%0.806SS**  trans-66.488.41601490000106.1K124K124-V126 PolarHBondContact O-N 3.05Å
127S37.8Very low41.4Very low107 Ų107139.8 Ų139.875%0.74880%0.804SS**  trans-97111.1157.7-1680000106.3S125 E129S125-S127 PolarHBondContact O-N 3.44Å; S127-E129 PolarHBondContact O-N 2.93Å
128Q38.6Very low40.7Very low171 Ų171146.3 Ų146.380%0.79981%0.809SS**  trans-31.1110.7162.5174.3177.529.500113.5
129E38.7Very low40.6Very low180 Ų180147.4 Ų147.484%0.84182%0.821SS**  167145.1111.362.2-161.3117.800113.4S127S127-E129 PolarHBondContact O-N 2.93Å
130D35.6Very low40.3Very low149 Ų149141.5 Ų141.580%0.79781%0.812SS**  trans100.5112.5156-136.3-122.8000121.1
131V42.8Very low40Very low106 Ų106139.7 Ų139.764%0.64282%0.817SS**  trans63.898.1146.9178.70000119.1
132E32.8Very low39.9Very low179 Ų179143 Ų14384%0.83683%0.825SS**  171.3130.6111.3-112.4158.4104.100111.2
133L42.8Very low40.3Very low172 Ų172139.8 Ų139.890%0.90182%0.821SS**  trans-62.2146.8172.7-77.1152.7000111
134P38.1Very low41.1Very low126 Ų126137.9 Ų137.982%0.81883%0.825SS**  -141166.8117.331.9-14.4000114.7
135A42.3Very low41.9Very low105 Ų105134.3 Ų134.387%0.86881%0.814SS**  trans-70.7147.5-163.500000116.3
136G37.6Very low42.8Very low84 Ų84134.3 Ų134.387%0.86681%0.812SS**  trans98.2111136.700000117.3
137G31.9Very low43.7Very low75 Ų75133.2 Ų133.277%0.77380%0.801SS**  trans154.982.6159.800000114.4
138F42.5Very low44.6Very low222 Ų222138.5 Ų138.597%0.97480%0.804SS**  trans-59.7139.7171-87.9-104.6000112
139G45.7Very low45.3Very low81 Ų81136.8 Ų136.884%0.83580%0.8SS**  trans-177.744.9175.100000117.8
140G48.1Very low46.2Very low69 Ų69131.1 Ų131.171%0.71178%0.78SS**  trans90.883.8150.100000118.4
141L47.1Very low47.2Very low181 Ų181127 Ų12795%0.94877%0.767SS**  trans-143.587.5134.7-76.4-176.3000107.3A143L141-A143 PolarHBondContact O-N 3.44Å
142Q46.9Very low47.9Very low190 Ų190128.5 Ų128.589%0.88877%0.769SS**  trans-55.5129.9-179.8-171.1178.264.100110.5L144Q142-L144 PolarHBondContact O-N 3.19Å
143A48.5Very low49.1Very low89 Ų89130 Ų13074%0.73677%0.767SS**  trans-42.7119.3176.300000113L141 N145L141-A143 PolarHBondContact O-N 3.44Å; A143-N145 PolarHBondContact O-N 3.08Å
144L52.2Low49.7Very low175 Ų175127.2 Ų127.292%0.91675%0.749SS**  trans-67.5118.6167.4-69.3175.2000108.6Q142Q142-L144 PolarHBondContact O-N 3.19Å
145N54Low50.6Low107 Ų107124.3 Ų124.357%0.57274%0.736SS**  trans-65.8130-169.6-150.8-72.4000111.4A143 N147 R148A143-N145 PolarHBondContact O-N 3.08Å; N145-N147 PolarHBondContact O-N 3.04Å; N145-R148 PolarHBondContact O-N 3.42Å
146P56.6Low51.1Low105 Ų105127.6 Ų127.668%0.68273%0.731SS**THydrogen-bonded Turntrans-63.2-16.3-175.923.3-32.8000114.1R148P146-R148 VanDerWaalsContact C-N 3.32Å; P146-R148 PolarHBondContact O-N 3.08Å
147N58Low51.9Low124 Ų124127.5 Ų127.566%0.66372%0.722SS**Hα-helixtrans-72.7-18.3178.1-117.7-44.6000114.4N145 S150N145-N147 PolarHBondContact O-N 3.04Å; N147-S150 PolarHBondContact O-OG 3.22Å; N147-S150 VanDerWaalsContact O-OG 3.08Å
148R56.1Low52.9Low218 Ų218132.9 Ų132.982%0.82372%0.719SS**Hα-helixtrans-83.2-25.9176.9-84.5-158.6168.1-165.8-1.5113.7N145 P146N145-R148 PolarHBondContact O-N 3.42Å; P146-R148 VanDerWaalsContact C-N 3.32Å; P146-R148 PolarHBondContact O-N 3.08Å
149L53.8Low53.5Low136 Ų136126.9 Ų126.971%0.71271%0.705SS**Hα-helixtrans-78.4-30.4178.7-90.7157.7000112.7R153L149-R153 PolarHBondContact O-N 3.43Å
