A0A087YD57_POEFO Loading...

Family with sequence similarity 163 member Aa

AlphaFold DB , UniProt , Accession A0A087YD57, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 163 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M58Low79.8Confident229 Ų22991.8 Ų91.8100%1.12859%0.586SS**  060.60-65.6168.572.300110.6
2T71.3Confident81.1Confident111 Ų11192.3 Ų92.368%0.68158%0.578SS**  trans-133.6-14.4-169.844.90000114.3T5T2-T5 PolarHBondContact O-OG1 2.93Å
3A70.1Confident82.1Confident79 Ų7993.6 Ų93.665%0.65358%0.578SS**Hα-helixtrans-74.6-34.1179.200000113.1V7A3-V7 WeakPolarHBondContact O-CG2 3.29Å
4G75.9Confident83Confident44 Ų4491.1 Ų91.145%0.45457%0.572SS.*Hα-helixtrans-72.7-35.3-177.200000113.9V7 I8G4-V7 PolarHBondContact O-N 3.36Å; G4-I8 VanDerWaalsContact O-CD1 3.31Å; G4-I8 WeakPolarHBondContact O-CD1 3.22Å; G4-I8 WeakPolarHBondContact O-CG1 3.46Å; G4-I8 PolarHBondContact O-N 2.95Å; G4-I8 VanDerWaalsContact O-N 3.09Å
5T78.4Confident83.8Confident82 Ų8290.1 Ų90.150%0.50357%0.565SS.*Hα-helixtrans-71.1-36.7-176.351.40000112.3T2 I8 T9T2-T5 PolarHBondContact O-OG1 2.93Å; T5-I8 PolarHBondContact O-N 2.98Å; T5-T9 WeakPolarHBondContact O-CB 3.45Å; T5-T9 WeakPolarHBondContact O-CG2 3.31Å; T5-T9 PolarHBondContact O-N 2.74Å; T5-T9 PolarHBondContact O-OG1 3.29Å
6V83.3Confident84.6Confident99 Ų9989.9 Ų89.960%0.656%0.562SS**Hα-helixtrans-66.9-36.7177.5-179.40000111.7T9 G10V6-T9 PolarHBondContact O-OG1 3.12Å; V6-G10 WeakPolarHBondContact O-CA 3.25Å; V6-G10 PolarHBondContact O-N 3.37Å
7V85.4Confident85.2Confident108 Ų10890.6 Ų90.666%0.65556%0.56SS**Hα-helixtrans-69.5-41.3175.6177.30000110.6A3 G4 G11A3-V7 WeakPolarHBondContact O-CG2 3.29Å; G4-V7 PolarHBondContact O-N 3.36Å; V7-G11 PolarHBondContact O-N 2.1Å
8I87.2Confident85.7Confident108 Ų10891.2 Ų91.255%0.55456%0.558SS**Hα-helixtrans-66.8-48.8178.6-65.8162.8000110.6G4 T5 G11 I12G4-I8 VanDerWaalsContact O-CD1 3.31Å; G4-I8 WeakPolarHBondContact O-CD1 3.22Å; G4-I8 WeakPolarHBondContact O-CG1 3.46Å; G4-I8 PolarHBondContact O-N 2.95Å; G4-I8 VanDerWaalsContact O-N 3.09Å; T5-I8 PolarHBondContact O-N 2.98Å; I8-G11 PolarHBondContact O-N 2.78Å; I8-I12 HydrophobicContact CG2-CD1 3.95Å; I8-I12 WeakPolarHBondContact O-CD1 3.36Å; I8-I12 VanDerWaalsContact O-CG1 3.23Å; I8-I12 WeakPolarHBondContact O-CG1 3.5Å; I8-I12 PolarHBondContact O-N 3.15Å
9T87.4Confident86.2Confident79 Ų7992.4 Ų92.449%0.48556%0.56SS.*Hα-helixtrans-68.8-40.917954.80000112.1T5 V6 G11 I12 L13T5-T9 WeakPolarHBondContact O-CB 3.45Å; T5-T9 WeakPolarHBondContact O-CG2 3.31Å; T5-T9 PolarHBondContact O-N 2.74Å; T5-T9 PolarHBondContact O-OG1 3.29Å; V6-T9 PolarHBondContact O-OG1 3.12Å; T9-G11 VanDerWaalsContact C-N 3.35Å; T9-G11 PolarHBondContact O-N 2.83Å; T9-I12 PolarHBondContact O-N 3.45Å; T9-L13 VanDerWaalsContact O-CG 3.3Å; T9-L13 WeakPolarHBondContact O-CG 3.27Å; T9-L13 PolarHBondContact O-N 3.01Å
10G89.5Confident86.6Confident35 Ų3591.5 Ų91.536%0.36156%0.557SS.*Hα-helixtrans-62.7-40.3175.300000112.5V6 L13 A14V6-G10 WeakPolarHBondContact O-CA 3.25Å; V6-G10 PolarHBondContact O-N 3.37Å; G10-L13 PolarHBondContact O-N 2.82Å; G10-A14 WeakPolarHBondContact O-CB 3.21Å; G10-A14 PolarHBondContact O-N 3.36Å
11G91.4Very high87Confident36 Ų3691.4 Ų91.437%0.37155%0.553SS.*Hα-helixtrans-63.7-44.1174.900000112.6V7 I8 T9 A14 T15V7-G11 PolarHBondContact O-N 2.1Å; I8-G11 PolarHBondContact O-N 2.78Å; T9-G11 VanDerWaalsContact C-N 3.35Å; T9-G11 PolarHBondContact O-N 2.83Å; G11-A14 PolarHBondContact O-N 3.5Å; G11-T15 WeakPolarHBondContact O-CG2 3.47Å; G11-T15 PolarHBondContact O-N 3Å; G11-T15 PolarHBondContact O-OG1 3.02Å
12I94.7Very high88.7Confident97 Ų9784.8 Ų84.850%0.49752%0.521SS..Hα-helixtrans-63.9-43.1176.4-64.8161.8000110.8I8 T9 A14 T15 V16I8-I12 HydrophobicContact CG2-CD1 3.95Å; I8-I12 WeakPolarHBondContact O-CD1 3.36Å; I8-I12 VanDerWaalsContact O-CG1 3.23Å; I8-I12 WeakPolarHBondContact O-CG1 3.5Å; I8-I12 PolarHBondContact O-N 3.15Å; T9-I12 PolarHBondContact O-N 3.45Å; I12-A14 VanDerWaalsContact C-N 3.34Å; I12-A14 PolarHBondContact O-N 3.47Å; I12-T15 PolarHBondContact O-N 2.9Å; I12-T15 PolarHBondContact O-OG1 3.06Å; I12-V16 HydrophobicContact CG2-CG2 4.37Å; I12-V16 WeakPolarHBondContact O-CB 3.09Å; I12-V16 VanDerWaalsContact O-CG2 3.22Å; I12-V16 WeakPolarHBondContact O-CG2 3.44Å; I12-V16 PolarHBondContact O-N 2.91Å
13L94.1Very high89.5Confident110 Ų11082.3 Ų82.358%0.57651%0.512SS*.Hα-helixtrans-62.9-42.8176.2-70.6169.7000111.2T9 G10 T15 V16 I17T9-L13 VanDerWaalsContact O-CG 3.3Å; T9-L13 WeakPolarHBondContact O-CG 3.27Å; T9-L13 PolarHBondContact O-N 3.01Å; G10-L13 PolarHBondContact O-N 2.82Å; L13-T15 PolarHBondContact O-N 2.85Å; L13-V16 PolarHBondContact O-N 3.45Å; L13-I17 WeakPolarHBondContact O-CB 2.95Å; L13-I17 WeakPolarHBondContact O-CD1 3.14Å; L13-I17 WeakPolarHBondContact O-CG1 3.48Å; L13-I17 PolarHBondContact O-N 2.72Å
14A94.8Very high90.4Very high59 Ų5982.2 Ų82.249%0.48850%0.503SS..Hα-helixtrans-62.1-43177.400000112.4G10 G11 I12 I17 L18G10-A14 WeakPolarHBondContact O-CB 3.21Å; G10-A14 PolarHBondContact O-N 3.36Å; G11-A14 PolarHBondContact O-N 3.5Å; I12-A14 VanDerWaalsContact C-N 3.34Å; I12-A14 PolarHBondContact O-N 3.47Å; A14-I17 PolarHBondContact O-N 3.24Å; A14-L18 WeakPolarHBondContact O-CB 3.21Å; A14-L18 PolarHBondContact O-N 3.22Å
