A0A2K5YQU6_MANLE Loading...

Glucose-fructose oxidoreductase domain-containing protein 2

Promotes matrix assembly.

AlphaFold DB , UniProt , Accession A0A2K5YQU6, Species MANLE (Mandrillus leucophaeus, Drill), Gene GFOD2, Length 90 aa.

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

 

Download Structure   PDB   PAE   Table  
Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M50.8Low86.8Confident234 Ų23459.1 Ų59.1100%1.15330%0.295SS*.  0118.10-77.5154.8110.900107.3M3M1-M3 PolarHBondContact O-N 3.01Å
2K56.4Low87.6Confident117 Ų11756.2 Ų56.251%0.50928%0.283SS..  trans-67.3116.4164.7-118.5178.7174.6-179.10105E31 D65K2-E31 IonicContact NZ-OE1 2.95Å; K2-E31 PolarHBondContact NZ-OE1 2.95Å; K2-D65 IonicContact NZ-OD1 2.86Å; K2-D65 PolarHBondContact NZ-OD1 3.26Å
3M79.5Confident88Confident180 Ų18054.6 Ų54.689%0.88729%0.29SS*.  trans-85.1-19.2-175.2-68-129.9-56.300113M1M1-M3 PolarHBondContact O-N 3.01Å
4L91.6Very high88.3Confident70 Ų7057.8 Ų57.837%0.36632%0.318SS..SBendtrans-131.9147.3177.9-68.2173.3000110.2E26 F28L4-E26 VanDerWaalsContact CD1-O 3.31Å; L4-E26 WeakPolarHBondContact CD1-O 3.4Å; L4-F28 HydrophobicContact CB-CD1 4.13Å; L4-F28 HydrophobicContact CB-CE1 4.3Å; L4-F28 HydrophobicContact CB-CG 4.44Å; L4-F28 HydrophobicContact CD1-CD2 4.06Å; L4-F28 HydrophobicContact CD1-CE2 4.15Å; L4-F28 HydrophobicContact CD1-CG 4.34Å; L4-F28 HydrophobicContact CD2-CE1 4.23Å; L4-F28 HydrophobicContact CD2-CE2 4.34Å; L4-F28 HydrophobicContact CD2-CZ 3.97Å
5P94.4Very high88.7Confident45 Ų4557.7 Ų57.729%0.29232%0.324SS..  trans-64.6144.618026.1-34000111.6F28 D67 L68P5-F28 HydrophobicContact CG-CD1 3.99Å; P5-F28 HydrophobicContact CG-CE1 3.63Å; P5-D67 WeakPolarHBondContact CA-OD2 3.39Å; P5-D67 HydrophobicContact CB-CB 3.55Å; P5-L68 HydrophobicContact CB-CB 4.06Å; P5-L68 HydrophobicContact CG-CB 4.21Å; P5-L68 HydrophobicContact CG-CD2 4.29Å
6G96Very high89Confident0 Ų054.1 Ų54.10%030%0.304CS..  trans-72.4138.516700000110.9D65 D67 L68G6-D65 WeakPolarHBondContact CA-O 3.31Å; G6-D67 PolarHBondContact N-OD2 3.23Å; G6-D67 PolarHBondContact O-N 3.38Å; G6-L68 PolarHBondContact O-N 3.24Å
7V97.6Very high89.4Confident0 Ų056.1 Ų56.10%031%0.305CS..EExtended strand (participates in β ladder)trans-110.7127.4-169.8-171.40000111.9V9 L23 F28 T29 E31 L68 C70V7-V9 HydrophobicContact CG1-CG2 4.1Å; V7-L23 HydrophobicContact CB-CD1 4.4Å; V7-L23 HydrophobicContact CG1-CD1 3.91Å; V7-F28 HydrophobicContact CG2-CB 4.05Å; V7-F28 HydrophobicContact CG2-CD1 3.79Å; V7-F28 HydrophobicContact CG2-CG 4.29Å; V7-T29 PolarHBondContact N-O 3.04Å; V7-E31 PolarHBondContact O-N 2.99Å; V7-L68 CarbonylContact C-O 3.54Å; V7-L68 VanDerWaalsContact CA-O 3.28Å; V7-L68 WeakPolarHBondContact CA-O 3.34Å; V7-L68 HydrophobicContact CG2-CB 4.47Å; V7-L68 HydrophobicContact CG2-CD2 4.18Å; V7-C70 HydrophobicContact CG1-CB 4.46Å
8G97.8Very high89.8Confident0 Ų058.1 Ų58.10%032%0.319CS..EExtended strand (participates in β ladder)trans-94.1121.4164.700000111A32 L68 V69 C70G8-A32 WeakPolarHBondContact CA-O 3.32Å; G8-L68 PolarHBondContact N-O 3.12Å; G8-V69 CarbonylContact O-C 3.55Å; G8-V69 VanDerWaalsContact O-CA 3.26Å; G8-V69 WeakPolarHBondContact O-CA 3.38Å; G8-C70 PolarHBondContact O-N 2.91Å
9V97.9Very high90.1Very high0 Ų057.3 Ų57.30%031%0.314CS..EExtended strand (participates in β ladder)trans-103.2124-179177.70000110.1V7 A16 V20 L23 V30 A32 L33 W34V7-V9 HydrophobicContact CG1-CG2 4.1Å; V9-A16 HydrophobicContact CG1-CB 4.29Å; V9-V20 HydrophobicContact CG1-CG2 4.48Å; V9-V20 HydrophobicContact CG2-CG2 4.19Å; V9-L23 HydrophobicContact CG2-CD1 4.28Å; V9-V30 HydrophobicContact CG2-CG1 3.97Å; V9-A32 PolarHBondContact N-O 3.4Å; V9-L33 HydrophobicContact CB-CD1 3.98Å; V9-L33 HydrophobicContact CG1-CD1 4.01Å; V9-W34 PolarHBondContact O-N 3.02Å
10F97.4Very high90.4Very high0 Ų054.5 Ų54.50%030%0.299CS..EExtended strand (participates in β ladder)trans-101116.6173.2-70-98.8000110.5W34 T57 I60 L61 V69 C70 I71 S72 I73 I81F10-W34 HydrophobicContact CB-CE3 4.27Å; F10-W34 HydrophobicContact CD1-CB 3.46Å; F10-W34 VanDerWaalsContact CD1-CB 3.46Å; F10-W34 AromaticContact CD1-CD2 3.61Å; F10-W34 HydrophobicContact CD1-CD2 3.61Å; F10-W34 AromaticContact CD1-CE3 3.86Å; F10-W34 HydrophobicContact CD1-CE3 3.86Å; F10-W34 AromaticContact CD1-CG 3.45Å; F10-W34 HydrophobicContact CD1-CG 3.45Å; F10-W34 VanDerWaalsContact CD1-CG 3.45Å; F10-W34 HydrophobicContact CE1-CB 3.76Å; F10-W34 AromaticContact CE1-CD1 3.99Å; F10-W34 HydrophobicContact CE1-CD2 4.17Å; F10-W34 AromaticContact CE1-CG 3.69Å; F10-W34 HydrophobicContact CE1-CG 3.69Å; F10-W34 HydrophobicContact CG-CB 4.06Å; F10-W34 HydrophobicContact CG-CG 4.45Å; F10-T57 HydrophobicContact CE1-CG2 3.84Å; F10-T57 HydrophobicContact CZ-CG2 4.21Å; F10-I60 HydrophobicContact CE1-CB 4.46Å; F10-I60 HydrophobicContact CE2-CB 4.25Å; F10-I60 HydrophobicContact CE2-CG2 3.68Å; F10-I60 HydrophobicContact CZ-CB 3.76Å; F10-I60 HydrophobicContact CZ-CG1 4.46Å; F10-I60 HydrophobicContact CZ-CG2 3.72Å; F10-L61 HydrophobicContact CE2-CD2 4.14Å; F10-L61 HydrophobicContact CZ-CD2 3.94Å; F10-L61 HydrophobicContact CZ-CG 4.25Å; F10-V69 HydrophobicContact CD2-CB 4.31Å; F10-V69 HydrophobicContact CE2-CB 4.05Å; F10-V69 HydrophobicContact CE2-CG1 3.89Å; F10-C70 PolarHBondContact N-O 3.23Å; F10-I71 HydrophobicContact CB-CG1 4.39Å; F10-I71 HydrophobicContact CB-CG2 4.35Å; F10-I71 HydrophobicContact CD2-CG1 4.07Å; F10-I71 HydrophobicContact CG-CG1 4.39Å; F10-S72 PolarHBondContact O-N 2.91Å; F10-I73 HydrophobicContact CB-CG2 4.37Å; F10-I73 WeakPolarHBondContact O-CG2 3.32Å; F10-I81 HydrophobicContact CD1-CD1 3.49Å; F10-I81 VanDerWaalsContact CD1-CD1 3.49Å; F10-I81 HydrophobicContact CD1-CG2 3.85Å; F10-I81 HydrophobicContact CD2-CG2 4.24Å; F10-I81 HydrophobicContact CE1-CD1 3.87Å; F10-I81 HydrophobicContact CE1-CG2 3.68Å; F10-I81 HydrophobicContact CE2-CG2 4.07Å; F10-I81 HydrophobicContact CG-CD1 4.31Å; F10-I81 HydrophobicContact CG-CG2 4.13Å; F10-I81 HydrophobicContact CZ-CG2 3.78Å
