A0A060YEC4_ONCMY Loading...

CTLH domain-containing protein

AlphaFold DB (A0A4W5KPL1), UniProt , Accession A0A060YEC4, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 229 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
1M38.5Very low54.5Low247 Ų247152.2 Ų152.2100%1.21777%0.772SS**  0107.30-79.4174.8-166.400107.1S3M1-S3 PolarHBondContact O-N 3.18Å
2M36.4Very low57.2Low178 Ų178144.5 Ų144.588%0.87774%0.738SS**  trans-74.6122.1174.9-71.8177.517900107.8Y4M2-Y4 PolarHBondContact O-N 2.78Å; M2-Y4 VanDerWaalsContact O-N 3.1Å
3S46.5Very low59.4Low114 Ų114140.1 Ų140.180%0.79771%0.707SS**  trans-61.5106.4168.7174.10000107.7M1 A5M1-S3 PolarHBondContact O-N 3.18Å; S3-A5 VanDerWaalsContact C-N 3.31Å; S3-A5 PolarHBondContact O-N 3.27Å
4Y44.8Very low61.4Low219 Ų219139.5 Ų139.586%0.85970%0.7SS**  trans-6697.8165.4-74.1-93000106.5M2 E6M2-Y4 PolarHBondContact O-N 2.78Å; M2-Y4 VanDerWaalsContact O-N 3.1Å; Y4-E6 PolarHBondContact O-N 2.7Å; Y4-E6 VanDerWaalsContact O-N 3.09Å
5A53.7Low63.2Low87 Ų87136.3 Ų136.372%0.71968%0.682SS**  trans-62.1110159.200000105.6S3 K7S3-A5 VanDerWaalsContact C-N 3.31Å; S3-A5 PolarHBondContact O-N 3.27Å; A5-K7 PolarHBondContact O-N 3.16Å; A5-K7 VanDerWaalsContact O-N 3.08Å
6E50.9Low64.9Low184 Ų184133.2 Ų133.286%0.8666%0.66SS**PPolyproline II helixtrans-49.4119.1169.9-76.2174.2161.800107.3Y4Y4-E6 PolarHBondContact O-N 2.7Å; Y4-E6 VanDerWaalsContact O-N 3.09Å
7K53.1Low66.3Low189 Ų189128.9 Ų128.982%0.82264%0.639SS**PPolyproline II helixtrans-58.3131.9169.7-79.2179.6174.1-179.80106.2A5 E9A5-K7 PolarHBondContact O-N 3.16Å; A5-K7 VanDerWaalsContact O-N 3.08Å; K7-E9 PolarHBondContact O-N 3.07Å; K7-E9 VanDerWaalsContact O-N 3.12Å
8P57.9Low67.7Low109 Ų109128.7 Ų128.771%0.70864%0.636SS**PPolyproline II helixtrans-55.1125175.222.4-30.5000107.7E10P8-E10 PolarHBondContact O-N 3.28Å
9E61.3Low68.9Low188 Ų188128.9 Ų128.988%0.87963%0.633SS**  trans-56110.8176.9-74.2-179.815600108K7 I11K7-E9 PolarHBondContact O-N 3.07Å; K7-E9 VanDerWaalsContact O-N 3.12Å; E9-I11 PolarHBondContact O-N 3.04Å; E9-I11 VanDerWaalsContact O-N 3.09Å
10E73.3Confident69.8Low128 Ų128126.5 Ų126.560%0.59862%0.622SS**  trans-71.2102.5173.8-70-172.5163.800107.1P8 K213P8-E10 PolarHBondContact O-N 3.28Å; E10-K213 HydrophobicContact CG-CD 4.46Å; E10-K213 WeakPolarHBondContact OE1-CD 3.46Å; E10-K213 WeakPolarHBondContact OE1-CE 3.35Å; E10-K213 IonicContact OE1-NZ 2.68Å; E10-K213 PolarHBondContact OE1-NZ 3.22Å; E10-K213 IonicContact OE2-NZ 2.76Å
11I83.1Confident70.7Confident31 Ų31126 Ų12616%0.15962%0.622CS.*  trans-74.3126.5178-171.5161.4000110E9 E15 W16 K19E9-I11 PolarHBondContact O-N 3.04Å; E9-I11 VanDerWaalsContact O-N 3.09Å; I11-E15 HydrophobicContact CD1-CB 4.31Å; I11-E15 HydrophobicContact CG1-CB 3.83Å; I11-W16 HydrophobicContact CD1-CB 4.27Å; I11-W16 HydrophobicContact CD1-CE3 4.01Å; I11-W16 HydrophobicContact CG1-CB 4.31Å; I11-W16 HydrophobicContact CG2-CE3 3.97Å; I11-K19 HydrophobicContact CD1-CD 3.9Å
12T86.6Confident73.2Confident60 Ų60119.9 Ų119.937%0.36860%0.595SS.*  trans-73.3162.9174.660.20000111.2E14 E15 W16T12-E14 VanDerWaalsContact C-N 3.27Å; T12-E14 PolarHBondContact O-N 3.43Å; T12-E15 PolarHBondContact N-OE2 3.4Å; T12-E15 PolarHBondContact O-N 2.9Å; T12-E15 WeakPolarHBondContact OG1-CB 3.22Å; T12-E15 WeakPolarHBondContact OG1-CG 3.47Å; T12-E15 PolarHBondContact OG1-N 2.81Å; T12-E15 PolarHBondContact OG1-OE2 3.38Å; T12-W16 WeakPolarHBondContact O-CB 3.4Å; T12-W16 PolarHBondContact O-N 2.62Å
13R86Confident75.8Confident87 Ų87116 Ų11633%0.32858%0.58SS.*Hα-helixtrans-62.9-38.1175.6-179.4178176.1176.51.1111.5W16 M17 P215 I225 D227R13-W16 PolarHBondContact O-N 3.16Å; R13-M17 HydrophobicContact CG-CG 4.35Å; R13-M17 WeakPolarHBondContact O-CB 3.28Å; R13-M17 VanDerWaalsContact O-CG 3.26Å; R13-M17 WeakPolarHBondContact O-CG 3.46Å; R13-M17 PolarHBondContact O-N 3.02Å; R13-P215 HydrophobicContact CB-CG 4.24Å; R13-I225 PolarHBondContact NH1-O 2.98Å; R13-I225 PolarHBondContact NH2-O 2.76Å; R13-D227 VanDerWaalsContact CB-OD1 3.3Å; R13-D227 WeakPolarHBondContact CB-OD1 3.45Å; R13-D227 WeakPolarHBondContact CD-OD1 3.4Å; R13-D227 IonicContact NH1-OD2 3.69Å; R13-D227 PolarHBondContact NH1-OD2 2.96Å
14E87.5Confident77.7Confident132 Ų132118.4 Ų118.462%0.61758%0.579SS**Hα-helixtrans-62.3-51.1178.6-66.473.5-162.100111.2T12 W16 M17 E18T12-E14 VanDerWaalsContact C-N 3.27Å; T12-E14 PolarHBondContact O-N 3.43Å; E14-W16 VanDerWaalsContact C-N 3.3Å; E14-W16 PolarHBondContact O-N 3.41Å; E14-M17 PolarHBondContact O-N 3.17Å; E14-E18 PolarHBondContact O-N 3.04Å
15E88.9Confident79.8Confident92 Ų92112.8 Ų112.843%0.4356%0.562SS.*Hα-helixtrans-62.4-37.4177.6-71.2164.3155.600112I11 T12 K19I11-E15 HydrophobicContact CD1-CB 4.31Å; I11-E15 HydrophobicContact CG1-CB 3.83Å; T12-E15 PolarHBondContact N-OE2 3.4Å; T12-E15 PolarHBondContact O-N 2.9Å; T12-E15 WeakPolarHBondContact OG1-CB 3.22Å; T12-E15 WeakPolarHBondContact OG1-CG 3.47Å; T12-E15 PolarHBondContact OG1-N 2.81Å; T12-E15 PolarHBondContact OG1-OE2 3.38Å; E15-K19 WeakPolarHBondContact O-CG 3.31Å; E15-K19 PolarHBondContact O-N 3.12Å
16W89.3Confident81.6Confident86 Ų86114 Ų11433%0.32655%0.553SS.*Hα-helixtrans-63.8-47.3174.8-177.8-85.4000111.9I11 T12 R13 E14 E18 K19 L20 P215I11-W16 HydrophobicContact CD1-CB 4.27Å; I11-W16 HydrophobicContact CD1-CE3 4.01Å; I11-W16 HydrophobicContact CG1-CB 4.31Å; I11-W16 HydrophobicContact CG2-CE3 3.97Å; T12-W16 WeakPolarHBondContact O-CB 3.4Å; T12-W16 PolarHBondContact O-N 2.62Å; R13-W16 PolarHBondContact O-N 3.16Å; E14-W16 VanDerWaalsContact C-N 3.3Å; E14-W16 PolarHBondContact O-N 3.41Å; W16-E18 VanDerWaalsContact C-N 3.33Å; W16-E18 PolarHBondContact O-N 3.22Å; W16-K19 PolarHBondContact O-N 2.78Å; W16-L20 WeakPolarHBondContact O-CB 3.46Å; W16-L20 PolarHBondContact O-N 3.12Å; W16-P215 HydrophobicContact CB-CB 4.44Å; W16-P215 HydrophobicContact CB-CG 3.65Å; W16-P215 HydrophobicContact CD2-CB 4.49Å; W16-P215 HydrophobicContact CD2-CG 4.15Å; W16-P215 HydrophobicContact CG-CB 4.12Å; W16-P215 HydrophobicContact CG-CG 3.74Å
17M89.7Confident83.6Confident61 Ų61114.2 Ų114.230%0.355%0.546SS..Hα-helixtrans-66.3-35.6178.8-71.4-58.5-63.300111.7R13 E14 L20 N21 I225R13-M17 HydrophobicContact CG-CG 4.35Å; R13-M17 WeakPolarHBondContact O-CB 3.28Å; R13-M17 VanDerWaalsContact O-CG 3.26Å; R13-M17 WeakPolarHBondContact O-CG 3.46Å; R13-M17 PolarHBondContact O-N 3.02Å; E14-M17 PolarHBondContact O-N 3.17Å; M17-L20 PolarHBondContact O-N 3.12Å; M17-N21 VanDerWaalsContact O-CB 3.29Å; M17-N21 WeakPolarHBondContact O-CB 3.46Å; M17-N21 PolarHBondContact O-N 3.43Å; M17-N21 PolarHBondContact O-ND2 3.27Å; M17-N21 VanDerWaalsContact O-ND2 3.16Å; M17-I225 HydrophobicContact SD-CD1 3.95Å