15T94.9Very high90.9Very high76 Ų7685.1 Ų85.147%0.46651%0.507SS..Hα-helixtrans-67.8-40.7177.756.30000111.9G11 I12 L13 L18 L19G11-T15 WeakPolarHBondContact O-CG2 3.47Å; G11-T15 PolarHBondContact O-N 3Å; G11-T15 PolarHBondContact O-OG1 3.02Å; I12-T15 PolarHBondContact O-N 2.9Å; I12-T15 PolarHBondContact O-OG1 3.06Å; L13-T15 PolarHBondContact O-N 2.85Å; T15-L18 PolarHBondContact O-N 3.23Å; T15-L19 WeakPolarHBondContact O-CB 3.29Å; T15-L19 VanDerWaalsContact O-CG 3.27Å; T15-L19 WeakPolarHBondContact O-CG 3.36Å; T15-L19 PolarHBondContact O-N 2.87Å
16V96.6Very high91.3Very high86 Ų8685.1 Ų85.152%0.52151%0.51SS..Hα-helixtrans-63.3-43.6176.1171.80000111.3I12 L13 L19 C20I12-V16 HydrophobicContact CG2-CG2 4.37Å; I12-V16 WeakPolarHBondContact O-CB 3.09Å; I12-V16 VanDerWaalsContact O-CG2 3.22Å; I12-V16 WeakPolarHBondContact O-CG2 3.44Å; I12-V16 PolarHBondContact O-N 2.91Å; L13-V16 PolarHBondContact O-N 3.45Å; V16-L19 PolarHBondContact O-N 3.2Å; V16-C20 VanDerWaalsContact O-CB 3.27Å; V16-C20 WeakPolarHBondContact O-CB 3.32Å; V16-C20 PolarHBondContact O-N 3.31Å
17I95.6Very high91.2Very high102 Ų10286.6 Ų86.652%0.52351%0.505SS..Hα-helixtrans-63-46.4176.9-67.6163.1000110.4L13 A14 C20 I21L13-I17 WeakPolarHBondContact O-CB 2.95Å; L13-I17 WeakPolarHBondContact O-CD1 3.14Å; L13-I17 WeakPolarHBondContact O-CG1 3.48Å; L13-I17 PolarHBondContact O-N 2.72Å; A14-I17 PolarHBondContact O-N 3.24Å; I17-C20 WeakPolarHBondContact O-CB 3.29Å; I17-C20 PolarHBondContact O-N 3.3Å; I17-I21 HydrophobicContact CG2-CD1 3.91Å; I17-I21 WeakPolarHBondContact O-CG1 2.83Å; I17-I21 PolarHBondContact O-N 2.79Å
18L94.7Very high90.9Very high102 Ų10284.6 Ų84.653%0.53450%0.495SS..Hα-helixtrans-61.1-46.7178.1-178.166.8000111.7A14 T15 C20 I21 I22A14-L18 WeakPolarHBondContact O-CB 3.21Å; A14-L18 PolarHBondContact O-N 3.22Å; T15-L18 PolarHBondContact O-N 3.23Å; L18-C20 VanDerWaalsContact C-N 3.3Å; L18-C20 PolarHBondContact O-N 2.95Å; L18-I21 PolarHBondContact O-N 3.32Å; L18-I22 HydrophobicContact CD1-CD1 4.22Å; L18-I22 HydrophobicContact CG-CD1 3.92Å; L18-I22 VanDerWaalsContact O-CG1 3.31Å; L18-I22 WeakPolarHBondContact O-CG1 3.19Å; L18-I22 PolarHBondContact O-N 3.3Å
19L94.6Very high90.5Very high113 Ų11386.5 Ų86.559%0.59250%0.496SS*.Hα-helixtrans-62.1-38.5176.5-73.4174.4000111.7T15 V16 I22 A23T15-L19 WeakPolarHBondContact O-CB 3.29Å; T15-L19 VanDerWaalsContact O-CG 3.27Å; T15-L19 WeakPolarHBondContact O-CG 3.36Å; T15-L19 PolarHBondContact O-N 2.87Å; V16-L19 PolarHBondContact O-N 3.2Å; L19-I22 PolarHBondContact O-N 2.99Å; L19-A23 WeakPolarHBondContact O-CB 3.17Å; L19-A23 PolarHBondContact O-N 3.14Å
20C94.3Very high89.6Confident74 Ų7487.5 Ų87.550%0.550%0.498SS..Hα-helixtrans-62.8-46.3175.4-170.60000111.4V16 I17 L18 A23 V24V16-C20 VanDerWaalsContact O-CB 3.27Å; V16-C20 WeakPolarHBondContact O-CB 3.32Å; V16-C20 PolarHBondContact O-N 3.31Å; I17-C20 WeakPolarHBondContact O-CB 3.29Å; I17-C20 PolarHBondContact O-N 3.3Å; L18-C20 VanDerWaalsContact C-N 3.3Å; L18-C20 PolarHBondContact O-N 2.95Å; C20-A23 PolarHBondContact O-N 3.23Å; C20-V24 WeakPolarHBondContact O-CB 3.29Å; C20-V24 VanDerWaalsContact O-CG2 3.29Å; C20-V24 WeakPolarHBondContact O-CG2 3.25Å; C20-V24 PolarHBondContact O-N 2.92Å
21I94.3Very high88.2Confident91 Ų9188.2 Ų88.247%0.46749%0.492SS..Hα-helixtrans-61.5-47.3176.3-65.6166000110.5I17 L18 A23 V24 L25I17-I21 HydrophobicContact CG2-CD1 3.91Å; I17-I21 WeakPolarHBondContact O-CG1 2.83Å; I17-I21 PolarHBondContact O-N 2.79Å; L18-I21 PolarHBondContact O-N 3.32Å; I21-A23 VanDerWaalsContact C-N 3.35Å; I21-A23 PolarHBondContact O-N 3.18Å; I21-V24 PolarHBondContact O-N 3.19Å; I21-L25 HydrophobicContact CG2-CD1 3.79Å; I21-L25 HydrophobicContact CG2-CG 4.22Å; I21-L25 WeakPolarHBondContact O-CB 3.22Å; I21-L25 VanDerWaalsContact O-CG 3.25Å; I21-L25 WeakPolarHBondContact O-CG 3.44Å; I21-L25 PolarHBondContact O-N 2.95Å
22I94.1Very high86.9Confident90 Ų9092.8 Ų92.846%0.46250%0.499SS..Hα-helixtrans-62-43.4178.1-66.6167.3000110.8L18 L19 L25 C26L18-I22 HydrophobicContact CD1-CD1 4.22Å; L18-I22 HydrophobicContact CG-CD1 3.92Å; L18-I22 VanDerWaalsContact O-CG1 3.31Å; L18-I22 WeakPolarHBondContact O-CG1 3.19Å; L18-I22 PolarHBondContact O-N 3.3Å; L19-I22 PolarHBondContact O-N 2.99Å; I22-L25 PolarHBondContact O-N 3.49Å; I22-C26 WeakPolarHBondContact O-CB 3.38Å; I22-C26 PolarHBondContact O-N 3.18Å
23A87.9Confident84.9Confident59 Ų5994.2 Ų94.249%0.48850%0.499SS..Hα-helixtrans-62.5-44.8178.200000111.4L19 C20 I21 C26 Y27L19-A23 WeakPolarHBondContact O-CB 3.17Å; L19-A23 PolarHBondContact O-N 3.14Å; C20-A23 PolarHBondContact O-N 3.23Å; I21-A23 VanDerWaalsContact C-N 3.35Å; I21-A23 PolarHBondContact O-N 3.18Å; A23-C26 PolarHBondContact O-N 2.91Å; A23-Y27 WeakPolarHBondContact O-CB 3.25Å; A23-Y27 PolarHBondContact O-N 2.91Å
24V89.8Confident83.2Confident76 Ų7691.6 Ų91.646%0.46149%0.489SS..Hα-helixtrans-63.8-46.3175.2172.70000110.7C20 I21 C26 Y27 C28C20-V24 WeakPolarHBondContact O-CB 3.29Å; C20-V24 VanDerWaalsContact O-CG2 3.29Å; C20-V24 WeakPolarHBondContact O-CG2 3.25Å; C20-V24 PolarHBondContact O-N 2.92Å; I21-V24 PolarHBondContact O-N 3.19Å; V24-C26 PolarHBondContact O-N 2.72Å; V24-Y27 CarbonylContact O-C 3.58Å; V24-Y27 PolarHBondContact O-N 3.35Å; V24-C28 VanDerWaalsContact O-CB 3.29Å; V24-C28 WeakPolarHBondContact O-CB 3.22Å; V24-C28 PolarHBondContact O-N 3.1Å; V24-C28 PolarHBondContact O-SG 2.91Å