11G95.6Very high90.7Very high4 Ų454.9 Ų54.94%0.04130%0.304CS..  trans121.5145.8176.400000112.8A16 W34 I73G11-A16 WeakPolarHBondContact O-CB 3.41Å; G11-W34 PolarHBondContact N-O 3.31Å; G11-I73 VanDerWaalsContact CA-CG2 3.48Å
12T96Very high92.9Very high24 Ų2448.6 Ų48.615%0.14728%0.275CS..  trans-117.57.7-176.150.50000113.1R17 E40 L44T12-R17 PolarHBondContact O-NH1 3.16Å; T12-E40 HydrophobicContact CG2-CB 4.15Å; T12-E40 WeakPolarHBondContact CG2-O 3.28Å; T12-E40 PolarHBondContact OG1-OE2 2.91Å; T12-L44 HydrophobicContact CG2-CB 4.38Å; T12-L44 HydrophobicContact CG2-CD2 4.24Å
13G92.8Very high94.8Very high36 Ų3644 Ų4437%0.37126%0.255SS..SBendtrans-77.8-171.5-178.500000114.1S15 A16 R17G13-S15 PolarHBondContact O-N 3.3Å; G13-A16 PolarHBondContact O-N 2.67Å; G13-A16 VanDerWaalsContact O-N 3.17Å; G13-R17 PolarHBondContact O-N 2.94Å
14S92.9Very high95.6Very high99 Ų9940 Ų4069%0.69223%0.23SC*.Hα-helixtrans-58.7-33.9-179.9-50.80000113.4A16 R17 V18S14-A16 PolarHBondContact O-N 2.84Å; S14-R17 PolarHBondContact O-N 3.39Å; S14-V18 PolarHBondContact O-N 2.96Å
15S93.1Very high95.9Very high57 Ų5740.5 Ų40.540%0.39925%0.245SC..Hα-helixtrans-59-43.9176.244.30000112.2G13 R17 V18 L19G13-S15 PolarHBondContact O-N 3.3Å; S15-R17 PolarHBondContact O-N 3.5Å; S15-V18 PolarHBondContact O-N 3.07Å; S15-L19 VanDerWaalsContact O-CB 3.29Å; S15-L19 WeakPolarHBondContact O-CB 3.49Å; S15-L19 PolarHBondContact O-N 3.21Å
16A94.5Very high95.9Very high0 Ų045.2 Ų45.20%026%0.263CS..Hα-helixtrans-65.5-38179.400000112.3V9 G11 G13 S14 V18 L19 V20 L44V9-A16 HydrophobicContact CG1-CB 4.29Å; G11-A16 WeakPolarHBondContact O-CB 3.41Å; G13-A16 PolarHBondContact O-N 2.67Å; G13-A16 VanDerWaalsContact O-N 3.17Å; S14-A16 PolarHBondContact O-N 2.84Å; A16-V18 PolarHBondContact O-N 3.02Å; A16-L19 PolarHBondContact O-N 2.85Å; A16-V20 WeakPolarHBondContact O-CB 3.35Å; A16-V20 WeakPolarHBondContact O-CG2 3.5Å; A16-V20 PolarHBondContact O-N 3.32Å; A16-L44 HydrophobicContact CB-CD2 3.77Å
17R95.1Very high95.9Very high88 Ų8847.5 Ų47.533%0.33229%0.287SS..Hα-helixtrans-65-20.7176.1-67.9-173.5174.775.90.1113.8T12 G13 S14 S15 P21 L44 E47 M48T12-R17 PolarHBondContact O-NH1 3.16Å; G13-R17 PolarHBondContact O-N 2.94Å; S14-R17 PolarHBondContact O-N 3.39Å; S15-R17 PolarHBondContact O-N 3.5Å; R17-P21 VanDerWaalsContact O-CD 3.25Å; R17-P21 WeakPolarHBondContact O-CD 3.43Å; R17-P21 WeakPolarHBondContact O-CG 3.4Å; R17-L44 HydrophobicContact CG-CD1 3.67Å; R17-E47 IonicContact CZ-OE2 3.52Å; R17-E47 IonicContact NE-OE2 3.2Å; R17-E47 PolarHBondContact NE-OE2 3.32Å; R17-E47 IonicContact NH2-OE1 3.04Å; R17-E47 IonicContact NH2-OE2 3.88Å; R17-E47 PolarHBondContact NH2-OE2 3Å; R17-M48 HydrophobicContact CB-CE 4.43Å; R17-M48 HydrophobicContact CG-CE 4.2Å
18V96.2Very high95.9Very high91 Ų9149.8 Ų49.855%0.55230%0.297SS*.Hα-helixtrans-92.9-44.6173.2176.10000110.6S14 S15 A16 P21 L22S14-V18 PolarHBondContact O-N 2.96Å; S15-V18 PolarHBondContact O-N 3.07Å; A16-V18 PolarHBondContact O-N 3.02Å; V18-P21 WeakPolarHBondContact O-CD 3.42Å; V18-L22 HydrophobicContact CG1-CD1 3.75Å; V18-L22 HydrophobicContact CG1-CG 4.46Å; V18-L22 VanDerWaalsContact O-CG 3.28Å; V18-L22 WeakPolarHBondContact O-CG 3.35Å; V18-L22 PolarHBondContact O-N 3.39Å
19L95.9Very high95.8Very high44 Ų4453.1 Ų53.123%0.2332%0.317CS..Hα-helixtrans-66.1-43.1-174.5-177.563.1000112.8S15 A16 L22 L23 C70S15-L19 VanDerWaalsContact O-CB 3.29Å; S15-L19 WeakPolarHBondContact O-CB 3.49Å; S15-L19 PolarHBondContact O-N 3.21Å; A16-L19 PolarHBondContact O-N 2.85Å; L19-L22 PolarHBondContact O-N 3.33Å; L19-L23 HydrophobicContact CD1-CD1 4.2Å; L19-L23 HydrophobicContact CD1-CG 4.07Å; L19-L23 HydrophobicContact CD2-CD1 4.44Å; L19-L23 HydrophobicContact CG-CD1 3.85Å; L19-L23 HydrophobicContact CG-CG 4.21Å; L19-L23 WeakPolarHBondContact O-CG 3.33Å; L19-L23 PolarHBondContact O-N 3.24Å; L19-C70 HydrophobicContact CD2-CB 3.66Å
20V96.9Very high95.7Very high1 Ų153.5 Ų53.51%0.00632%0.32CS..Hα-helixtrans-60.7-50-177.8165.90000112V9 A16 L22 L23 R24 V30 M48 I50V9-V20 HydrophobicContact CG1-CG2 4.48Å; V9-V20 HydrophobicContact CG2-CG2 4.19Å; A16-V20 WeakPolarHBondContact O-CB 3.35Å; A16-V20 WeakPolarHBondContact O-CG2 3.5Å; A16-V20 PolarHBondContact O-N 3.32Å; V20-L22 VanDerWaalsContact C-N 3.34Å; V20-L22 PolarHBondContact O-N 3.47Å; V20-L23 PolarHBondContact O-N 3.16Å; V20-R24 WeakPolarHBondContact O-CG 3.25Å; V20-R24 PolarHBondContact O-N 3.3Å; V20-R24 VanDerWaalsContact O-N 3.16Å; V20-V30 HydrophobicContact CG1-CG2 4.19Å; V20-V30 HydrophobicContact CG2-CG1 4.37Å; V20-V30 HydrophobicContact CG2-CG2 4.4Å; V20-M48 HydrophobicContact CG1-CB 4.19Å; V20-M48 HydrophobicContact CG1-CG 4.32Å; V20-M48 HydrophobicContact CG1-SD 4.34Å; V20-I50 HydrophobicContact CG1-CD1 4.24Å; V20-I50 HydrophobicContact CG2-CD1 4.33Å
21P96.8Very high95.8Very high62 Ų6255.3 Ų55.340%0.40333%0.328SS..Hα-helixtrans-59.9-40.2173.7-27.135.3000113.8R17 V18 R24 A25 M48R17-P21 VanDerWaalsContact O-CD 3.25Å; R17-P21 WeakPolarHBondContact O-CD 3.43Å; R17-P21 WeakPolarHBondContact O-CG 3.4Å; V18-P21 WeakPolarHBondContact O-CD 3.42Å; P21-R24 PolarHBondContact O-N 3.2Å; P21-A25 WeakPolarHBondContact O-CB 3.5Å; P21-A25 PolarHBondContact O-N 3.25Å; P21-M48 HydrophobicContact CG-SD 4.43Å
22L97.1Very high95.9Very high103 Ų10355.1 Ų55.154%0.53933%0.326SS..Hα-helixtrans-63.7-46.9179.1-71.8174.4000111.9V18 L19 V20 R24 A25 E26V18-L22 HydrophobicContact CG1-CD1 3.75Å; V18-L22 HydrophobicContact CG1-CG 4.46Å; V18-L22 VanDerWaalsContact O-CG 3.28Å; V18-L22 WeakPolarHBondContact O-CG 3.35Å; V18-L22 PolarHBondContact O-N 3.39Å; L19-L22 PolarHBondContact O-N 3.33Å; V20-L22 VanDerWaalsContact C-N 3.34Å; V20-L22 PolarHBondContact O-N 3.47Å; L22-R24 VanDerWaalsContact C-N 3.31Å; L22-R24 PolarHBondContact O-N 2.91Å; L22-A25 PolarHBondContact O-N 3.45Å; L22-E26 WeakPolarHBondContact O-CG 3.42Å; L22-E26 PolarHBondContact O-N 3.36Å; L22-E26 VanDerWaalsContact O-N 3.12Å