18E91.4Very high85.4Confident124 Ų124106.9 Ų106.958%0.57952%0.521SS*.Hα-helixtrans-61.8-49172.6-174.2180179.400111.1E14 W16 L20 N21 N22E14-E18 PolarHBondContact O-N 3.04Å; W16-E18 VanDerWaalsContact C-N 3.33Å; W16-E18 PolarHBondContact O-N 3.22Å; E18-L20 VanDerWaalsContact C-N 3.3Å; E18-L20 PolarHBondContact O-N 2.89Å; E18-N21 PolarHBondContact O-N 3.42Å; E18-N22 WeakPolarHBondContact O-CB 3.42Å; E18-N22 VanDerWaalsContact O-CG 3.22Å; E18-N22 PolarHBondContact O-N 3.5Å; E18-N22 PolarHBondContact O-ND2 2.94Å; E18-N22 VanDerWaalsContact O-ND2 3.15Å
19K90.1Very high87Confident133 Ų133104.8 Ų104.858%0.57850%0.504SS*.Hα-helixtrans-58.1-43.5175.2-73.4-179.9-173.5179.50111.6I11 E15 W16 N22 V23I11-K19 HydrophobicContact CD1-CD 3.9Å; E15-K19 WeakPolarHBondContact O-CG 3.31Å; E15-K19 PolarHBondContact O-N 3.12Å; W16-K19 PolarHBondContact O-N 2.78Å; K19-N22 PolarHBondContact O-N 2.9Å; K19-V23 WeakPolarHBondContact O-CG2 3.21Å; K19-V23 PolarHBondContact O-N 3.28Å
20L87.9Confident88.5Confident80 Ų80100 Ų10042%0.41948%0.482SS..Hα-helixtrans-66.2-42.9-180-171.9136.4000112.2W16 M17 E18 N22 V23W16-L20 WeakPolarHBondContact O-CB 3.46Å; W16-L20 PolarHBondContact O-N 3.12Å; M17-L20 PolarHBondContact O-N 3.12Å; E18-L20 VanDerWaalsContact C-N 3.3Å; E18-L20 PolarHBondContact O-N 2.89Å; L20-N22 PolarHBondContact O-N 3.25Å; L20-V23 WeakPolarHBondContact O-CB 3.31Å; L20-V23 PolarHBondContact O-N 2.86Å; L20-V23 VanDerWaalsContact O-N 3.11Å
21N87.7Confident89.5Confident117 Ų11794.9 Ų94.963%0.62646%0.459SS*.Hα-helixtrans-66.6-27.6177.1-71.5-24.4000112.6M17 E18 V23M17-N21 VanDerWaalsContact O-CB 3.29Å; M17-N21 WeakPolarHBondContact O-CB 3.46Å; M17-N21 PolarHBondContact O-N 3.43Å; M17-N21 PolarHBondContact O-ND2 3.27Å; M17-N21 VanDerWaalsContact O-ND2 3.16Å; E18-N21 PolarHBondContact O-N 3.42Å; N21-V23 VanDerWaalsContact C-N 3.26Å; N21-V23 PolarHBondContact O-N 3.42Å
22N91.1Very high90Very high119 Ų119100 Ų10064%0.63648%0.477SS*.THydrogen-bonded Turntrans-76.9-10.6175.1-71.7-28.1000113.2E18 K19 L20 H24E18-N22 WeakPolarHBondContact O-CB 3.42Å; E18-N22 VanDerWaalsContact O-CG 3.22Å; E18-N22 PolarHBondContact O-N 3.5Å; E18-N22 PolarHBondContact O-ND2 2.94Å; E18-N22 VanDerWaalsContact O-ND2 3.15Å; K19-N22 PolarHBondContact O-N 2.9Å; L20-N22 PolarHBondContact O-N 3.25Å; N22-H24 PolarHBondContact O-N 3.29Å
23V90.3Very high90.4Very high95 Ų9599.4 Ų99.458%0.57647%0.471SS*.  trans-75.4105.5172.8-178.90000109.3K19 L20 N21 I25K19-V23 WeakPolarHBondContact O-CG2 3.21Å; K19-V23 PolarHBondContact O-N 3.28Å; L20-V23 WeakPolarHBondContact O-CB 3.31Å; L20-V23 PolarHBondContact O-N 2.86Å; L20-V23 VanDerWaalsContact O-N 3.11Å; N21-V23 VanDerWaalsContact C-N 3.26Å; N21-V23 PolarHBondContact O-N 3.42Å; V23-I25 HydrophobicContact CG1-CG1 4.14Å; V23-I25 PolarHBondContact O-N 2.97Å
24H87.8Confident90.8Very high165 Ų16598.7 Ų98.776%0.76447%0.473SS*.  trans-82.2114.4175.4-170.469.3000111.2N22N22-H24 PolarHBondContact O-N 3.29Å
25I88.6Confident91.2Very high101 Ų10192.7 Ų92.752%0.51845%0.445SS..  trans-104.8124.3172.8-54.7176.6000108.4V23 M30V23-I25 HydrophobicContact CG1-CG1 4.14Å; V23-I25 PolarHBondContact O-N 2.97Å; I25-M30 HydrophobicContact CG2-CG 3.74Å; I25-M30 HydrophobicContact CG2-SD 4.47Å
26Q92Very high91.4Very high112 Ų11288.9 Ų88.952%0.52343%0.428SS..  trans-69139.9178.1-59.3-170.53.700110.4A28 D29 M30Q26-A28 PolarHBondContact O-N 3.44Å; Q26-D29 PolarHBondContact O-N 3.15Å; Q26-M30 PolarHBondContact O-N 3.43Å
27R91.3Very high91.6Very high189 Ų18988.8 Ų88.871%0.71343%0.428SS*.Hα-helixtrans-55.9-34.8175.2-172.1178.8-179.8-160.7-0.7112.4D29 M30 N31R27-D29 VanDerWaalsContact C-N 3.3Å; R27-D29 PolarHBondContact O-N 3.42Å; R27-M30 HydrophobicContact CB-CE 4.27Å; R27-M30 HydrophobicContact CG-CE 4.45Å; R27-M30 PolarHBondContact O-N 2.98Å; R27-N31 WeakPolarHBondContact O-CB 3.48Å; R27-N31 PolarHBondContact O-N 2.82Å; R27-N31 PolarHBondContact O-OD1 3.5Å
28A91.6Very high91.8Very high36 Ų3687 Ų8730%0.29842%0.419SS..Hα-helixtrans-60.4-38.8176.100000112.4Q26 N31 R32Q26-A28 PolarHBondContact O-N 3.44Å; A28-N31 PolarHBondContact O-N 3.09Å; A28-R32 VanDerWaalsContact O-CG 3.3Å; A28-R32 WeakPolarHBondContact O-CG 3.44Å; A28-R32 PolarHBondContact O-N 3.18Å
29D91.6Very high91.9Very high64 Ų6481.3 Ų81.334%0.34239%0.393SS..Hα-helixtrans-73.3-38.6179.9-62-36.1000111.8Q26 R27 N31 R32 L33Q26-D29 PolarHBondContact O-N 3.15Å; R27-D29 VanDerWaalsContact C-N 3.3Å; R27-D29 PolarHBondContact O-N 3.42Å; D29-N31 VanDerWaalsContact C-N 3.34Å; D29-N31 PolarHBondContact O-N 3.33Å; D29-R32 PolarHBondContact O-N 3.12Å; D29-R32 IonicContact OD1-NH1 3.86Å; D29-R32 PolarHBondContact OD1-NH1 2.87Å; D29-L33 PolarHBondContact O-N 3.04Å
30M92.6Very high91.9Very high87 Ų8775.3 Ų75.343%0.42937%0.367SS..Hα-helixtrans-59.7-45.7170.2-66.8-170.7-7200111.2I25 Q26 R27 R32 L33 I34I25-M30 HydrophobicContact CG2-CG 3.74Å; I25-M30 HydrophobicContact CG2-SD 4.47Å; Q26-M30 PolarHBondContact O-N 3.43Å; R27-M30 HydrophobicContact CB-CE 4.27Å; R27-M30 HydrophobicContact CG-CE 4.45Å; R27-M30 PolarHBondContact O-N 2.98Å; M30-R32 VanDerWaalsContact C-N 3.31Å; M30-R32 PolarHBondContact O-N 3.5Å; M30-L33 WeakPolarHBondContact O-CB 3.48Å; M30-L33 PolarHBondContact O-N 2.9Å; M30-L33 VanDerWaalsContact O-N 3.15Å; M30-I34 WeakPolarHBondContact O-CG1 3.37Å; M30-I34 PolarHBondContact O-N 3.06Å
31N94.9Very high91.9Very high22 Ų2273 Ų7312%0.11836%0.355CS..Hα-helixtrans-63.8-37178.4-67.7-10.7000111.9R27 A28 D29 L33 I34 M35 F50 I56R27-N31 WeakPolarHBondContact O-CB 3.48Å; R27-N31 PolarHBondContact O-N 2.82Å; R27-N31 PolarHBondContact O-OD1 3.5Å; A28-N31 PolarHBondContact O-N 3.09Å; D29-N31 VanDerWaalsContact C-N 3.34Å; D29-N31 PolarHBondContact O-N 3.33Å; N31-L33 VanDerWaalsContact C-N 3.34Å; N31-L33 PolarHBondContact O-N 3.45Å; N31-I34 PolarHBondContact O-N 3.43Å; N31-M35 WeakPolarHBondContact O-CB 3.48Å; N31-M35 PolarHBondContact O-N 2.84Å; N31-F50 HydrophobicContact CB-CE1 4.03Å; N31-F50 HydrophobicContact CB-CZ 3.8Å; N31-F50 VanDerWaalsContact O-CE1 3.3Å; N31-F50 WeakPolarHBondContact O-CE1 3.4Å; N31-I56 HydrophobicContact CB-CD1 4.37Å; N31-I56 HydrophobicContact CB-CG1 3.61Å
32R94.1Very high92Very high138 Ų13867.6 Ų67.652%0.52133%0.327SS..Hα-helixtrans-62.9-38.7173.2-74.7171.5-179134.20.1112.6A28 D29 M30 N36 I56A28-R32 VanDerWaalsContact O-CG 3.3Å; A28-R32 WeakPolarHBondContact O-CG 3.44Å; A28-R32 PolarHBondContact O-N 3.18Å; D29-R32 PolarHBondContact O-N 3.12Å; D29-R32 IonicContact OD1-NH1 3.86Å; D29-R32 PolarHBondContact OD1-NH1 2.87Å; M30-R32 VanDerWaalsContact C-N 3.31Å; M30-R32 PolarHBondContact O-N 3.5Å; R32-N36 VanDerWaalsContact O-CB 3.31Å; R32-N36 WeakPolarHBondContact O-CB 3.35Å; R32-N36 PolarHBondContact O-N 3.5Å; R32-I56 HydrophobicContact CG-CD1 4.2Å; R32-I56 HydrophobicContact CG-CG2 4.13Å