25L86.5Confident81.1Confident106 Ų10692 Ų9256%0.55549%0.487SS*.Hα-helixtrans-64.2-41.2178.4-71.2175.9000112.3I21 I22 Y27 R29I21-L25 HydrophobicContact CG2-CD1 3.79Å; I21-L25 HydrophobicContact CG2-CG 4.22Å; I21-L25 WeakPolarHBondContact O-CB 3.22Å; I21-L25 VanDerWaalsContact O-CG 3.25Å; I21-L25 WeakPolarHBondContact O-CG 3.44Å; I21-L25 PolarHBondContact O-N 2.95Å; I22-L25 PolarHBondContact O-N 3.49Å; L25-Y27 VanDerWaalsContact C-N 3.35Å; L25-R29 VanDerWaalsContact O-CB 3.25Å; L25-R29 WeakPolarHBondContact O-CB 3.45Å; L25-R29 VanDerWaalsContact O-CG 3.29Å; L25-R29 WeakPolarHBondContact O-CG 3.33Å; L25-R29 PolarHBondContact O-N 3.14Å
26C87.3Confident78.9Confident81 Ų8195 Ų9555%0.54749%0.494SS..Hα-helixtrans-64-42.3174.7-175.30000110.6I22 A23 V24 R29 L30I22-C26 WeakPolarHBondContact O-CB 3.38Å; I22-C26 PolarHBondContact O-N 3.18Å; A23-C26 PolarHBondContact O-N 2.91Å; V24-C26 PolarHBondContact O-N 2.72Å; C26-R29 PolarHBondContact O-N 3.24Å; C26-L30 WeakPolarHBondContact O-CB 3.27Å; C26-L30 PolarHBondContact O-N 2.96Å
27Y81.3Confident76.4Confident130 Ų13097.2 Ų97.251%0.5150%0.497SS..Hα-helixtrans-69.6-41.2177.5-175.6-114.9000112.2A23 V24 L25 R29 L30 Q31A23-Y27 WeakPolarHBondContact O-CB 3.25Å; A23-Y27 PolarHBondContact O-N 2.91Å; V24-Y27 CarbonylContact O-C 3.58Å; V24-Y27 PolarHBondContact O-N 3.35Å; L25-Y27 VanDerWaalsContact C-N 3.35Å; Y27-R29 VanDerWaalsContact C-N 3.35Å; Y27-L30 PolarHBondContact O-N 2.73Å; Y27-Q31 HydrophobicContact CD1-CG 4.43Å; Y27-Q31 VanDerWaalsContact CD1-NE2 3.31Å; Y27-Q31 HydrophobicContact CD2-CG 4.46Å; Y27-Q31 HydrophobicContact CE1-CG 4.12Å; Y27-Q31 HydrophobicContact CE2-CG 4.1Å; Y27-Q31 VanDerWaalsContact CZ-NE2 3.32Å; Y27-Q31 VanDerWaalsContact O-CB 3.27Å; Y27-Q31 WeakPolarHBondContact O-CB 3.46Å; Y27-Q31 WeakPolarHBondContact O-CG 3.37Å; Y27-Q31 PolarHBondContact O-N 2.82Å
28C78Confident74.1Confident66 Ų6698.6 Ų98.645%0.44651%0.505SS..Hα-helixtrans-64.8-39.3173.7-70.80000111.2V24 Y32V24-C28 VanDerWaalsContact O-CB 3.29Å; V24-C28 WeakPolarHBondContact O-CB 3.22Å; V24-C28 PolarHBondContact O-N 3.1Å; V24-C28 PolarHBondContact O-SG 2.91Å; C28-Y32 WeakPolarHBondContact O-CB 3.1Å; C28-Y32 PolarHBondContact O-N 3.4Å
29R79.1Confident71.7Confident148 Ų14897.2 Ų97.256%0.55852%0.515SS*.Hα-helixtrans-65.7-48.3172.2-80.4-70.1-173.8-177.40.2110.7L25 C26 Y27 Q31 Y32 Y33L25-R29 VanDerWaalsContact O-CB 3.25Å; L25-R29 WeakPolarHBondContact O-CB 3.45Å; L25-R29 VanDerWaalsContact O-CG 3.29Å; L25-R29 WeakPolarHBondContact O-CG 3.33Å; L25-R29 PolarHBondContact O-N 3.14Å; C26-R29 PolarHBondContact O-N 3.24Å; Y27-R29 VanDerWaalsContact C-N 3.35Å; R29-Q31 VanDerWaalsContact C-N 3.34Å; R29-Q31 PolarHBondContact O-N 2.68Å; R29-Y32 CarbonylContact O-C 3.53Å; R29-Y32 WeakPolarHBondContact O-CA 3.31Å; R29-Y32 WeakPolarHBondContact O-CB 3.38Å; R29-Y32 PolarHBondContact O-N 3.21Å; R29-Y32 VanDerWaalsContact O-N 3.1Å; R29-Y33 VanDerWaalsContact C-CD2 3.46Å; R29-Y33 HydrophobicContact CB-CD2 4.22Å; R29-Y33 HydrophobicContact CB-CE2 3.91Å; R29-Y33 HydrophobicContact CG-CE2 4.48Å; R29-Y33 WeakPolarHBondContact O-CD2 3.3Å; R29-Y33 PolarHBondContact O-N 3.45Å
30L67.7Low69.4Low101 Ų10195.9 Ų95.953%0.52952%0.515SS..Hα-helixtrans-62.5-42.1179.3-171.364.2000110.8C26 Y27 Y33 C34C26-L30 WeakPolarHBondContact O-CB 3.27Å; C26-L30 PolarHBondContact O-N 2.96Å; Y27-L30 PolarHBondContact O-N 2.73Å; L30-Y33 CarbonylContact O-C 3.48Å; L30-Y33 PolarHBondContact O-N 2.75Å; L30-C34 VanDerWaalsContact O-CB 3.32Å; L30-C34 WeakPolarHBondContact O-CB 3.32Å; L30-C34 PolarHBondContact O-N 3.32Å; L30-C34 PolarHBondContact O-SG 2.8Å
31Q61.2Low66.9Low50 Ų5097.6 Ų97.623%0.23452%0.519CS..Hα-helixtrans-62.8-41.9170.9-79.4-161.677.900111.9Y27 R29 Y33 C34 C35Y27-Q31 HydrophobicContact CD1-CG 4.43Å; Y27-Q31 VanDerWaalsContact CD1-NE2 3.31Å; Y27-Q31 HydrophobicContact CD2-CG 4.46Å; Y27-Q31 HydrophobicContact CE1-CG 4.12Å; Y27-Q31 HydrophobicContact CE2-CG 4.1Å; Y27-Q31 VanDerWaalsContact CZ-NE2 3.32Å; Y27-Q31 VanDerWaalsContact O-CB 3.27Å; Y27-Q31 WeakPolarHBondContact O-CB 3.46Å; Y27-Q31 WeakPolarHBondContact O-CG 3.37Å; Y27-Q31 PolarHBondContact O-N 2.82Å; R29-Q31 VanDerWaalsContact C-N 3.34Å; R29-Q31 PolarHBondContact O-N 2.68Å; Q31-Y33 VanDerWaalsContact C-N 3.28Å; Q31-Y33 PolarHBondContact O-N 3.17Å; Q31-C34 PolarHBondContact O-N 2.88Å; Q31-C35 VanDerWaalsContact O-CB 3.25Å; Q31-C35 WeakPolarHBondContact O-CB 3.43Å; Q31-C35 PolarHBondContact O-N 3.48Å; Q31-C35 PolarHBondContact O-SG 2.84Å
32Y62.9Low64.5Low132 Ų13299.5 Ų99.552%0.51854%0.541SS..Hα-helixtrans-60.8-38.8173.1176.6-98.7000111.8C28 R29 K36C28-Y32 WeakPolarHBondContact O-CB 3.1Å; C28-Y32 PolarHBondContact O-N 3.4Å; R29-Y32 CarbonylContact O-C 3.53Å; R29-Y32 WeakPolarHBondContact O-CA 3.31Å; R29-Y32 WeakPolarHBondContact O-CB 3.38Å; R29-Y32 PolarHBondContact O-N 3.21Å; R29-Y32 VanDerWaalsContact O-N 3.1Å; Y32-K36 HydrophobicContact CE1-CD 4.44Å; Y32-K36 WeakPolarHBondContact O-CB 3.4Å; Y32-K36 PolarHBondContact O-N 2.76Å