23L96.5Very high96Very high20 Ų2054 Ų5411%0.10532%0.319CS..Hα-helixtrans-56.7-46.2176.2-74.6170.7000111.6V7 V9 L19 V20 E26 G27 F28 V30V7-L23 HydrophobicContact CB-CD1 4.4Å; V7-L23 HydrophobicContact CG1-CD1 3.91Å; V9-L23 HydrophobicContact CG2-CD1 4.28Å; L19-L23 HydrophobicContact CD1-CD1 4.2Å; L19-L23 HydrophobicContact CD1-CG 4.07Å; L19-L23 HydrophobicContact CD2-CD1 4.44Å; L19-L23 HydrophobicContact CG-CD1 3.85Å; L19-L23 HydrophobicContact CG-CG 4.21Å; L19-L23 WeakPolarHBondContact O-CG 3.33Å; L19-L23 PolarHBondContact O-N 3.24Å; V20-L23 PolarHBondContact O-N 3.16Å; L23-E26 CarbonylContact O-C 3.57Å; L23-E26 PolarHBondContact O-N 3.31Å; L23-G27 PolarHBondContact O-N 2.86Å; L23-F28 HydrophobicContact CB-CB 4.15Å; L23-F28 HydrophobicContact CD2-CB 4.44Å; L23-F28 HydrophobicContact CD2-CD2 4.3Å; L23-F28 HydrophobicContact CD2-CG 4.25Å; L23-F28 WeakPolarHBondContact O-CB 3.41Å; L23-F28 PolarHBondContact O-N 2.96Å; L23-V30 HydrophobicContact CB-CG2 4.33Å; L23-V30 HydrophobicContact CD1-CG2 4.18Å
24R96.1Very high96.2Very high95 Ų9553.1 Ų53.136%0.35831%0.305SS..Hα-helixtrans-66.3-37.1178.5-72.9176.7172.9171.5-3.6112.8V20 P21 L22 E26 G27 V30 M48 N49V20-R24 WeakPolarHBondContact O-CG 3.25Å; V20-R24 PolarHBondContact O-N 3.3Å; V20-R24 VanDerWaalsContact O-N 3.16Å; P21-R24 PolarHBondContact O-N 3.2Å; L22-R24 VanDerWaalsContact C-N 3.31Å; L22-R24 PolarHBondContact O-N 2.91Å; R24-E26 PolarHBondContact O-N 3.46Å; R24-G27 PolarHBondContact O-N 2.83Å; R24-V30 HydrophobicContact CG-CG2 4.42Å; R24-M48 VanDerWaalsContact CZ-O 3.24Å; R24-M48 PolarHBondContact NH1-O 2.97Å; R24-M48 PolarHBondContact NH2-O 3.38Å; R24-N49 PolarHBondContact NH2-O 2.88Å
25A96.9Very high96.4Very high82 Ų8248.4 Ų48.468%0.67827%0.272SS*.Hα-helixtrans-62.2-32.7175.300000112.1P21 L22 G27P21-A25 WeakPolarHBondContact O-CB 3.5Å; P21-A25 PolarHBondContact O-N 3.25Å; L22-A25 PolarHBondContact O-N 3.45Å; A25-G27 VanDerWaalsContact C-N 3.28Å
26E95.7Very high96.5Very high143 Ų14352.7 Ų52.767%0.66828%0.283SS*.THydrogen-bonded Turntrans-84.32.8174-62.4-58.6139.500113.5L4 L22 L23 R24 F28L4-E26 VanDerWaalsContact CD1-O 3.31Å; L4-E26 WeakPolarHBondContact CD1-O 3.4Å; L22-E26 WeakPolarHBondContact O-CG 3.42Å; L22-E26 PolarHBondContact O-N 3.36Å; L22-E26 VanDerWaalsContact O-N 3.12Å; L23-E26 CarbonylContact O-C 3.57Å; L23-E26 PolarHBondContact O-N 3.31Å; R24-E26 PolarHBondContact O-N 3.46Å; E26-F28 HydrophobicContact CB-CD2 3.95Å; E26-F28 HydrophobicContact CB-CE2 4.08Å
27G95.5Very high96.6Very high49 Ų4955.4 Ų55.451%0.50530%0.3SS..THydrogen-bonded Turntrans88.76.8175.300000115.9L23 R24 A25L23-G27 PolarHBondContact O-N 2.86Å; R24-G27 PolarHBondContact O-N 2.83Å; A25-G27 VanDerWaalsContact C-N 3.28Å
28F96.5Very high96.7Very high48 Ų4855.5 Ų55.521%0.21130%0.304CS..  trans-75145.1172.4-66.5-102.5000111.1L4 P5 V7 L23 E26 L68L4-F28 HydrophobicContact CB-CD1 4.13Å; L4-F28 HydrophobicContact CB-CE1 4.3Å; L4-F28 HydrophobicContact CB-CG 4.44Å; L4-F28 HydrophobicContact CD1-CD2 4.06Å; L4-F28 HydrophobicContact CD1-CE2 4.15Å; L4-F28 HydrophobicContact CD1-CG 4.34Å; L4-F28 HydrophobicContact CD2-CE1 4.23Å; L4-F28 HydrophobicContact CD2-CE2 4.34Å; L4-F28 HydrophobicContact CD2-CZ 3.97Å; P5-F28 HydrophobicContact CG-CD1 3.99Å; P5-F28 HydrophobicContact CG-CE1 3.63Å; V7-F28 HydrophobicContact CG2-CB 4.05Å; V7-F28 HydrophobicContact CG2-CD1 3.79Å; V7-F28 HydrophobicContact CG2-CG 4.29Å; L23-F28 HydrophobicContact CB-CB 4.15Å; L23-F28 HydrophobicContact CD2-CB 4.44Å; L23-F28 HydrophobicContact CD2-CD2 4.3Å; L23-F28 HydrophobicContact CD2-CG 4.25Å; L23-F28 WeakPolarHBondContact O-CB 3.41Å; L23-F28 PolarHBondContact O-N 2.96Å; E26-F28 HydrophobicContact CB-CD2 3.95Å; E26-F28 HydrophobicContact CB-CE2 4.08Å; F28-L68 HydrophobicContact CE1-CD2 4.45Å
29T96Very high96.8Very high70 Ų7057.6 Ų57.643%0.42931%0.308SS..  trans-90.3129.6168.3-53.40000109.4V7 E31V7-T29 PolarHBondContact N-O 3.04Å; T29-E31 VanDerWaalsContact CG2-CD 3.4Å; T29-E31 HydrophobicContact CG2-CG 4.04Å; T29-E31 WeakPolarHBondContact CG2-OE1 2.88Å
30V97.3Very high96.8Very high8 Ų859.1 Ų59.15%0.04831%0.314CS..EExtended strand (participates in β ladder)trans-91.5104.1168.6179.70000107.5V9 V20 L23 R24 I50V9-V30 HydrophobicContact CG2-CG1 3.97Å; V20-V30 HydrophobicContact CG1-CG2 4.19Å; V20-V30 HydrophobicContact CG2-CG1 4.37Å; V20-V30 HydrophobicContact CG2-CG2 4.4Å; L23-V30 HydrophobicContact CB-CG2 4.33Å; L23-V30 HydrophobicContact CD1-CG2 4.18Å; R24-V30 HydrophobicContact CG-CG2 4.42Å; V30-I50 HydrophobicContact CG1-CD1 3.7Å; V30-I50 HydrophobicContact CG1-CG1 4.15Å; V30-I50 HydrophobicContact CG1-CG2 4.44Å
31E97.6Very high96.9Very high38 Ų3859.1 Ų59.118%0.17831%0.314CS..EExtended strand (participates in β ladder)trans-89-32.1-170-58.9-76.9-164.800111.4K2 V7 T29 D65 V66K2-E31 IonicContact NZ-OE1 2.95Å; K2-E31 PolarHBondContact NZ-OE1 2.95Å; V7-E31 PolarHBondContact O-N 2.99Å; T29-E31 VanDerWaalsContact CG2-CD 3.4Å; T29-E31 HydrophobicContact CG2-CG 4.04Å; T29-E31 WeakPolarHBondContact CG2-OE1 2.88Å; E31-D65 HydrophobicContact CB-CB 4.42Å; E31-D65 HydrophobicContact CG-CB 4.07Å; E31-D65 WeakPolarHBondContact CG-O 3.22Å; E31-V66 HydrophobicContact CB-CG2 3.95Å
32A97.9Very high97Very high0 Ų059.9 Ų59.90%031%0.311CS..EExtended strand (participates in β ladder)trans-145.1143.6-173.900000112.5G8 V9 F52 I60 V66G8-A32 WeakPolarHBondContact CA-O 3.32Å; V9-A32 PolarHBondContact N-O 3.4Å; A32-F52 WeakPolarHBondContact CA-O 3.29Å; A32-F52 HydrophobicContact CB-CD1 3.7Å; A32-F52 HydrophobicContact CB-CE1 4.4Å; A32-I60 HydrophobicContact CB-CB 4.49Å; A32-I60 HydrophobicContact CB-CD1 3.77Å; A32-I60 HydrophobicContact CB-CG1 4.07Å; A32-I60 HydrophobicContact CB-CG2 4.07Å; A32-V66 HydrophobicContact CB-CG2 3.88Å
33L98.3Very high97Very high0 Ų059.9 Ų59.90%031%0.308CS..EExtended strand (participates in β ladder)trans-125.6125.3176.2-176.273.1000112V9 A41 L44 A45 I50 F52 Y53 T54V9-L33 HydrophobicContact CB-CD1 3.98Å; V9-L33 HydrophobicContact CG1-CD1 4.01Å; L33-A41 WeakPolarHBondContact CD2-O 3.13Å; L33-L44 HydrophobicContact CD1-CD2 4.12Å; L33-L44 HydrophobicContact CD2-CB 3.78Å; L33-L44 HydrophobicContact CD2-CD2 3.9Å; L33-L44 HydrophobicContact CD2-CG 3.74Å; L33-A45 HydrophobicContact CD2-CB 4.03Å; L33-I50 HydrophobicContact CB-CD1 4.15Å; L33-I50 HydrophobicContact CB-CG2 4.22Å; L33-I50 HydrophobicContact CD1-CD1 4.45Å; L33-I50 HydrophobicContact CD2-CD1 4.29Å; L33-F52 PolarHBondContact N-O 3.37Å; L33-Y53 WeakPolarHBondContact O-CA 3.46Å; L33-T54 PolarHBondContact O-N 2.87Å; L33-T54 VanDerWaalsContact O-N 3.09Å