33L94Very high91.9Very high48 Ų4865 Ų6525%0.25131%0.31SS..Hα-helixtrans-65.3-43.1175.1-73.5172.6000111.7D29 M30 N31 N36 Y37 K192 L196D29-L33 PolarHBondContact O-N 3.04Å; M30-L33 WeakPolarHBondContact O-CB 3.48Å; M30-L33 PolarHBondContact O-N 2.9Å; M30-L33 VanDerWaalsContact O-N 3.15Å; N31-L33 VanDerWaalsContact C-N 3.34Å; N31-L33 PolarHBondContact O-N 3.45Å; L33-N36 PolarHBondContact O-N 3.39Å; L33-Y37 PolarHBondContact O-N 3.25Å; L33-K192 HydrophobicContact CD2-CB 3.6Å; L33-K192 HydrophobicContact CD2-CD 4.44Å; L33-L196 HydrophobicContact CD1-CD1 3.98Å; L33-L196 HydrophobicContact CD2-CD1 4.1Å
34I94.6Very high92Very high72 Ų7261.9 Ų61.937%0.36929%0.288SS..Hα-helixtrans-63.1-48.1176.1-63.8168.3000110M30 N31 N36 Y37 L38 F50M30-I34 WeakPolarHBondContact O-CG1 3.37Å; M30-I34 PolarHBondContact O-N 3.06Å; N31-I34 PolarHBondContact O-N 3.43Å; I34-N36 VanDerWaalsContact C-N 3.34Å; I34-N36 PolarHBondContact O-N 2.88Å; I34-Y37 WeakPolarHBondContact O-CB 3.48Å; I34-Y37 PolarHBondContact O-N 3.26Å; I34-Y37 VanDerWaalsContact O-N 3.14Å; I34-L38 HydrophobicContact CG2-CD1 4.01Å; I34-L38 HydrophobicContact CG2-CG 4.3Å; I34-L38 WeakPolarHBondContact O-CG 3.33Å; I34-L38 PolarHBondContact O-N 3.28Å; I34-F50 HydrophobicContact CB-CE1 4.1Å; I34-F50 HydrophobicContact CB-CE2 4.29Å; I34-F50 HydrophobicContact CB-CZ 3.79Å; I34-F50 HydrophobicContact CD1-CE2 4.26Å; I34-F50 HydrophobicContact CD1-CZ 4.11Å; I34-F50 HydrophobicContact CG2-CD1 4.37Å; I34-F50 HydrophobicContact CG2-CD2 4.13Å; I34-F50 HydrophobicContact CG2-CE1 4.03Å; I34-F50 HydrophobicContact CG2-CE2 3.76Å; I34-F50 HydrophobicContact CG2-CG 4.42Å; I34-F50 HydrophobicContact CG2-CZ 3.71Å
35M95.4Very high92.2Very high5 Ų560.7 Ų60.73%0.02528%0.283CS..Hα-helixtrans-58.6-45.4177.7-17858.785.500111.8N31 Y37 L38 V39 A47 F50 R51 I56 P58N31-M35 WeakPolarHBondContact O-CB 3.48Å; N31-M35 PolarHBondContact O-N 2.84Å; M35-Y37 VanDerWaalsContact C-N 3.32Å; M35-Y37 PolarHBondContact O-N 2.92Å; M35-L38 PolarHBondContact O-N 3.47Å; M35-V39 HydrophobicContact CG-CG2 4.44Å; M35-V39 WeakPolarHBondContact O-CB 3.47Å; M35-V39 WeakPolarHBondContact O-CG2 3.37Å; M35-V39 PolarHBondContact O-N 3.42Å; M35-V39 HydrophobicContact SD-CG2 4.03Å; M35-A47 HydrophobicContact SD-CB 4.05Å; M35-F50 HydrophobicContact CB-CD1 4.26Å; M35-F50 HydrophobicContact CB-CE1 4.21Å; M35-F50 HydrophobicContact CE-CD1 3.81Å; M35-F50 HydrophobicContact SD-CD1 4.47Å; M35-R51 HydrophobicContact CE-CB 3.76Å; M35-I56 HydrophobicContact CB-CG2 3.88Å; M35-I56 WeakPolarHBondContact CE-O 3.44Å; M35-I56 HydrophobicContact CG-CG2 4.03Å; M35-P58 HydrophobicContact CG-CB 4.38Å; M35-P58 HydrophobicContact SD-CB 4.11Å
36N94.3Very high92.5Very high13 Ų1357.9 Ų57.97%0.0728%0.275CS..Hα-helixtrans-57.9-44.9175.4172.8-105.4000111.6R32 L33 I34 V39 T40 E188 K192R32-N36 VanDerWaalsContact O-CB 3.31Å; R32-N36 WeakPolarHBondContact O-CB 3.35Å; R32-N36 PolarHBondContact O-N 3.5Å; L33-N36 PolarHBondContact O-N 3.39Å; I34-N36 VanDerWaalsContact C-N 3.34Å; I34-N36 PolarHBondContact O-N 2.88Å; N36-V39 PolarHBondContact O-N 3.08Å; N36-T40 VanDerWaalsContact O-CB 3.31Å; N36-T40 WeakPolarHBondContact O-CB 3.32Å; N36-T40 PolarHBondContact O-N 3.05Å; N36-T40 PolarHBondContact O-OG1 3.31Å; N36-E188 PolarHBondContact ND2-OE2 3.02Å; N36-K192 WeakPolarHBondContact OD1-CB 3.4Å; N36-K192 WeakPolarHBondContact OD1-CG 3.48Å; N36-K192 PolarHBondContact OD1-N 3.21Å
37Y93.7Very high92.6Very high84 Ų8452.6 Ų52.633%0.32925%0.25SS..Hα-helixtrans-60.8-48.6176.5177.7-96.3000112.3L33 I34 M35 V39 T40 E41 F43 P191L33-Y37 PolarHBondContact O-N 3.25Å; I34-Y37 WeakPolarHBondContact O-CB 3.48Å; I34-Y37 PolarHBondContact O-N 3.26Å; I34-Y37 VanDerWaalsContact O-N 3.14Å; M35-Y37 VanDerWaalsContact C-N 3.32Å; M35-Y37 PolarHBondContact O-N 2.92Å; Y37-V39 VanDerWaalsContact C-N 3.31Å; Y37-V39 PolarHBondContact O-N 3.32Å; Y37-T40 PolarHBondContact O-N 3.42Å; Y37-E41 HydrophobicContact CD1-CG 4.48Å; Y37-E41 HydrophobicContact CD2-CG 3.95Å; Y37-E41 HydrophobicContact CE1-CG 4.15Å; Y37-E41 HydrophobicContact CE2-CG 3.56Å; Y37-E41 HydrophobicContact CG-CG 4.38Å; Y37-E41 WeakPolarHBondContact O-CB 3.48Å; Y37-E41 WeakPolarHBondContact O-CG 3.5Å; Y37-E41 PolarHBondContact O-N 3.03Å; Y37-F43 HydrophobicContact CE1-CD2 4.19Å; Y37-F43 AromaticContact CE1-CE2 3.8Å; Y37-F43 HydrophobicContact CE1-CE2 3.8Å; Y37-P191 HydrophobicContact CD2-CB 3.72Å; Y37-P191 HydrophobicContact CD2-CG 3.84Å; Y37-P191 HydrophobicContact CE2-CG 4.3Å
38L93.4Very high92.7Very high22 Ų2246.6 Ų46.612%0.11523%0.23CC..Hα-helixtrans-60.5-41.6-179.4-65.3175.5000112I34 M35 G42 F43 A46 A47 F50I34-L38 HydrophobicContact CG2-CD1 4.01Å; I34-L38 HydrophobicContact CG2-CG 4.3Å; I34-L38 WeakPolarHBondContact O-CG 3.33Å; I34-L38 PolarHBondContact O-N 3.28Å; M35-L38 PolarHBondContact O-N 3.47Å; L38-G42 PolarHBondContact O-N 3.31Å; L38-F43 HydrophobicContact CB-CB 4.35Å; L38-F43 HydrophobicContact CD2-CB 3.94Å; L38-F43 HydrophobicContact CD2-CD2 3.98Å; L38-F43 HydrophobicContact CD2-CG 4.34Å; L38-F43 PolarHBondContact O-N 3.47Å; L38-A46 HydrophobicContact CD1-CB 4.22Å; L38-A46 HydrophobicContact CD2-CB 3.84Å; L38-A47 HydrophobicContact CB-CB 3.99Å; L38-F50 HydrophobicContact CD1-CB 3.84Å; L38-F50 HydrophobicContact CD1-CD1 4.4Å; L38-F50 HydrophobicContact CD1-CG 4.05Å
39V92.3Very high92.9Very high5 Ų551 Ų513%0.0324%0.243CC..Hα-helixtrans-69-48.1178.1168.60000111.7M35 N36 Y37 E41 G42 A47 P58 V60 L62 R68M35-V39 HydrophobicContact CG-CG2 4.44Å; M35-V39 WeakPolarHBondContact O-CB 3.47Å; M35-V39 WeakPolarHBondContact O-CG2 3.37Å; M35-V39 PolarHBondContact O-N 3.42Å; M35-V39 HydrophobicContact SD-CG2 4.03Å; N36-V39 PolarHBondContact O-N 3.08Å; Y37-V39 VanDerWaalsContact C-N 3.31Å; Y37-V39 PolarHBondContact O-N 3.32Å; V39-E41 VanDerWaalsContact C-N 3.34Å; V39-E41 PolarHBondContact O-N 2.89Å; V39-G42 PolarHBondContact O-N 3.36Å; V39-G42 VanDerWaalsContact O-N 3.14Å; V39-A47 HydrophobicContact CG2-CB 4.4Å; V39-P58 HydrophobicContact CG2-CB 3.85Å; V39-V60 HydrophobicContact CG1-CG2 3.38Å; V39-L62 HydrophobicContact CG2-CD2 3.95Å; V39-R68 PolarHBondContact O-NH2 3.2Å
40T90.3Very high93.1Very high7 Ų749.5 Ų49.54%0.04323%0.233CC..Hα-helixtrans-64.5-38.4-177.8-64.20000111.6N36 Y37 G42 N178 L182 E188 P191N36-T40 VanDerWaalsContact O-CB 3.31Å; N36-T40 WeakPolarHBondContact O-CB 3.32Å; N36-T40 PolarHBondContact O-N 3.05Å; N36-T40 PolarHBondContact O-OG1 3.31Å; Y37-T40 PolarHBondContact O-N 3.42Å; T40-G42 VanDerWaalsContact C-N 3.27Å; T40-G42 PolarHBondContact O-N 3.45Å; T40-N178 PolarHBondContact O-ND2 2.89Å; T40-L182 HydrophobicContact CG2-CD1 3.88Å; T40-E188 WeakPolarHBondContact CG2-O 3.43Å; T40-P191 HydrophobicContact CG2-CB 4.42Å; T40-P191 HydrophobicContact CG2-CG 3.64Å