33Y54.3Low62.1Low127 Ų12798 Ų9850%0.49855%0.547SS..Hα-helixtrans-73.8-34.8175.2-68.2-62.8000112.2R29 L30 Q31 K37R29-Y33 VanDerWaalsContact C-CD2 3.46Å; R29-Y33 HydrophobicContact CB-CD2 4.22Å; R29-Y33 HydrophobicContact CB-CE2 3.91Å; R29-Y33 HydrophobicContact CG-CE2 4.48Å; R29-Y33 WeakPolarHBondContact O-CD2 3.3Å; R29-Y33 PolarHBondContact O-N 3.45Å; L30-Y33 CarbonylContact O-C 3.48Å; L30-Y33 PolarHBondContact O-N 2.75Å; Q31-Y33 VanDerWaalsContact C-N 3.28Å; Q31-Y33 PolarHBondContact O-N 3.17Å; Y33-K37 WeakPolarHBondContact O-CA 3.37Å; Y33-K37 WeakPolarHBondContact O-CB 3.49Å; Y33-K37 PolarHBondContact O-N 3.43Å
34C57.3Low59.6Low55 Ų55100.3 Ų100.337%0.37256%0.56SS.*Hα-helixtrans-68.2-51.6173.5-71.30000109.7L30 Q31 K36 K37 N38L30-C34 VanDerWaalsContact O-CB 3.32Å; L30-C34 WeakPolarHBondContact O-CB 3.32Å; L30-C34 PolarHBondContact O-N 3.32Å; L30-C34 PolarHBondContact O-SG 2.8Å; Q31-C34 PolarHBondContact O-N 2.88Å; C34-K36 VanDerWaalsContact C-N 3.29Å; C34-K36 PolarHBondContact O-N 3.37Å; C34-K37 PolarHBondContact O-N 2.83Å; C34-N38 WeakPolarHBondContact O-CB 3.4Å; C34-N38 PolarHBondContact O-N 3.24Å; C34-N38 PolarHBondContact O-ND2 3.47Å; C34-N38 PolarHBondContact O-OD1 3.35Å
35C50.6Low57.2Low67 Ų67104.7 Ų104.745%0.45358%0.58SS.*Hα-helixtrans-58.9-38.1175.2-66.40000112.3Q31Q31-C35 VanDerWaalsContact O-CB 3.25Å; Q31-C35 WeakPolarHBondContact O-CB 3.43Å; Q31-C35 PolarHBondContact O-N 3.48Å; Q31-C35 PolarHBondContact O-SG 2.84Å
36K48.3Very low54.7Low138 Ų138105 Ų10560%0.659%0.591SS**Hα-helixtrans-73.5-41.1175-176.5170177175.80113Y32 C34 G39Y32-K36 HydrophobicContact CE1-CD 4.44Å; Y32-K36 WeakPolarHBondContact O-CB 3.4Å; Y32-K36 PolarHBondContact O-N 2.76Å; C34-K36 VanDerWaalsContact C-N 3.29Å; C34-K36 PolarHBondContact O-N 3.37Å; K36-G39 PolarHBondContact O-N 2.77Å
37K44Very low52.4Low134 Ų134110.3 Ų110.358%0.58361%0.608SS**Hα-helixtrans-73.5-33.9-178.8-174.1173.6177.9-175.80112.2Y33 C34 G39 S40 D41Y33-K37 WeakPolarHBondContact O-CA 3.37Å; Y33-K37 WeakPolarHBondContact O-CB 3.49Å; Y33-K37 PolarHBondContact O-N 3.43Å; C34-K37 PolarHBondContact O-N 2.83Å; K37-G39 PolarHBondContact O-N 2.74Å; K37-S40 PolarHBondContact O-N 3.49Å; K37-D41 PolarHBondContact O-N 2.73Å; K37-D41 VanDerWaalsContact O-N 3.14Å
38N47.2Very low50.4Low131 Ų131112 Ų11270%0.70162%0.62SS**THydrogen-bonded Turntrans-64.9-20.6172.8-60.7-1000112.2C34C34-N38 WeakPolarHBondContact O-CB 3.4Å; C34-N38 PolarHBondContact O-N 3.24Å; C34-N38 PolarHBondContact O-ND2 3.47Å; C34-N38 PolarHBondContact O-OD1 3.35Å
39G45.9Very low48.6Very low72 Ų72117.3 Ų117.374%0.74264%0.638SS**THydrogen-bonded Turntrans-87.8-8.4171.900000114.5K36 K37K36-G39 PolarHBondContact O-N 2.77Å; K37-G39 PolarHBondContact O-N 2.74Å
40S44.9Very low46.7Very low85 Ų85119.9 Ų119.959%0.59465%0.654SS**THydrogen-bonded Turntrans-120-22.2-170.9-166.40000115.6K37K37-S40 PolarHBondContact O-N 3.49Å
41D41.6Very low45.4Very low111 Ų111118.1 Ų118.159%0.59465%0.653SS**  trans-130.772.4-178-63.2-40.3000111.5K37 G43K37-D41 PolarHBondContact O-N 2.73Å; K37-D41 VanDerWaalsContact O-N 3.14Å; D41-G43 PolarHBondContact O-N 3.07Å
42S44.3Very low44.4Very low131 Ų131118.2 Ų118.292%0.91666%0.659SS**  trans-69.183.7159.755.40000108.9
43G43.7Very low43.7Very low57 Ų57118.2 Ų118.259%0.58867%0.668SS**  trans-164.876.9-175.700000113.5D41D41-G43 PolarHBondContact O-N 3.07Å
44S35.6Very low43.3Very low109 Ų109115.9 Ų115.976%0.76268%0.675SS**  trans72.8120.5156.372.70000119.6
45L40.6Very low42.9Very low167 Ų167116 Ų11687%0.87468%0.676SS**  trans64.977.3141.2-60.6161000117.5
46S32.5Very low42.6Very low113 Ų113116.1 Ų116.179%0.7968%0.678SS**  trans-15582.7135.332.20000109.8Q48S46-Q48 PolarHBondContact O-N 3.49Å
47Q38.7Very low42.1Very low193 Ų193115.9 Ų115.990%0.90268%0.681SS**  trans-54.481.2156.4179.8-179.6-2.600109.7
48Q40.4Very low41.9Very low165 Ų165115.1 Ų115.177%0.77169%0.688SS**  trans-140.874.7163-94-175.2-2800108.8S46 F50S46-Q48 PolarHBondContact O-N 3.49Å; Q48-F50 VanDerWaalsContact C-N 3.29Å; Q48-F50 PolarHBondContact O-N 2.93Å
49H40.5Very low41.6Very low177 Ų177111.8 Ų111.882%0.81969%0.685SS**  23.862.5124.7-151.1-93.6000116.9
50F39Very low41.8Very low203 Ų203115.8 Ų115.889%0.8969%0.688SS**  trans-120.577.1145.7-81.9-82.3000106.1Q48 C52Q48-F50 VanDerWaalsContact C-N 3.29Å; Q48-F50 PolarHBondContact O-N 2.93Å; F50-C52 PolarHBondContact O-N 2.94Å
51A39.1Very low41.5Very low63 Ų63119.4 Ų119.452%0.52170%0.701SS.*  trans-52112.2167.700000107.9N53A51-N53 VanDerWaalsContact CB-OD1 3.31Å; A51-N53 WeakPolarHBondContact CB-OD1 3.23Å; A51-N53 PolarHBondContact O-N 3.24Å; A51-N53 PolarHBondContact O-OD1 2.89Å; A51-N53 VanDerWaalsContact O-OD1 3.06Å
52C41.7Very low41.2Very low53 Ų53117.5 Ų117.536%0.35871%0.708SS.*  trans-70.488.6165.2-176.60000106.3F50 A54 C55F50-C52 PolarHBondContact O-N 2.94Å; C52-A54 PolarHBondContact O-N 3.46Å; C52-C55 PolarHBondContact O-N 3.28Å; C52-C55 VanDerWaalsContact O-N 3.15Å
53N47.5Very low41.3Very low131 Ų131117.2 Ų117.270%0.70170%0.703SS**THydrogen-bonded Turntrans-60.2-5.1-176.3-58.3-24.3000113.4A51 S56A51-N53 VanDerWaalsContact CB-OD1 3.31Å; A51-N53 WeakPolarHBondContact CB-OD1 3.23Å; A51-N53 PolarHBondContact O-N 3.24Å; A51-N53 PolarHBondContact O-OD1 2.89Å; A51-N53 VanDerWaalsContact O-OD1 3.06Å; N53-S56 PolarHBondContact O-OG 3.44Å
54A46.2Very low40.9Very low79 Ų79122.5 Ų122.565%0.65372%0.715SS**THydrogen-bonded Turntrans-93.9-20.2178.600000114.5C52C52-A54 PolarHBondContact O-N 3.46Å