34W98.1Very high97.1Very high18 Ų1859 Ų597%0.06830%0.303CS..EExtended strand (participates in β ladder)trans-103.3131.2174.9-18093.4000111V9 F10 G11 K36 T54 S55 I60 I73 L77V9-W34 PolarHBondContact O-N 3.02Å; F10-W34 HydrophobicContact CB-CE3 4.27Å; F10-W34 HydrophobicContact CD1-CB 3.46Å; F10-W34 VanDerWaalsContact CD1-CB 3.46Å; F10-W34 AromaticContact CD1-CD2 3.61Å; F10-W34 HydrophobicContact CD1-CD2 3.61Å; F10-W34 AromaticContact CD1-CE3 3.86Å; F10-W34 HydrophobicContact CD1-CE3 3.86Å; F10-W34 AromaticContact CD1-CG 3.45Å; F10-W34 HydrophobicContact CD1-CG 3.45Å; F10-W34 VanDerWaalsContact CD1-CG 3.45Å; F10-W34 HydrophobicContact CE1-CB 3.76Å; F10-W34 AromaticContact CE1-CD1 3.99Å; F10-W34 HydrophobicContact CE1-CD2 4.17Å; F10-W34 AromaticContact CE1-CG 3.69Å; F10-W34 HydrophobicContact CE1-CG 3.69Å; F10-W34 HydrophobicContact CG-CB 4.06Å; F10-W34 HydrophobicContact CG-CG 4.45Å; G11-W34 PolarHBondContact N-O 3.31Å; W34-K36 HydrophobicContact CH2-CB 4.22Å; W34-T54 VanDerWaalsContact CA-O 3.32Å; W34-T54 WeakPolarHBondContact CA-O 3.28Å; W34-S55 PolarHBondContact NE1-O 2.94Å; W34-I60 HydrophobicContact CB-CD1 3.39Å; W34-I60 HydrophobicContact CB-CG1 4.19Å; W34-I60 VanDerWaalsContact N-CD1 3.25Å; W34-I73 HydrophobicContact CE3-CG2 4.44Å; W34-I73 HydrophobicContact CZ3-CD1 4.14Å; W34-I73 HydrophobicContact CZ3-CG2 4.02Å; W34-L77 HydrophobicContact CH2-CD1 4.45Å
35G96.8Very high97.1Very high0 Ų054.5 Ų54.50%029%0.287CS..  trans-115.8160.116900000111.6T37 T54 S55G35-T37 PolarHBondContact O-N 3.43Å; G35-T54 PolarHBondContact N-O 2.95Å; G35-T54 VanDerWaalsContact N-O 3.16Å; G35-S55 VanDerWaalsContact O-CA 3.31Å; G35-S55 WeakPolarHBondContact O-CA 3.31Å
36K94.4Very high97.2Very high146 Ų14656.2 Ų56.264%0.63528%0.281SS*.SBendtrans-63.9-31.7174-177-176.4174.5-171.10111.1W34W34-K36 HydrophobicContact CH2-CB 4.22Å
37T96.4Very high97.2Very high57 Ų5753.6 Ų53.635%0.3527%0.268SS..SBendtrans-126.1156.7172.269.60000109.9G35 E39 E40 A41G35-T37 PolarHBondContact O-N 3.43Å; T37-E39 PolarHBondContact O-N 3.38Å; T37-E40 PolarHBondContact O-N 3.48Å; T37-E40 WeakPolarHBondContact OG1-CB 3.34Å; T37-E40 VanDerWaalsContact OG1-CG 3.3Å; T37-E40 WeakPolarHBondContact OG1-CG 3.37Å; T37-E40 PolarHBondContact OG1-N 2.91Å; T37-A41 PolarHBondContact O-N 3.49Å; T37-A41 VanDerWaalsContact O-N 3.09Å
38E97.4Very high97.3Very high90 Ų9052.8 Ų52.842%0.42125%0.252SS..Hα-helixtrans-60.3-38.5177.8-162.275.2179.200111.2A41 K42 Y53 S55E38-A41 PolarHBondContact O-N 2.88Å; E38-K42 VanDerWaalsContact O-CB 3.25Å; E38-K42 WeakPolarHBondContact O-CB 3.46Å; E38-K42 PolarHBondContact O-N 2.89Å; E38-Y53 HydrophobicContact CG-CE2 4.5Å; E38-S55 PolarHBondContact OE2-N 3.42Å
39E98.1Very high97.3Very high136 Ų13657.2 Ų57.264%0.63628%0.278SS*.Hα-helixtrans-63.7-47.5179.4-167.569.1-169.700111.7T37 A41 K42 Q43T37-E39 PolarHBondContact O-N 3.38Å; E39-A41 VanDerWaalsContact C-N 3.31Å; E39-A41 PolarHBondContact O-N 3.18Å; E39-K42 PolarHBondContact O-N 3.47Å; E39-Q43 WeakPolarHBondContact O-CB 3.44Å; E39-Q43 PolarHBondContact O-N 2.86Å
40E97.1Very high97.4Very high76 Ų7654.3 Ų54.336%0.35526%0.259SS..Hα-helixtrans-62.3-40.4176.6-74172.4-16600111.7T12 T37 L44T12-E40 HydrophobicContact CG2-CB 4.15Å; T12-E40 WeakPolarHBondContact CG2-O 3.28Å; T12-E40 PolarHBondContact OG1-OE2 2.91Å; T37-E40 PolarHBondContact O-N 3.48Å; T37-E40 WeakPolarHBondContact OG1-CB 3.34Å; T37-E40 VanDerWaalsContact OG1-CG 3.3Å; T37-E40 WeakPolarHBondContact OG1-CG 3.37Å; T37-E40 PolarHBondContact OG1-N 2.91Å; E40-L44 PolarHBondContact O-N 3.17Å
41A98Very high97.3Very high0 Ų058.9 Ų58.90%030%0.298CS..Hα-helixtrans-64.4-49.8178.200000110.5L33 T37 E38 E39 Q43 L44 A45 Y53L33-A41 WeakPolarHBondContact CD2-O 3.13Å; T37-A41 PolarHBondContact O-N 3.49Å; T37-A41 VanDerWaalsContact O-N 3.09Å; E38-A41 PolarHBondContact O-N 2.88Å; E39-A41 VanDerWaalsContact C-N 3.31Å; E39-A41 PolarHBondContact O-N 3.18Å; A41-Q43 PolarHBondContact O-N 3.26Å; A41-L44 PolarHBondContact O-N 2.93Å; A41-A45 VanDerWaalsContact O-CB 3.22Å; A41-A45 WeakPolarHBondContact O-CB 3.39Å; A41-A45 PolarHBondContact O-N 2.92Å; A41-Y53 HydrophobicContact CB-CD2 4.15Å
42K98.4Very high97.3Very high79 Ų7960.3 Ų60.334%0.34330%0.304SS..Hα-helixtrans-58-49.8178.4-178.6178.5173.9-172.90111.6E38 E39 L44 A45 E46 Y53E38-K42 VanDerWaalsContact O-CB 3.25Å; E38-K42 WeakPolarHBondContact O-CB 3.46Å; E38-K42 PolarHBondContact O-N 2.89Å; E39-K42 PolarHBondContact O-N 3.47Å; K42-L44 PolarHBondContact O-N 2.91Å; K42-A45 PolarHBondContact O-N 2.85Å; K42-E46 WeakPolarHBondContact CE-OE1 3.25Å; K42-E46 HydrophobicContact CG-CG 4.4Å; K42-E46 IonicContact NZ-OE1 3.9Å; K42-E46 WeakPolarHBondContact O-CG 3.5Å; K42-E46 PolarHBondContact O-N 2.78Å; K42-Y53 HydrophobicContact CB-CD2 4.03Å; K42-Y53 HydrophobicContact CB-CE1 4.44Å; K42-Y53 HydrophobicContact CB-CE2 3.57Å; K42-Y53 HydrophobicContact CG-CE1 4.23Å; K42-Y53 HydrophobicContact CG-CE2 4.02Å
43Q98.2Very high97.3Very high103 Ų10363.9 Ų63.948%0.48132%0.318SS..Hα-helixtrans-56.1-50-178.3-176.1-173.5-15.800111.3E39 A41 E46 E47E39-Q43 WeakPolarHBondContact O-CB 3.44Å; E39-Q43 PolarHBondContact O-N 2.86Å; A41-Q43 PolarHBondContact O-N 3.26Å; Q43-E46 PolarHBondContact O-N 3.46Å; Q43-E47 WeakPolarHBondContact CG-OE1 3.26Å; Q43-E47 PolarHBondContact NE2-OE1 3Å; Q43-E47 WeakPolarHBondContact O-CG 3.36Å; Q43-E47 PolarHBondContact O-N 3.09Å