41E88.8Confident93.2Very high32 Ų3249.2 Ų49.215%0.1523%0.227CC..THydrogen-bonded Turntrans-80.9-3.4176.7-64.7-62.4134.600114Y37 V39 F43 R72 P191Y37-E41 HydrophobicContact CD1-CG 4.48Å; Y37-E41 HydrophobicContact CD2-CG 3.95Å; Y37-E41 HydrophobicContact CE1-CG 4.15Å; Y37-E41 HydrophobicContact CE2-CG 3.56Å; Y37-E41 HydrophobicContact CG-CG 4.38Å; Y37-E41 WeakPolarHBondContact O-CB 3.48Å; Y37-E41 WeakPolarHBondContact O-CG 3.5Å; Y37-E41 PolarHBondContact O-N 3.03Å; V39-E41 VanDerWaalsContact C-N 3.34Å; V39-E41 PolarHBondContact O-N 2.89Å; E41-F43 HydrophobicContact CB-CD2 3.48Å; E41-F43 VanDerWaalsContact CB-CD2 3.48Å; E41-F43 HydrophobicContact CB-CE2 3.38Å; E41-F43 HydrophobicContact CB-CG 4.36Å; E41-F43 HydrophobicContact CB-CZ 4.23Å; E41-F43 HydrophobicContact CG-CD2 4.39Å; E41-F43 HydrophobicContact CG-CE2 4Å; E41-R72 PolarHBondContact O-NH1 3.47Å; E41-P191 HydrophobicContact CG-CG 4.21Å; E41-P191 VanDerWaalsContact OE1-CG 3.24Å; E41-P191 WeakPolarHBondContact OE1-CG 3.23Å
42G88.6Confident93.2Very high4 Ų455.2 Ų55.24%0.04126%0.257CS..THydrogen-bonded Turntrans74.525.3178.500000114.6L38 V39 T40 K44 I69L38-G42 PolarHBondContact O-N 3.31Å; V39-G42 PolarHBondContact O-N 3.36Å; V39-G42 VanDerWaalsContact O-N 3.14Å; T40-G42 VanDerWaalsContact C-N 3.27Å; T40-G42 PolarHBondContact O-N 3.45Å; G42-K44 VanDerWaalsContact C-N 3.3Å; G42-K44 PolarHBondContact O-N 3.12Å; G42-I69 WeakPolarHBondContact O-CG1 3.32Å
43F90.4Very high93.2Very high65 Ų6556.6 Ų56.629%0.28527%0.269SS..  trans-81.766.5176.2-63.2-58000112Y37 L38 E41 E45 A46 A47 R72Y37-F43 HydrophobicContact CE1-CD2 4.19Å; Y37-F43 AromaticContact CE1-CE2 3.8Å; Y37-F43 HydrophobicContact CE1-CE2 3.8Å; L38-F43 HydrophobicContact CB-CB 4.35Å; L38-F43 HydrophobicContact CD2-CB 3.94Å; L38-F43 HydrophobicContact CD2-CD2 3.98Å; L38-F43 HydrophobicContact CD2-CG 4.34Å; L38-F43 PolarHBondContact O-N 3.47Å; E41-F43 HydrophobicContact CB-CD2 3.48Å; E41-F43 VanDerWaalsContact CB-CD2 3.48Å; E41-F43 HydrophobicContact CB-CE2 3.38Å; E41-F43 HydrophobicContact CB-CG 4.36Å; E41-F43 HydrophobicContact CB-CZ 4.23Å; E41-F43 HydrophobicContact CG-CD2 4.39Å; E41-F43 HydrophobicContact CG-CE2 4Å; F43-E45 PolarHBondContact O-N 3.01Å; F43-A46 HydrophobicContact CB-CB 4.1Å; F43-A46 PolarHBondContact O-N 3.4Å; F43-A47 WeakPolarHBondContact O-CB 3.27Å; F43-A47 PolarHBondContact O-N 3.05Å; F43-R72 VanDerWaalsContact CD1-NH1 3.33Å; F43-R72 VanDerWaalsContact CE1-CZ 3.48Å
44K92.3Very high93.2Very high28 Ų2855.7 Ų55.712%0.12227%0.267CS..Hα-helixtrans-53.6-54.9-174.1179.4178.8-170.9-179.40113.8G42 A46 A47 E48 L62 D63 L65 D66 I69G42-K44 VanDerWaalsContact C-N 3.3Å; G42-K44 PolarHBondContact O-N 3.12Å; K44-A46 VanDerWaalsContact C-N 3.26Å; K44-A46 PolarHBondContact O-N 3.3Å; K44-A47 WeakPolarHBondContact O-CB 3.46Å; K44-A47 PolarHBondContact O-N 2.82Å; K44-E48 VanDerWaalsContact CE-OE1 3.22Å; K44-E48 WeakPolarHBondContact CE-OE1 3.42Å; K44-E48 HydrophobicContact CG-CG 4.43Å; K44-E48 WeakPolarHBondContact O-CG 3.49Å; K44-E48 PolarHBondContact O-N 3.37Å; K44-L62 WeakPolarHBondContact CE-O 3.09Å; K44-L62 HydrophobicContact CG-CB 4.4Å; K44-D63 WeakPolarHBondContact CE-OD1 3.36Å; K44-D63 IonicContact NZ-OD1 3.44Å; K44-D63 PolarHBondContact NZ-OD1 3.46Å; K44-L65 HydrophobicContact CB-CB 4.42Å; K44-L65 HydrophobicContact CB-CD1 4.06Å; K44-D66 VanDerWaalsContact CD-OD1 3.28Å; K44-D66 WeakPolarHBondContact CD-OD1 3.42Å; K44-D66 VanDerWaalsContact NZ-CG 3.34Å; K44-D66 IonicContact NZ-OD1 3.27Å; K44-D66 PolarHBondContact NZ-OD1 2.82Å; K44-D66 IonicContact NZ-OD2 2.78Å; K44-D66 PolarHBondContact NZ-OD2 2.91Å; K44-I69 HydrophobicContact CB-CD1 3.44Å; K44-I69 VanDerWaalsContact CB-CD1 3.44Å; K44-I69 HydrophobicContact CD-CD1 4.04Å; K44-I69 HydrophobicContact CG-CD1 4.36Å
45E91.8Very high93.1Very high141 Ų14155 Ų5566%0.65928%0.278SS*.Hα-helixtrans-58.9-38.9-177.7-63.5-175.6-17500112.6F43 K49F43-E45 PolarHBondContact O-N 3.01Å; E45-K49 WeakPolarHBondContact O-CG 3.39Å; E45-K49 PolarHBondContact O-N 3.35Å; E45-K49 VanDerWaalsContact O-N 3.12Å
46A94.4Very high93Very high42 Ų4256 Ų5635%0.34728%0.283SS..Hα-helixtrans-69.2-41.7176.900000110.7L38 F43 K44 E48 K49 F50L38-A46 HydrophobicContact CD1-CB 4.22Å; L38-A46 HydrophobicContact CD2-CB 3.84Å; F43-A46 HydrophobicContact CB-CB 4.1Å; F43-A46 PolarHBondContact O-N 3.4Å; K44-A46 VanDerWaalsContact C-N 3.26Å; K44-A46 PolarHBondContact O-N 3.3Å; A46-E48 PolarHBondContact O-N 3.13Å; A46-K49 PolarHBondContact O-N 3.17Å; A46-F50 WeakPolarHBondContact O-CB 3.43Å; A46-F50 PolarHBondContact O-N 3.35Å
47A94.2Very high93Very high0 Ų061.7 Ų61.70%031%0.309CS..Hα-helixtrans-62.1-40.9175.900000111.9M35 L38 V39 F43 K44 F50 R51 L62M35-A47 HydrophobicContact SD-CB 4.05Å; L38-A47 HydrophobicContact CB-CB 3.99Å; V39-A47 HydrophobicContact CG2-CB 4.4Å; F43-A47 WeakPolarHBondContact O-CB 3.27Å; F43-A47 PolarHBondContact O-N 3.05Å; K44-A47 WeakPolarHBondContact O-CB 3.46Å; K44-A47 PolarHBondContact O-N 2.82Å; A47-F50 PolarHBondContact O-N 2.96Å; A47-R51 WeakPolarHBondContact O-CB 3.41Å; A47-R51 PolarHBondContact O-N 3.47Å; A47-L62 HydrophobicContact CB-CD1 4.37Å; A47-L62 HydrophobicContact CB-CD2 3.92Å
48E94.1Very high92.8Very high63 Ų6358.8 Ų58.829%0.29430%0.301SS..Hα-helixtrans-63.8-49.5177.3-72.8177.9171.700112.3K44 A46 F50 R51 M52 L62K44-E48 VanDerWaalsContact CE-OE1 3.22Å; K44-E48 WeakPolarHBondContact CE-OE1 3.42Å; K44-E48 HydrophobicContact CG-CG 4.43Å; K44-E48 WeakPolarHBondContact O-CG 3.49Å; K44-E48 PolarHBondContact O-N 3.37Å; A46-E48 PolarHBondContact O-N 3.13Å; E48-F50 VanDerWaalsContact C-N 3.33Å; E48-R51 WeakPolarHBondContact O-CB 3.44Å; E48-R51 PolarHBondContact O-N 3.24Å; E48-M52 WeakPolarHBondContact O-CG 3.41Å; E48-M52 PolarHBondContact O-N 3.43Å; E48-M52 VanDerWaalsContact O-N 3.15Å; E48-L62 HydrophobicContact CB-CD1 4.45Å; E48-L62 HydrophobicContact CG-CD1 3.54Å
49K95.9Very high92.3Very high129 Ų12962.4 Ų62.456%0.56133%0.328SS*.Hα-helixtrans-62.1-44176.2-71.3174-177.2167.60110.7E45 A46 R51 M52 E53E45-K49 WeakPolarHBondContact O-CG 3.39Å; E45-K49 PolarHBondContact O-N 3.35Å; E45-K49 VanDerWaalsContact O-N 3.12Å; A46-K49 PolarHBondContact O-N 3.17Å; K49-R51 VanDerWaalsContact C-N 3.33Å; K49-R51 PolarHBondContact O-N 3.24Å; K49-M52 PolarHBondContact O-N 3Å; K49-E53 PolarHBondContact O-N 3.47Å; K49-E53 VanDerWaalsContact O-N 3.09Å
