A0A093HFG6_STRCA Loading...

Transcription factor MafG

AlphaFold DB , UniProt , Accession A0A093HFG6, Species STRCA (Struthio camelus australis), Gene n/a, Length 162 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
1M42.4Very low48.9Very low246 Ų246150.2 Ų150.2100%1.21286%0.862SS**  0120.20-71-155.1-161.800108.2
2T48.1Very low49.1Very low147 Ų147154.8 Ų154.890%0.90286%0.864SS**  trans-111.1125.8-173.7-110000107.3
3T46.5Very low49.3Very low136 Ų136152.2 Ų152.283%0.83485%0.854SS**  trans-133.7146.617052.10000110.9
4P47.6Very low49.2Very low124 Ų124153.5 Ų153.581%0.80585%0.846SS**  trans-105.2159.3-145.737.4-29.9000115.4
5N51.3Low49.3Very low150 Ų150158.9 Ų158.980%0.80285%0.849SS**  trans-29.9133.1160.3-173.715000115.9
6K47.6Very low49.1Very low202 Ų202156.9 Ų156.988%0.87883%0.833SS**  trans-132.5109.1157.6-118.9174.5-178.8173.10109.1S8K6-S8 PolarHBondContact O-N 3.45Å
7G48.4Very low49.4Very low64 Ų64154.6 Ų154.666%0.6683%0.829SS**  trans-58.7127.5-17800000113.1K9G7-K9 PolarHBondContact O-N 3.02Å
8S50.1Low49Very low122 Ų122150.1 Ų150.185%0.85383%0.825SS**  trans-74.5108.1168.9-53.40000108.5K6 A10K6-S8 PolarHBondContact O-N 3.45Å; S8-A10 PolarHBondContact O-N 3.26Å
9K49.5Very low49Very low197 Ų197151.8 Ų151.886%0.85783%0.826SS**  trans-50.3123.6174.9-66.7-178.8177.9-179.30110G7 L11G7-K9 PolarHBondContact O-N 3.02Å; K9-L11 PolarHBondContact O-N 2.67Å
10A54.6Low48.7Very low98 Ų98152.1 Ų152.181%0.8183%0.827SS**  trans-59.2111.3168.900000108.9S8 K12S8-A10 PolarHBondContact O-N 3.26Å; A10-K12 PolarHBondContact O-N 3.27Å
11L51.9Low48.6Very low166 Ų166147.2 Ų147.287%0.86981%0.812SS**  trans-64.9102.1170.4-75.7161.3000107.5K9 V13K9-L11 PolarHBondContact O-N 2.67Å; L11-V13 VanDerWaalsContact C-N 3.35Å; L11-V13 PolarHBondContact O-N 2.96Å
12K51.3Low49.1Very low205 Ų205141 Ų14189%0.89179%0.788SS**  trans-69.694.8173.4-167.1157.1-177.4171.90107.7A10 K14A10-K12 PolarHBondContact O-N 3.27Å; K12-K14 PolarHBondContact O-N 3.07Å
13V51.1Low50.2Low121 Ų121139.7 Ų139.773%0.73379%0.785SS**  trans-61.9105.71701770000107L11 R15L11-V13 VanDerWaalsContact C-N 3.35Å; L11-V13 PolarHBondContact O-N 2.96Å; V13-R15 PolarHBondContact O-N 2.99Å
14K48.9Very low51.9Low171 Ų171134.2 Ų134.274%0.74375%0.751SS**  trans-67.299.1171.8-156.8-172.8-169.8-138.50106.9K12 E16K12-K14 PolarHBondContact O-N 3.07Å; K14-E16 WeakPolarHBondContact CD-OE1 3.04Å; K14-E16 WeakPolarHBondContact CE-OE1 3.36Å; K14-E16 IonicContact NZ-OE1 2.85Å; K14-E16 PolarHBondContact NZ-OE1 3.03Å; K14-E16 PolarHBondContact O-N 3.47Å
15R50.8Low54.1Low235 Ų235131.6 Ų131.689%0.88773%0.732SS**  trans-83.7104.6169.4-117.2-179179.1165.7-0.9106.8V13V13-R15 PolarHBondContact O-N 2.99Å
16E45.5Very low56.2Low127 Ų127127.5 Ų127.559%0.59371%0.71SS**  trans-78.3135.7165.3-64.6-66156.900108.4K14 G18K14-E16 WeakPolarHBondContact CD-OE1 3.04Å; K14-E16 WeakPolarHBondContact CE-OE1 3.36Å; K14-E16 IonicContact NZ-OE1 2.85Å; K14-E16 PolarHBondContact NZ-OE1 3.03Å; K14-E16 PolarHBondContact O-N 3.47Å; E16-G18 PolarHBondContact O-N 3.49Å
17P54.3Low58.4Low117 Ų117124.6 Ų124.676%0.7670%0.7SS**  trans-87.5108177.433.3-26.7000109.1
18G42.6Very low60.6Low73 Ų73126.3 Ų126.375%0.75369%0.691SS**  trans-13278.1171.400000109.4E16 N20E16-G18 PolarHBondContact O-N 3.49Å; G18-N20 PolarHBondContact O-N 3.22Å
19E48.1Very low62.7Low183 Ų183120.5 Ų120.586%0.85565%0.65SS**  trans-62.6108.2164.9-79.6170.5118.700108.6
20N44.3Very low65Low157 Ų157113.2 Ų113.284%0.8462%0.622SS**  trans171.649.5143.9-82.7-28.5000112.4G18G18-N20 PolarHBondContact O-N 3.22Å
21G46.8Very low66.9Low50 Ų50113.4 Ų113.452%0.51561%0.613SS.*SBendtrans-148.8111.7159.500000106.1S23G21-S23 PolarHBondContact O-N 3.28Å
22T52.8Low69Low116 Ų116106.2 Ų106.271%0.71258%0.576SS**  trans-39.7120.4172.823.40000108.9L24T22-L24 PolarHBondContact O-N 2.99Å
23S69.3Low71.2Confident119 Ų11998.6 Ų98.683%0.83255%0.548SS*.  trans-58.284.1-173.7-59.60000110.7G21 T25G21-S23 PolarHBondContact O-N 3.28Å; S23-T25 PolarHBondContact O-N 3.5Å
24L83.9Confident73.3Confident22 Ų2297.3 Ų97.312%0.11554%0.54CS..  trans-72.6123-169.5-142.5133.6000109T22 E28 L29 M32 H40 R55T22-L24 PolarHBondContact O-N 2.99Å; L24-E28 HydrophobicContact CD2-CB 3.97Å; L24-L29 HydrophobicContact CD2-CB 3.63Å; L24-L29 HydrophobicContact CD2-CD1 4.02Å; L24-L29 HydrophobicContact CD2-CG 4.38Å; L24-M32 HydrophobicContact CD1-CE 3.87Å; L24-M32 HydrophobicContact CD2-CE 3.47Å; L24-M32 VanDerWaalsContact CD2-CE 3.47Å; L24-M32 HydrophobicContact CD2-SD 4.17Å; L24-M32 HydrophobicContact CG-CE 4.17Å; L24-H40 HydrophobicContact CD1-CB 4.42Å; L24-R55 PolarHBondContact O-NH1 3.12Å; L24-R55 PolarHBondContact O-NH2 3.45Å; L24-R55 VanDerWaalsContact O-NH2 3.09Å
25T93.5Very high75.6Confident68 Ų6899.7 Ų99.742%0.41754%0.544SS..  trans-72.7157.6-176.966.20000110.7S23 E27 E28 L29S23-T25 PolarHBondContact O-N 3.5Å; T25-E27 PolarHBondContact O-N 3.29Å; T25-E28 WeakPolarHBondContact CB-OE2 3.31Å; T25-E28 WeakPolarHBondContact CG2-OE2 3.35Å; T25-E28 PolarHBondContact N-OE2 3.42Å; T25-E28 PolarHBondContact O-N 3.08Å; T25-E28 WeakPolarHBondContact OG1-CB 3.19Å; T25-E28 WeakPolarHBondContact OG1-CG 3.28Å; T25-E28 PolarHBondContact OG1-N 3.31Å; T25-E28 PolarHBondContact OG1-OE2 3.01Å; T25-L29 VanDerWaalsContact O-CB 3.31Å; T25-L29 WeakPolarHBondContact O-CB 3.31Å; T25-L29 PolarHBondContact O-N 2.63Å
26D94.4Very high77.7Confident64 Ų6493.2 Ų93.234%0.34252%0.524SS..Hα-helixtrans-59.6-38.4177.4-82.1-5.7000111.5L29 V30 R55 L59D26-L29 PolarHBondContact O-N 3.43Å; D26-V30 WeakPolarHBondContact O-CG2 3.31Å; D26-V30 PolarHBondContact O-N 2.87Å; D26-V30 VanDerWaalsContact O-N 3.12Å; D26-R55 IonicContact OD1-CZ 3.51Å; D26-R55 IonicContact OD1-NE 3.58Å; D26-R55 PolarHBondContact OD1-NE 3.35Å; D26-R55 IonicContact OD1-NH2 3.91Å; D26-R55 PolarHBondContact OD1-NH2 3.25Å; D26-L59 HydrophobicContact CB-CD1 3.75Å; D26-L59 HydrophobicContact CB-CD2 4.06Å; D26-L59 WeakPolarHBondContact OD1-CD1 3.41Å; D26-L59 WeakPolarHBondContact OD2-CD2 3.4Å
27E93.8Very high80.1Confident141 Ų14187.6 Ų87.666%0.65950%0.498SS*.Hα-helixtrans-67.2-48.8179.7-74.4-59157.600112.1T25 L29 V30 T31T25-E27 PolarHBondContact O-N 3.29Å; E27-L29 VanDerWaalsContact C-N 3.27Å; E27-L29 PolarHBondContact O-N 2.84Å; E27-V30 PolarHBondContact O-N 2.96Å; E27-T31 WeakPolarHBondContact O-CB 3.47Å; E27-T31 VanDerWaalsContact O-CG2 3.29Å; E27-T31 WeakPolarHBondContact O-CG2 3.43Å; E27-T31 PolarHBondContact O-N 3.17Å; E27-T31 PolarHBondContact O-OG1 3.29Å
28E94.8Very high82.1Confident100 Ų10085.8 Ų85.847%0.46748%0.482SS..Hα-helixtrans-58.6-42.1175.3-70.2163.6146.500110.9L24 T25 V30 T31 M32L24-E28 HydrophobicContact CD2-CB 3.97Å; T25-E28 WeakPolarHBondContact CB-OE2 3.31Å; T25-E28 WeakPolarHBondContact CG2-OE2 3.35Å; T25-E28 PolarHBondContact N-OE2 3.42Å; T25-E28 PolarHBondContact O-N 3.08Å; T25-E28 WeakPolarHBondContact OG1-CB 3.19Å; T25-E28 WeakPolarHBondContact OG1-CG 3.28Å; T25-E28 PolarHBondContact OG1-N 3.31Å; T25-E28 PolarHBondContact OG1-OE2 3.01Å; E28-V30 VanDerWaalsContact C-N 3.34Å; E28-V30 PolarHBondContact O-N 3.49Å; E28-T31 WeakPolarHBondContact CA-OG1 3.44Å; E28-T31 PolarHBondContact O-N 3.34Å; E28-T31 PolarHBondContact O-OG1 2.91Å; E28-M32 VanDerWaalsContact O-CB 3.28Å; E28-M32 WeakPolarHBondContact O-CB 3.48Å; E28-M32 WeakPolarHBondContact O-CG 3.34Å; E28-M32 PolarHBondContact O-N 3.41Å
29L95.6Very high84.6Confident0 Ų087.9 Ų87.90%047%0.472CS..Hα-helixtrans-64.6-35.6-178.4-174.558.6000113L24 T25 D26 E27 M32 L37 L52 R55 R56 L59L24-L29 HydrophobicContact CD2-CB 3.63Å; L24-L29 HydrophobicContact CD2-CD1 4.02Å; L24-L29 HydrophobicContact CD2-CG 4.38Å; T25-L29 VanDerWaalsContact O-CB 3.31Å; T25-L29 WeakPolarHBondContact O-CB 3.31Å; T25-L29 PolarHBondContact O-N 2.63Å; D26-L29 PolarHBondContact O-N 3.43Å; E27-L29 VanDerWaalsContact C-N 3.27Å; E27-L29 PolarHBondContact O-N 2.84Å; L29-M32 HydrophobicContact CD1-SD 3.99Å; L29-M32 WeakPolarHBondContact O-CG 3.46Å; L29-L37 HydrophobicContact CD1-CD1 3.9Å; L29-L52 HydrophobicContact CD1-CD1 4.02Å; L29-L52 HydrophobicContact CD1-CD2 4.42Å; L29-L52 HydrophobicContact CD1-CG 3.97Å; L29-L52 HydrophobicContact CD2-CD1 3.95Å; L29-R55 HydrophobicContact CD2-CB 4.13Å; L29-R55 HydrophobicContact CD2-CG 3.81Å; L29-R56 HydrophobicContact CD1-CB 4.02Å; L29-R56 HydrophobicContact CD1-CG 4.29Å; L29-R56 HydrophobicContact CD2-CB 4.05Å; L29-R56 HydrophobicContact CG-CB 3.81Å; L29-R56 HydrophobicContact CG-CG 4.06Å; L29-R56 VanDerWaalsContact O-CD 3.3Å; L29-R56 WeakPolarHBondContact O-CD 3.37Å; L29-R56 WeakPolarHBondContact O-CG 3.37Å; L29-R56 PolarHBondContact O-NE 2.83Å; L29-L59 HydrophobicContact CD2-CD1 4.06Å