55C48.4Very low41.1Very low58 Ų58124.2 Ų124.239%0.39272%0.715SS.*THydrogen-bonded Turntrans-105.3-0.1172.1-75.50000112.8C52 I57 C92C52-C55 PolarHBondContact O-N 3.28Å; C52-C55 VanDerWaalsContact O-N 3.15Å; C55-I57 VanDerWaalsContact C-N 3.28Å; C55-I57 PolarHBondContact O-N 2.82Å; C55-I57 VanDerWaalsContact O-N 3.12Å; C55-C92 HydrophobicContact CB-CB 4.44Å; C55-C92 WeakPolarHBondContact CB-SG 3.31Å; C55-C92 WeakPolarHBondContact SG-CB 3.27Å; C55-C92 CovalentContact SG-SG 2.1Å; C55-C92 PolarHBondContact SG-SG 2.94Å
56S44.9Very low40.7Very low69 Ų69122 Ų12248%0.48371%0.709SS.*  trans-82.277.2164.957.90000109.3N53 T58N53-S56 PolarHBondContact O-OG 3.44Å; S56-T58 VanDerWaalsContact C-N 3.31Å; S56-T58 PolarHBondContact O-N 3.44Å
57I36.4Very low40.8Very low132 Ų132122.6 Ų122.668%0.67771%0.709SS**  trans-59.8108.8153.4-74.4171.1000104.4C55 G59C55-I57 VanDerWaalsContact C-N 3.28Å; C55-I57 PolarHBondContact O-N 2.82Å; C55-I57 VanDerWaalsContact O-N 3.12Å; I57-G59 PolarHBondContact O-N 2.91Å
58T40.5Very low40.7Very low119 Ų119121.1 Ų121.173%0.7371%0.707SS**  trans-57.687.7164.8-49.20000106.3S56 L60S56-T58 VanDerWaalsContact C-N 3.31Å; S56-T58 PolarHBondContact O-N 3.44Å; T58-L60 VanDerWaalsContact C-N 3.26Å; T58-L60 PolarHBondContact O-N 2.88Å
59G40.9Very low40.3Very low60 Ų60119.1 Ų119.162%0.61971%0.711SS**  trans-57.9101.1159.100000105.5I57 D61I57-G59 PolarHBondContact O-N 2.91Å; G59-D61 PolarHBondContact O-N 3.46Å
60L49.6Very low40Very low157 Ų157118.4 Ų118.482%0.82271%0.713SS**  trans-67.788.4174.5-167.690.6000107.3T58T58-L60 VanDerWaalsContact C-N 3.26Å; T58-L60 PolarHBondContact O-N 2.88Å
61D39.6Very low39.6Very low161 Ų161114.3 Ų114.386%0.86171%0.709SS**  trans-136.3112.4155.9-80.8-47000107.4G59G59-D61 PolarHBondContact O-N 3.46Å
62G35.6Very low39.6Very low71 Ų71117 Ų11773%0.73272%0.721SS**  trans-79.1-148.1-174.300000114.3
63P45.9Very low39.8Very low125 Ų125120.1 Ų120.181%0.81274%0.741SS**  -124.5139.3-102.733.8-19.8000112.9
64I36.1Very low39.1Very low167 Ų167123.2 Ų123.286%0.85675%0.751SS**  trans-146.8104.8157.8-47.2177.3000103
65I38.6Very low38.9Very low146 Ų146124.8 Ų124.875%0.74975%0.754SS**  -154.7133.974.6-68.1160.7000108.9
66T32.3Very low38.3Very low121 Ų121126.4 Ų126.474%0.74277%0.772SS**  trans-30.3146.4164.740.90000116.9
67P35.4Very low37.5Very low124 Ų124133 Ų13381%0.80579%0.792SS**  -126.3143.8102.735.9-29.4000113.7
68L35.4Very low37.7Very low162 Ų162131.2 Ų131.285%0.84879%0.791SS**  trans-19.3121.8175.9-73.759.6000117.4
69S32Very low37.3Very low124 Ų124135 Ų13587%0.86780%0.798SS**  trans-162.5144.9137.8-140.90000111.3
70L34.7Very low37.1Very low162 Ų162138.8 Ų138.885%0.84880%0.804SS**  trans-80.9151.1-160.8-71.982.7000115.5
71S31Very low36.6Very low117 Ų117137.2 Ų137.282%0.81880%0.804SS**  trans102.4158.3148.399.60000118.7
72P38.8Very low36.4Very low119 Ų119135.4 Ų135.477%0.77380%0.799SS**  -129.6-161.5-114.846-25.4000114.4
73P46.7Very low36.4Very low118 Ų118140.6 Ų140.677%0.76680%0.801SS**  -111.8167.5-115.134.1-13.3000116
74E31.7Very low35.8Very low196 Ų196142 Ų14292%0.91680%0.8SS**  trans-178.5158.9144.7-99.3-159.8136.500113.3
75P43Very low36.1Very low112 Ų112140.6 Ų140.673%0.72780%0.8SS**  trans-123.3164.4-135.441.2-27.9000118.7
76A34.2Very low36Very low93 Ų93139.9 Ų139.977%0.76980%0.802SS**  trans63.7125.4143.900000121.9
77K28.9Very low36.3Very low207 Ų207136.8 Ų136.890%0.979%0.794SS**  -157.4113.4126.2-107.4166.8-161.9179.50112.2
78S40.8Very low36.6Very low94 Ų94140 Ų14066%0.65780%0.799SS**  trans-45.1138.7162.6161.70000112.5
79F32.2Very low37Very low198 Ų198138.7 Ų138.787%0.86879%0.788SS**  trans-156.2108.1131-94.2-74.3000109.8
80N36.9Very low37.5Very low140 Ų140142.2 Ų142.275%0.74979%0.79SS**  trans-75.9147.2154.8-77.1-49.8000108.4
81P38.6Very low37.9Very low125 Ų125143.4 Ų143.481%0.81279%0.785SS**  -130.6133.4120.931.5-19.6000112.7
82T35Very low38.6Very low123 Ų123139.4 Ų139.476%0.75576%0.756SS**  trans-63.7135.7177.9-50.40000112.2
83K35.8Very low39.2Very low179 Ų179137.2 Ų137.278%0.77874%0.742SS**  trans70.6108.1143-167-175.6-172.2-174.80117.1
84L33.7Very low39.3Very low154 Ų154137 Ų13781%0.80674%0.739SS**  -165.8117.3108.8-116.4102.3000110.8V86L84-V86 PolarHBondContact O-N 2.99Å
85T43.4Very low40.2Very low138 Ų138131.3 Ų131.385%0.84772%0.72SS**  trans-68.2105.6167.640.80000110.8
86V36.3Very low40.2Very low131 Ų131128.4 Ų128.479%0.79470%0.703SS**  trans-147.3108.8152.5179.70000107.9L84 Q88L84-V86 PolarHBondContact O-N 2.99Å; V86-Q88 PolarHBondContact O-N 3.09Å
87G38.7Very low41Very low56 Ų56129.6 Ų129.658%0.57770%0.702SS**  trans34.279.2161.800000118H89G87-H89 PolarHBondContact O-CD2 3.13Å; G87-H89 VanDerWaalsContact O-CD2 3.29Å; G87-H89 PolarHBondContact O-N 2.92Å
88Q41.2Very low41.8Very low193 Ų193125.9 Ų125.990%0.90268%0.684SS**  trans-70.679.1160.7-93.6-174-29.200109.2V86 H90V86-Q88 PolarHBondContact O-N 3.09Å; Q88-H90 PolarHBondContact O-N 3.38Å
89H42.6Very low42.2Very low133 Ų133126.8 Ų126.862%0.61668%0.681SS**  trans-61.5124.5164.3-69.8-82.6000108.3G87 Y91G87-H89 PolarHBondContact O-CD2 3.13Å; G87-H89 VanDerWaalsContact O-CD2 3.29Å; G87-H89 PolarHBondContact O-N 2.92Å; H89-Y91 HydrophobicContact CB-CD2 3.48Å; H89-Y91 VanDerWaalsContact CB-CD2 3.48Å; H89-Y91 HydrophobicContact CB-CE2 3.15Å; H89-Y91 AromaticContact CG-CE2 3.87Å; H89-Y91 WeakPolarHBondContact O-CD2 3.37Å; H89-Y91 PolarHBondContact O-N 3.41Å