50F96Very high92Very high33 Ų3364 Ų6415%0.14534%0.338CS..Hα-helixtrans-63.8-37.2178.7-170-99.8000112.3N31 I34 M35 L38 A46 A47 E48 E53 S54N31-F50 HydrophobicContact CB-CE1 4.03Å; N31-F50 HydrophobicContact CB-CZ 3.8Å; N31-F50 VanDerWaalsContact O-CE1 3.3Å; N31-F50 WeakPolarHBondContact O-CE1 3.4Å; I34-F50 HydrophobicContact CB-CE1 4.1Å; I34-F50 HydrophobicContact CB-CE2 4.29Å; I34-F50 HydrophobicContact CB-CZ 3.79Å; I34-F50 HydrophobicContact CD1-CE2 4.26Å; I34-F50 HydrophobicContact CD1-CZ 4.11Å; I34-F50 HydrophobicContact CG2-CD1 4.37Å; I34-F50 HydrophobicContact CG2-CD2 4.13Å; I34-F50 HydrophobicContact CG2-CE1 4.03Å; I34-F50 HydrophobicContact CG2-CE2 3.76Å; I34-F50 HydrophobicContact CG2-CG 4.42Å; I34-F50 HydrophobicContact CG2-CZ 3.71Å; M35-F50 HydrophobicContact CB-CD1 4.26Å; M35-F50 HydrophobicContact CB-CE1 4.21Å; M35-F50 HydrophobicContact CE-CD1 3.81Å; M35-F50 HydrophobicContact SD-CD1 4.47Å; L38-F50 HydrophobicContact CD1-CB 3.84Å; L38-F50 HydrophobicContact CD1-CD1 4.4Å; L38-F50 HydrophobicContact CD1-CG 4.05Å; A46-F50 WeakPolarHBondContact O-CB 3.43Å; A46-F50 PolarHBondContact O-N 3.35Å; A47-F50 PolarHBondContact O-N 2.96Å; E48-F50 VanDerWaalsContact C-N 3.33Å; F50-E53 PolarHBondContact O-N 2.72Å; F50-S54 WeakPolarHBondContact CE1-OG 3.29Å; F50-S54 WeakPolarHBondContact O-CB 3.34Å; F50-S54 PolarHBondContact O-N 3.46Å; F50-S54 PolarHBondContact O-OG 3.2Å
51R94.9Very high91.8Very high80 Ų8068.7 Ų68.730%0.30236%0.362SS..Hα-helixtrans-59.2-48172.2177.2-174.563.6-177.3-3.7111M35 A47 E48 K49 E53 G55 I56 E57M35-R51 HydrophobicContact CE-CB 3.76Å; A47-R51 WeakPolarHBondContact O-CB 3.41Å; A47-R51 PolarHBondContact O-N 3.47Å; E48-R51 WeakPolarHBondContact O-CB 3.44Å; E48-R51 PolarHBondContact O-N 3.24Å; K49-R51 VanDerWaalsContact C-N 3.33Å; K49-R51 PolarHBondContact O-N 3.24Å; R51-E53 VanDerWaalsContact C-N 3.33Å; R51-E53 PolarHBondContact O-N 3.47Å; R51-G55 WeakPolarHBondContact O-CA 3.24Å; R51-G55 PolarHBondContact O-N 3.06Å; R51-I56 WeakPolarHBondContact CG-O 3.45Å; R51-E57 WeakPolarHBondContact CD-OE2 3.49Å
52M94.6Very high91.7Very high148 Ų14867.5 Ų67.573%0.72936%0.357SS*.Hα-helixtrans-61.5-39.8-179.5-66.6-178.4-17100112.4E48 K49E48-M52 WeakPolarHBondContact O-CG 3.41Å; E48-M52 PolarHBondContact O-N 3.43Å; E48-M52 VanDerWaalsContact O-N 3.15Å; K49-M52 PolarHBondContact O-N 3Å
53E94.7Very high91.6Very high167 Ų16771.8 Ų71.878%0.7838%0.379SS*.Hα-helixtrans-80.5-39.2-178.4-69.4-178-178.100113.6K49 F50 R51K49-E53 PolarHBondContact O-N 3.47Å; K49-E53 VanDerWaalsContact O-N 3.09Å; F50-E53 PolarHBondContact O-N 2.72Å; R51-E53 VanDerWaalsContact C-N 3.33Å; R51-E53 PolarHBondContact O-N 3.47Å
54S93.6Very high91.3Very high30 Ų3070.2 Ų70.221%0.2138%0.376CS..Hα-helixtrans-94.9-18.7-172.871.90000114.2F50 I56F50-S54 WeakPolarHBondContact CE1-OG 3.29Å; F50-S54 WeakPolarHBondContact O-CB 3.34Å; F50-S54 PolarHBondContact O-N 3.46Å; F50-S54 PolarHBondContact O-OG 3.2Å; S54-I56 PolarHBondContact O-N 3.37Å; S54-I56 PolarHBondContact OG-N 2.73Å
55G92.8Very high91.1Very high58 Ų5868.9 Ų68.960%0.59837%0.37SS*.  trans67.39.7-17200000114.3R51R51-G55 WeakPolarHBondContact O-CA 3.24Å; R51-G55 PolarHBondContact O-N 3.06Å
56I93.3Very high91Very high24 Ų2465.1 Ų65.112%0.12336%0.355CS..PPolyproline II helixtrans-83.3123.6176.4-62-57.2000109.3N31 R32 M35 R51 S54N31-I56 HydrophobicContact CB-CD1 4.37Å; N31-I56 HydrophobicContact CB-CG1 3.61Å; R32-I56 HydrophobicContact CG-CD1 4.2Å; R32-I56 HydrophobicContact CG-CG2 4.13Å; M35-I56 HydrophobicContact CB-CG2 3.88Å; M35-I56 WeakPolarHBondContact CE-O 3.44Å; M35-I56 HydrophobicContact CG-CG2 4.03Å; R51-I56 WeakPolarHBondContact CG-O 3.45Å; S54-I56 PolarHBondContact O-N 3.37Å; S54-I56 PolarHBondContact OG-N 2.73Å
57E92.4Very high90.9Very high133 Ų13367.3 Ų67.362%0.62136%0.357SS*.PPolyproline II helixtrans-78139.8172.7-68-59.4149.100111.5R51R51-E57 WeakPolarHBondContact CD-OE2 3.49Å
58P89.8Confident90.8Very high24 Ų2467.5 Ų67.516%0.15636%0.358CS..PPolyproline II helixtrans-69.3152.4174.430.2-33.2000111.1M35 V39 V60 L62M35-P58 HydrophobicContact CG-CB 4.38Å; M35-P58 HydrophobicContact SD-CB 4.11Å; V39-P58 HydrophobicContact CG2-CB 3.85Å; P58-V60 WeakPolarHBondContact CB-O 3.22Å; P58-V60 WeakPolarHBondContact CG-O 3.3Å; P58-V60 PolarHBondContact O-N 3.41Å; P58-L62 HydrophobicContact CB-CD2 3.8Å; P58-L62 HydrophobicContact CB-CG 4.28Å; P58-L62 HydrophobicContact CG-CD1 4.17Å; P58-L62 HydrophobicContact CG-CD2 3.93Å; P58-L62 HydrophobicContact CG-CG 3.83Å
59S84.1Confident90.6Very high98 Ų9866.3 Ų66.369%0.68535%0.354SS*.SBendtrans-75.8-10.7179.1560000114
60V85.1Confident90.6Very high39 Ų3965.9 Ų65.924%0.23635%0.351CS..SBendtrans-136.9160.6179.1-55.50000108.8V39 P58 L62V39-V60 HydrophobicContact CG1-CG2 3.38Å; P58-V60 WeakPolarHBondContact CB-O 3.22Å; P58-V60 WeakPolarHBondContact CG-O 3.3Å; P58-V60 PolarHBondContact O-N 3.41Å; V60-L62 PolarHBondContact O-N 3.26Å
61D86.6Confident90.5Very high105 Ų10564.3 Ų64.356%0.56135%0.345SS*.  trans-63.6127.5169.5-173.12.2000110.3D63 S64D61-D63 PolarHBondContact O-N 2.82Å; D61-D63 PolarHBondContact OD1-N 3.28Å; D61-S64 WeakPolarHBondContact O-CB 3.28Å; D61-S64 PolarHBondContact O-N 3.37Å; D61-S64 VanDerWaalsContact O-N 3.16Å; D61-S64 PolarHBondContact O-OG 3.2Å
62L86.9Confident90.5Very high6 Ų662.9 Ų62.93%0.03134%0.339CS..G310 helixtrans-69.1-24.2-178.2-63.9-179.5000112V39 K44 A47 E48 P58 V60 S64 L65V39-L62 HydrophobicContact CG2-CD2 3.95Å; K44-L62 WeakPolarHBondContact CE-O 3.09Å; K44-L62 HydrophobicContact CG-CB 4.4Å; A47-L62 HydrophobicContact CB-CD1 4.37Å; A47-L62 HydrophobicContact CB-CD2 3.92Å; E48-L62 HydrophobicContact CB-CD1 4.45Å; E48-L62 HydrophobicContact CG-CD1 3.54Å; P58-L62 HydrophobicContact CB-CD2 3.8Å; P58-L62 HydrophobicContact CB-CG 4.28Å; P58-L62 HydrophobicContact CG-CD1 4.17Å; P58-L62 HydrophobicContact CG-CD2 3.93Å; P58-L62 HydrophobicContact CG-CG 3.83Å; V60-L62 PolarHBondContact O-N 3.26Å; L62-S64 PolarHBondContact O-N 3.37Å; L62-L65 HydrophobicContact CB-CD1 4.48Å; L62-L65 HydrophobicContact CD2-CD1 3.77Å; L62-L65 VanDerWaalsContact O-CB 3.23Å; L62-L65 WeakPolarHBondContact O-CB 3.46Å; L62-L65 WeakPolarHBondContact O-CG 3.5Å; L62-L65 PolarHBondContact O-N 3.45Å; L62-L65 VanDerWaalsContact O-N 3.12Å
63D86.5Confident90.5Very high94 Ų9460.3 Ų60.350%0.50333%0.325SS..G310 helixtrans-69.3-25.5175.2-68.3-29.2000111.8K44 D61 L65 D66K44-D63 WeakPolarHBondContact CE-OD1 3.36Å; K44-D63 IonicContact NZ-OD1 3.44Å; K44-D63 PolarHBondContact NZ-OD1 3.46Å; D61-D63 PolarHBondContact O-N 2.82Å; D61-D63 PolarHBondContact OD1-N 3.28Å; D63-L65 PolarHBondContact O-N 3.14Å; D63-L65 VanDerWaalsContact O-N 3.07Å; D63-D66 WeakPolarHBondContact O-CB 3.5Å; D63-D66 PolarHBondContact O-N 2.95Å; D63-D66 VanDerWaalsContact O-N 3.16Å