30V96.3Very high86.6Confident45 Ų4583.1 Ų83.127%0.27345%0.45SS..Hα-helixtrans-74.4-45.5178.1171.30000110.9D26 E27 E28 R56 L59 K60D26-V30 WeakPolarHBondContact O-CG2 3.31Å; D26-V30 PolarHBondContact O-N 2.87Å; D26-V30 VanDerWaalsContact O-N 3.12Å; E27-V30 PolarHBondContact O-N 2.96Å; E28-V30 VanDerWaalsContact C-N 3.34Å; E28-V30 PolarHBondContact O-N 3.49Å; V30-R56 PolarHBondContact O-NH2 3.02Å; V30-L59 HydrophobicContact CG2-CB 3.32Å; V30-L59 HydrophobicContact CG2-CD1 3.94Å; V30-L59 HydrophobicContact CG2-CG 4.25Å; V30-K60 HydrophobicContact CG1-CG 4.28Å
31T95.9Very high89Confident102 Ų10276.3 Ų76.363%0.62641%0.413SS*.Hα-helixtrans-76.6-33.7-17153.40000113.8E27 E28E27-T31 WeakPolarHBondContact O-CB 3.47Å; E27-T31 VanDerWaalsContact O-CG2 3.29Å; E27-T31 WeakPolarHBondContact O-CG2 3.43Å; E27-T31 PolarHBondContact O-N 3.17Å; E27-T31 PolarHBondContact O-OG1 3.29Å; E28-T31 WeakPolarHBondContact CA-OG1 3.44Å; E28-T31 PolarHBondContact O-N 3.34Å; E28-T31 PolarHBondContact O-OG1 2.91Å
32M95.6Very high91.3Very high15 Ų1582.7 Ų82.77%0.07442%0.422CS..SBendtrans-56.5147.8-177.958.9178.335.600113.3L24 E28 L29 E36 L37 R56L24-M32 HydrophobicContact CD1-CE 3.87Å; L24-M32 HydrophobicContact CD2-CE 3.47Å; L24-M32 VanDerWaalsContact CD2-CE 3.47Å; L24-M32 HydrophobicContact CD2-SD 4.17Å; L24-M32 HydrophobicContact CG-CE 4.17Å; E28-M32 VanDerWaalsContact O-CB 3.28Å; E28-M32 WeakPolarHBondContact O-CB 3.48Å; E28-M32 WeakPolarHBondContact O-CG 3.34Å; E28-M32 PolarHBondContact O-N 3.41Å; L29-M32 HydrophobicContact CD1-SD 3.99Å; L29-M32 WeakPolarHBondContact O-CG 3.46Å; M32-E36 VanDerWaalsContact CA-OE2 3.25Å; M32-E36 WeakPolarHBondContact CA-OE2 3.4Å; M32-E36 HydrophobicContact CB-CB 4.08Å; M32-E36 WeakPolarHBondContact CB-OE2 3.36Å; M32-L37 HydrophobicContact CG-CB 4.39Å; M32-L37 HydrophobicContact SD-CB 3.84Å; M32-L37 HydrophobicContact SD-CD1 3.79Å; M32-L37 HydrophobicContact SD-CG 4.42Å; M32-R56 PolarHBondContact O-NH2 3.35Å
33S96.7Very high93.1Very high45 Ų4581.4 Ų81.432%0.31543%0.431SS..  trans-67.7170.6175.8730000111.8R35 E36 L37 R56S33-R35 PolarHBondContact O-N 2.84Å; S33-R35 PolarHBondContact OG-N 3.48Å; S33-E36 WeakPolarHBondContact CB-OE1 3.42Å; S33-E36 PolarHBondContact N-OE2 2.92Å; S33-E36 PolarHBondContact OG-N 3.49Å; S33-E36 VanDerWaalsContact OG-N 3.12Å; S33-E36 PolarHBondContact OG-OE1 3.47Å; S33-L37 WeakPolarHBondContact O-CB 3.5Å; S33-L37 PolarHBondContact O-N 3.01Å; S33-L37 VanDerWaalsContact O-N 3.08Å; S33-R56 PolarHBondContact O-NH1 3.28Å
34V96.1Very high94.2Very high93 Ų9377.8 Ų77.856%0.56440%0.403SS*.Hα-helixtrans-65.7-33.7171.7177.40000110.4N38V34-N38 WeakPolarHBondContact O-CB 3.49Å; V34-N38 PolarHBondContact O-N 3.44Å; V34-N38 PolarHBondContact O-ND2 3.04Å
35R97.1Very high94.8Very high221 Ų22179.1 Ų79.183%0.83441%0.414SS*.Hα-helixtrans-66.5-48.6178.5-67.7-175.6179.7-165.50.4111.4S33 N38 Q39S33-R35 PolarHBondContact O-N 2.84Å; S33-R35 PolarHBondContact OG-N 3.48Å; R35-N38 PolarHBondContact O-N 3.37Å; R35-Q39 PolarHBondContact O-N 3.46Å
36E95.4Very high94.9Very high99 Ų9983.1 Ų83.146%0.46343%0.425SS..Hα-helixtrans-60-46.9174.8-75.9142.3-125.200111.8M32 S33 N38 Q39 H40M32-E36 VanDerWaalsContact CA-OE2 3.25Å; M32-E36 WeakPolarHBondContact CA-OE2 3.4Å; M32-E36 HydrophobicContact CB-CB 4.08Å; M32-E36 WeakPolarHBondContact CB-OE2 3.36Å; S33-E36 WeakPolarHBondContact CB-OE1 3.42Å; S33-E36 PolarHBondContact N-OE2 2.92Å; S33-E36 PolarHBondContact OG-N 3.49Å; S33-E36 VanDerWaalsContact OG-N 3.12Å; S33-E36 PolarHBondContact OG-OE1 3.47Å; E36-N38 VanDerWaalsContact C-N 3.3Å; E36-N38 PolarHBondContact O-N 2.93Å; E36-Q39 WeakPolarHBondContact O-CB 3.43Å; E36-Q39 PolarHBondContact O-N 2.64Å; E36-H40 PolarHBondContact O-CD2 3.42Å; E36-H40 VanDerWaalsContact O-CD2 3.31Å; E36-H40 PolarHBondContact O-N 2.85Å
37L95.1Very high95Very high10 Ų1085.6 Ų85.65%0.05244%0.435CS..Hα-helixtrans-55.8-48.4175.8176.166.7000110.6L29 M32 S33 Q39 H40 L41 L52L29-L37 HydrophobicContact CD1-CD1 3.9Å; M32-L37 HydrophobicContact CG-CB 4.39Å; M32-L37 HydrophobicContact SD-CB 3.84Å; M32-L37 HydrophobicContact SD-CD1 3.79Å; M32-L37 HydrophobicContact SD-CG 4.42Å; S33-L37 WeakPolarHBondContact O-CB 3.5Å; S33-L37 PolarHBondContact O-N 3.01Å; S33-L37 VanDerWaalsContact O-N 3.08Å; L37-Q39 PolarHBondContact O-N 2.97Å; L37-H40 PolarHBondContact O-N 3.09Å; L37-L41 HydrophobicContact CD1-CD1 4.48Å; L37-L41 HydrophobicContact CD1-CD2 4.35Å; L37-L41 HydrophobicContact CD1-CG 4.24Å; L37-L41 HydrophobicContact CD2-CD1 4.43Å; L37-L41 HydrophobicContact CG-CD1 4.01Å; L37-L41 HydrophobicContact CG-CG 4.2Å; L37-L41 VanDerWaalsContact O-CG 3.27Å; L37-L41 WeakPolarHBondContact O-CG 3.39Å; L37-L41 PolarHBondContact O-N 3.27Å; L37-L52 HydrophobicContact CD1-CD2 3.96Å; L37-L52 HydrophobicContact CD1-CG 4.46Å
38N95.5Very high94.9Very high79 Ų7983.3 Ų83.342%0.42242%0.424SS..Hα-helixtrans-62.9-29-179.8-73.6-22.5000113.1V34 R35 E36 L41V34-N38 WeakPolarHBondContact O-CB 3.49Å; V34-N38 PolarHBondContact O-N 3.44Å; V34-N38 PolarHBondContact O-ND2 3.04Å; R35-N38 PolarHBondContact O-N 3.37Å; E36-N38 VanDerWaalsContact C-N 3.3Å; E36-N38 PolarHBondContact O-N 2.93Å; N38-L41 PolarHBondContact O-N 3.44Å
39Q94.8Very high95Very high116 Ų11680.5 Ų80.554%0.54241%0.412SS..Hα-helixtrans-67.5-44.1172-173.760.431.400111.2R35 E36 L37 L41 R42R35-Q39 PolarHBondContact O-N 3.46Å; E36-Q39 WeakPolarHBondContact O-CB 3.43Å; E36-Q39 PolarHBondContact O-N 2.64Å; L37-Q39 PolarHBondContact O-N 2.97Å; Q39-L41 VanDerWaalsContact C-N 3.27Å; Q39-L41 PolarHBondContact O-N 2.67Å; Q39-R42 WeakPolarHBondContact O-CB 3.27Å; Q39-R42 PolarHBondContact O-N 3.33Å; Q39-R42 VanDerWaalsContact OE1-NE 3.16Å
40H91.1Very high95Very high83 Ų8385.3 Ų85.338%0.38444%0.437SS..Hα-helixtrans-67.1-23.7175.4-79.3-80.3000113.9L24 E36 L37 R42L24-H40 HydrophobicContact CD1-CB 4.42Å; E36-H40 PolarHBondContact O-CD2 3.42Å; E36-H40 VanDerWaalsContact O-CD2 3.31Å; E36-H40 PolarHBondContact O-N 2.85Å; L37-H40 PolarHBondContact O-N 3.09Å; H40-R42 VanDerWaalsContact C-N 3.31Å
41L94.2Very high94.9Very high14 Ų1489.7 Ų89.77%0.07345%0.454CS..THydrogen-bonded Turntrans-78.3-12.4177-66.8176.7000113.5L37 N38 Q39 G43 L44 I49 L52L37-L41 HydrophobicContact CD1-CD1 4.48Å; L37-L41 HydrophobicContact CD1-CD2 4.35Å; L37-L41 HydrophobicContact CD1-CG 4.24Å; L37-L41 HydrophobicContact CD2-CD1 4.43Å; L37-L41 HydrophobicContact CG-CD1 4.01Å; L37-L41 HydrophobicContact CG-CG 4.2Å; L37-L41 VanDerWaalsContact O-CG 3.27Å; L37-L41 WeakPolarHBondContact O-CG 3.39Å; L37-L41 PolarHBondContact O-N 3.27Å; N38-L41 PolarHBondContact O-N 3.44Å; Q39-L41 VanDerWaalsContact C-N 3.27Å; Q39-L41 PolarHBondContact O-N 2.67Å; L41-G43 PolarHBondContact O-N 3.04Å; L41-L44 HydrophobicContact CD2-CD1 4.25Å; L41-L44 PolarHBondContact O-N 2.98Å; L41-I49 HydrophobicContact CB-CG1 4.34Å; L41-I49 HydrophobicContact CD1-CG2 4.18Å; L41-I49 HydrophobicContact CD2-CB 4.29Å; L41-I49 HydrophobicContact CD2-CG1 4.05Å; L41-I49 HydrophobicContact CD2-CG2 4.14Å; L41-L52 HydrophobicContact CD2-CB 4.29Å; L41-L52 HydrophobicContact CD2-CD2 3.67Å; L41-L52 HydrophobicContact CD2-CG 4.49Å
42R94.8Very high94.9Very high185 Ų18586 Ų8670%0.69843%0.431SS*.THydrogen-bonded Turntrans-68.1131.4-180-65-175.1-176.4-1322.4110.1Q39 H40 L44Q39-R42 WeakPolarHBondContact O-CB 3.27Å; Q39-R42 PolarHBondContact O-N 3.33Å; Q39-R42 VanDerWaalsContact OE1-NE 3.16Å; H40-R42 VanDerWaalsContact C-N 3.31Å; R42-L44 VanDerWaalsContact C-N 3.27Å; R42-L44 PolarHBondContact O-N 3.44Å
43G91.1Very high94.9Very high88 Ų8890.4 Ų90.491%0.90745%0.449SS*.THydrogen-bonded Turntrans83.4-4.4178.700000114.9L41L41-G43 PolarHBondContact O-N 3.04Å
44L93.6Very high94.9Very high43 Ų4393.1 Ų93.123%0.22546%0.457CS..  trans-81152.4171.9-62.6-174.8000111.6L41 R42 E48 I49L41-L44 HydrophobicContact CD2-CD1 4.25Å; L41-L44 PolarHBondContact O-N 2.98Å; R42-L44 VanDerWaalsContact C-N 3.27Å; R42-L44 PolarHBondContact O-N 3.44Å; L44-E48 HydrophobicContact CB-CB 4.18Å; L44-I49 HydrophobicContact CB-CD1 4.48Å; L44-I49 HydrophobicContact CB-CG1 3.91Å