150S56.5Low54.2Low60 Ų60134.5 Ų134.542%0.4271%0.708SS.*Hα-helixtrans-69-41.5177.254.20000112.5N147 M152 R153 E154N147-S150 PolarHBondContact O-OG 3.22Å; N147-S150 VanDerWaalsContact O-OG 3.08Å; S150-M152 VanDerWaalsContact C-N 3.3Å; S150-M152 PolarHBondContact O-N 3.14Å; S150-R153 PolarHBondContact O-N 3.17Å; S150-R153 VanDerWaalsContact O-N 3.17Å; S150-E154 PolarHBondContact O-N 3.35Å; S150-E154 VanDerWaalsContact O-N 3.14Å
151A58Low54.4Low64 Ų64136.9 Ų136.953%0.52971%0.714SS.*Hα-helixtrans-61.9-35.4178.600000113.1A155A151-A155 PolarHBondContact O-N 3.32Å
152M57.4Low54.9Low136 Ų136136.2 Ų136.267%0.6771%0.71SS**Hα-helixtrans-69.5-38.6175.2-104.3-167.8155.400112.3S150 E154 F156S150-M152 VanDerWaalsContact C-N 3.3Å; S150-M152 PolarHBondContact O-N 3.14Å; M152-E154 VanDerWaalsContact C-N 3.32Å; M152-E154 PolarHBondContact O-N 3.42Å; M152-F156 WeakPolarHBondContact O-CD2 3.39Å
153R57.4Low55.2Low211 Ų211132.5 Ų132.580%0.79670%0.704SS**Hα-helixtrans-65.2-36.3177.2-177.5-178.9-72.7-99.51.4112.1L149 S150L149-R153 PolarHBondContact O-N 3.43Å; S150-R153 PolarHBondContact O-N 3.17Å; S150-R153 VanDerWaalsContact O-N 3.17Å
154E54.5Low55.9Low113 Ų113134.1 Ų134.153%0.52871%0.706SS.*Hα-helixtrans-76-28.2-177.4-162.2172.115600113.3S150 M152 F156 A157 R158S150-E154 PolarHBondContact O-N 3.35Å; S150-E154 VanDerWaalsContact O-N 3.14Å; M152-E154 VanDerWaalsContact C-N 3.32Å; M152-E154 PolarHBondContact O-N 3.42Å; E154-F156 VanDerWaalsContact C-N 3.33Å; E154-F156 PolarHBondContact O-N 3.46Å; E154-A157 PolarHBondContact O-N 3.39Å; E154-R158 IonicContact OE1-CZ 3.49Å; E154-R158 IonicContact OE1-NH1 3.89Å; E154-R158 PolarHBondContact OE1-NH1 2.79Å; E154-R158 IonicContact OE1-NH2 3.67Å
155A57.6Low55.9Low65 Ų65133.4 Ų133.454%0.53770%0.703SS.*Hα-helixtrans-68.5-27.3177.400000113.6A151A151-A155 PolarHBondContact O-N 3.32Å
156F52.8Low55.5Low174 Ų174137.9 Ų137.976%0.76373%0.733SS**THydrogen-bonded Turntrans-89.9-9.7177.8-75.4-82.2000114.1M152 E154M152-F156 WeakPolarHBondContact O-CD2 3.39Å; E154-F156 VanDerWaalsContact C-N 3.33Å; E154-F156 PolarHBondContact O-N 3.46Å
157A53.5Low55.4Low83 Ų83139.5 Ų139.569%0.68674%0.736SS**THydrogen-bonded Turntrans-88.8-1317800000113.7E154E154-A157 PolarHBondContact O-N 3.39Å
158R54.7Low55.3Low187 Ų187140.3 Ų140.371%0.70674%0.74SS**SBendtrans-87.91.1180-89.7-176175.387.9-0.9114.9E154E154-R158 IonicContact OE1-CZ 3.49Å; E154-R158 IonicContact OE1-NH1 3.89Å; E154-R158 PolarHBondContact OE1-NH1 2.79Å; E154-R158 IonicContact OE1-NH2 3.67Å
159S53.7Low55.2Low97 Ų97136 Ų13668%0.67874%0.735SS**  trans-98.426.3-172.3-49.80000115.3
160R60.1Low55.3Low240 Ų240136 Ų13691%0.90674%0.736SS**  trans-140.885.6172.1-79.1-171.1174-179.5-1.5112.5
161S52.9Low55.2Low120 Ų120140.8 Ų140.884%0.83976%0.756SS**  trans-178.399.8141.955.60000109.6
162I57.2Low55Low167 Ų167145.9 Ų145.986%0.85677%0.771SS**  trans-107106.9157.7-162.2157.4000105.9
163S54.4Low54.9Low111 Ų111146.6 Ų146.678%0.77678%0.779SS**  trans-89.7119.1170.6-170.30000106.5D165S163-D165 PolarHBondContact O-N 3.42Å
164T63.2Low54.7Low124 Ų124141.6 Ų141.676%0.76178%0.777SS**  trans-77111.3168.252.70000107.7
165D51.8Low54.7Low159 Ų159144 Ų14485%0.8580%0.798SS**  trans-95.8126.1162.4-159.1-114.8000106.8S163S163-D165 PolarHBondContact O-N 3.42Å
166V44.4Very low54.4Low201 Ų201151.2 Ų151.2100%1.21882%0.822SS**  trans-117.60175.3165.70000107.3

Retrieved 166 of 166 residues in 32.3 ms (Link to these results)