44L97.6Very high97.3Very high1 Ų164.1 Ų64.11%0.00532%0.319CS..Hα-helixtrans-71.4-34179.9178.463.2000112.3T12 A16 R17 L33 E40 A41 K42 E46 E47 M48T12-L44 HydrophobicContact CG2-CB 4.38Å; T12-L44 HydrophobicContact CG2-CD2 4.24Å; A16-L44 HydrophobicContact CB-CD2 3.77Å; R17-L44 HydrophobicContact CG-CD1 3.67Å; L33-L44 HydrophobicContact CD1-CD2 4.12Å; L33-L44 HydrophobicContact CD2-CB 3.78Å; L33-L44 HydrophobicContact CD2-CD2 3.9Å; L33-L44 HydrophobicContact CD2-CG 3.74Å; E40-L44 PolarHBondContact O-N 3.17Å; A41-L44 PolarHBondContact O-N 2.93Å; K42-L44 PolarHBondContact O-N 2.91Å; L44-E46 VanDerWaalsContact C-N 3.34Å; L44-E47 HydrophobicContact CD1-CB 4.41Å; L44-E47 PolarHBondContact O-N 2.84Å; L44-M48 HydrophobicContact CD1-CE 4.1Å; L44-M48 HydrophobicContact CD1-CG 3.63Å; L44-M48 HydrophobicContact CG-CG 4.25Å; L44-M48 WeakPolarHBondContact O-CB 3.2Å; L44-M48 WeakPolarHBondContact O-CG 3.46Å; L44-M48 PolarHBondContact O-N 3.09Å
45A97.8Very high97.3Very high1 Ų165.4 Ų65.41%0.00833%0.331CS..Hα-helixtrans-62.9-41.4175.900000111.6L33 A41 K42 M48 N49 I50 Y53L33-A45 HydrophobicContact CD2-CB 4.03Å; A41-A45 VanDerWaalsContact O-CB 3.22Å; A41-A45 WeakPolarHBondContact O-CB 3.39Å; A41-A45 PolarHBondContact O-N 2.92Å; K42-A45 PolarHBondContact O-N 2.85Å; A45-M48 CarbonylContact O-C 3.51Å; A45-M48 PolarHBondContact O-N 3.44Å; A45-N49 CarbonylContact O-C 3.55Å; A45-N49 WeakPolarHBondContact O-CA 3.32Å; A45-N49 PolarHBondContact O-N 3.39Å; A45-I50 HydrophobicContact CB-CB 4.24Å; A45-I50 PolarHBondContact O-N 3.06Å; A45-Y53 HydrophobicContact CB-CD1 3.56Å; A45-Y53 HydrophobicContact CB-CE1 4.47Å; A45-Y53 HydrophobicContact CB-CG 3.87Å
46E97.9Very high97.2Very high118 Ų11872.9 Ų72.955%0.55136%0.359SS*.Hα-helixtrans-65-47.9173-71.5177.5173.400111.3K42 Q43 L44 M48 N49K42-E46 WeakPolarHBondContact CE-OE1 3.25Å; K42-E46 HydrophobicContact CG-CG 4.4Å; K42-E46 IonicContact NZ-OE1 3.9Å; K42-E46 WeakPolarHBondContact O-CG 3.5Å; K42-E46 PolarHBondContact O-N 2.78Å; Q43-E46 PolarHBondContact O-N 3.46Å; L44-E46 VanDerWaalsContact C-N 3.34Å; E46-M48 PolarHBondContact O-N 3.35Å; E46-M48 VanDerWaalsContact O-N 3.16Å; E46-N49 PolarHBondContact O-N 2.84Å
47E96.8Very high97.2Very high87 Ų8767.3 Ų67.341%0.40734%0.337SS..Hα-helixtrans-54.2-35.2175.6-75.8171.6-161.400112.1R17 Q43 L44R17-E47 IonicContact CZ-OE2 3.52Å; R17-E47 IonicContact NE-OE2 3.2Å; R17-E47 PolarHBondContact NE-OE2 3.32Å; R17-E47 IonicContact NH2-OE1 3.04Å; R17-E47 IonicContact NH2-OE2 3.88Å; R17-E47 PolarHBondContact NH2-OE2 3Å; Q43-E47 WeakPolarHBondContact CG-OE1 3.26Å; Q43-E47 PolarHBondContact NE2-OE1 3Å; Q43-E47 WeakPolarHBondContact O-CG 3.36Å; Q43-E47 PolarHBondContact O-N 3.09Å; L44-E47 HydrophobicContact CD1-CB 4.41Å; L44-E47 PolarHBondContact O-N 2.84Å
48M96.4Very high97.1Very high33 Ų3367.7 Ų67.716%0.16334%0.337CS..Hα-helixtrans-107.43.4-173.3-61.8-68.1145.700113.7R17 V20 P21 R24 L44 A45 E46 I50R17-M48 HydrophobicContact CB-CE 4.43Å; R17-M48 HydrophobicContact CG-CE 4.2Å; V20-M48 HydrophobicContact CG1-CB 4.19Å; V20-M48 HydrophobicContact CG1-CG 4.32Å; V20-M48 HydrophobicContact CG1-SD 4.34Å; P21-M48 HydrophobicContact CG-SD 4.43Å; R24-M48 VanDerWaalsContact CZ-O 3.24Å; R24-M48 PolarHBondContact NH1-O 2.97Å; R24-M48 PolarHBondContact NH2-O 3.38Å; L44-M48 HydrophobicContact CD1-CE 4.1Å; L44-M48 HydrophobicContact CD1-CG 3.63Å; L44-M48 HydrophobicContact CG-CG 4.25Å; L44-M48 WeakPolarHBondContact O-CB 3.2Å; L44-M48 WeakPolarHBondContact O-CG 3.46Å; L44-M48 PolarHBondContact O-N 3.09Å; A45-M48 CarbonylContact O-C 3.51Å; A45-M48 PolarHBondContact O-N 3.44Å; E46-M48 PolarHBondContact O-N 3.35Å; E46-M48 VanDerWaalsContact O-N 3.16Å; M48-I50 HydrophobicContact CB-CD1 3.93Å; M48-I50 HydrophobicContact CB-CG1 4.07Å; M48-I50 PolarHBondContact O-N 3.23Å
49N97Very high97.1Very high141 Ų14166 Ų6675%0.75433%0.331SS*.THydrogen-bonded Turntrans49.356.4-172.9-57.9-63.3000113R24 A45 E46R24-N49 PolarHBondContact NH2-O 2.88Å; A45-N49 CarbonylContact O-C 3.55Å; A45-N49 WeakPolarHBondContact O-CA 3.32Å; A45-N49 PolarHBondContact O-N 3.39Å; E46-N49 PolarHBondContact O-N 2.84Å
50I97.4Very high97Very high9 Ų959.6 Ų59.65%0.04630%0.301CS..  trans-104.7125.9173.2-60.1166.6000107.9V20 V30 L33 A45 M48V20-I50 HydrophobicContact CG1-CD1 4.24Å; V20-I50 HydrophobicContact CG2-CD1 4.33Å; V30-I50 HydrophobicContact CG1-CD1 3.7Å; V30-I50 HydrophobicContact CG1-CG1 4.15Å; V30-I50 HydrophobicContact CG1-CG2 4.44Å; L33-I50 HydrophobicContact CB-CD1 4.15Å; L33-I50 HydrophobicContact CB-CG2 4.22Å; L33-I50 HydrophobicContact CD1-CD1 4.45Å; L33-I50 HydrophobicContact CD2-CD1 4.29Å; A45-I50 HydrophobicContact CB-CB 4.24Å; A45-I50 PolarHBondContact O-N 3.06Å; M48-I50 HydrophobicContact CB-CD1 3.93Å; M48-I50 HydrophobicContact CB-CG1 4.07Å; M48-I50 PolarHBondContact O-N 3.23Å
51A95.3Very high96.8Very high104 Ų10457 Ų5786%0.8629%0.29SS*.SBendtrans-73.7-38.4-170.200000113.5
52F98.1Very high96.6Very high68 Ų6863.3 Ų63.330%0.29832%0.323SS..EExtended strand (participates in β ladder)trans-110.4126.4-178.6-174.3-101.3000111A32 L33 T54 D59 H63A32-F52 WeakPolarHBondContact CA-O 3.29Å; A32-F52 HydrophobicContact CB-CD1 3.7Å; A32-F52 HydrophobicContact CB-CE1 4.4Å; L33-F52 PolarHBondContact N-O 3.37Å; F52-T54 HydrophobicContact CE1-CG2 4.06Å; F52-T54 HydrophobicContact CZ-CG2 4.43Å; F52-D59 HydrophobicContact CE1-CB 4.48Å; F52-D59 HydrophobicContact CZ-CB 4.16Å; F52-H63 AromaticContact CD1-CD2 3.65Å; F52-H63 AromaticContact CE1-CD2 3.8Å; F52-H63 AromaticContact CG-CD2 3.97Å
53Y98.4Very high96.5Very high74 Ų7461.6 Ų61.629%0.2932%0.316SS..EExtended strand (participates in β ladder)trans-142.2155.117664.7-97.3000110.1L33 E38 A41 K42 A45L33-Y53 WeakPolarHBondContact O-CA 3.46Å; E38-Y53 HydrophobicContact CG-CE2 4.5Å; A41-Y53 HydrophobicContact CB-CD2 4.15Å; K42-Y53 HydrophobicContact CB-CD2 4.03Å; K42-Y53 HydrophobicContact CB-CE1 4.44Å; K42-Y53 HydrophobicContact CB-CE2 3.57Å; K42-Y53 HydrophobicContact CG-CE1 4.23Å; K42-Y53 HydrophobicContact CG-CE2 4.02Å; A45-Y53 HydrophobicContact CB-CD1 3.56Å; A45-Y53 HydrophobicContact CB-CE1 4.47Å; A45-Y53 HydrophobicContact CB-CG 3.87Å