45S95.8Very high95Very high50 Ų5093.6 Ų93.635%0.3545%0.449SS..  trans-66.5159.9171.366.80000111.6E47 E48 I49S45-E47 PolarHBondContact O-N 3.49Å; S45-E48 VanDerWaalsContact CB-OE2 3.31Å; S45-E48 WeakPolarHBondContact CB-OE2 3.35Å; S45-E48 PolarHBondContact N-OE2 3.42Å; S45-E48 PolarHBondContact O-N 3.49Å; S45-E48 WeakPolarHBondContact OG-CB 3.3Å; S45-E48 WeakPolarHBondContact OG-CG 3.44Å; S45-E48 PolarHBondContact OG-N 3.32Å; S45-E48 PolarHBondContact OG-OE2 2.92Å; S45-I49 VanDerWaalsContact O-CG1 3.28Å; S45-I49 WeakPolarHBondContact O-CG1 3.49Å; S45-I49 PolarHBondContact O-N 3.14Å
46K96.1Very high95Very high152 Ų15283.9 Ų83.966%0.66141%0.412SS*.Hα-helixtrans-58.8-40.4179.9-174.2-179.2178.7-175.90111.5I49 I50K46-I49 PolarHBondContact O-N 3.07Å; K46-I50 HydrophobicContact CG-CD1 4.22Å; K46-I50 VanDerWaalsContact O-CG1 3.31Å; K46-I50 WeakPolarHBondContact O-CG1 3.41Å; K46-I50 PolarHBondContact O-N 3.39Å; K46-I50 VanDerWaalsContact O-N 3.08Å
47E95.2Very high95.1Very high117 Ų11786.9 Ų86.955%0.54742%0.419SS..Hα-helixtrans-64.1-45.6179.5-70.662.9-139.500111.1S45 I49 I50 Q51S45-E47 PolarHBondContact O-N 3.49Å; E47-I49 PolarHBondContact O-N 3.1Å; E47-I50 PolarHBondContact O-N 3.37Å; E47-Q51 WeakPolarHBondContact O-CG 3.36Å; E47-Q51 PolarHBondContact O-N 3.38Å
48E93.3Very high95.3Very high92 Ų9289.6 Ų89.643%0.4344%0.436SS..Hα-helixtrans-63.7-41.1176.7-71.6165.8136.400112L44 S45 I50 Q51 L52L44-E48 HydrophobicContact CB-CB 4.18Å; S45-E48 VanDerWaalsContact CB-OE2 3.31Å; S45-E48 WeakPolarHBondContact CB-OE2 3.35Å; S45-E48 PolarHBondContact N-OE2 3.42Å; S45-E48 PolarHBondContact O-N 3.49Å; S45-E48 WeakPolarHBondContact OG-CB 3.3Å; S45-E48 WeakPolarHBondContact OG-CG 3.44Å; S45-E48 PolarHBondContact OG-N 3.32Å; S45-E48 PolarHBondContact OG-OE2 2.92Å; E48-I50 VanDerWaalsContact C-N 3.33Å; E48-I50 PolarHBondContact O-N 3.32Å; E48-Q51 PolarHBondContact O-N 2.87Å; E48-L52 WeakPolarHBondContact O-CB 3.3Å; E48-L52 PolarHBondContact O-N 2.95Å
49I94.9Very high95.4Very high42 Ų4286.6 Ų86.622%0.21542%0.42CS..Hα-helixtrans-59.6-44.8176.1-67.8168.5000110.8L41 L44 S45 K46 E47 L52 K53L41-I49 HydrophobicContact CB-CG1 4.34Å; L41-I49 HydrophobicContact CD1-CG2 4.18Å; L41-I49 HydrophobicContact CD2-CB 4.29Å; L41-I49 HydrophobicContact CD2-CG1 4.05Å; L41-I49 HydrophobicContact CD2-CG2 4.14Å; L44-I49 HydrophobicContact CB-CD1 4.48Å; L44-I49 HydrophobicContact CB-CG1 3.91Å; S45-I49 VanDerWaalsContact O-CG1 3.28Å; S45-I49 WeakPolarHBondContact O-CG1 3.49Å; S45-I49 PolarHBondContact O-N 3.14Å; K46-I49 PolarHBondContact O-N 3.07Å; E47-I49 PolarHBondContact O-N 3.1Å; I49-L52 PolarHBondContact O-N 3.37Å; I49-K53 HydrophobicContact CG2-CD 4.12Å; I49-K53 WeakPolarHBondContact O-CB 3.41Å; I49-K53 WeakPolarHBondContact O-CG 3.47Å; I49-K53 PolarHBondContact O-N 2.87Å
50I96.4Very high95.5Very high101 Ų10184.1 Ų84.152%0.51841%0.408SS..Hα-helixtrans-63.3-46.4178.3-68.5166000110.2K46 E47 E48 L52 K53 Q54K46-I50 HydrophobicContact CG-CD1 4.22Å; K46-I50 VanDerWaalsContact O-CG1 3.31Å; K46-I50 WeakPolarHBondContact O-CG1 3.41Å; K46-I50 PolarHBondContact O-N 3.39Å; K46-I50 VanDerWaalsContact O-N 3.08Å; E47-I50 PolarHBondContact O-N 3.37Å; E48-I50 VanDerWaalsContact C-N 3.33Å; E48-I50 PolarHBondContact O-N 3.32Å; I50-L52 PolarHBondContact O-N 3.16Å; I50-K53 PolarHBondContact O-N 2.95Å; I50-Q54 VanDerWaalsContact O-CB 3.31Å; I50-Q54 WeakPolarHBondContact O-CB 3.17Å; I50-Q54 PolarHBondContact O-N 3.06Å
51Q94.9Very high95.9Very high136 Ų13684.1 Ų84.164%0.63641%0.41SS*.Hα-helixtrans-60.5-45.1178.3-71.5-179.922.800112E47 E48 Q54 R55E47-Q51 WeakPolarHBondContact O-CG 3.36Å; E47-Q51 PolarHBondContact O-N 3.38Å; E48-Q51 PolarHBondContact O-N 2.87Å; Q51-Q54 PolarHBondContact O-N 3.26Å; Q51-R55 WeakPolarHBondContact O-CB 3.48Å; Q51-R55 PolarHBondContact O-N 2.95Å
52L95Very high96Very high26 Ų2691 Ų9114%0.13644%0.435CS..Hα-helixtrans-67-41.5-178.8-16467000111.8L29 L37 L41 E48 I49 I50 R55 R56L29-L52 HydrophobicContact CD1-CD1 4.02Å; L29-L52 HydrophobicContact CD1-CD2 4.42Å; L29-L52 HydrophobicContact CD1-CG 3.97Å; L29-L52 HydrophobicContact CD2-CD1 3.95Å; L37-L52 HydrophobicContact CD1-CD2 3.96Å; L37-L52 HydrophobicContact CD1-CG 4.46Å; L41-L52 HydrophobicContact CD2-CB 4.29Å; L41-L52 HydrophobicContact CD2-CD2 3.67Å; L41-L52 HydrophobicContact CD2-CG 4.49Å; E48-L52 WeakPolarHBondContact O-CB 3.3Å; E48-L52 PolarHBondContact O-N 2.95Å; I49-L52 PolarHBondContact O-N 3.37Å; I50-L52 PolarHBondContact O-N 3.16Å; L52-R55 PolarHBondContact O-N 3.37Å; L52-R56 WeakPolarHBondContact O-CB 3.31Å; L52-R56 PolarHBondContact O-N 3.39Å
53K96.3Very high96.2Very high107 Ų10783.8 Ų83.847%0.46542%0.419SS..Hα-helixtrans-63.1-41.7173.9-75.5179.8176.7178.70111.9I49 I50 R56 R57I49-K53 HydrophobicContact CG2-CD 4.12Å; I49-K53 WeakPolarHBondContact O-CB 3.41Å; I49-K53 WeakPolarHBondContact O-CG 3.47Å; I49-K53 PolarHBondContact O-N 2.87Å; I50-K53 PolarHBondContact O-N 2.95Å; K53-R56 PolarHBondContact O-N 3.39Å; K53-R57 WeakPolarHBondContact O-CB 3.43Å; K53-R57 PolarHBondContact O-N 3.07Å
54Q97.3Very high96.5Very high102 Ų10286.5 Ų86.548%0.47740%0.403SS..Hα-helixtrans-67.7-41.6178.4-176.558.225.500111.9I50 Q51 R57 T58I50-Q54 VanDerWaalsContact O-CB 3.31Å; I50-Q54 WeakPolarHBondContact O-CB 3.17Å; I50-Q54 PolarHBondContact O-N 3.06Å; Q51-Q54 PolarHBondContact O-N 3.26Å; Q54-R57 PolarHBondContact O-N 3.29Å; Q54-T58 WeakPolarHBondContact O-CB 3.4Å; Q54-T58 PolarHBondContact O-N 3.27Å; Q54-T58 PolarHBondContact O-OG1 2.99Å
55R96.5Very high96.8Very high102 Ų10286.7 Ų86.739%0.38541%0.411SS..Hα-helixtrans-57.9-50.3172.3-176.9177.9169.9-157.4-3.6110.2L24 D26 L29 Q51 L52 R57 T58 L59L24-R55 PolarHBondContact O-NH1 3.12Å; L24-R55 PolarHBondContact O-NH2 3.45Å; L24-R55 VanDerWaalsContact O-NH2 3.09Å; D26-R55 IonicContact OD1-CZ 3.51Å; D26-R55 IonicContact OD1-NE 3.58Å; D26-R55 PolarHBondContact OD1-NE 3.35Å; D26-R55 IonicContact OD1-NH2 3.91Å; D26-R55 PolarHBondContact OD1-NH2 3.25Å; L29-R55 HydrophobicContact CD2-CB 4.13Å; L29-R55 HydrophobicContact CD2-CG 3.81Å; Q51-R55 WeakPolarHBondContact O-CB 3.48Å; Q51-R55 PolarHBondContact O-N 2.95Å; L52-R55 PolarHBondContact O-N 3.37Å; R55-R57 PolarHBondContact O-N 3.48Å; R55-T58 WeakPolarHBondContact O-CB 3.2Å; R55-T58 PolarHBondContact O-N 2.97Å; R55-T58 VanDerWaalsContact O-N 3.17Å; R55-L59 HydrophobicContact CG-CD1 4.13Å; R55-L59 WeakPolarHBondContact O-CG 3.27Å; R55-L59 PolarHBondContact O-N 3.24Å
56R97.5Very high96.9Very high18 Ų1886.8 Ų86.87%0.06842%0.415CS..Hα-helixtrans-56.8-45.7176.8-172.3172.7-171.9-166.4-8.2112.8L29 V30 M32 S33 L52 K53 T58 L59 K60L29-R56 HydrophobicContact CD1-CB 4.02Å; L29-R56 HydrophobicContact CD1-CG 4.29Å; L29-R56 HydrophobicContact CD2-CB 4.05Å; L29-R56 HydrophobicContact CG-CB 3.81Å; L29-R56 HydrophobicContact CG-CG 4.06Å; L29-R56 VanDerWaalsContact O-CD 3.3Å; L29-R56 WeakPolarHBondContact O-CD 3.37Å; L29-R56 WeakPolarHBondContact O-CG 3.37Å; L29-R56 PolarHBondContact O-NE 2.83Å; V30-R56 PolarHBondContact O-NH2 3.02Å; M32-R56 PolarHBondContact O-NH2 3.35Å; S33-R56 PolarHBondContact O-NH1 3.28Å; L52-R56 WeakPolarHBondContact O-CB 3.31Å; L52-R56 PolarHBondContact O-N 3.39Å; K53-R56 PolarHBondContact O-N 3.39Å; R56-T58 VanDerWaalsContact C-N 3.34Å; R56-T58 PolarHBondContact O-N 3.34Å; R56-L59 PolarHBondContact O-N 3.03Å; R56-K60 VanDerWaalsContact NH2-NZ 3.2Å; R56-K60 PolarHBondContact O-N 3.44Å
57R98.3Very high97Very high162 Ų16283.1 Ų83.161%0.61141%0.408SS*.Hα-helixtrans-60.3-44.8177.4-176.5179.4-175.8-177.61.3111.5K53 Q54 R55 L59 K60 N61K53-R57 WeakPolarHBondContact O-CB 3.43Å; K53-R57 PolarHBondContact O-N 3.07Å; Q54-R57 PolarHBondContact O-N 3.29Å; R55-R57 PolarHBondContact O-N 3.48Å; R57-L59 VanDerWaalsContact C-N 3.34Å; R57-L59 PolarHBondContact O-N 3.29Å; R57-K60 PolarHBondContact O-N 2.67Å; R57-N61 WeakPolarHBondContact O-CB 3.47Å; R57-N61 VanDerWaalsContact O-CG 3.27Å; R57-N61 PolarHBondContact O-N 3.14Å