64S83.4Confident90.6Very high33 Ų3354.7 Ų54.723%0.23130%0.3CS..G310 helixtrans-67.2-6.7171.978.70000114D61 L62D61-S64 WeakPolarHBondContact O-CB 3.28Å; D61-S64 PolarHBondContact O-N 3.37Å; D61-S64 VanDerWaalsContact O-N 3.16Å; D61-S64 PolarHBondContact O-OG 3.2Å; L62-S64 PolarHBondContact O-N 3.37Å
65L88.4Confident90.7Very high0 Ų053.2 Ų53.20%029%0.29CS..G310 helixtrans-84.5-16.1175.8-54.8178.3000112.7K44 L62 D63 E67 R68 I69K44-L65 HydrophobicContact CB-CB 4.42Å; K44-L65 HydrophobicContact CB-CD1 4.06Å; L62-L65 HydrophobicContact CB-CD1 4.48Å; L62-L65 HydrophobicContact CD2-CD1 3.77Å; L62-L65 VanDerWaalsContact O-CB 3.23Å; L62-L65 WeakPolarHBondContact O-CB 3.46Å; L62-L65 WeakPolarHBondContact O-CG 3.5Å; L62-L65 PolarHBondContact O-N 3.45Å; L62-L65 VanDerWaalsContact O-N 3.12Å; D63-L65 PolarHBondContact O-N 3.14Å; D63-L65 VanDerWaalsContact O-N 3.07Å; L65-E67 VanDerWaalsContact C-N 3.29Å; L65-E67 PolarHBondContact O-N 2.64Å; L65-R68 PolarHBondContact O-N 3Å; L65-R68 VanDerWaalsContact O-N 3.12Å; L65-I69 HydrophobicContact CB-CD1 4.07Å; L65-I69 VanDerWaalsContact O-CG1 3.27Å; L65-I69 WeakPolarHBondContact O-CG1 3.42Å; L65-I69 PolarHBondContact O-N 3.38Å
66D90.4Very high90.8Very high62 Ų6252.9 Ų52.933%0.33227%0.274SS..Hα-helixtrans-60.4-39.3-171.1-72-16.6000112.7K44 D63 I69 K70K44-D66 VanDerWaalsContact CD-OD1 3.28Å; K44-D66 WeakPolarHBondContact CD-OD1 3.42Å; K44-D66 VanDerWaalsContact NZ-CG 3.34Å; K44-D66 IonicContact NZ-OD1 3.27Å; K44-D66 PolarHBondContact NZ-OD1 2.82Å; K44-D66 IonicContact NZ-OD2 2.78Å; K44-D66 PolarHBondContact NZ-OD2 2.91Å; D63-D66 WeakPolarHBondContact O-CB 3.5Å; D63-D66 PolarHBondContact O-N 2.95Å; D63-D66 VanDerWaalsContact O-N 3.16Å; D66-I69 PolarHBondContact O-N 2.96Å; D66-K70 VanDerWaalsContact O-CG 3.31Å; D66-K70 WeakPolarHBondContact O-CG 3.28Å; D66-K70 PolarHBondContact O-N 2.86Å
67E90.6Very high90.9Very high87 Ų8757.6 Ų57.641%0.40729%0.294SS..Hα-helixtrans-63.6-46.8176.2-74.6175.5174.800111.8L65 I69 K70 I71 L90L65-E67 VanDerWaalsContact C-N 3.29Å; L65-E67 PolarHBondContact O-N 2.64Å; E67-I69 VanDerWaalsContact C-N 3.32Å; E67-I69 PolarHBondContact O-N 2.8Å; E67-K70 PolarHBondContact O-N 3.23Å; E67-I71 WeakPolarHBondContact O-CG1 3.35Å; E67-I71 PolarHBondContact O-N 2.98Å; E67-I71 VanDerWaalsContact O-N 3.12Å; E67-L90 HydrophobicContact CB-CD1 3.81Å; E67-L90 HydrophobicContact CG-CD1 3.98Å; E67-L90 HydrophobicContact CG-CD2 4.17Å
68R92.1Very high91.1Very high5 Ų552 Ų522%0.01927%0.271CS..Hα-helixtrans-64.7-37.4177.3-63.4-149.6-50.7-93.92.5112V39 L65 I71 R72 W174 N178 V181 E185V39-R68 PolarHBondContact O-NH2 3.2Å; L65-R68 PolarHBondContact O-N 3Å; L65-R68 VanDerWaalsContact O-N 3.12Å; R68-I71 PolarHBondContact O-N 2.93Å; R68-R72 WeakPolarHBondContact O-CB 3.09Å; R68-R72 PolarHBondContact O-N 3.38Å; R68-W174 HydrophobicContact CB-CH2 4.22Å; R68-W174 VanDerWaalsContact O-CH2 3.24Å; R68-W174 WeakPolarHBondContact O-CH2 3.5Å; R68-N178 PolarHBondContact NE-OD1 2.93Å; R68-V181 HydrophobicContact CG-CG1 4.17Å; R68-E185 IonicContact NH1-OE2 2.84Å
69I91.6Very high91.4Very high38 Ų3854.6 Ų54.620%0.19528%0.281CS..Hα-helixtrans-63.7-42.3176.3-67.7163.8000110.6G42 K44 L65 D66 E67 I71 R72 E73G42-I69 WeakPolarHBondContact O-CG1 3.32Å; K44-I69 HydrophobicContact CB-CD1 3.44Å; K44-I69 VanDerWaalsContact CB-CD1 3.44Å; K44-I69 HydrophobicContact CD-CD1 4.04Å; K44-I69 HydrophobicContact CG-CD1 4.36Å; L65-I69 HydrophobicContact CB-CD1 4.07Å; L65-I69 VanDerWaalsContact O-CG1 3.27Å; L65-I69 WeakPolarHBondContact O-CG1 3.42Å; L65-I69 PolarHBondContact O-N 3.38Å; D66-I69 PolarHBondContact O-N 2.96Å; E67-I69 VanDerWaalsContact C-N 3.32Å; E67-I69 PolarHBondContact O-N 2.8Å; I69-I71 PolarHBondContact O-N 3.45Å; I69-R72 WeakPolarHBondContact O-CB 3.35Å; I69-R72 PolarHBondContact O-N 2.74Å; I69-E73 HydrophobicContact CG2-CG 4.47Å; I69-E73 WeakPolarHBondContact O-CG 3.48Å; I69-E73 PolarHBondContact O-N 3.02Å
70K94.2Very high92Very high119 Ų11950 Ų5052%0.51725%0.249SC..Hα-helixtrans-60.8-46.4176.1-71.8168.3-174.3172.80111.8D66 E67 R72 E73 M74 L86D66-K70 VanDerWaalsContact O-CG 3.31Å; D66-K70 WeakPolarHBondContact O-CG 3.28Å; D66-K70 PolarHBondContact O-N 2.86Å; E67-K70 PolarHBondContact O-N 3.23Å; K70-R72 VanDerWaalsContact C-N 3.34Å; K70-R72 PolarHBondContact O-N 3.4Å; K70-E73 PolarHBondContact O-N 3.37Å; K70-M74 WeakPolarHBondContact O-CG 3.49Å; K70-M74 PolarHBondContact O-N 3.2Å; K70-M74 VanDerWaalsContact O-N 3.08Å; K70-L86 HydrophobicContact CB-CD2 3.89Å
71I94.8Very high92.5Very high0 Ų051.7 Ų51.70%025%0.254CS..Hα-helixtrans-59-47.5175.9-64165.6000110.3E67 R68 I69 E73 M74 I75 L86 I87 L90 W174 V177E67-I71 WeakPolarHBondContact O-CG1 3.35Å; E67-I71 PolarHBondContact O-N 2.98Å; E67-I71 VanDerWaalsContact O-N 3.12Å; R68-I71 PolarHBondContact O-N 2.93Å; I69-I71 PolarHBondContact O-N 3.45Å; I71-E73 PolarHBondContact O-N 3.45Å; I71-M74 PolarHBondContact O-N 2.99Å; I71-I75 HydrophobicContact CG2-CD1 3.81Å; I71-I75 WeakPolarHBondContact O-CG1 3.49Å; I71-I75 PolarHBondContact O-N 3.19Å; I71-L86 HydrophobicContact CG1-CD2 3.66Å; I71-L86 HydrophobicContact CG1-CG 3.94Å; I71-I87 HydrophobicContact CD1-CG1 3.93Å; I71-I87 HydrophobicContact CG1-CG1 4.23Å; I71-I87 HydrophobicContact CG2-CD1 3.99Å; I71-I87 HydrophobicContact CG2-CG1 3.93Å; I71-L90 HydrophobicContact CD1-CD1 4.14Å; I71-W174 HydrophobicContact CB-CZ3 4.21Å; I71-W174 HydrophobicContact CG2-CE3 4.44Å; I71-W174 HydrophobicContact CG2-CZ3 3.94Å; I71-V177 HydrophobicContact CG2-CG1 3.82Å
72R94.5Very high93.1Very high50 Ų5051.3 Ų51.319%0.18925%0.249CC..Hα-helixtrans-55.5-49.4177.1-178.2177.4179.5160.94112E41 F43 R68 I69 K70 M74 I75 L76 W174E41-R72 PolarHBondContact O-NH1 3.47Å; F43-R72 VanDerWaalsContact CD1-NH1 3.33Å; F43-R72 VanDerWaalsContact CE1-CZ 3.48Å; R68-R72 WeakPolarHBondContact O-CB 3.09Å; R68-R72 PolarHBondContact O-N 3.38Å; I69-R72 WeakPolarHBondContact O-CB 3.35Å; I69-R72 PolarHBondContact O-N 2.74Å; K70-R72 VanDerWaalsContact C-N 3.34Å; K70-R72 PolarHBondContact O-N 3.4Å; R72-M74 VanDerWaalsContact C-N 3.35Å; R72-M74 PolarHBondContact O-N 3Å; R72-I75 PolarHBondContact O-N 3.35Å; R72-L76 HydrophobicContact CG-CD1 3.79Å; R72-L76 HydrophobicContact CG-CG 4.19Å; R72-L76 WeakPolarHBondContact O-CB 3.47Å; R72-L76 VanDerWaalsContact O-CG 3.29Å; R72-L76 WeakPolarHBondContact O-CG 3.48Å; R72-L76 PolarHBondContact O-N 2.95Å; R72-W174 VanDerWaalsContact CA-CE3 3.46Å; R72-W174 HydrophobicContact CB-CD2 3.7Å; R72-W174 HydrophobicContact CB-CE3 3.69Å; R72-W174 HydrophobicContact CB-CH2 3.63Å; R72-W174 HydrophobicContact CB-CZ2 3.65Å; R72-W174 HydrophobicContact CB-CZ3 3.65Å; R72-W174 HydrophobicContact CG-CD2 3.61Å; R72-W174 HydrophobicContact CG-CE3 4.12Å; R72-W174 HydrophobicContact CG-CG 3.99Å; R72-W174 HydrophobicContact CG-CH2 4.37Å; R72-W174 HydrophobicContact CG-CZ2 3.91Å; R72-W174 HydrophobicContact CG-CZ3 4.47Å