90H42.8Very low43.1Very low198 Ų198120.1 Ų120.192%0.91766%0.659SS**  trans-65.576.9173.7-66.2-91.8000110.4Q88Q88-H90 PolarHBondContact O-N 3.38Å
91Y43.5Very low43.9Very low187 Ų187119.5 Ų119.573%0.73366%0.662SS**  trans-86.6111.1169.7-71.2-73.7000108.5H89 P93H89-Y91 HydrophobicContact CB-CD2 3.48Å; H89-Y91 VanDerWaalsContact CB-CD2 3.48Å; H89-Y91 HydrophobicContact CB-CE2 3.15Å; H89-Y91 AromaticContact CG-CE2 3.87Å; H89-Y91 WeakPolarHBondContact O-CD2 3.37Å; H89-Y91 PolarHBondContact O-N 3.41Å; Y91-P93 WeakPolarHBondContact O-CD 3.31Å
92C46.4Very low44.6Very low33 Ų33122.3 Ų122.322%0.22366%0.662CS.*  trans-70.9119.4168.5-161.20000106.5C55 T94 C95C55-C92 HydrophobicContact CB-CB 4.44Å; C55-C92 WeakPolarHBondContact CB-SG 3.31Å; C55-C92 WeakPolarHBondContact SG-CB 3.27Å; C55-C92 CovalentContact SG-SG 2.1Å; C55-C92 PolarHBondContact SG-SG 2.94Å; C92-T94 PolarHBondContact O-N 2.88Å; C92-C95 HydrophobicContact CB-CB 4.36Å; C92-C95 PolarHBondContact O-N 2.85Å
93P49.9Very low45.5Very low74 Ų74121 Ų12148%0.48164%0.644SS.*THydrogen-bonded Turntrans-62.5-16.4-171.722.9-32.1000113.1Y91Y91-P93 WeakPolarHBondContact O-CD 3.31Å
94T49.6Very low46.4Very low113 Ų113119 Ų11969%0.69364%0.641SS**THydrogen-bonded Turntrans-88.5-8.4177.12.70000114.8C92C92-T94 PolarHBondContact O-N 2.88Å
95C50.6Low47.4Very low76 Ų76121.3 Ų121.351%0.51464%0.639SS.*SBendtrans-110.95.3-172.3-67.60000114.1C92 P97C92-C95 HydrophobicContact CB-CB 4.36Å; C92-C95 PolarHBondContact O-N 2.85Å; C95-P97 WeakPolarHBondContact O-CD 3.18Å
96S44.3Very low47.9Very low52 Ų52119.8 Ų119.836%0.36463%0.63SS.*  trans-86.2119.8170.61470000108.8Y98 D99S96-Y98 PolarHBondContact O-N 3.49Å; S96-Y98 PolarHBondContact OG-N 3.34Å; S96-D99 PolarHBondContact O-N 3.32Å; S96-D99 PolarHBondContact OG-N 3.48Å
97P49.2Very low48.6Very low118 Ų118118.1 Ų118.177%0.76662%0.62SS**THydrogen-bonded Turntrans-63.5-2.7174-19.231.6000114C95C95-P97 WeakPolarHBondContact O-CD 3.18Å
98Y47.3Very low49.2Very low129 Ų129123.2 Ų123.251%0.50663%0.634SS.*THydrogen-bonded Turntrans-110.53.4-169.6-95.1-111.4000113.9S96 S100 Y103S96-Y98 PolarHBondContact O-N 3.49Å; S96-Y98 PolarHBondContact OG-N 3.34Å; Y98-S100 VanDerWaalsContact C-N 3.29Å; Y98-S100 PolarHBondContact O-N 3.39Å; Y98-Y103 AromaticContact CD1-CD1 3.27Å; Y98-Y103 HydrophobicContact CD1-CD1 3.27Å; Y98-Y103 HydrophobicContact CD1-CD2 4.31Å; Y98-Y103 AromaticContact CD1-CE1 3.34Å; Y98-Y103 HydrophobicContact CD1-CE1 3.34Å; Y98-Y103 HydrophobicContact CD1-CE2 4.31Å; Y98-Y103 AromaticContact CD1-CG 3.82Å; Y98-Y103 HydrophobicContact CD1-CG 3.82Å; Y98-Y103 AromaticContact CD1-CZ 3.87Å; Y98-Y103 HydrophobicContact CD2-CE2 4.27Å; Y98-Y103 AromaticContact CE1-CD1 3.35Å; Y98-Y103 HydrophobicContact CE1-CD1 3.35Å; Y98-Y103 HydrophobicContact CE1-CD2 4.48Å; Y98-Y103 AromaticContact CE1-CE1 2.83Å; Y98-Y103 HydrophobicContact CE1-CE1 2.83Å; Y98-Y103 HydrophobicContact CE1-CE2 4.06Å; Y98-Y103 HydrophobicContact CE1-CG 4.17Å; Y98-Y103 AromaticContact CE1-CZ 3.24Å; Y98-Y103 HydrophobicContact CE2-CE1 4.18Å; Y98-Y103 AromaticContact CE2-CE2 3.94Å; Y98-Y103 HydrophobicContact CE2-CE2 3.94Å; Y98-Y103 AromaticContact CE2-CZ 3.71Å; Y98-Y103 HydrophobicContact CG-CD1 4.08Å; Y98-Y103 HydrophobicContact CG-CD2 4.37Å; Y98-Y103 HydrophobicContact CG-CE1 4.23Å; Y98-Y103 HydrophobicContact CG-CE2 4.45Å; Y98-Y103 HydrophobicContact CG-CG 4.19Å; Y98-Y103 AromaticContact CZ-CE1 3.31Å; Y98-Y103 AromaticContact CZ-CE2 3.84Å; Y98-Y103 AromaticContact CZ-CZ 3.12Å; Y98-Y103 VanDerWaalsContact OH-CZ 3.31Å; Y98-Y103 PolarHBondContact OH-OH 2.97Å
99D49.1Very low49.9Very low112 Ų112121.8 Ų121.860%0.59963%0.627SS**  trans-91.917.1-178.3-135.8-16000113.5S96S96-D99 PolarHBondContact O-N 3.32Å; S96-D99 PolarHBondContact OG-N 3.48Å
100S49.5Very low50.4Low59 Ų59122.3 Ų122.341%0.41363%0.633SS.*SBendtrans-83.3133.9170.193.30000108.9Y98 F102 Y103Y98-S100 VanDerWaalsContact C-N 3.29Å; Y98-S100 PolarHBondContact O-N 3.39Å; S100-F102 PolarHBondContact O-N 3.49Å; S100-Y103 PolarHBondContact O-N 2.98Å; S100-Y103 PolarHBondContact OG-N 2.93Å
101P54.7Low50.9Low126 Ų126124 Ų12482%0.81863%0.631SS**THydrogen-bonded Turntrans-64.9-2.9178.327.5-34.4000113.3
102F53Low51.3Low185 Ų185123.7 Ų123.781%0.81164%0.642SS**THydrogen-bonded Turntrans-101.71.8175-60-75.6000113.3S100 I104S100-F102 PolarHBondContact O-N 3.49Å; F102-I104 PolarHBondContact O-N 3.39Å
103Y53.2Low51.8Low94 Ų94125.6 Ų125.637%0.36967%0.668SS.*  trans-80101.4174.6-161.1-77.8000109.9Y98 S100 R105Y98-Y103 AromaticContact CD1-CD1 3.27Å; Y98-Y103 HydrophobicContact CD1-CD1 3.27Å; Y98-Y103 HydrophobicContact CD1-CD2 4.31Å; Y98-Y103 AromaticContact CD1-CE1 3.34Å; Y98-Y103 HydrophobicContact CD1-CE1 3.34Å; Y98-Y103 HydrophobicContact CD1-CE2 4.31Å; Y98-Y103 AromaticContact CD1-CG 3.82Å; Y98-Y103 HydrophobicContact CD1-CG 3.82Å; Y98-Y103 AromaticContact CD1-CZ 3.87Å; Y98-Y103 HydrophobicContact CD2-CE2 4.27Å; Y98-Y103 AromaticContact CE1-CD1 3.35Å; Y98-Y103 HydrophobicContact CE1-CD1 3.35Å; Y98-Y103 HydrophobicContact CE1-CD2 4.48Å; Y98-Y103 AromaticContact CE1-CE1 2.83Å; Y98-Y103 HydrophobicContact CE1-CE1 2.83Å; Y98-Y103 HydrophobicContact CE1-CE2 4.06Å; Y98-Y103 HydrophobicContact CE1-CG 4.17Å; Y98-Y103 AromaticContact CE1-CZ 3.24Å; Y98-Y103 HydrophobicContact CE2-CE1 4.18Å; Y98-Y103 AromaticContact CE2-CE2 3.94Å; Y98-Y103 HydrophobicContact CE2-CE2 3.94Å; Y98-Y103 AromaticContact CE2-CZ 3.71Å; Y98-Y103 HydrophobicContact CG-CD1 4.08Å; Y98-Y103 HydrophobicContact CG-CD2 4.37Å; Y98-Y103 HydrophobicContact CG-CE1 4.23Å; Y98-Y103 HydrophobicContact CG-CE2 4.45Å; Y98-Y103 HydrophobicContact CG-CG 4.19Å; Y98-Y103 AromaticContact CZ-CE1 3.31Å; Y98-Y103 AromaticContact CZ-CE2 3.84Å; Y98-Y103 AromaticContact CZ-CZ 3.12Å; Y98-Y103 VanDerWaalsContact OH-CZ 3.31Å; Y98-Y103 PolarHBondContact OH-OH 2.97Å; S100-Y103 PolarHBondContact O-N 2.98Å; S100-Y103 PolarHBondContact OG-N 2.93Å; Y103-R105 PolarHBondContact O-N 3.4Å