58T98.1Very high97.2Very high67 Ų6780.6 Ų80.641%0.41140%0.402SS..Hα-helixtrans-62.4-43.2179.6-570000111.2Q54 R55 R56 N61 R62Q54-T58 WeakPolarHBondContact O-CB 3.4Å; Q54-T58 PolarHBondContact O-N 3.27Å; Q54-T58 PolarHBondContact O-OG1 2.99Å; R55-T58 WeakPolarHBondContact O-CB 3.2Å; R55-T58 PolarHBondContact O-N 2.97Å; R55-T58 VanDerWaalsContact O-N 3.17Å; R56-T58 VanDerWaalsContact C-N 3.34Å; R56-T58 PolarHBondContact O-N 3.34Å; T58-N61 PolarHBondContact O-N 3.04Å; T58-R62 PolarHBondContact O-N 3.26Å
59L97.8Very high97.4Very high16 Ų1684.7 Ų84.78%0.08441%0.414CS..Hα-helixtrans-66.3-44177.1-65.1170.1000112.3D26 L29 V30 R55 R56 R57 N61 R62 G63D26-L59 HydrophobicContact CB-CD1 3.75Å; D26-L59 HydrophobicContact CB-CD2 4.06Å; D26-L59 WeakPolarHBondContact OD1-CD1 3.41Å; D26-L59 WeakPolarHBondContact OD2-CD2 3.4Å; L29-L59 HydrophobicContact CD2-CD1 4.06Å; V30-L59 HydrophobicContact CG2-CB 3.32Å; V30-L59 HydrophobicContact CG2-CD1 3.94Å; V30-L59 HydrophobicContact CG2-CG 4.25Å; R55-L59 HydrophobicContact CG-CD1 4.13Å; R55-L59 WeakPolarHBondContact O-CG 3.27Å; R55-L59 PolarHBondContact O-N 3.24Å; R56-L59 PolarHBondContact O-N 3.03Å; R57-L59 VanDerWaalsContact C-N 3.34Å; R57-L59 PolarHBondContact O-N 3.29Å; L59-N61 VanDerWaalsContact C-N 3.34Å; L59-N61 PolarHBondContact O-N 3.31Å; L59-R62 VanDerWaalsContact O-CB 3.3Å; L59-R62 WeakPolarHBondContact O-CB 3.45Å; L59-R62 PolarHBondContact O-N 2.85Å; L59-R62 VanDerWaalsContact O-N 3.16Å; L59-G63 PolarHBondContact O-N 3.11Å; L59-G63 VanDerWaalsContact O-N 3.1Å
60K98.1Very high97.6Very high64 Ų6487.2 Ų87.228%0.27843%0.431SS..Hα-helixtrans-61.1-42.4174.4-76.3-167.7174.2-171.10112.2V30 R56 R57 R62 G63 Y64V30-K60 HydrophobicContact CG1-CG 4.28Å; R56-K60 VanDerWaalsContact NH2-NZ 3.2Å; R56-K60 PolarHBondContact O-N 3.44Å; R57-K60 PolarHBondContact O-N 2.67Å; K60-R62 VanDerWaalsContact C-N 3.27Å; K60-R62 PolarHBondContact O-N 3.2Å; K60-G63 WeakPolarHBondContact O-CA 3.46Å; K60-G63 PolarHBondContact O-N 2.58Å; K60-Y64 HydrophobicContact CB-CE2 3.99Å; K60-Y64 VanDerWaalsContact O-CD2 3.27Å; K60-Y64 WeakPolarHBondContact O-CD2 3.38Å; K60-Y64 PolarHBondContact O-N 3.09Å
61N98.1Very high97.7Very high83 Ų8388.9 Ų88.944%0.44444%0.435SS..Hα-helixtrans-61.8-35.4175.7-76-7.4000112.5R57 T58 L59 Y64 A65R57-N61 WeakPolarHBondContact O-CB 3.47Å; R57-N61 VanDerWaalsContact O-CG 3.27Å; R57-N61 PolarHBondContact O-N 3.14Å; T58-N61 PolarHBondContact O-N 3.04Å; L59-N61 VanDerWaalsContact C-N 3.34Å; L59-N61 PolarHBondContact O-N 3.31Å; N61-Y64 PolarHBondContact O-N 3.46Å; N61-A65 WeakPolarHBondContact O-CB 3.29Å; N61-A65 PolarHBondContact O-N 3.44Å
62R98.1Very high97.9Very high157 Ų15790.2 Ų90.259%0.59243%0.434SS*.Hα-helixtrans-60.3-46171.4-173-173.4-67.8157-1.8110.9T58 L59 K60 A65 A66T58-R62 PolarHBondContact O-N 3.26Å; L59-R62 VanDerWaalsContact O-CB 3.3Å; L59-R62 WeakPolarHBondContact O-CB 3.45Å; L59-R62 PolarHBondContact O-N 2.85Å; L59-R62 VanDerWaalsContact O-N 3.16Å; K60-R62 VanDerWaalsContact C-N 3.27Å; K60-R62 PolarHBondContact O-N 3.2Å; R62-A65 PolarHBondContact O-N 3.37Å; R62-A66 PolarHBondContact O-N 2.91Å; R62-A66 VanDerWaalsContact O-N 3.14Å
63G97.8Very high98.1Very high35 Ų3592.6 Ų92.636%0.36145%0.449SS..Hα-helixtrans-59.3-47.717400000112.6L59 K60 A65 A66 S67L59-G63 PolarHBondContact O-N 3.11Å; L59-G63 VanDerWaalsContact O-N 3.1Å; K60-G63 WeakPolarHBondContact O-CA 3.46Å; K60-G63 PolarHBondContact O-N 2.58Å; G63-A65 VanDerWaalsContact C-N 3.3Å; G63-A65 PolarHBondContact O-N 3.08Å; G63-A66 WeakPolarHBondContact O-CB 3.14Å; G63-A66 PolarHBondContact O-N 3.04Å; G63-A66 VanDerWaalsContact O-N 3.11Å; G63-S67 PolarHBondContact O-N 3.12Å; G63-S67 PolarHBondContact O-OG 2.94Å
64Y98.3Very high98.2Very high144 Ų14491.1 Ų91.157%0.56545%0.45SS*.Hα-helixtrans-60.7-37177.4-61.4-39.4000112.9K60 N61 C68K60-Y64 HydrophobicContact CB-CE2 3.99Å; K60-Y64 VanDerWaalsContact O-CD2 3.27Å; K60-Y64 WeakPolarHBondContact O-CD2 3.38Å; K60-Y64 PolarHBondContact O-N 3.09Å; N61-Y64 PolarHBondContact O-N 3.46Å; Y64-C68 WeakPolarHBondContact O-CB 3.25Å; Y64-C68 PolarHBondContact O-N 3.18Å
65A98.6Very high98.2Very high47 Ų4791.6 Ų91.639%0.38845%0.452SS..Hα-helixtrans-64.5-41.5174.800000112N61 R62 G63 C68 R69N61-A65 WeakPolarHBondContact O-CB 3.29Å; N61-A65 PolarHBondContact O-N 3.44Å; R62-A65 PolarHBondContact O-N 3.37Å; G63-A65 VanDerWaalsContact C-N 3.3Å; G63-A65 PolarHBondContact O-N 3.08Å; A65-C68 PolarHBondContact O-N 3.06Å; A65-R69 WeakPolarHBondContact O-CG 3.28Å; A65-R69 PolarHBondContact O-N 3.4Å; A65-R69 VanDerWaalsContact O-N 3.14Å
66A98.2Very high98.3Very high53 Ų5392.7 Ų92.744%0.43846%0.459SS..Hα-helixtrans-63.8-50.217500000111.3R62 G63 C68 R69 V70R62-A66 PolarHBondContact O-N 2.91Å; R62-A66 VanDerWaalsContact O-N 3.14Å; G63-A66 WeakPolarHBondContact O-CB 3.14Å; G63-A66 PolarHBondContact O-N 3.04Å; G63-A66 VanDerWaalsContact O-N 3.11Å; A66-C68 VanDerWaalsContact C-N 3.27Å; A66-C68 PolarHBondContact O-N 3.31Å; A66-R69 WeakPolarHBondContact O-CB 3.41Å; A66-R69 PolarHBondContact O-N 3.06Å; A66-R69 VanDerWaalsContact O-N 3.09Å; A66-V70 PolarHBondContact O-N 3.43Å
67S98.5Very high98.4Very high75 Ų7597 Ų9752%0.52448%0.48SS..Hα-helixtrans-60.1-36.2176.9-55.30000112.5G63 V70 K71G63-S67 PolarHBondContact O-N 3.12Å; G63-S67 PolarHBondContact O-OG 2.94Å; S67-V70 PolarHBondContact O-N 2.92Å; S67-K71 WeakPolarHBondContact O-CB 3.45Å; S67-K71 PolarHBondContact O-N 3.06Å
68C98.7Very high98.4Very high63 Ų6393.4 Ų93.443%0.42647%0.47SS..Hα-helixtrans-62.9-41.9175.1-179.60000111.8Y64 A65 A66 R72Y64-C68 WeakPolarHBondContact O-CB 3.25Å; Y64-C68 PolarHBondContact O-N 3.18Å; A65-C68 PolarHBondContact O-N 3.06Å; A66-C68 VanDerWaalsContact C-N 3.27Å; A66-C68 PolarHBondContact O-N 3.31Å; C68-R72 WeakPolarHBondContact O-CB 2.91Å; C68-R72 PolarHBondContact O-N 2.73Å
69R98.7Very high98.5Very high179 Ų17995.5 Ų95.568%0.67548%0.479SS*.Hα-helixtrans-63.8-48.4176.1-68.1170.6-172.1-1551.3111A65 A66 R72 V73A65-R69 WeakPolarHBondContact O-CG 3.28Å; A65-R69 PolarHBondContact O-N 3.4Å; A65-R69 VanDerWaalsContact O-N 3.14Å; A66-R69 WeakPolarHBondContact O-CB 3.41Å; A66-R69 PolarHBondContact O-N 3.06Å; A66-R69 VanDerWaalsContact O-N 3.09Å; R69-R72 PolarHBondContact O-N 3.44Å; R69-V73 WeakPolarHBondContact O-CG2 3.41Å; R69-V73 PolarHBondContact O-N 3.5Å
70V98.6Very high98.5Very high95 Ų9599.7 Ų99.758%0.57650%0.498SS*.Hα-helixtrans-57.1-52.9177.2174.50000110.3A66 S67 R72 V73 T74A66-V70 PolarHBondContact O-N 3.43Å; S67-V70 PolarHBondContact O-N 2.92Å; V70-R72 VanDerWaalsContact C-N 3.25Å; V70-R72 PolarHBondContact O-N 2.9Å; V70-V73 PolarHBondContact O-N 3.14Å; V70-V73 VanDerWaalsContact O-N 3.14Å; V70-T74 PolarHBondContact O-N 3.21Å; V70-T74 PolarHBondContact O-OG1 3.47Å; V70-T74 VanDerWaalsContact O-OG1 3.06Å
71K98.7Very high98.5Very high135 Ų135102 Ų10259%0.58751%0.508SS*.Hα-helixtrans-55.8-40.9179.6-173.6174.5-178.4177.90112.2S67 Q75S67-K71 WeakPolarHBondContact O-CB 3.45Å; S67-K71 PolarHBondContact O-N 3.06Å; K71-Q75 HydrophobicContact CG-CG 4.49Å; K71-Q75 VanDerWaalsContact O-CB 3.3Å; K71-Q75 WeakPolarHBondContact O-CB 3.44Å; K71-Q75 VanDerWaalsContact O-CG 3.23Å; K71-Q75 WeakPolarHBondContact O-CG 3.41Å; K71-Q75 PolarHBondContact O-N 3.01Å
72R98.8Very high98.6Very high164 Ų164102 Ų10262%0.61951%0.505SS*.Hα-helixtrans-67.1-44.2179.2-169.4-173.3-50.2174.53.8112.4C68 R69 V70 Q75 K76C68-R72 WeakPolarHBondContact O-CB 2.91Å; C68-R72 PolarHBondContact O-N 2.73Å; R69-R72 PolarHBondContact O-N 3.44Å; V70-R72 VanDerWaalsContact C-N 3.25Å; V70-R72 PolarHBondContact O-N 2.9Å; R72-Q75 PolarHBondContact O-N 3.34Å; R72-K76 WeakPolarHBondContact O-CB 3.33Å; R72-K76 PolarHBondContact O-N 2.94Å
73V98.7Very high98.6Very high76 Ų76101.9 Ų101.946%0.46151%0.509SS..Hα-helixtrans-64.3-50178.4172.50000109.8R69 V70 Q75 K76 E77R69-V73 WeakPolarHBondContact O-CG2 3.41Å; R69-V73 PolarHBondContact O-N 3.5Å; V70-V73 PolarHBondContact O-N 3.14Å; V70-V73 VanDerWaalsContact O-N 3.14Å; V73-Q75 VanDerWaalsContact C-N 3.33Å; V73-Q75 PolarHBondContact O-N 3.5Å; V73-K76 WeakPolarHBondContact O-CB 3.34Å; V73-K76 PolarHBondContact O-N 2.88Å; V73-E77 HydrophobicContact CG1-CG 4.37Å; V73-E77 WeakPolarHBondContact CG1-OE1 3.31Å; V73-E77 WeakPolarHBondContact O-CG 3.45Å; V73-E77 PolarHBondContact O-N 2.68Å