54T98.1Very high96.3Very high5 Ų565 Ų653%0.03133%0.332CS..EExtended strand (participates in β ladder)trans-165.8157.6-177-179.30000110.8L33 W34 G35 F52 R56 D59 I60L33-T54 PolarHBondContact O-N 2.87Å; L33-T54 VanDerWaalsContact O-N 3.09Å; W34-T54 VanDerWaalsContact CA-O 3.32Å; W34-T54 WeakPolarHBondContact CA-O 3.28Å; G35-T54 PolarHBondContact N-O 2.95Å; G35-T54 VanDerWaalsContact N-O 3.16Å; F52-T54 HydrophobicContact CE1-CG2 4.06Å; F52-T54 HydrophobicContact CZ-CG2 4.43Å; T54-R56 WeakPolarHBondContact CG2-O 3.31Å; T54-R56 WeakPolarHBondContact OG1-CB 3.3Å; T54-R56 PolarHBondContact OG1-N 2.85Å; T54-D59 HydrophobicContact CG2-CB 3.98Å; T54-D59 PolarHBondContact OG1-OD2 3.29Å; T54-I60 HydrophobicContact CG2-CD1 4.25Å; T54-I60 HydrophobicContact CG2-CG1 3.67Å
55S97Very high96.1Very high45 Ų4567.5 Ų67.532%0.31535%0.345SS..SBendtrans-93.63.7163.878.40000114.1W34 G35 E38W34-S55 PolarHBondContact NE1-O 2.94Å; G35-S55 VanDerWaalsContact O-CA 3.31Å; G35-S55 WeakPolarHBondContact O-CA 3.31Å; E38-S55 PolarHBondContact OE2-N 3.42Å
56R96Very high96Very high157 Ų15768.5 Ų68.559%0.59235%0.351SS*.  trans-101.8120.9-176.5-61168.157.31036.2110.1T54 D58 D59T54-R56 WeakPolarHBondContact CG2-O 3.31Å; T54-R56 WeakPolarHBondContact OG1-CB 3.3Å; T54-R56 PolarHBondContact OG1-N 2.85Å; R56-D58 PolarHBondContact O-N 3.32Å; R56-D59 HydrophobicContact CB-CB 4.2Å; R56-D59 WeakPolarHBondContact CB-OD2 3.21Å; R56-D59 WeakPolarHBondContact CD-OD2 3.42Å; R56-D59 IonicContact NE-OD1 3.19Å; R56-D59 PolarHBondContact NE-OD1 3.18Å; R56-D59 IonicContact NE-OD2 3.2Å; R56-D59 PolarHBondContact NE-OD2 3.38Å; R56-D59 IonicContact NH2-OD1 2.68Å; R56-D59 PolarHBondContact O-N 2.83Å
57T94.5Very high95.9Very high29 Ų2968 Ų6818%0.17835%0.353CS..Hα-helixtrans-61.7-44.9-175.9-57.80000112.6F10 D59 I60 L61 I81 K84F10-T57 HydrophobicContact CE1-CG2 3.84Å; F10-T57 HydrophobicContact CZ-CG2 4.21Å; T57-D59 PolarHBondContact O-N 3.12Å; T57-I60 PolarHBondContact O-N 3.34Å; T57-L61 HydrophobicContact CG2-CD1 3.86Å; T57-L61 HydrophobicContact CG2-CG 4.27Å; T57-L61 PolarHBondContact O-N 3.29Å; T57-I81 HydrophobicContact CG2-CB 4.3Å; T57-I81 HydrophobicContact CG2-CD1 4.28Å; T57-I81 HydrophobicContact CG2-CG1 3.86Å; T57-I81 HydrophobicContact CG2-CG2 4.01Å; T57-K84 HydrophobicContact CG2-CD 4.35Å
58D94.2Very high95.8Very high66 Ų6667.3 Ų67.335%0.35335%0.351SS..Hα-helixtrans-65.5-31.7-173.5-59.8-19.5000111.7R56 I60 L61 L62 K84R56-D58 PolarHBondContact O-N 3.32Å; D58-I60 VanDerWaalsContact C-N 3.26Å; D58-I60 PolarHBondContact O-N 2.9Å; D58-L61 PolarHBondContact O-N 3.37Å; D58-L62 HydrophobicContact CB-CD1 4.45Å; D58-L62 WeakPolarHBondContact O-CB 3.4Å; D58-L62 WeakPolarHBondContact O-CG 3.36Å; D58-L62 PolarHBondContact O-N 3.2Å; D58-K84 WeakPolarHBondContact OD1-CD 3.43Å; D58-K84 IonicContact OD1-NZ 3.4Å; D58-K84 PolarHBondContact OD1-NZ 3.01Å; D58-K84 IonicContact OD2-NZ 2.99Å; D58-K84 PolarHBondContact OD2-NZ 3.21Å
59D96.4Very high95.8Very high55 Ų5567.7 Ų67.729%0.29436%0.355SS..Hα-helixtrans-64.4-29.6179-6310.7000112.2F52 T54 R56 T57F52-D59 HydrophobicContact CE1-CB 4.48Å; F52-D59 HydrophobicContact CZ-CB 4.16Å; T54-D59 HydrophobicContact CG2-CB 3.98Å; T54-D59 PolarHBondContact OG1-OD2 3.29Å; R56-D59 HydrophobicContact CB-CB 4.2Å; R56-D59 WeakPolarHBondContact CB-OD2 3.21Å; R56-D59 WeakPolarHBondContact CD-OD2 3.42Å; R56-D59 IonicContact NE-OD1 3.19Å; R56-D59 PolarHBondContact NE-OD1 3.18Å; R56-D59 IonicContact NE-OD2 3.2Å; R56-D59 PolarHBondContact NE-OD2 3.38Å; R56-D59 IonicContact NH2-OD1 2.68Å; R56-D59 PolarHBondContact O-N 2.83Å; T57-D59 PolarHBondContact O-N 3.12Å
60I95.9Very high95.7Very high0 Ų062.2 Ų62.20%033%0.327CS..Hα-helixtrans-79.8-45.5171.6-61.9-148.5000111.3F10 A32 W34 T54 T57 D58 L62 H63 V66F10-I60 HydrophobicContact CE1-CB 4.46Å; F10-I60 HydrophobicContact CE2-CB 4.25Å; F10-I60 HydrophobicContact CE2-CG2 3.68Å; F10-I60 HydrophobicContact CZ-CB 3.76Å; F10-I60 HydrophobicContact CZ-CG1 4.46Å; F10-I60 HydrophobicContact CZ-CG2 3.72Å; A32-I60 HydrophobicContact CB-CB 4.49Å; A32-I60 HydrophobicContact CB-CD1 3.77Å; A32-I60 HydrophobicContact CB-CG1 4.07Å; A32-I60 HydrophobicContact CB-CG2 4.07Å; W34-I60 HydrophobicContact CB-CD1 3.39Å; W34-I60 HydrophobicContact CB-CG1 4.19Å; W34-I60 VanDerWaalsContact N-CD1 3.25Å; T54-I60 HydrophobicContact CG2-CD1 4.25Å; T54-I60 HydrophobicContact CG2-CG1 3.67Å; T57-I60 PolarHBondContact O-N 3.34Å; D58-I60 VanDerWaalsContact C-N 3.26Å; D58-I60 PolarHBondContact O-N 2.9Å; I60-L62 PolarHBondContact O-N 3.16Å; I60-H63 VanDerWaalsContact O-CB 3.31Å; I60-H63 WeakPolarHBondContact O-CB 3.43Å; I60-H63 PolarHBondContact O-N 2.96Å; I60-H63 VanDerWaalsContact O-N 3.12Å; I60-V66 HydrophobicContact CG2-CG1 4.45Å
61L93.9Very high95.6Very high23 Ų2364 Ų6412%0.1234%0.336CS..Hα-helixtrans-65.2-27.5-175.6-63.3-178000112.7F10 T57 D58 V69 K84 A85F10-L61 HydrophobicContact CE2-CD2 4.14Å; F10-L61 HydrophobicContact CZ-CD2 3.94Å; F10-L61 HydrophobicContact CZ-CG 4.25Å; T57-L61 HydrophobicContact CG2-CD1 3.86Å; T57-L61 HydrophobicContact CG2-CG 4.27Å; T57-L61 PolarHBondContact O-N 3.29Å; D58-L61 PolarHBondContact O-N 3.37Å; L61-V69 HydrophobicContact CD2-CG1 4.01Å; L61-K84 HydrophobicContact CD1-CB 3.44Å; L61-K84 VanDerWaalsContact CD1-CB 3.44Å; L61-K84 HydrophobicContact CD1-CD 4.43Å; L61-A85 HydrophobicContact CD2-CB 3.8Å
62L94.2Very high95.4Very high132 Ų13261.3 Ų61.369%0.69131%0.311SS*.THydrogen-bonded Turntrans-98.84.5177.7-60.1174.1000112.9D58 I60 Q64D58-L62 HydrophobicContact CB-CD1 4.45Å; D58-L62 WeakPolarHBondContact O-CB 3.4Å; D58-L62 WeakPolarHBondContact O-CG 3.36Å; D58-L62 PolarHBondContact O-N 3.2Å; I60-L62 PolarHBondContact O-N 3.16Å; L62-Q64 PolarHBondContact O-N 3Å
63H95.2Very high95.1Very high42 Ų4259.2 Ų59.219%0.19430%0.303CS..  trans-69.6120.5179.9-168.2-78.3000109.8F52 I60 D65 V66F52-H63 AromaticContact CD1-CD2 3.65Å; F52-H63 AromaticContact CE1-CD2 3.8Å; F52-H63 AromaticContact CG-CD2 3.97Å; I60-H63 VanDerWaalsContact O-CB 3.31Å; I60-H63 WeakPolarHBondContact O-CB 3.43Å; I60-H63 PolarHBondContact O-N 2.96Å; I60-H63 VanDerWaalsContact O-N 3.12Å; H63-D65 PolarHBondContact ND1-N 2.91Å; H63-D65 PolarHBondContact O-N 3Å; H63-V66 HydrophobicContact CB-CB 4.15Å; H63-V66 HydrophobicContact CB-CG2 3.78Å; H63-V66 PolarHBondContact O-N 3.31Å