73E94.6Very high93.6Very high94 Ų9451 Ų5144%0.43925%0.248SC..Hα-helixtrans-60.9-44.2-178.8-78-168.5-16600112.1I69 K70 I71 L76 K77I69-E73 HydrophobicContact CG2-CG 4.47Å; I69-E73 WeakPolarHBondContact O-CG 3.48Å; I69-E73 PolarHBondContact O-N 3.02Å; K70-E73 PolarHBondContact O-N 3.37Å; I71-E73 PolarHBondContact O-N 3.45Å; E73-L76 PolarHBondContact O-N 2.68Å; E73-K77 VanDerWaalsContact O-CB 3.3Å; E73-K77 WeakPolarHBondContact O-CB 3.33Å; E73-K77 VanDerWaalsContact O-CG 3.22Å; E73-K77 WeakPolarHBondContact O-CG 3.22Å; E73-K77 PolarHBondContact O-N 3.44Å; E73-K77 IonicContact OE2-NZ 2.7Å; E73-K77 PolarHBondContact OE2-NZ 3.44Å
74M96.9Very high94Very high49 Ų4947 Ų4724%0.24123%0.226CC..Hα-helixtrans-59.7-47.6176.9-70.6175.9175.400110.7K70 I71 R72 L76 K77 G78 Q79 E82 A83 L86K70-M74 WeakPolarHBondContact O-CG 3.49Å; K70-M74 PolarHBondContact O-N 3.2Å; K70-M74 VanDerWaalsContact O-N 3.08Å; I71-M74 PolarHBondContact O-N 2.99Å; R72-M74 VanDerWaalsContact C-N 3.35Å; R72-M74 PolarHBondContact O-N 3Å; M74-L76 PolarHBondContact O-N 2.79Å; M74-K77 PolarHBondContact O-N 3.48Å; M74-G78 PolarHBondContact O-N 2.88Å; M74-G78 VanDerWaalsContact O-N 3.12Å; M74-Q79 HydrophobicContact CB-CB 4.13Å; M74-Q79 WeakPolarHBondContact O-CA 3.47Å; M74-Q79 WeakPolarHBondContact O-CB 3.39Å; M74-Q79 PolarHBondContact O-N 3.42Å; M74-E82 HydrophobicContact SD-CB 4.04Å; M74-A83 HydrophobicContact CB-CB 3.83Å; M74-L86 HydrophobicContact CE-CD2 4.07Å; M74-L86 HydrophobicContact SD-CB 4.31Å; M74-L86 HydrophobicContact SD-CD2 3.85Å
75I96.7Very high94.7Very high0 Ų048.4 Ų48.40%024%0.24CC..Hα-helixtrans-61.9-47.1178.6-67.9168.3000111.4I71 R72 K77 G78 I80 A83 L105 V173 W174 V177I71-I75 HydrophobicContact CG2-CD1 3.81Å; I71-I75 WeakPolarHBondContact O-CG1 3.49Å; I71-I75 PolarHBondContact O-N 3.19Å; R72-I75 PolarHBondContact O-N 3.35Å; I75-K77 VanDerWaalsContact C-N 3.29Å; I75-K77 PolarHBondContact O-N 2.78Å; I75-G78 PolarHBondContact O-N 2.93Å; I75-I80 HydrophobicContact CB-CD1 4.43Å; I75-I80 HydrophobicContact CG1-CD1 4.43Å; I75-I80 HydrophobicContact CG2-CD1 4.25Å; I75-A83 HydrophobicContact CD1-CB 4.37Å; I75-A83 HydrophobicContact CG1-CB 3.69Å; I75-L105 HydrophobicContact CD1-CD2 4.34Å; I75-V173 HydrophobicContact CG2-CB 4.5Å; I75-V173 HydrophobicContact CG2-CG1 4.32Å; I75-W174 HydrophobicContact CD1-CE3 4.06Å; I75-W174 HydrophobicContact CG2-CB 4Å; I75-V177 HydrophobicContact CD1-CB 4.09Å; I75-V177 HydrophobicContact CD1-CG1 4.1Å; I75-V177 HydrophobicContact CD1-CG2 3.79Å
76L94.3Very high95.1Very high50 Ų5050.3 Ų50.326%0.26225%0.25SC..Hα-helixtrans-67.9-28.7-178.8-66.7-177000112.8R72 E73 M74 G78 R170 Q171R72-L76 HydrophobicContact CG-CD1 3.79Å; R72-L76 HydrophobicContact CG-CG 4.19Å; R72-L76 WeakPolarHBondContact O-CB 3.47Å; R72-L76 VanDerWaalsContact O-CG 3.29Å; R72-L76 WeakPolarHBondContact O-CG 3.48Å; R72-L76 PolarHBondContact O-N 2.95Å; E73-L76 PolarHBondContact O-N 2.68Å; M74-L76 PolarHBondContact O-N 2.79Å; L76-G78 VanDerWaalsContact C-N 3.29Å; L76-R170 HydrophobicContact CD2-CB 4.2Å; L76-R170 VanDerWaalsContact O-CD 3.28Å; L76-R170 WeakPolarHBondContact O-CD 3.21Å; L76-R170 PolarHBondContact O-NH1 3.2Å; L76-Q171 HydrophobicContact CD2-CG 3.91Å
77K95.5Very high95.3Very high124 Ų12447.3 Ų47.354%0.53923%0.234SC..Hα-helixtrans-78-10.7172.2-70.8169.6-172.2161.40113.1E73 M74 I75 Q79E73-K77 VanDerWaalsContact O-CB 3.3Å; E73-K77 WeakPolarHBondContact O-CB 3.33Å; E73-K77 VanDerWaalsContact O-CG 3.22Å; E73-K77 WeakPolarHBondContact O-CG 3.22Å; E73-K77 PolarHBondContact O-N 3.44Å; E73-K77 IonicContact OE2-NZ 2.7Å; E73-K77 PolarHBondContact OE2-NZ 3.44Å; M74-K77 PolarHBondContact O-N 3.48Å; I75-K77 VanDerWaalsContact C-N 3.29Å; I75-K77 PolarHBondContact O-N 2.78Å; K77-Q79 HydrophobicContact CB-CG 4.3Å
78G95.3Very high95.6Very high15 Ų1546.2 Ų46.216%0.15523%0.231CC..THydrogen-bonded Turntrans8510.9-176.500000113.9M74 I75 L76 I80M74-G78 PolarHBondContact O-N 2.88Å; M74-G78 VanDerWaalsContact O-N 3.12Å; I75-G78 PolarHBondContact O-N 2.93Å; L76-G78 VanDerWaalsContact C-N 3.29Å; G78-I80 PolarHBondContact O-N 3.21Å
79Q96.9Very high95.8Very high78 Ų7850.4 Ų50.436%0.36426%0.26SS..  trans-83.261.4178.7-69.9178.1-63.500111M74 K77 E82 A83M74-Q79 HydrophobicContact CB-CB 4.13Å; M74-Q79 WeakPolarHBondContact O-CA 3.47Å; M74-Q79 WeakPolarHBondContact O-CB 3.39Å; M74-Q79 PolarHBondContact O-N 3.42Å; K77-Q79 HydrophobicContact CB-CG 4.3Å; Q79-E82 HydrophobicContact CB-CB 4.34Å; Q79-E82 WeakPolarHBondContact CB-OE2 3.37Å; Q79-E82 VanDerWaalsContact CG-OE2 3.31Å; Q79-E82 WeakPolarHBondContact CG-OE2 3.42Å; Q79-E82 PolarHBondContact NE2-OE2 2.99Å; Q79-E82 PolarHBondContact O-N 3.36Å; Q79-A83 PolarHBondContact O-N 3.41Å
80I97.1Very high95.8Very high1 Ų150.9 Ų50.91%0.00526%0.263CS..Hα-helixtrans-70.6-40-166.2-52-55.7000113I75 G78 E82 A83 I84 L105 Q108 H109 E112I75-I80 HydrophobicContact CB-CD1 4.43Å; I75-I80 HydrophobicContact CG1-CD1 4.43Å; I75-I80 HydrophobicContact CG2-CD1 4.25Å; G78-I80 PolarHBondContact O-N 3.21Å; I80-E82 VanDerWaalsContact C-N 3.31Å; I80-E82 PolarHBondContact O-N 3.05Å; I80-A83 WeakPolarHBondContact O-CB 3.36Å; I80-A83 PolarHBondContact O-N 3.19Å; I80-I84 HydrophobicContact CG2-CD1 4.12Å; I80-I84 HydrophobicContact CG2-CG1 4.43Å; I80-I84 WeakPolarHBondContact O-CG1 3.3Å; I80-I84 PolarHBondContact O-N 2.99Å; I80-L105 HydrophobicContact CG2-CB 4.27Å; I80-L105 HydrophobicContact CG2-CD2 4.03Å; I80-L105 VanDerWaalsContact CG2-O 3.23Å; I80-L105 WeakPolarHBondContact CG2-O 3.37Å; I80-Q108 HydrophobicContact CD1-CB 4.29Å; I80-Q108 HydrophobicContact CD1-CG 3.59Å; I80-Q108 HydrophobicContact CG1-CB 4.19Å; I80-Q108 HydrophobicContact CG1-CG 3.79Å; I80-H109 HydrophobicContact CB-CB 4.05Å; I80-H109 HydrophobicContact CG2-CB 4.16Å; I80-E112 HydrophobicContact CG1-CG 4.14Å
81Q95.9Very high95.8Very high75 Ų7545.6 Ų45.635%0.3524%0.24SC..Hα-helixtrans-64.5-37.9178.5-66.2-58-30.700112.1I84 A85 H109Q81-I84 PolarHBondContact O-N 3.01Å; Q81-A85 PolarHBondContact O-N 3.46Å; Q81-H109 PolarHBondContact NE2-CD2 3Å
82E97.6Very high95.7Very high98 Ų9849 Ų4946%0.45826%0.262SS..Hα-helixtrans-67-39.4175.3-66.3155.2-16100110.9M74 Q79 I80 A85 L86M74-E82 HydrophobicContact SD-CB 4.04Å; Q79-E82 HydrophobicContact CB-CB 4.34Å; Q79-E82 WeakPolarHBondContact CB-OE2 3.37Å; Q79-E82 VanDerWaalsContact CG-OE2 3.31Å; Q79-E82 WeakPolarHBondContact CG-OE2 3.42Å; Q79-E82 PolarHBondContact NE2-OE2 2.99Å; Q79-E82 PolarHBondContact O-N 3.36Å; I80-E82 VanDerWaalsContact C-N 3.31Å; I80-E82 PolarHBondContact O-N 3.05Å; E82-A85 PolarHBondContact O-N 3.25Å; E82-L86 WeakPolarHBondContact O-CB 3.45Å; E82-L86 PolarHBondContact O-N 3.47Å