74T98.6Very high98.6Very high77 Ų77103.1 Ų103.147%0.47252%0.516SS..Hα-helixtrans-59.3-41.7177.5-54.10000112.3V70 K76 E77 E78V70-T74 PolarHBondContact O-N 3.21Å; V70-T74 PolarHBondContact O-OG1 3.47Å; V70-T74 VanDerWaalsContact O-OG1 3.06Å; T74-K76 VanDerWaalsContact C-N 3.33Å; T74-K76 PolarHBondContact O-N 3.06Å; T74-E77 PolarHBondContact O-N 2.86Å; T74-E78 WeakPolarHBondContact O-CB 3.23Å; T74-E78 PolarHBondContact O-N 3.35Å
75Q98.7Very high98.6Very high111 Ų111100.9 Ų100.952%0.51951%0.51SS..Hα-helixtrans-63.8-38.6175.6-80.3-176.4-20.800112.5K71 R72 V73 L79K71-Q75 HydrophobicContact CG-CG 4.49Å; K71-Q75 VanDerWaalsContact O-CB 3.3Å; K71-Q75 WeakPolarHBondContact O-CB 3.44Å; K71-Q75 VanDerWaalsContact O-CG 3.23Å; K71-Q75 WeakPolarHBondContact O-CG 3.41Å; K71-Q75 PolarHBondContact O-N 3.01Å; R72-Q75 PolarHBondContact O-N 3.34Å; V73-Q75 VanDerWaalsContact C-N 3.33Å; V73-Q75 PolarHBondContact O-N 3.5Å; Q75-L79 VanDerWaalsContact O-CG 3.31Å; Q75-L79 WeakPolarHBondContact O-CG 3.3Å; Q75-L79 PolarHBondContact O-N 3.03Å; Q75-L79 VanDerWaalsContact O-N 3.1Å
76K98.6Very high98.7Very high125 Ų125104.5 Ų104.554%0.54352%0.522SS..Hα-helixtrans-64.9-48.7176.5-178.1-171166-166.20110.9R72 V73 T74 E78 L79 E80R72-K76 WeakPolarHBondContact O-CB 3.33Å; R72-K76 PolarHBondContact O-N 2.94Å; V73-K76 WeakPolarHBondContact O-CB 3.34Å; V73-K76 PolarHBondContact O-N 2.88Å; T74-K76 VanDerWaalsContact C-N 3.33Å; T74-K76 PolarHBondContact O-N 3.06Å; K76-E78 VanDerWaalsContact C-N 3.31Å; K76-E78 PolarHBondContact O-N 2.9Å; K76-L79 PolarHBondContact O-N 3.44Å; K76-E80 WeakPolarHBondContact CE-OE1 3.35Å; K76-E80 IonicContact NZ-OE1 2.67Å; K76-E80 WeakPolarHBondContact O-CG 3.39Å; K76-E80 PolarHBondContact O-N 3.46Å
77E98.7Very high98.7Very high110 Ų110106.5 Ų106.551%0.51452%0.523SS..Hα-helixtrans-60-42.2179.3-70.716916900111.5V73 T74 L79 E80 K81V73-E77 HydrophobicContact CG1-CG 4.37Å; V73-E77 WeakPolarHBondContact CG1-OE1 3.31Å; V73-E77 WeakPolarHBondContact O-CG 3.45Å; V73-E77 PolarHBondContact O-N 2.68Å; T74-E77 PolarHBondContact O-N 2.86Å; E77-L79 PolarHBondContact O-N 3.26Å; E77-E80 PolarHBondContact O-N 3.49Å; E77-K81 WeakPolarHBondContact O-CB 3.38Å; E77-K81 PolarHBondContact O-N 3.44Å
78E98.8Very high98.7Very high85 Ų85109.5 Ų109.540%0.39753%0.528SS..Hα-helixtrans-62.6-42.5176.1-178.457.4-150.500111.9T74 K76 K81 Q82T74-E78 WeakPolarHBondContact O-CB 3.23Å; T74-E78 PolarHBondContact O-N 3.35Å; K76-E78 VanDerWaalsContact C-N 3.31Å; K76-E78 PolarHBondContact O-N 2.9Å; E78-K81 PolarHBondContact O-N 2.96Å; E78-Q82 WeakPolarHBondContact O-CG 3.48Å; E78-Q82 PolarHBondContact O-N 2.96Å; E78-Q82 PolarHBondContact OE1-NE2 3.32Å
79L98.8Very high98.7Very high112 Ų112110.4 Ų110.459%0.58653%0.526SS*.Hα-helixtrans-65.6-37.8175.1-72.4171.9000112.4Q75 K76 E77 K81 Q82 K83Q75-L79 VanDerWaalsContact O-CG 3.31Å; Q75-L79 WeakPolarHBondContact O-CG 3.3Å; Q75-L79 PolarHBondContact O-N 3.03Å; Q75-L79 VanDerWaalsContact O-N 3.1Å; K76-L79 PolarHBondContact O-N 3.44Å; E77-L79 PolarHBondContact O-N 3.26Å; L79-K81 VanDerWaalsContact C-N 3.35Å; L79-Q82 PolarHBondContact O-N 2.93Å; L79-K83 WeakPolarHBondContact O-CB 3.32Å; L79-K83 PolarHBondContact O-N 2.94Å
80E98.7Very high98.7Very high103 Ų103106.1 Ų106.148%0.48152%0.52SS..Hα-helixtrans-64.9-40.3175.5-75176.1164.500111.4K76 E77 K83 A84K76-E80 WeakPolarHBondContact CE-OE1 3.35Å; K76-E80 IonicContact NZ-OE1 2.67Å; K76-E80 WeakPolarHBondContact O-CG 3.39Å; K76-E80 PolarHBondContact O-N 3.46Å; E77-E80 PolarHBondContact O-N 3.49Å; E80-K83 PolarHBondContact O-N 3.21Å; E80-A84 PolarHBondContact O-N 3.1Å
81K98.7Very high98.7Very high113 Ų113107.1 Ų107.149%0.49152%0.518SS..Hα-helixtrans-62.3-50.2173.3-179.3-176.6166.8-167.40111.6E77 E78 L79 K83 A84 E85E77-K81 WeakPolarHBondContact O-CB 3.38Å; E77-K81 PolarHBondContact O-N 3.44Å; E78-K81 PolarHBondContact O-N 2.96Å; L79-K81 VanDerWaalsContact C-N 3.35Å; K81-K83 VanDerWaalsContact C-N 3.28Å; K81-K83 PolarHBondContact O-N 2.95Å; K81-A84 WeakPolarHBondContact O-CB 3.46Å; K81-A84 PolarHBondContact O-N 3.46Å; K81-E85 WeakPolarHBondContact CE-OE1 3.44Å; K81-E85 IonicContact NZ-OE1 3.12Å; K81-E85 WeakPolarHBondContact O-CG 3.32Å; K81-E85 PolarHBondContact O-N 3.46Å
82Q98.7Very high98.7Very high82 Ų82105.1 Ų105.138%0.38351%0.51SS..Hα-helixtrans-59.1-40.1177.7-72.7174.712.200112E78 L79 E85 L86E78-Q82 WeakPolarHBondContact O-CG 3.48Å; E78-Q82 PolarHBondContact O-N 2.96Å; E78-Q82 PolarHBondContact OE1-NE2 3.32Å; L79-Q82 PolarHBondContact O-N 2.93Å; Q82-E85 PolarHBondContact O-N 2.94Å; Q82-L86 WeakPolarHBondContact O-CB 2.94Å; Q82-L86 WeakPolarHBondContact O-CG 3.27Å; Q82-L86 PolarHBondContact O-N 2.9Å
83K98.6Very high98.7Very high156 Ų156101.5 Ų101.568%0.67850%0.502SS*.Hα-helixtrans-60.7-45174.1-178.7-173.2173.8-1730111.6L79 E80 K81 Q87L79-K83 WeakPolarHBondContact O-CB 3.32Å; L79-K83 PolarHBondContact O-N 2.94Å; E80-K83 PolarHBondContact O-N 3.21Å; K81-K83 VanDerWaalsContact C-N 3.28Å; K81-K83 PolarHBondContact O-N 2.95Å; K83-Q87 VanDerWaalsContact O-CB 3.32Å; K83-Q87 WeakPolarHBondContact O-CB 3.35Å; K83-Q87 PolarHBondContact O-N 2.99Å
84A98.7Very high98.7Very high61 Ų61100.7 Ų100.750%0.50450%0.504SS..Hα-helixtrans-64.7-43.1179.600000111.9E80 K81 Q87 Q88E80-A84 PolarHBondContact O-N 3.1Å; K81-A84 WeakPolarHBondContact O-CB 3.46Å; K81-A84 PolarHBondContact O-N 3.46Å; A84-Q87 PolarHBondContact O-N 2.93Å; A84-Q88 PolarHBondContact O-N 2.97Å
85E98.7Very high98.7Very high97 Ų97100.5 Ų100.545%0.45351%0.505SS..Hα-helixtrans-61.4-46.8176.4-71.1174176.100111.7K81 Q82 Q87 Q88 E89K81-E85 WeakPolarHBondContact CE-OE1 3.44Å; K81-E85 IonicContact NZ-OE1 3.12Å; K81-E85 WeakPolarHBondContact O-CG 3.32Å; K81-E85 PolarHBondContact O-N 3.46Å; Q82-E85 PolarHBondContact O-N 2.94Å; E85-Q87 VanDerWaalsContact C-N 3.34Å; E85-Q87 PolarHBondContact O-N 3.46Å; E85-Q88 PolarHBondContact O-N 3.32Å; E85-E89 PolarHBondContact O-N 3.34Å
86L98.8Very high98.7Very high122 Ų12298.5 Ų98.564%0.63950%0.496SS*.Hα-helixtrans-63.7-39.6176.8-73.2173000112.3Q82 Q88 E89 V90Q82-L86 WeakPolarHBondContact O-CB 2.94Å; Q82-L86 WeakPolarHBondContact O-CG 3.27Å; Q82-L86 PolarHBondContact O-N 2.9Å; L86-Q88 VanDerWaalsContact C-N 3.33Å; L86-E89 PolarHBondContact O-N 3.06Å; L86-V90 WeakPolarHBondContact O-CG2 3.33Å; L86-V90 PolarHBondContact O-N 3.33Å
87Q98.6Very high98.7Very high96 Ų9696.5 Ų96.545%0.44949%0.491SS..Hα-helixtrans-62.6-43176.9-176.659.942.600111.1K83 A84 E85 E89 V90 E91K83-Q87 VanDerWaalsContact O-CB 3.32Å; K83-Q87 WeakPolarHBondContact O-CB 3.35Å; K83-Q87 PolarHBondContact O-N 2.99Å; A84-Q87 PolarHBondContact O-N 2.93Å; E85-Q87 VanDerWaalsContact C-N 3.34Å; E85-Q87 PolarHBondContact O-N 3.46Å; Q87-E89 PolarHBondContact O-N 2.88Å; Q87-V90 PolarHBondContact O-N 3.48Å; Q87-E91 PolarHBondContact NE2-OE1 3.48Å; Q87-E91 WeakPolarHBondContact O-CG 3.43Å; Q87-E91 PolarHBondContact O-N 3.49Å
88Q98.8Very high98.7Very high137 Ų13793.7 Ų93.764%0.6449%0.486SS*.Hα-helixtrans-62.2-42175.9-173.5-179.710.300111.8A84 E85 L86 E91 K92A84-Q88 PolarHBondContact O-N 2.97Å; E85-Q88 PolarHBondContact O-N 3.32Å; L86-Q88 VanDerWaalsContact C-N 3.33Å; Q88-E91 PolarHBondContact O-N 3.01Å; Q88-K92 WeakPolarHBondContact O-CB 3.44Å; Q88-K92 PolarHBondContact O-N 2.98Å
89E98.6Very high98.6Very high82 Ų8292 Ų9238%0.38348%0.484SS..Hα-helixtrans-66.3-39.1178.1-171.159.8-154.900111.7E85 L86 Q87 E91 K92 L93E85-E89 PolarHBondContact O-N 3.34Å; L86-E89 PolarHBondContact O-N 3.06Å; Q87-E89 PolarHBondContact O-N 2.88Å; E89-E91 PolarHBondContact O-N 3.3Å; E89-K92 PolarHBondContact O-N 3.31Å; E89-K92 IonicContact OE1-NZ 3.49Å; E89-K92 PolarHBondContact OE1-NZ 3.03Å; E89-K92 IonicContact OE2-NZ 3.21Å; E89-L93 HydrophobicContact CG-CD1 4.13Å; E89-L93 HydrophobicContact CG-CG 4.44Å; E89-L93 WeakPolarHBondContact O-CB 3.22Å; E89-L93 VanDerWaalsContact O-CG 3.3Å; E89-L93 WeakPolarHBondContact O-CG 3.3Å; E89-L93 PolarHBondContact O-N 2.99Å
90V98.8Very high98.6Very high89 Ų8992.1 Ų92.154%0.53948%0.483SS..Hα-helixtrans-60.4-45.6174168.50000111.1L86 Q87 L93 A94L86-V90 WeakPolarHBondContact O-CG2 3.33Å; L86-V90 PolarHBondContact O-N 3.33Å; Q87-V90 PolarHBondContact O-N 3.48Å; V90-L93 PolarHBondContact O-N 3.34Å; V90-A94 VanDerWaalsContact O-CB 3.27Å; V90-A94 WeakPolarHBondContact O-CB 3.43Å; V90-A94 PolarHBondContact O-N 2.92Å