64Q93.4Very high94.6Very high175 Ų17559.6 Ų59.682%0.81832%0.315SS*.THydrogen-bonded Turntrans-56.6-25.1-171.568.2179.816.700115.2L62L62-Q64 PolarHBondContact O-N 3Å
65D95.1Very high94.1Very high54 Ų5464.5 Ų64.529%0.28935%0.347SS..THydrogen-bonded Turntrans-97.4-1.7-179.7-73.1-70.1000113.5K2 G6 E31 H63K2-D65 IonicContact NZ-OD1 2.86Å; K2-D65 PolarHBondContact NZ-OD1 3.26Å; G6-D65 WeakPolarHBondContact CA-O 3.31Å; E31-D65 HydrophobicContact CB-CB 4.42Å; E31-D65 HydrophobicContact CG-CB 4.07Å; E31-D65 WeakPolarHBondContact CG-O 3.22Å; H63-D65 PolarHBondContact ND1-N 2.91Å; H63-D65 PolarHBondContact O-N 3Å
66V95.4Very high93.6Very high21 Ų2167.2 Ų67.213%0.12736%0.363CS..  trans-94.2112.8178.1172.50000109.8E31 A32 I60 H63 V69E31-V66 HydrophobicContact CB-CG2 3.95Å; A32-V66 HydrophobicContact CB-CG2 3.88Å; I60-V66 HydrophobicContact CG2-CG1 4.45Å; H63-V66 HydrophobicContact CB-CB 4.15Å; H63-V66 HydrophobicContact CB-CG2 3.78Å; H63-V66 PolarHBondContact O-N 3.31Å; V66-V69 HydrophobicContact CG1-CG1 3.96Å
67D94.3Very high93.1Very high109 Ų10963 Ų6358%0.58335%0.352SS*.  trans-107.4-18.9178.4-49-73.8000112.3P5 G6P5-D67 WeakPolarHBondContact CA-OD2 3.39Å; P5-D67 HydrophobicContact CB-CB 3.55Å; G6-D67 PolarHBondContact N-OD2 3.23Å; G6-D67 PolarHBondContact O-N 3.38Å
68L94.9Very high92.9Very high72 Ų7263.4 Ų63.438%0.37736%0.355SS..EExtended strand (participates in β ladder)trans-136.9139.8-177.8174.165.2000110P5 G6 V7 G8 F28P5-L68 HydrophobicContact CB-CB 4.06Å; P5-L68 HydrophobicContact CG-CB 4.21Å; P5-L68 HydrophobicContact CG-CD2 4.29Å; G6-L68 PolarHBondContact O-N 3.24Å; V7-L68 CarbonylContact C-O 3.54Å; V7-L68 VanDerWaalsContact CA-O 3.28Å; V7-L68 WeakPolarHBondContact CA-O 3.34Å; V7-L68 HydrophobicContact CG2-CB 4.47Å; V7-L68 HydrophobicContact CG2-CD2 4.18Å; G8-L68 PolarHBondContact N-O 3.12Å; F28-L68 HydrophobicContact CE1-CD2 4.45Å
69V96.3Very high92.7Very high40 Ų4069.6 Ų69.624%0.24237%0.373CS..EExtended strand (participates in β ladder)trans-116.5137.1172.9-62.20000112.3G8 F10 L61 V66 I71 A85G8-V69 CarbonylContact O-C 3.55Å; G8-V69 VanDerWaalsContact O-CA 3.26Å; G8-V69 WeakPolarHBondContact O-CA 3.38Å; F10-V69 HydrophobicContact CD2-CB 4.31Å; F10-V69 HydrophobicContact CE2-CB 4.05Å; F10-V69 HydrophobicContact CE2-CG1 3.89Å; L61-V69 HydrophobicContact CD2-CG1 4.01Å; V66-V69 HydrophobicContact CG1-CG1 3.96Å; V69-I71 HydrophobicContact CG2-CD1 4.31Å; V69-I71 HydrophobicContact CG2-CG1 4.36Å; V69-A85 HydrophobicContact CG2-CB 4.05Å
70C96Very high92.3Very high26 Ų2673.5 Ų73.518%0.17639%0.389CS..EExtended strand (participates in β ladder)trans-110.6112.4171.3-65.60000109.8V7 G8 F10 L19V7-C70 HydrophobicContact CG1-CB 4.46Å; G8-C70 PolarHBondContact O-N 2.91Å; F10-C70 PolarHBondContact N-O 3.23Å; L19-C70 HydrophobicContact CD2-CB 3.66Å
71I95.3Very high92Very high46 Ų4673.8 Ų73.824%0.23639%0.391CS..EExtended strand (participates in β ladder)trans-102.7105.7-175.6-54.5168.9000110.2F10 V69 I73 T78 I81F10-I71 HydrophobicContact CB-CG1 4.39Å; F10-I71 HydrophobicContact CB-CG2 4.35Å; F10-I71 HydrophobicContact CD2-CG1 4.07Å; F10-I71 HydrophobicContact CG-CG1 4.39Å; V69-I71 HydrophobicContact CG2-CD1 4.31Å; V69-I71 HydrophobicContact CG2-CG1 4.36Å; I71-I73 HydrophobicContact CG2-CD1 4.1Å; I71-I73 HydrophobicContact CG2-CG1 3.81Å; I71-T78 HydrophobicContact CG2-CG2 4.01Å; I71-I81 HydrophobicContact CD1-CB 4.26Å; I71-I81 HydrophobicContact CD1-CG2 3.68Å; I71-I81 HydrophobicContact CG1-CG2 4.11Å
72S91.2Very high92Very high48 Ų4874.6 Ų74.634%0.33640%0.399SS..  trans-122.754.3-176.7-66.30000111.9F10F10-S72 PolarHBondContact O-N 2.91Å
73I91.3Very high91.9Very high24 Ų2471.1 Ų71.112%0.12338%0.383CS..SBendtrans-126.6168.8-175.867.4-178.4000111.6F10 G11 W34 I71 L77 T78 I81F10-I73 HydrophobicContact CB-CG2 4.37Å; F10-I73 WeakPolarHBondContact O-CG2 3.32Å; G11-I73 VanDerWaalsContact CA-CG2 3.48Å; W34-I73 HydrophobicContact CE3-CG2 4.44Å; W34-I73 HydrophobicContact CZ3-CD1 4.14Å; W34-I73 HydrophobicContact CZ3-CG2 4.02Å; I71-I73 HydrophobicContact CG2-CD1 4.1Å; I71-I73 HydrophobicContact CG2-CG1 3.81Å; I73-L77 HydrophobicContact CD1-CB 3.54Å; I73-L77 HydrophobicContact CG1-CB 4.14Å; I73-T78 WeakPolarHBondContact CG1-OG1 3.32Å; I73-T78 PolarHBondContact O-OG1 3.14Å; I73-I81 HydrophobicContact CD1-CD1 3.39Å; I73-I81 HydrophobicContact CD1-CG1 4.36Å
74P88.3Confident91.6Very high82 Ų8272.7 Ų72.753%0.53239%0.389SS..  trans-57149.8179.4-2836.9000113.9L77 T78P74-L77 PolarHBondContact O-N 3.46Å; P74-L77 VanDerWaalsContact O-N 3.15Å; P74-T78 PolarHBondContact O-N 3.2Å; P74-T78 VanDerWaalsContact O-N 3.14Å; P74-T78 PolarHBondContact O-OG1 3.25Å
75P87.3Confident91.5Very high108 Ų10865 Ų6570%0.70136%0.356SS*.Hα-helixtrans-52.5-39.1-176.7-27.233.7000116.2L77 T78P75-L77 VanDerWaalsContact C-N 3.26Å; P75-L77 PolarHBondContact O-N 3.47Å; P75-T78 PolarHBondContact O-N 2.72Å
76P86.4Confident91.3Very high103 Ų10368.8 Ų68.867%0.66938%0.375SS*.Hα-helixtrans-60.2-33.5-179.6-26.336000114.1
77L84.8Confident90.9Very high69 Ų6973.8 Ų73.836%0.36140%0.397SS..Hα-helixtrans-86.8-33.4178.6-63.7173.7000111.6W34 I73 P74 P75 R79 Q80 I81W34-L77 HydrophobicContact CH2-CD1 4.45Å; I73-L77 HydrophobicContact CD1-CB 3.54Å; I73-L77 HydrophobicContact CG1-CB 4.14Å; P74-L77 PolarHBondContact O-N 3.46Å; P74-L77 VanDerWaalsContact O-N 3.15Å; P75-L77 VanDerWaalsContact C-N 3.26Å; P75-L77 PolarHBondContact O-N 3.47Å; L77-R79 VanDerWaalsContact C-N 3.28Å; L77-R79 PolarHBondContact O-N 3.15Å; L77-Q80 PolarHBondContact O-N 3.48Å; L77-I81 PolarHBondContact O-N 3.34Å
78T91.4Very high90Very high37 Ų3771.4 Ų71.423%0.22739%0.389CS..Hα-helixtrans-55.6-40.6-177.6-620000112.6I71 I73 P74 P75 Q80 I81 S82I71-T78 HydrophobicContact CG2-CG2 4.01Å; I73-T78 WeakPolarHBondContact CG1-OG1 3.32Å; I73-T78 PolarHBondContact O-OG1 3.14Å; P74-T78 PolarHBondContact O-N 3.2Å; P74-T78 VanDerWaalsContact O-N 3.14Å; P74-T78 PolarHBondContact O-OG1 3.25Å; P75-T78 PolarHBondContact O-N 2.72Å; T78-Q80 PolarHBondContact O-N 3.46Å; T78-I81 PolarHBondContact O-N 3.05Å; T78-S82 WeakPolarHBondContact O-CB 3.28Å; T78-S82 PolarHBondContact O-N 3.24Å; T78-S82 PolarHBondContact O-OG 2.93Å