104I55.8Low52.5Low139 Ų139126.2 Ų126.271%0.71369%0.687SS**  trans-71.5109.2168.7-64.4165.7000107F102 T106F102-I104 PolarHBondContact O-N 3.39Å; I104-T106 PolarHBondContact O-N 3.06Å
105R54Low52.8Low202 Ų202129.4 Ų129.476%0.76269%0.694SS**  trans-57.9101.4164.2-91-159.2-176.5-172.93.1108.1Y103 T107Y103-R105 PolarHBondContact O-N 3.4Å; R105-T107 VanDerWaalsContact C-N 3.29Å; R105-T107 PolarHBondContact O-N 3.27Å
106T53.6Low53.4Low106 Ų106137.2 Ų137.265%0.6571%0.713SS**  trans-72.392.4164.6-2.10000108I104 D108I104-T106 PolarHBondContact O-N 3.06Å; T106-D108 PolarHBondContact O-N 2.94Å
107T52.1Low54.2Low96 Ų96141 Ų14159%0.58973%0.734SS**  trans52.451.7138.152.60000117.2R105 E109R105-T107 VanDerWaalsContact C-N 3.29Å; R105-T107 PolarHBondContact O-N 3.27Å; T107-E109 PolarHBondContact O-N 3.09Å
108D51.7Low54.6Low163 Ų163140.8 Ų140.887%0.87273%0.73SS**SBendtrans-90.433.4156.2-166.539.3000111.4T106T106-D108 PolarHBondContact O-N 2.94Å
109E54.9Low54.8Low163 Ų163143.5 Ų143.576%0.76274%0.741SS**  trans-154.251.1174-149.2179.314500112.1T107T107-E109 PolarHBondContact O-N 3.09Å
110I53.2Low55.2Low144 Ų144145.3 Ų145.374%0.73875%0.748SS**  trans-116.9104.415745.7162.9000108.7
111R53.9Low55Low233 Ų233146.9 Ų146.988%0.87976%0.756SS**  trans-51143.7172.1-67.3173.1170-160.9-3.7110.4G113R111-G113 PolarHBondContact O-N 3.05Å
112N52.3Low54.7Low180 Ų180147.2 Ų147.296%0.96376%0.756SS**SBendtrans-15.7109166.8-82.7-41.6000115.3
113G56Low54.4Low74 Ų74145.9 Ų145.976%0.76375%0.752SS**  trans-168.797.4169.200000108.1R111 E115R111-G113 PolarHBondContact O-N 3.05Å; G113-E115 PolarHBondContact O-N 3.31Å
114G64.1Low53.8Low86 Ų86150.6 Ų150.689%0.88777%0.771SS**  trans-69.8127.4-168.500000114
115E55.4Low53.3Low181 Ų181150.2 Ų150.285%0.84677%0.766SS**  trans-150.1131.3141.8-162.6168.9174.500109.1G113 V117G113-E115 PolarHBondContact O-N 3.31Å; E115-V117 PolarHBondContact O-N 2.86Å
116R63.6Low52.6Low239 Ų239144.9 Ų144.990%0.90275%0.752SS**  trans-80.987.3-169.2-58.6166.294.8149.64.6109T118R116-T118 PolarHBondContact O-N 3.35Å; R116-T118 VanDerWaalsContact O-N 3.09Å
117V60.9Low52.3Low132 Ų132148.1 Ų148.180%0.876%0.76SS**  trans-79.393.5167.7-173.90000108.3E115 Y119E115-V117 PolarHBondContact O-N 2.86Å; V117-Y119 PolarHBondContact O-N 3.45Å
118T59.1Low52Low113 Ų113147.3 Ų147.369%0.69376%0.763SS**  trans-67.693168.7-51.80000108.4R116 M120R116-T118 PolarHBondContact O-N 3.35Å; R116-T118 VanDerWaalsContact O-N 3.09Å; T118-M120 HydrophobicContact CG2-CG 4.26Å; T118-M120 PolarHBondContact O-N 3.09Å; T118-M120 VanDerWaalsContact O-N 3.13Å
119Y51Low51.9Low187 Ų187147 Ų14773%0.73376%0.761SS**  trans-70.5105167.1-175-100.5000108V117 P121V117-Y119 PolarHBondContact O-N 3.45Å; Y119-P121 HydrophobicContact CD1-CG 3.97Å; Y119-P121 HydrophobicContact CE1-CB 4.03Å; Y119-P121 HydrophobicContact CE1-CG 3.94Å; Y119-P121 VanDerWaalsContact O-CD 3.31Å; Y119-P121 WeakPolarHBondContact O-CD 3.13Å
120M56.8Low51.2Low150 Ų150143.9 Ų143.974%0.73976%0.763SS**  trans-84.7109.4165.6-69.9-117.475.600107.3T118 T122T118-M120 HydrophobicContact CG2-CG 4.26Å; T118-M120 PolarHBondContact O-N 3.09Å; T118-M120 VanDerWaalsContact O-N 3.13Å; M120-T122 PolarHBondContact O-N 2.88Å; M120-T122 VanDerWaalsContact O-N 3.09Å
121P45.1Very low50.9Low91 Ų91145 Ų14559%0.59177%0.767SS**  trans-64.2117170.6-12.928.6000107Y119 H123Y119-P121 HydrophobicContact CD1-CG 3.97Å; Y119-P121 HydrophobicContact CE1-CB 4.03Å; Y119-P121 HydrophobicContact CE1-CG 3.94Å; Y119-P121 VanDerWaalsContact O-CD 3.31Å; Y119-P121 WeakPolarHBondContact O-CD 3.13Å; P121-H123 PolarHBondContact O-N 3.45Å
122T48.5Very low50.4Low133 Ų133139.6 Ų139.682%0.81676%0.762SS**  trans-49.9117.217346.60000109.2M120 Y124M120-T122 PolarHBondContact O-N 2.88Å; M120-T122 VanDerWaalsContact O-N 3.09Å; T122-Y124 PolarHBondContact O-N 3.06Å
123H48.2Very low49.9Very low157 Ų157138.8 Ų138.873%0.72776%0.757SS**  trans-28.1102.4170.8-165.2-109.4000113P121 E125P121-H123 PolarHBondContact O-N 3.45Å; H123-E125 IonicContact CE1-OE2 3.18Å; H123-E125 PolarHBondContact CE1-OE2 3.36Å; H123-E125 IonicContact ND1-OE2 3.57Å
124Y39.2Very low49.2Very low194 Ų194141.1 Ų141.176%0.76176%0.759SS**  trans-88.4100.9160.1-171.4-107.4000106.7T122 N126T122-Y124 PolarHBondContact O-N 3.06Å; Y124-N126 VanDerWaalsContact C-N 3.34Å; Y124-N126 HydrophobicContact CD1-CB 3.82Å; Y124-N126 HydrophobicContact CE1-CB 3.74Å; Y124-N126 WeakPolarHBondContact CE1-ND2 3.46Å; Y124-N126 PolarHBondContact O-N 2.95Å