91E98.7Very high98.6Very high116 Ų11693 Ų9354%0.54249%0.485SS..Hα-helixtrans-63.9-42.8178.5-74.5170.2-161.200111.9Q87 Q88 E89 A94 S95Q87-E91 PolarHBondContact NE2-OE1 3.48Å; Q87-E91 WeakPolarHBondContact O-CG 3.43Å; Q87-E91 PolarHBondContact O-N 3.49Å; Q88-E91 PolarHBondContact O-N 3.01Å; E89-E91 PolarHBondContact O-N 3.3Å; E91-A94 PolarHBondContact O-N 2.98Å; E91-S95 PolarHBondContact O-N 2.99Å
92K98.6Very high98.6Very high93 Ų9393.8 Ų93.840%0.40449%0.492SS..Hα-helixtrans-58.2-54.3174.8174.3166.4159.7-81.80111Q88 E89 A94 S95 E96Q88-K92 WeakPolarHBondContact O-CB 3.44Å; Q88-K92 PolarHBondContact O-N 2.98Å; E89-K92 PolarHBondContact O-N 3.31Å; E89-K92 IonicContact OE1-NZ 3.49Å; E89-K92 PolarHBondContact OE1-NZ 3.03Å; E89-K92 IonicContact OE2-NZ 3.21Å; K92-A94 VanDerWaalsContact C-N 3.3Å; K92-A94 PolarHBondContact O-N 2.69Å; K92-S95 PolarHBondContact O-N 2.98Å; K92-S95 VanDerWaalsContact O-N 3.12Å; K92-S95 PolarHBondContact O-OG 3.34Å; K92-E96 WeakPolarHBondContact CE-OE1 3.46Å; K92-E96 VanDerWaalsContact CG-OE1 3.32Å; K92-E96 WeakPolarHBondContact CG-OE1 3.28Å; K92-E96 IonicContact NZ-OE1 3.43Å; K92-E96 PolarHBondContact NZ-OE1 2.9Å; K92-E96 WeakPolarHBondContact O-CG 3.37Å; K92-E96 PolarHBondContact O-N 3.33Å
93L98.7Very high98.5Very high89 Ų8996 Ų9647%0.46650%0.503SS..Hα-helixtrans-61.8-36.6178.9-69.8173.2000112.5E89 V90 E96 N97E89-L93 HydrophobicContact CG-CD1 4.13Å; E89-L93 HydrophobicContact CG-CG 4.44Å; E89-L93 WeakPolarHBondContact O-CB 3.22Å; E89-L93 VanDerWaalsContact O-CG 3.3Å; E89-L93 WeakPolarHBondContact O-CG 3.3Å; E89-L93 PolarHBondContact O-N 2.99Å; V90-L93 PolarHBondContact O-N 3.34Å; L93-E96 PolarHBondContact O-N 2.92Å; L93-N97 WeakPolarHBondContact O-CB 3.32Å; L93-N97 PolarHBondContact O-N 3.47Å
94A98.6Very high98.5Very high59 Ų5992.4 Ų92.449%0.48849%0.49SS..Hα-helixtrans-63.1-42.1175.400000111.7V90 E91 K92 A98V90-A94 VanDerWaalsContact O-CB 3.27Å; V90-A94 WeakPolarHBondContact O-CB 3.43Å; V90-A94 PolarHBondContact O-N 2.92Å; E91-A94 PolarHBondContact O-N 2.98Å; K92-A94 VanDerWaalsContact C-N 3.3Å; K92-A94 PolarHBondContact O-N 2.69Å; A94-A98 WeakPolarHBondContact O-CB 3.44Å; A94-A98 PolarHBondContact O-N 3.3Å
95S98.6Very high98.5Very high72 Ų7293.8 Ų93.850%0.50349%0.489SS..Hα-helixtrans-66.2-43.4176.875.90000112.4E91 K92 N97 A98 S99E91-S95 PolarHBondContact O-N 2.99Å; K92-S95 PolarHBondContact O-N 2.98Å; K92-S95 VanDerWaalsContact O-N 3.12Å; K92-S95 PolarHBondContact O-OG 3.34Å; S95-N97 PolarHBondContact O-N 3.37Å; S95-A98 PolarHBondContact O-N 3.47Å; S95-S99 PolarHBondContact O-N 3.12Å
96E98.5Very high98.5Very high70 Ų7091.4 Ų91.433%0.32749%0.486SS..Hα-helixtrans-62.2-44.6176.8-70.5173.4-168.800110.9K92 L93 A98 S99 M100K92-E96 WeakPolarHBondContact CE-OE1 3.46Å; K92-E96 VanDerWaalsContact CG-OE1 3.32Å; K92-E96 WeakPolarHBondContact CG-OE1 3.28Å; K92-E96 IonicContact NZ-OE1 3.43Å; K92-E96 PolarHBondContact NZ-OE1 2.9Å; K92-E96 WeakPolarHBondContact O-CG 3.37Å; K92-E96 PolarHBondContact O-N 3.33Å; L93-E96 PolarHBondContact O-N 2.92Å; E96-A98 PolarHBondContact O-N 2.97Å; E96-S99 WeakPolarHBondContact O-CB 3.49Å; E96-S99 PolarHBondContact O-N 3.32Å; E96-M100 HydrophobicContact CB-CE 4.14Å; E96-M100 WeakPolarHBondContact O-CG 3.35Å; E96-M100 PolarHBondContact O-N 3.41Å
97N98.6Very high98.4Very high83 Ų8391.3 Ų91.344%0.44449%0.485SS..Hα-helixtrans-64.4-40.3177.7-167.8-18.8000112L93 S95 S99 M100 K101L93-N97 WeakPolarHBondContact O-CB 3.32Å; L93-N97 PolarHBondContact O-N 3.47Å; S95-N97 PolarHBondContact O-N 3.37Å; N97-S99 VanDerWaalsContact C-N 3.34Å; N97-S99 PolarHBondContact O-N 3.21Å; N97-M100 PolarHBondContact O-N 2.91Å; N97-K101 WeakPolarHBondContact O-CG 3.48Å; N97-K101 PolarHBondContact O-N 3.49Å; N97-K101 VanDerWaalsContact OD1-CE 3.28Å; N97-K101 WeakPolarHBondContact OD1-CE 3.45Å
98A98.5Very high98.4Very high50 Ų5093.4 Ų93.441%0.41349%0.489SS..Hα-helixtrans-61.2-43.1173.600000111.7A94 S95 E96 K101 M102A94-A98 WeakPolarHBondContact O-CB 3.44Å; A94-A98 PolarHBondContact O-N 3.3Å; S95-A98 PolarHBondContact O-N 3.47Å; E96-A98 PolarHBondContact O-N 2.97Å; A98-K101 PolarHBondContact O-N 3.12Å; A98-M102 WeakPolarHBondContact O-CG 3.49Å; A98-M102 PolarHBondContact O-N 3.49Å; A98-M102 VanDerWaalsContact O-N 3.16Å
99S98.4Very high98.3Very high50 Ų5090.5 Ų90.535%0.3548%0.484SS..Hα-helixtrans-60.5-49.6175.1-165.20000111.9S95 E96 N97 K101 M102 E103S95-S99 PolarHBondContact O-N 3.12Å; E96-S99 WeakPolarHBondContact O-CB 3.49Å; E96-S99 PolarHBondContact O-N 3.32Å; N97-S99 VanDerWaalsContact C-N 3.34Å; N97-S99 PolarHBondContact O-N 3.21Å; S99-K101 VanDerWaalsContact C-N 3.29Å; S99-K101 PolarHBondContact O-N 3.16Å; S99-M102 WeakPolarHBondContact O-CB 3.2Å; S99-M102 PolarHBondContact O-N 3.43Å; S99-M102 VanDerWaalsContact O-N 3.12Å; S99-E103 PolarHBondContact O-N 3.39Å
100M98.3Very high98.2Very high114 Ų11493.6 Ų93.656%0.56250%0.496SS*.Hα-helixtrans-60.1-39.2179.3-69.7-177-142.500112.1E96 N97 E103 L104E96-M100 HydrophobicContact CB-CE 4.14Å; E96-M100 WeakPolarHBondContact O-CG 3.35Å; E96-M100 PolarHBondContact O-N 3.41Å; N97-M100 PolarHBondContact O-N 2.91Å; M100-E103 PolarHBondContact O-N 3.5Å; M100-L104 VanDerWaalsContact O-CB 3.28Å; M100-L104 WeakPolarHBondContact O-CB 3.28Å; M100-L104 PolarHBondContact O-N 2.94Å
101K98.3Very high98.2Very high122 Ų12296 Ų9653%0.5350%0.497SS..Hα-helixtrans-60.9-44.9175.3-77174.1178.11740111.9N97 A98 S99 E103 L104 D105N97-K101 WeakPolarHBondContact O-CG 3.48Å; N97-K101 PolarHBondContact O-N 3.49Å; N97-K101 VanDerWaalsContact OD1-CE 3.28Å; N97-K101 WeakPolarHBondContact OD1-CE 3.45Å; A98-K101 PolarHBondContact O-N 3.12Å; S99-K101 VanDerWaalsContact C-N 3.29Å; S99-K101 PolarHBondContact O-N 3.16Å; K101-E103 VanDerWaalsContact C-N 3.35Å; K101-E103 PolarHBondContact O-N 2.92Å; K101-L104 PolarHBondContact O-N 3.03Å; K101-D105 WeakPolarHBondContact O-CB 3.46Å; K101-D105 PolarHBondContact O-N 3.22Å
102M98.2Very high98.1Very high130 Ų13095.8 Ų95.864%0.6450%0.496SS*.Hα-helixtrans-61.4-43.3176.8-67.6-170-62.700112A98 S99 L104 D105 A106A98-M102 WeakPolarHBondContact O-CG 3.49Å; A98-M102 PolarHBondContact O-N 3.49Å; A98-M102 VanDerWaalsContact O-N 3.16Å; S99-M102 WeakPolarHBondContact O-CB 3.2Å; S99-M102 PolarHBondContact O-N 3.43Å; S99-M102 VanDerWaalsContact O-N 3.12Å; M102-L104 VanDerWaalsContact C-N 3.35Å; M102-D105 PolarHBondContact O-N 3.49Å; M102-A106 WeakPolarHBondContact O-CB 3.37Å; M102-A106 PolarHBondContact O-N 2.85Å
103E98Very high97.9Very high129 Ų12994.2 Ų94.260%0.60350%0.5SS*.Hα-helixtrans-63.2-42.2177.1-71.5176-15400112S99 M100 K101 A106 L107S99-E103 PolarHBondContact O-N 3.39Å; M100-E103 PolarHBondContact O-N 3.5Å; K101-E103 VanDerWaalsContact C-N 3.35Å; K101-E103 PolarHBondContact O-N 2.92Å; E103-A106 PolarHBondContact O-N 3.2Å; E103-L107 WeakPolarHBondContact O-CB 3.38Å; E103-L107 PolarHBondContact O-N 3.35Å
104L98.3Very high97.8Very high79 Ų7995.3 Ų95.341%0.41451%0.506SS..Hα-helixtrans-62.9-46.8177.7-159.6176.2000110.5M100 K101 M102 A106 L107 R108M100-L104 VanDerWaalsContact O-CB 3.28Å; M100-L104 WeakPolarHBondContact O-CB 3.28Å; M100-L104 PolarHBondContact O-N 2.94Å; K101-L104 PolarHBondContact O-N 3.03Å; M102-L104 VanDerWaalsContact C-N 3.35Å; L104-A106 PolarHBondContact O-N 2.92Å; L104-L107 PolarHBondContact O-N 3.38Å; L104-R108 VanDerWaalsContact CD2-CD 3.45Å; L104-R108 HydrophobicContact CD2-CG 3.76Å; L104-R108 WeakPolarHBondContact O-CG 3.46Å; L104-R108 PolarHBondContact O-N 3.44Å
105D98.1Very high97.7Very high90 Ų9095.6 Ų95.648%0.48150%0.497SS..Hα-helixtrans-65-39.5178.5-70.7-21000111.9K101 M102 L107 R108 S109K101-D105 WeakPolarHBondContact O-CB 3.46Å; K101-D105 PolarHBondContact O-N 3.22Å; M102-D105 PolarHBondContact O-N 3.49Å; D105-L107 VanDerWaalsContact C-N 3.32Å; D105-L107 PolarHBondContact O-N 3.41Å; D105-R108 PolarHBondContact O-N 2.94Å; D105-R108 IonicContact OD1-NH1 2.64Å; D105-R108 PolarHBondContact OD1-NH1 3.36Å; D105-S109 PolarHBondContact O-N 3.43Å
106A97.9Very high97.5Very high47 Ų4795.9 Ų95.939%0.38849%0.493SS..Hα-helixtrans-61.9-40.3173.200000112M102 E103 L104 K110M102-A106 WeakPolarHBondContact O-CB 3.37Å; M102-A106 PolarHBondContact O-N 2.85Å; E103-A106 PolarHBondContact O-N 3.2Å; L104-A106 PolarHBondContact O-N 2.92Å; A106-K110 WeakPolarHBondContact O-CG 3.42Å; A106-K110 PolarHBondContact O-N 3.45Å; A106-K110 VanDerWaalsContact O-N 3.17Å