79R89.4Confident88.3Confident195 Ų19572.9 Ų72.974%0.73641%0.405SS*.Hα-helixtrans-57-51.9-178.2-180-177.9175.186.22112.2L77 I81 S82 V83L77-R79 VanDerWaalsContact C-N 3.28Å; L77-R79 PolarHBondContact O-N 3.15Å; R79-I81 PolarHBondContact O-N 3.42Å; R79-S82 PolarHBondContact O-N 3.49Å; R79-V83 VanDerWaalsContact O-CG2 3.32Å; R79-V83 WeakPolarHBondContact O-CG2 3.32Å; R79-V83 PolarHBondContact O-N 3.47Å
80Q87.8Confident85.9Confident137 Ų13781 Ų8164%0.6445%0.446SS*.Hα-helixtrans-65.6-42.2-174.3-65.9-176.113.400111.4L77 T78 K84L77-Q80 PolarHBondContact O-N 3.48Å; T78-Q80 PolarHBondContact O-N 3.46Å; Q80-K84 WeakPolarHBondContact O-CG 3.32Å; Q80-K84 PolarHBondContact O-N 3.37Å; Q80-K84 VanDerWaalsContact O-N 3.1Å
81I90.4Very high85.4Confident6 Ų683.8 Ų83.83%0.03146%0.46CS..Hα-helixtrans-66.4-43.3179.2-55.9-170.9000110.8F10 T57 I71 I73 L77 T78 R79 V83 K84 A85F10-I81 HydrophobicContact CD1-CD1 3.49Å; F10-I81 VanDerWaalsContact CD1-CD1 3.49Å; F10-I81 HydrophobicContact CD1-CG2 3.85Å; F10-I81 HydrophobicContact CD2-CG2 4.24Å; F10-I81 HydrophobicContact CE1-CD1 3.87Å; F10-I81 HydrophobicContact CE1-CG2 3.68Å; F10-I81 HydrophobicContact CE2-CG2 4.07Å; F10-I81 HydrophobicContact CG-CD1 4.31Å; F10-I81 HydrophobicContact CG-CG2 4.13Å; F10-I81 HydrophobicContact CZ-CG2 3.78Å; T57-I81 HydrophobicContact CG2-CB 4.3Å; T57-I81 HydrophobicContact CG2-CD1 4.28Å; T57-I81 HydrophobicContact CG2-CG1 3.86Å; T57-I81 HydrophobicContact CG2-CG2 4.01Å; I71-I81 HydrophobicContact CD1-CB 4.26Å; I71-I81 HydrophobicContact CD1-CG2 3.68Å; I71-I81 HydrophobicContact CG1-CG2 4.11Å; I73-I81 HydrophobicContact CD1-CD1 3.39Å; I73-I81 HydrophobicContact CD1-CG1 4.36Å; L77-I81 PolarHBondContact O-N 3.34Å; T78-I81 PolarHBondContact O-N 3.05Å; R79-I81 PolarHBondContact O-N 3.42Å; I81-V83 PolarHBondContact O-N 3.38Å; I81-K84 PolarHBondContact O-N 3.1Å; I81-A85 WeakPolarHBondContact O-CB 3.42Å; I81-A85 PolarHBondContact O-N 3.48Å
82S92.5Very high84.9Confident40 Ų4085.8 Ų85.828%0.2847%0.472SS..Hα-helixtrans-64-42.3179.9-54.50000111.8T78 R79 A85 L86T78-S82 WeakPolarHBondContact O-CB 3.28Å; T78-S82 PolarHBondContact O-N 3.24Å; T78-S82 PolarHBondContact O-OG 2.93Å; R79-S82 PolarHBondContact O-N 3.49Å; S82-A85 PolarHBondContact O-N 3.1Å; S82-L86 VanDerWaalsContact O-CG 3.28Å; S82-L86 WeakPolarHBondContact O-CG 3.37Å; S82-L86 PolarHBondContact O-N 3.24Å; S82-L86 VanDerWaalsContact O-N 3.1Å
83V92.1Very high84.5Confident59 Ų5987.9 Ų87.936%0.35848%0.479SS..Hα-helixtrans-62.2-49.1176.5171.30000110.7R79 I81 A85 L86 E87R79-V83 VanDerWaalsContact O-CG2 3.32Å; R79-V83 WeakPolarHBondContact O-CG2 3.32Å; R79-V83 PolarHBondContact O-N 3.47Å; I81-V83 PolarHBondContact O-N 3.38Å; V83-A85 VanDerWaalsContact C-N 3.33Å; V83-A85 PolarHBondContact O-N 2.73Å; V83-L86 PolarHBondContact O-N 3.44Å; V83-E87 HydrophobicContact CG1-CG 4.48Å; V83-E87 WeakPolarHBondContact O-CG 3.32Å; V83-E87 PolarHBondContact O-N 2.92Å
84K90.5Very high84.1Confident76 Ų7691.6 Ų91.633%0.3350%0.5SS..Hα-helixtrans-60.3-40.5178.3-74.4-176.4163-160.80112.9T57 D58 L61 Q80 I81 L86 E87 S88T57-K84 HydrophobicContact CG2-CD 4.35Å; D58-K84 WeakPolarHBondContact OD1-CD 3.43Å; D58-K84 IonicContact OD1-NZ 3.4Å; D58-K84 PolarHBondContact OD1-NZ 3.01Å; D58-K84 IonicContact OD2-NZ 2.99Å; D58-K84 PolarHBondContact OD2-NZ 3.21Å; L61-K84 HydrophobicContact CD1-CB 3.44Å; L61-K84 VanDerWaalsContact CD1-CB 3.44Å; L61-K84 HydrophobicContact CD1-CD 4.43Å; Q80-K84 WeakPolarHBondContact O-CG 3.32Å; Q80-K84 PolarHBondContact O-N 3.37Å; Q80-K84 VanDerWaalsContact O-N 3.1Å; I81-K84 PolarHBondContact O-N 3.1Å; K84-L86 VanDerWaalsContact C-N 3.35Å; K84-E87 PolarHBondContact O-N 2.92Å; K84-S88 WeakPolarHBondContact O-CB 3.44Å; K84-S88 PolarHBondContact O-N 3.3Å; K84-S88 PolarHBondContact O-OG 3.39Å
85A91.3Very high83.9Confident14 Ų1492.3 Ų92.312%0.11650%0.498CS..Hα-helixtrans-62.9-41.7177.700000111.9L61 V69 I81 S82 V83 E87 S88 S89L61-A85 HydrophobicContact CD2-CB 3.8Å; V69-A85 HydrophobicContact CG2-CB 4.05Å; I81-A85 WeakPolarHBondContact O-CB 3.42Å; I81-A85 PolarHBondContact O-N 3.48Å; S82-A85 PolarHBondContact O-N 3.1Å; V83-A85 VanDerWaalsContact C-N 3.33Å; V83-A85 PolarHBondContact O-N 2.73Å; A85-E87 VanDerWaalsContact C-N 3.35Å; A85-S88 PolarHBondContact O-N 3.49Å; A85-S89 PolarHBondContact O-N 3.45Å; A85-S89 PolarHBondContact O-OG 3.19Å
86L89.6Confident83.6Confident132 Ų13291.2 Ų91.269%0.69149%0.485SS*.Hα-helixtrans-65.9-36.8175.9-69.2169000112.2S82 V83 K84S82-L86 VanDerWaalsContact O-CG 3.28Å; S82-L86 WeakPolarHBondContact O-CG 3.37Å; S82-L86 PolarHBondContact O-N 3.24Å; S82-L86 VanDerWaalsContact O-N 3.1Å; V83-L86 PolarHBondContact O-N 3.44Å; K84-L86 VanDerWaalsContact C-N 3.35Å
87E88.6Confident83.4Confident127 Ų12790.4 Ų90.459%0.59347%0.471SS*.Hα-helixtrans-74.6-30.7178-71.2176166.900113.2V83 K84 A85 S89V83-E87 HydrophobicContact CG1-CG 4.48Å; V83-E87 WeakPolarHBondContact O-CG 3.32Å; V83-E87 PolarHBondContact O-N 2.92Å; K84-E87 PolarHBondContact O-N 2.92Å; A85-E87 VanDerWaalsContact C-N 3.35Å; E87-S89 PolarHBondContact O-N 2.68Å
88S75.7Confident83.3Confident58 Ų5892 Ų9241%0.40648%0.48SS..THydrogen-bonded Turntrans-78.5-7.1-179.7-54.50000113.3K84 A85 L90K84-S88 WeakPolarHBondContact O-CB 3.44Å; K84-S88 PolarHBondContact O-N 3.3Å; K84-S88 PolarHBondContact O-OG 3.39Å; A85-S88 PolarHBondContact O-N 3.49Å; S88-L90 VanDerWaalsContact C-N 3.31Å
89S59.2Low82.7Confident103 Ų10396.6 Ų96.672%0.7250%0.501SS*.THydrogen-bonded Turntrans-89.88.3178.4-56.40000113.2A85 E87A85-S89 PolarHBondContact O-N 3.45Å; A85-S89 PolarHBondContact O-OG 3.19Å; E87-S89 PolarHBondContact O-N 2.68Å
90L45Very low82.1Confident212 Ų21287.6 Ų87.6100%1.1148%0.48SS*.  trans-111.60177.7-71.3170.3000110.6S88S88-L90 VanDerWaalsContact C-N 3.31Å

Retrieved 90 of 90 residues in 222.6 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).