125E45.4Very low48.2Very low130 Ų130141.9 Ų141.961%0.60776%0.757SS**  trans-69.893.1175.2-163161.2140.500108.5H123H123-E125 IonicContact CE1-OE2 3.18Å; H123-E125 PolarHBondContact CE1-OE2 3.36Å; H123-E125 IonicContact ND1-OE2 3.57Å
126N40.4Very low47.7Very low90 Ų90140 Ų14048%0.48176%0.757SS.*  trans-116.777.2165.3-138.6-80.8000108.5Y124 A128Y124-N126 VanDerWaalsContact C-N 3.34Å; Y124-N126 HydrophobicContact CD1-CB 3.82Å; Y124-N126 HydrophobicContact CE1-CB 3.74Å; Y124-N126 WeakPolarHBondContact CE1-ND2 3.46Å; Y124-N126 PolarHBondContact O-N 2.95Å; N126-A128 PolarHBondContact O-N 3.18Å
127Q46.9Very low46.6Very low174 Ų174140.6 Ų140.681%0.81376%0.76SS**THydrogen-bonded Turntrans-73.138.4-178.8-168.612821.800113.2
128A46.4Very low45.5Very low79 Ų79137.5 Ų137.565%0.65375%0.754SS**THydrogen-bonded Turntrans-127.3-3.6-177.800000114.8N126N126-A128 PolarHBondContact O-N 3.18Å
129L49.2Very low44.4Very low156 Ų156137.2 Ų137.282%0.81776%0.757SS**SBendtrans-134.28.9-175.4-77.3170.2000116.3M131L129-M131 PolarHBondContact O-N 2.89Å; L129-M131 VanDerWaalsContact O-N 3.1Å
130A40Very low43.8Very low99 Ų99135.2 Ų135.282%0.81876%0.758SS**  trans-86.375.9175.800000111.6
131M47.2Very low42.9Very low167 Ų167135 Ų13582%0.82376%0.759SS**  trans-75.5127.3160.8-72.8-65.5-74.400108.7L129 L133L129-M131 PolarHBondContact O-N 2.89Å; L129-M131 VanDerWaalsContact O-N 3.1Å; M131-L133 PolarHBondContact O-N 3.1Å; M131-L133 VanDerWaalsContact O-N 3.17Å
132P42.1Very low42.5Very low120 Ų120141.1 Ų141.178%0.77977%0.77SS**  trans-74.3109.9-178.820-18.4000110.5
133L43.2Very low41.9Very low162 Ų162142.2 Ų142.285%0.84877%0.771SS**PPolyproline II helixtrans-84.3127.4161.7-75.2169.2000108.6M131 A135M131-L133 PolarHBondContact O-N 3.1Å; M131-L133 VanDerWaalsContact O-N 3.17Å; L133-A135 PolarHBondContact O-N 3.17Å
134P41.3Very low41.3Very low124 Ų124138.9 Ų138.981%0.80577%0.766SS**PPolyproline II helixtrans-70.1124.9-179.825.7-30.4000110.9
135A42.5Very low41.5Very low101 Ų101138.5 Ų138.584%0.83577%0.771SS**PPolyproline II helixtrans-70.3130.5174.800000111.4L133L133-A135 PolarHBondContact O-N 3.17Å
136V43.7Very low41.2Very low142 Ų142144.1 Ų144.186%0.86179%0.787SS**PPolyproline II helixtrans-59.2128.6174.9172.80000111.1
137R42Very low41Very low252 Ų252143.9 Ų143.995%0.95181%0.805SS**  trans-101.4105.5160.5-95.9-173.4174.4121.9-2.7109.5
138G37.7Very low40.8Very low67 Ų67147 Ų14769%0.69181%0.809SS**  trans-100.8155.3146.400000107.5
139S36.3Very low41.2Very low107 Ų107148.5 Ų148.575%0.74881%0.813SS**  cis-170.3159.623.1-162.50000109.9
140L38Very low41.3Very low145 Ų145146 Ų14676%0.75981%0.806SS**  trans87.8113.4152.8-53.3-168.4000122.7
141L38Very low41.6Very low146 Ų146148.6 Ų148.676%0.76481%0.806SS**  77102.6127.4-72.5169.3000120.7
142R35.5Very low41.7Very low218 Ų218149.8 Ų149.882%0.82381%0.807SS**  71.2103119.2-157.7-173.8178.1-142.6-5.6116.8
143D36.9Very low42Very low156 Ų156153.9 Ų153.983%0.83481%0.808SS**  -150.8153.7116.8-127.6-36.4000113.6
144S35.4Very low42.3Very low88 Ų88151.8 Ų151.862%0.61580%0.802SS**  trans-93.7125.1-161.1157.70000112.4
145Q44.2Very low42.2Very low186 Ų186151.1 Ų151.187%0.86979%0.792SS**  trans-155.8101.2143.5-73.5-152-15.300110.1
146R38.1Very low42.7Very low248 Ų248152.2 Ų152.294%0.93679%0.789SS**  36.710999.4-88.2-168.2-178.5-1691.8114.8
147G37.3Very low43.1Very low84 Ų84155.6 Ų155.687%0.86679%0.786SS**  trans179.4117.6162.700000112.9
148R41.9Very low43.9Very low239 Ų239148.5 Ų148.590%0.90278%0.781SS**  trans-78.9158.7-169-168.8174.9-152.8-159.52.5113.5
149P54.1Low44.7Very low112 Ų112152.4 Ų152.473%0.72779%0.785SS**  trans-77.1165175.334.4-37.8000112.5
150P51.1Low45.6Very low103 Ų103153.3 Ų153.367%0.66979%0.791SS**  -148159.3107.836.8-19.7000116F152P150-F152 HydrophobicContact CG-CE2 4.3Å
151D46.4Very low46.6Very low154 Ų154151.8 Ų151.882%0.82479%0.788SS**  trans-56.3136.6167.4-53.1-70.9000112.6
152F51Low47.2Very low191 Ų191154.1 Ų154.184%0.83879%0.794SS**  trans-140.2111.5154.2-86.8-78.3000111P150P150-F152 HydrophobicContact CG-CE2 4.3Å
153Y47.5Very low47.6Very low207 Ų207154 Ų15481%0.81282%0.817SS**  trans-77.4119.3169.8-164.5-90.8000108.5N155Y153-N155 HydrophobicContact CE1-CB 4.17Å
154T50.5Low48.1Very low118 Ų118153.9 Ų153.972%0.72482%0.816SS**  trans-138.397.4162.1-38.60000109.9
155N37.7Very low48.8Very low110 Ų110157.3 Ų157.359%0.58883%0.827SS**  trans-72.6118.8160.6-175.1-59.7000108.1Y153Y153-N155 HydrophobicContact CE1-CB 4.17Å
156T53.5Low49Very low124 Ų124155.7 Ų155.776%0.76183%0.825SS**  trans-137.4105.3159.6-44.20000109.3
157R52.9Low49.7Very low213 Ų213150.3 Ų150.380%0.80482%0.818SS**  trans-54.3134.7165.9-65.5176.3175.8-176.1-2.5110.6
158A57.5Low50.4Low102 Ų102154.4 Ų154.484%0.84382%0.815SS**  trans-147.2102146.600000108.4
159I54Low51Low150 Ų150148.8 Ų148.877%0.76981%0.809SS**  trans-77.7133.9167.2-68.3159.3000106.6T161I159-T161 HydrophobicContact CG2-CG2 4.05Å
160S55.2Low50.8Low125 Ų125151.4 Ų151.487%0.87482%0.815SS**  trans-139.4127.9154.6-160.70000109.3
161T60Low50.8Low114 Ų114155.2 Ų155.270%0.69983%0.827SS**  trans-94.3138.9-168.847.80000110.6I159I159-T161 HydrophobicContact CG2-CG2 4.05Å
162E51.5Low51.1Low194 Ų194155.3 Ų155.391%0.90783%0.827SS**  trans-164.5120140-147.6171.3159.200110.7
163V42.2Very low51.1Low215 Ų215152 Ų152100%1.30383%0.826SS**  trans-127.80157.3-179.10000105.1

Retrieved 163 of 163 residues in 421.5 ms (Link to these results)