107L97.9Very high97.2Very high120 Ų12097.3 Ų97.363%0.62850%0.498SS*.Hα-helixtrans-69.7-41.7177.8-171.861.4000111.9E103 L104 D105 S109 K110 Y111E103-L107 WeakPolarHBondContact O-CB 3.38Å; E103-L107 PolarHBondContact O-N 3.35Å; L104-L107 PolarHBondContact O-N 3.38Å; D105-L107 VanDerWaalsContact C-N 3.32Å; D105-L107 PolarHBondContact O-N 3.41Å; L107-S109 PolarHBondContact O-N 2.98Å; L107-K110 PolarHBondContact O-N 2.88Å; L107-Y111 WeakPolarHBondContact O-CB 3.47Å; L107-Y111 PolarHBondContact O-N 2.96Å
108R97.7Very high96.9Very high141 Ų14196 Ų9653%0.53250%0.498SS..Hα-helixtrans-57.2-47.3172.7-81173.7173.5158.31111.5L104 D105 K110 Y111 E112L104-R108 VanDerWaalsContact CD2-CD 3.45Å; L104-R108 HydrophobicContact CD2-CG 3.76Å; L104-R108 WeakPolarHBondContact O-CG 3.46Å; L104-R108 PolarHBondContact O-N 3.44Å; D105-R108 PolarHBondContact O-N 2.94Å; D105-R108 IonicContact OD1-NH1 2.64Å; D105-R108 PolarHBondContact OD1-NH1 3.36Å; R108-K110 VanDerWaalsContact C-N 3.35Å; R108-K110 PolarHBondContact O-N 3.14Å; R108-Y111 WeakPolarHBondContact O-CB 3.45Å; R108-Y111 PolarHBondContact O-N 3.41Å; R108-Y111 VanDerWaalsContact O-N 3.14Å; R108-E112 WeakPolarHBondContact O-CG 3.37Å; R108-E112 PolarHBondContact O-N 3.17Å
109S97.5Very high96.6Very high75 Ų75100.3 Ų100.352%0.52450%0.504SS..Hα-helixtrans-60.3-43.8179-175.20000112.2D105 L107 Y111 E112 A113D105-S109 PolarHBondContact O-N 3.43Å; L107-S109 PolarHBondContact O-N 2.98Å; S109-Y111 VanDerWaalsContact C-N 3.33Å; S109-Y111 PolarHBondContact O-N 3.47Å; S109-E112 PolarHBondContact O-N 3.4Å; S109-A113 WeakPolarHBondContact O-CB 3.46Å; S109-A113 PolarHBondContact O-N 2.94Å
110K97Very high96.1Very high148 Ų148102.8 Ų102.864%0.64352%0.517SS*.Hα-helixtrans-60.9-42.6174.9-71.6171.5-175.7173.80111.8A106 L107 R108 A113 L114A106-K110 WeakPolarHBondContact O-CG 3.42Å; A106-K110 PolarHBondContact O-N 3.45Å; A106-K110 VanDerWaalsContact O-N 3.17Å; L107-K110 PolarHBondContact O-N 2.88Å; R108-K110 VanDerWaalsContact C-N 3.35Å; R108-K110 PolarHBondContact O-N 3.14Å; K110-A113 PolarHBondContact O-N 3.12Å; K110-L114 PolarHBondContact O-N 2.98Å; K110-L114 VanDerWaalsContact O-N 3.07Å
111Y97.6Very high95.5Very high139 Ų139101.6 Ų101.655%0.54552%0.516SS..Hα-helixtrans-64.8-44.8178.8178.6-106.4000112.2L107 R108 S109 L114 Q115L107-Y111 WeakPolarHBondContact O-CB 3.47Å; L107-Y111 PolarHBondContact O-N 2.96Å; R108-Y111 WeakPolarHBondContact O-CB 3.45Å; R108-Y111 PolarHBondContact O-N 3.41Å; R108-Y111 VanDerWaalsContact O-N 3.14Å; S109-Y111 VanDerWaalsContact C-N 3.33Å; S109-Y111 PolarHBondContact O-N 3.47Å; Y111-L114 PolarHBondContact O-N 3.33Å; Y111-Q115 HydrophobicContact CD1-CG 4.33Å; Y111-Q115 HydrophobicContact CE1-CG 3.92Å; Y111-Q115 HydrophobicContact CE2-CG 4.34Å; Y111-Q115 PolarHBondContact O-N 3.06Å; Y111-Q115 PolarHBondContact OH-NE2 3.47Å
112E96.9Very high94.4Very high112 Ų11299.9 Ų99.952%0.52353%0.525SS..Hα-helixtrans-62.2-42.8175.8-73.7-177.4176.100112.2R108 S109 L114 Q115 N116R108-E112 WeakPolarHBondContact O-CG 3.37Å; R108-E112 PolarHBondContact O-N 3.17Å; S109-E112 PolarHBondContact O-N 3.4Å; E112-L114 VanDerWaalsContact C-N 3.3Å; E112-L114 PolarHBondContact O-N 3.49Å; E112-Q115 PolarHBondContact O-N 3.44Å; E112-N116 WeakPolarHBondContact O-CB 3.37Å; E112-N116 PolarHBondContact O-N 2.86Å; E112-N116 PolarHBondContact O-ND2 3.5Å
113A95.4Very high93Very high59 Ų59104.3 Ų104.349%0.48853%0.534SS..Hα-helixtrans-58.2-44.117500000111.5S109 K110 N116 F117S109-A113 WeakPolarHBondContact O-CB 3.46Å; S109-A113 PolarHBondContact O-N 2.94Å; K110-A113 PolarHBondContact O-N 3.12Å; A113-N116 PolarHBondContact O-N 3.42Å; A113-F117 WeakPolarHBondContact O-CB 3.39Å; A113-F117 PolarHBondContact O-N 3.28Å
114L96Very high90.9Very high113 Ų113102 Ų10259%0.59253%0.532SS*.Hα-helixtrans-66.5-42177.5-173.862.6000112.3K110 Y111 E112 F117 A118K110-L114 PolarHBondContact O-N 2.98Å; K110-L114 VanDerWaalsContact O-N 3.07Å; Y111-L114 PolarHBondContact O-N 3.33Å; E112-L114 VanDerWaalsContact C-N 3.3Å; E112-L114 PolarHBondContact O-N 3.49Å; L114-F117 PolarHBondContact O-N 2.89Å; L114-A118 WeakPolarHBondContact O-CB 3.38Å; L114-A118 PolarHBondContact O-N 3.41Å
115Q95.8Very high88.7Confident65 Ų65103.2 Ų103.230%0.30455%0.545SS..Hα-helixtrans-61.5-44.7174.5-76.9-163.3-7.200112.1Y111 E112 F117 A118 R119Y111-Q115 HydrophobicContact CD1-CG 4.33Å; Y111-Q115 HydrophobicContact CE1-CG 3.92Å; Y111-Q115 HydrophobicContact CE2-CG 4.34Å; Y111-Q115 PolarHBondContact O-N 3.06Å; Y111-Q115 PolarHBondContact OH-NE2 3.47Å; E112-Q115 PolarHBondContact O-N 3.44Å; Q115-F117 VanDerWaalsContact C-N 3.32Å; Q115-F117 PolarHBondContact O-N 2.86Å; Q115-A118 PolarHBondContact O-N 2.73Å; Q115-R119 WeakPolarHBondContact O-CB 3.41Å; Q115-R119 WeakPolarHBondContact O-CG 3.38Å; Q115-R119 PolarHBondContact O-N 2.95Å
116N93.9Very high86.6Confident77 Ų77105.5 Ų105.541%0.41256%0.562SS.*Hα-helixtrans-63.6-40.8179.2-72.6-20.4000110.9E112 A113 R119 T120E112-N116 WeakPolarHBondContact O-CB 3.37Å; E112-N116 PolarHBondContact O-N 2.86Å; E112-N116 PolarHBondContact O-ND2 3.5Å; A113-N116 PolarHBondContact O-N 3.42Å; N116-R119 PolarHBondContact O-N 2.91Å; N116-R119 PolarHBondContact OD1-NH1 3.07Å; N116-T120 WeakPolarHBondContact O-CB 3.47Å; N116-T120 PolarHBondContact O-N 3.33Å; N116-T120 PolarHBondContact O-OG1 3.25Å
117F92.8Very high84.3Confident100 Ų100108.7 Ų108.744%0.43958%0.577SS.*Hα-helixtrans-59-53.3172.4177.6-101.4000111.6A113 L114 Q115 R119 T120 V121 I151A113-F117 WeakPolarHBondContact O-CB 3.39Å; A113-F117 PolarHBondContact O-N 3.28Å; L114-F117 PolarHBondContact O-N 2.89Å; Q115-F117 VanDerWaalsContact C-N 3.32Å; Q115-F117 PolarHBondContact O-N 2.86Å; F117-R119 VanDerWaalsContact C-N 3.31Å; F117-R119 PolarHBondContact O-N 3.39Å; F117-T120 PolarHBondContact O-N 3.33Å; F117-T120 VanDerWaalsContact O-N 3.08Å; F117-V121 HydrophobicContact CD1-CG2 4.29Å; F117-V121 HydrophobicContact CD2-CG2 4.33Å; F117-V121 HydrophobicContact CE1-CG2 3.87Å; F117-V121 HydrophobicContact CE2-CG2 3.92Å; F117-V121 HydrophobicContact CZ-CG2 3.67Å; F117-V121 WeakPolarHBondContact O-CG2 3.43Å; F117-V121 PolarHBondContact O-N 3.5Å; F117-I151 HydrophobicContact CD2-CD1 4.26Å; F117-I151 HydrophobicContact CE2-CD1 4.48Å; F117-I151 HydrophobicContact CG-CD1 4.47Å
118A92.9Very high81.7Confident55 Ų55108.4 Ų108.446%0.45558%0.582SS.*Hα-helixtrans-58-41.8179.400000112.5L114 Q115 V121 A122L114-A118 WeakPolarHBondContact O-CB 3.38Å; L114-A118 PolarHBondContact O-N 3.41Å; Q115-A118 PolarHBondContact O-N 2.73Å; A118-V121 PolarHBondContact O-N 3.36Å; A118-A122 VanDerWaalsContact O-CB 3.31Å; A118-A122 WeakPolarHBondContact O-CB 3.4Å; A118-A122 PolarHBondContact O-N 3.25Å
119R92.4Very high79.3Confident141 Ų141106.7 Ų106.753%0.53260%0.598SS.*Hα-helixtrans-63.6-40.8175.2-76.1-174.5-113.6153.9-4.8112.4Q115 N116 F117 A122 R123Q115-R119 WeakPolarHBondContact O-CB 3.41Å; Q115-R119 WeakPolarHBondContact O-CG 3.38Å; Q115-R119 PolarHBondContact O-N 2.95Å; N116-R119 PolarHBondContact O-N 2.91Å; N116-R119 PolarHBondContact OD1-NH1 3.07Å; F117-R119 VanDerWaalsContact C-N 3.31Å; F117-R119 PolarHBondContact O-N 3.39Å; R119-A122 PolarHBondContact O-N 2.95Å; R119-R123 WeakPolarHBondContact O-CB 3.49Å; R119-R123 PolarHBondContact O-N 2.98Å
120T87.9Confident77Confident102 Ų102114.8 Ų114.863%0.62662%0.617SS**Hα-helixtrans-66.5-44178.9-54.90000110.9N116 F117 A122 R123 S124N116-T120 WeakPolarHBondContact O-CB 3.47Å; N116-T120 PolarHBondContact O-N 3.33Å; N116-T120 PolarHBondContact O-OG1 3.25Å; F117-T120 PolarHBondContact O-N 3.33Å; F117-T120 VanDerWaalsContact O-N 3.08Å; T120-A122 VanDerWaalsContact C-N 3.35Å; T120-A122 PolarHBondContact O-N 3.18Å; T120-R123 PolarHBondContact O-N 3.2Å; T120-S124 PolarHBondContact O-N 3.37Å
121V85.1Confident74.5Confident89 Ų89110.7 Ų110.754%0.53962%0.617SS.*Hα-helixtrans-62-42.6175.1174.50000111F117 A118 R123F117-V121 HydrophobicContact CD1-CG2 4.29Å; F117-V121 HydrophobicContact CD2-CG2 4.33Å; F117-V121 HydrophobicContact CE1-CG2 3.87Å; F117-V121 HydrophobicContact CE2-CG2 3.92Å; F117-V121 HydrophobicContact CZ-CG2 3.67Å; F117-V121 WeakPolarHBondContact O-CG2 3.43Å; F117-V121 PolarHBondContact O-N 3.5Å; A118-V121 PolarHBondContact O-N 3.36Å; V121-R123 PolarHBondContact O-N 3.49Å
122A76Confident72.1Confident86 Ų86110.2 Ų110.271%0.71163%0.631SS**Hα-helixtrans-71.9-25.6179.800000114.4A118 R119 T120A118-A122 VanDerWaalsContact O-CB 3.31Å; A118-A122 WeakPolarHBondContact O-CB 3.4Å; A118-A122 PolarHBondContact O-N 3.25Å; R119-A122 PolarHBondContact O-N 2.95Å; T120-A122 VanDerWaalsContact C-N 3.35Å; T120-A122 PolarHBondContact O-N 3.18Å
123R68.9Low69.5Low224 Ų224113 Ų11385%0.84565%0.649SS**Hα-helixtrans-90.9-8.4178.3-91.1-175.8166.4179.8-3.6114.5R119 T120 V121 P125R119-R123 WeakPolarHBondContact O-CB 3.49Å; R119-R123 PolarHBondContact O-N 2.98Å; T120-R123 PolarHBondContact O-N 3.2Å; V121-R123 PolarHBondContact O-N 3.49Å; R123-P125 WeakPolarHBondContact O-CD 3.31Å; R123-P125 VanDerWaalsContact O-N 3.16Å
124S53.6Low67Low79 Ų79115.7 Ų115.755%0.55266%0.661SS**SBendtrans-61.6118.8171.2-162.90000107.9T120 V126T120-S124 PolarHBondContact O-N 3.37Å; S124-V126 PolarHBondContact O-N 3.47Å
125P52.5Low64.7Low106 Ų106116.3 Ų116.369%0.68868%0.675SS**  trans-65.9105.7-176.826-30.6000107.5R123 T127R123-P125 WeakPolarHBondContact O-CD 3.31Å; R123-P125 VanDerWaalsContact O-N 3.16Å; P125-T127 PolarHBondContact O-N 2.92Å
126V54.1Low62Low137 Ų137118.1 Ų118.183%0.8370%0.695SS**  trans-66.291.4156.3-154.60000103.9S124 P128S124-V126 PolarHBondContact O-N 3.47Å; V126-P128 WeakPolarHBondContact O-CD 3.16Å
127T48Very low59.8Low114 Ų114124.4 Ų124.470%0.69972%0.724SS**  trans-53.9114.2169.8450000106.7P125 A129P125-T127 PolarHBondContact O-N 2.92Å; T127-A129 PolarHBondContact O-N 3.08Å
128P44.8Very low57.5Low114 Ų114122.4 Ų122.474%0.7473%0.732SS**  trans-74.5101.9169.630-25.7000105.1V126 R130V126-P128 WeakPolarHBondContact O-CD 3.16Å; P128-R130 PolarHBondContact O-N 3.42Å
129A45.9Very low55.1Low105 Ų105126 Ų12687%0.86875%0.75SS**  trans-65.584.2166.500000107.7T127T127-A129 PolarHBondContact O-N 3.08Å
130R49.7Very low52.7Low246 Ų246127.4 Ų127.493%0.92877%0.767SS**  trans-11482.7169.9-151-179.5-168.7-168.83.2107.5P128P128-R130 PolarHBondContact O-N 3.42Å
131G44.7Very low50.7Low62 Ų62129.9 Ų129.964%0.63978%0.775SS**SBendtrans-149.1146.7170.600000109.4
132P46.8Very low48.8Very low129 Ų129131.3 Ų131.384%0.83879%0.787SS**PPolyproline II helixtrans-69.5143.3-171.8-10.726.5000111.6P134P132-P134 WeakPolarHBondContact O-CD 3.45Å
133L42Very low47.2Very low171 Ų171130.3 Ų130.390%0.89578%0.784SS**PPolyproline II helixtrans-46.7129.4175.6-69.8146.6000112.8
134P42.3Very low46.2Very low114 Ų114130.1 Ų130.174%0.7479%0.79SS**PPolyproline II helixtrans-99.3125.9150.432.3-24.4000110.1P132 S136P132-P134 WeakPolarHBondContact O-CD 3.45Å; P134-S136 PolarHBondContact O-N 3.32Å; P134-S136 VanDerWaalsContact O-N 3.15Å
135S47.8Very low46Very low127 Ų127132.8 Ų132.889%0.88880%0.802SS**  trans-64.9102.4168.5-55.90000110.1
136S39.9Very low46Very low103 Ų103132 Ų13272%0.7281%0.805SS**  trans-159.2109.9156.764.60000110.7P134 G138P134-S136 PolarHBondContact O-N 3.32Å; P134-S136 VanDerWaalsContact O-N 3.15Å; S136-G138 PolarHBondContact O-N 2.95Å
137M48Very low45.7Very low208 Ų208131.9 Ų131.9100%1.02580%0.804SS**  trans-57.7114.8164.3-80.9-107.4-119.800109.5
138G44Very low45.9Very low59 Ų59132.3 Ų132.361%0.60881%0.807SS**  trans-137.9150.8169.200000110S136S136-G138 PolarHBondContact O-N 2.95Å
139P43.4Very low46.2Very low130 Ų130131.7 Ų131.784%0.84481%0.806SS**  trans-68136.6-168.7-15.129.2000112.6I141P139-I141 PolarHBondContact O-N 2.94Å
140L40.3Very low46.9Very low170 Ų170132.8 Ų132.889%0.8980%0.801SS**  trans-68.1106.9-176.9-154.474.7000110.7
141I47.2Very low47.2Very low154 Ų154126.5 Ų126.579%0.7979%0.785SS**PPolyproline II helixtrans-81121.4166.4-57.4172.1000107P139 G143P139-I141 PolarHBondContact O-N 2.94Å; I141-G143 PolarHBondContact O-N 2.88Å
142P44.1Very low48.1Very low120 Ų120129.1 Ų129.178%0.77979%0.788SS**PPolyproline II helixtrans-65.4119.9-178.6-17.830.7000110.4
143G44.1Very low49Very low64 Ų64130 Ų13066%0.6679%0.785SS**PPolyproline II helixtrans-58.4144.2179.700000112.6I141 V145I141-G143 PolarHBondContact O-N 2.88Å; G143-V145 VanDerWaalsContact C-N 3.32Å; G143-V145 PolarHBondContact O-N 3.4Å
144K46.7Very low49.9Very low220 Ų220127.6 Ų127.696%0.95778%0.777SS**  trans-56.597.4162.2-98.9164.2171.3168.50108.3A146K144-A146 PolarHBondContact O-N 3.34Å
145V49.3Very low50.3Low136 Ų136131.7 Ų131.782%0.82478%0.783SS**  trans-58.8117.6164.2-1200000106.5G143 T147G143-V145 VanDerWaalsContact C-N 3.32Å; G143-V145 PolarHBondContact O-N 3.4Å; V145-T147 PolarHBondContact O-N 3.29Å; V145-T147 VanDerWaalsContact O-N 3.1Å
146A51.9Low50.6Low89 Ų89130.4 Ų130.474%0.73677%0.774SS**  trans-54.2120.316900000107.3K144 T148K144-A146 PolarHBondContact O-N 3.34Å; A146-T148 VanDerWaalsContact C-N 3.33Å; A146-T148 PolarHBondContact O-N 3.03Å
147T49.7Very low51.4Low134 Ų134134.2 Ų134.282%0.82278%0.777SS**  trans-60.996.4175.610.30000107.8V145 S149V145-T147 PolarHBondContact O-N 3.29Å; V145-T147 VanDerWaalsContact O-N 3.1Å; T147-S149 VanDerWaalsContact C-N 3.31Å; T147-S149 PolarHBondContact O-N 3.27Å
148T51.5Low51.7Low124 Ų124130.5 Ų130.576%0.76177%0.766SS**  trans-61.496.9166.6-59.50000107A146 V150A146-T148 VanDerWaalsContact C-N 3.33Å; A146-T148 PolarHBondContact O-N 3.03Å; T148-V150 PolarHBondContact O-N 3.1Å
149S50.8Low51.8Low101 Ų101134.3 Ų134.371%0.70677%0.773SS**  trans-63.1108.8173.7-59.40000108.3T147 I151T147-S149 VanDerWaalsContact C-N 3.31Å; T147-S149 PolarHBondContact O-N 3.27Å; S149-I151 PolarHBondContact O-N 3.21Å
150V61.3Low52.2Low127 Ų127133.1 Ų133.177%0.7777%0.774SS**  trans-68.6119.7178.3-176.50000108.2T148 T152T148-V150 PolarHBondContact O-N 3.1Å; V150-T152 PolarHBondContact O-N 2.85Å
151I56.4Low53Low115 Ų115136.1 Ų136.159%0.5977%0.773SS**  trans-82110171.9-60.5174.1000107.6F117 S149 I153F117-I151 HydrophobicContact CD2-CD1 4.26Å; F117-I151 HydrophobicContact CE2-CD1 4.48Å; F117-I151 HydrophobicContact CG-CD1 4.47Å; S149-I151 PolarHBondContact O-N 3.21Å; I151-I153 HydrophobicContact CG2-CG1 4.32Å; I151-I153 PolarHBondContact O-N 2.87Å
152T62.3Low52.9Low116 Ų116137.9 Ų137.971%0.71280%0.799SS**  trans-77.3106172-45.80000109.4V150 V154V150-T152 PolarHBondContact O-N 2.85Å; T152-V154 HydrophobicContact CG2-CG2 4.36Å; T152-V154 PolarHBondContact O-N 3.02Å
153I65.3Low53.3Low149 Ų149138.8 Ų138.876%0.76480%0.8SS**  trans-83.6100.9170.2-57.5176000107.7I151 K155I151-I153 HydrophobicContact CG2-CG1 4.32Å; I151-I153 PolarHBondContact O-N 2.87Å; I153-K155 PolarHBondContact O-N 2.88Å
154V61.1Low53.8Low120 Ų120142.7 Ų142.773%0.72781%0.807SS**  trans-74.1111.3170.8-178.70000108.3T152 S156T152-V154 HydrophobicContact CG2-CG2 4.36Å; T152-V154 PolarHBondContact O-N 3.02Å; V154-S156 PolarHBondContact O-N 2.87Å
155K52.3Low54.2Low200 Ų200138.4 Ų138.487%0.8780%0.799SS**  trans-77.994.9172.9-173.3164.6-178.1161.30108.8I153 K157I153-K155 PolarHBondContact O-N 2.88Å; K155-K157 PolarHBondContact O-N 2.78Å
156S53.1Low54.5Low99 Ų99138.5 Ų138.569%0.69280%0.798SS**  trans-71.411817049.60000109.4V154 T158V154-S156 PolarHBondContact O-N 2.87Å; S156-T158 PolarHBondContact O-N 3.17Å
157K57.1Low54.7Low184 Ų184141.6 Ų141.680%0.880%0.802SS**  trans-67.8113.8173.5-156.4172.4-173.5173.80107.4K155 D159K155-K157 PolarHBondContact O-N 2.78Å; K157-D159 PolarHBondContact O-N 3.24Å; K157-D159 VanDerWaalsContact O-N 3.12Å
158T53.2Low55Low129 Ų129142.1 Ų142.179%0.79180%0.8SS**  trans-70.999.6168.344.20000107.2S156 A160S156-T158 PolarHBondContact O-N 3.17Å; T158-A160 PolarHBondContact O-N 3.24Å
159D47.5Very low55.3Low140 Ų140143.4 Ų143.475%0.74980%0.803SS**  trans-67.3102.6163.7-79.4-40.6000107.2K157 R161K157-D159 PolarHBondContact O-N 3.24Å; K157-D159 VanDerWaalsContact O-N 3.12Å; D159-R161 PolarHBondContact O-N 3.15Å
160A52Low55.6Low104 Ų104146.7 Ų146.786%0.8681%0.81SS**  trans-61.7101.5165.700000107.2T158T158-A160 PolarHBondContact O-N 3.24Å
161R55.4Low55.1Low234 Ų234148.3 Ų148.388%0.88381%0.814SS**  trans-101.5104.4174.6-161.2175.8177-175.4-1.8108.6D159D159-R161 PolarHBondContact O-N 3.15Å
162S46Very low55Low190 Ų190151.4 Ų151.4100%1.32983%0.834SS**  trans63.80161.3-64.40000118.5

Retrieved 162 of 162 residues in 933.3 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).