83A97.4Very high95.6Very high0 Ų052.6 Ų52.60%028%0.281CS..Hα-helixtrans-62.3-44.3172.800000112.1M74 I75 Q79 I80 L86 I87M74-A83 HydrophobicContact CB-CB 3.83Å; I75-A83 HydrophobicContact CD1-CB 4.37Å; I75-A83 HydrophobicContact CG1-CB 3.69Å; Q79-A83 PolarHBondContact O-N 3.41Å; I80-A83 WeakPolarHBondContact O-CB 3.36Å; I80-A83 PolarHBondContact O-N 3.19Å; A83-L86 PolarHBondContact O-N 2.95Å; A83-I87 WeakPolarHBondContact O-CB 3.43Å; A83-I87 WeakPolarHBondContact O-CD1 3.47Å; A83-I87 WeakPolarHBondContact O-CG1 3.23Å; A83-I87 PolarHBondContact O-N 3.27Å
84I96.3Very high95.5Very high10 Ų1048.4 Ų48.45%0.05126%0.262CS..Hα-helixtrans-59.8-47.3176.5-70.3167.5000110.7I80 Q81 L86 I87 N88 L95 Y102 L105I80-I84 HydrophobicContact CG2-CD1 4.12Å; I80-I84 HydrophobicContact CG2-CG1 4.43Å; I80-I84 WeakPolarHBondContact O-CG1 3.3Å; I80-I84 PolarHBondContact O-N 2.99Å; Q81-I84 PolarHBondContact O-N 3.01Å; I84-L86 VanDerWaalsContact C-N 3.31Å; I84-L86 PolarHBondContact O-N 3.48Å; I84-I87 PolarHBondContact O-N 2.97Å; I84-N88 PolarHBondContact O-N 3.46Å; I84-L95 HydrophobicContact CB-CD1 4.47Å; I84-L95 HydrophobicContact CG2-CD1 3.84Å; I84-Y102 HydrophobicContact CG2-CE2 4.41Å; I84-L105 HydrophobicContact CD1-CB 4Å; I84-L105 HydrophobicContact CG1-CB 4.08Å; I84-L105 HydrophobicContact CG1-CD1 4.09Å; I84-L105 HydrophobicContact CG1-CG 4.48Å
85A96.9Very high95.3Very high62 Ų6246.3 Ų46.351%0.51225%0.252SS..Hα-helixtrans-60.8-41.9178.200000111.7Q81 E82 N88 S89Q81-A85 PolarHBondContact O-N 3.46Å; E82-A85 PolarHBondContact O-N 3.25Å; A85-N88 PolarHBondContact O-N 3.41Å; A85-S89 WeakPolarHBondContact O-CB 3.15Å; A85-S89 PolarHBondContact O-N 2.91Å
86L96.4Very high95Very high39 Ų3951.9 Ų51.920%0.20428%0.282CS..Hα-helixtrans-65.5-43.2176.5-177.359.1000111.9K70 I71 M74 E82 A83 I84 S89 L90K70-L86 HydrophobicContact CB-CD2 3.89Å; I71-L86 HydrophobicContact CG1-CD2 3.66Å; I71-L86 HydrophobicContact CG1-CG 3.94Å; M74-L86 HydrophobicContact CE-CD2 4.07Å; M74-L86 HydrophobicContact SD-CB 4.31Å; M74-L86 HydrophobicContact SD-CD2 3.85Å; E82-L86 WeakPolarHBondContact O-CB 3.45Å; E82-L86 PolarHBondContact O-N 3.47Å; A83-L86 PolarHBondContact O-N 2.95Å; I84-L86 VanDerWaalsContact C-N 3.31Å; I84-L86 PolarHBondContact O-N 3.48Å; L86-S89 PolarHBondContact O-N 2.71Å; L86-L90 HydrophobicContact CD1-CD1 3.68Å; L86-L90 HydrophobicContact CD1-CG 3.98Å; L86-L90 HydrophobicContact CG-CD1 3.83Å; L86-L90 HydrophobicContact CG-CG 4.45Å; L86-L90 WeakPolarHBondContact O-CG 3.46Å; L86-L90 PolarHBondContact O-N 2.93Å
87I96.1Very high94.8Very high0 Ų054.4 Ų54.40%030%0.299CS..Hα-helixtrans-59.1-49.8175.9-70.2162.2000110.4I71 A83 I84 S89 L90 H91 L94 L95 L105 V177I71-I87 HydrophobicContact CD1-CG1 3.93Å; I71-I87 HydrophobicContact CG1-CG1 4.23Å; I71-I87 HydrophobicContact CG2-CD1 3.99Å; I71-I87 HydrophobicContact CG2-CG1 3.93Å; A83-I87 WeakPolarHBondContact O-CB 3.43Å; A83-I87 WeakPolarHBondContact O-CD1 3.47Å; A83-I87 WeakPolarHBondContact O-CG1 3.23Å; A83-I87 PolarHBondContact O-N 3.27Å; I84-I87 PolarHBondContact O-N 2.97Å; I87-S89 PolarHBondContact O-N 2.75Å; I87-L90 PolarHBondContact O-N 3.39Å; I87-H91 CarbonylContact O-C 3.55Å; I87-H91 WeakPolarHBondContact O-CA 3.46Å; I87-H91 PolarHBondContact O-N 3.42Å; I87-L94 HydrophobicContact CG2-CB 4.49Å; I87-L94 HydrophobicContact CG2-CD2 3.86Å; I87-L95 HydrophobicContact CB-CD1 4.37Å; I87-L95 HydrophobicContact CG2-CD1 3.98Å; I87-L95 HydrophobicContact CG2-CD2 4.19Å; I87-L95 HydrophobicContact CG2-CG 3.91Å; I87-L105 HydrophobicContact CD1-CD1 4.15Å; I87-V177 HydrophobicContact CD1-CG1 3.78Å; I87-V177 HydrophobicContact CD1-CG2 4.41Å; I87-V177 HydrophobicContact CG1-CG1 4.47Å
88N95.5Very high94.6Very high64 Ų6450.9 Ų50.934%0.34229%0.286SS..Hα-helixtrans-64.2-28.8179.4-77.1-25.3000113I84 A85 L95I84-N88 PolarHBondContact O-N 3.46Å; A85-N88 PolarHBondContact O-N 3.41Å; N88-L95 WeakPolarHBondContact OD1-CD1 3.49Å
89S96.1Very high94.3Very high92 Ų9256.7 Ų56.764%0.64330%0.303SS*.Hα-helixtrans-74.1-34.6175.4-176.70000113.1A85 L86 I87A85-S89 WeakPolarHBondContact O-CB 3.15Å; A85-S89 PolarHBondContact O-N 2.91Å; L86-S89 PolarHBondContact O-N 2.71Å; I87-S89 PolarHBondContact O-N 2.75Å
90L93.3Very high93.9Very high48 Ų4859.2 Ų59.225%0.25131%0.31SS..Hα-helixtrans-94-37.5-174.4-67.4175.7000112.6E67 I71 L86 I87 P92E67-L90 HydrophobicContact CB-CD1 3.81Å; E67-L90 HydrophobicContact CG-CD1 3.98Å; E67-L90 HydrophobicContact CG-CD2 4.17Å; I71-L90 HydrophobicContact CD1-CD1 4.14Å; L86-L90 HydrophobicContact CD1-CD1 3.68Å; L86-L90 HydrophobicContact CD1-CG 3.98Å; L86-L90 HydrophobicContact CG-CD1 3.83Å; L86-L90 HydrophobicContact CG-CG 4.45Å; L86-L90 WeakPolarHBondContact O-CG 3.46Å; L86-L90 PolarHBondContact O-N 2.93Å; I87-L90 PolarHBondContact O-N 3.39Å; L90-P92 WeakPolarHBondContact O-CD 3.49Å
91H93.1Very high93.8Very high8 Ų859.3 Ų59.34%0.03731%0.311CS..SBendtrans-127.374.9-177.6-53.599.2000109.3I87 E93 L94 V181 Y184 E185I87-H91 CarbonylContact O-C 3.55Å; I87-H91 WeakPolarHBondContact O-CA 3.46Å; I87-H91 PolarHBondContact O-N 3.42Å; H91-E93 PolarHBondContact O-N 3.29Å; H91-L94 HydrophobicContact CB-CB 3.96Å; H91-L94 HydrophobicContact CB-CD2 4.08Å; H91-L94 VanDerWaalsContact O-CB 3.32Å; H91-L94 WeakPolarHBondContact O-CB 3.4Å; H91-L94 PolarHBondContact O-N 3.23Å; H91-V181 VanDerWaalsContact CE1-CG1 3.48Å; H91-V181 WeakPolarHBondContact CE1-CG1 3.39Å; H91-Y184 HydrophobicContact CB-CD1 4.13Å; H91-Y184 HydrophobicContact CB-CE1 4.02Å; H91-Y184 AromaticContact CD2-CD1 3.68Å; H91-Y184 AromaticContact CD2-CE1 3.94Å; H91-E185 IonicContact CD2-OE1 3.17Å; H91-E185 IonicContact CE1-OE1 3.9Å; H91-E185 IonicContact NE2-OE1 2.7Å; H91-E185 PolarHBondContact NE2-OE1 3.32Å
92P92.9Very high93.6Very high71 Ų7158.5 Ų58.546%0.46131%0.305SS..THydrogen-bonded Turntrans-53.7141.5178.4-23.834.1000110.9L90 L94 Y184L90-P92 WeakPolarHBondContact O-CD 3.49Å; P92-L94 PolarHBondContact O-N 2.83Å; P92-Y184 WeakPolarHBondContact O-CE2 3.06Å; P92-Y184 PolarHBondContact O-OH 3.33Å
93E91.8Very high93.4Very high126 Ų12654 Ų5459%0.58928%0.284SS*.THydrogen-bonded Turntrans71.1-3.7179.3-46.1175.4171.100115.8H91 L95 D96 T97H91-E93 PolarHBondContact O-N 3.29Å; E93-L95 VanDerWaalsContact C-N 3.33Å; E93-L95 PolarHBondContact O-N 3.45Å; E93-D96 WeakPolarHBondContact CA-OD2 3.3Å; E93-D96 PolarHBondContact O-N 3.23Å; E93-T97 HydrophobicContact CB-CG2 4.5Å; E93-T97 WeakPolarHBondContact O-CB 3.35Å; E93-T97 WeakPolarHBondContact O-CG2 3.28Å; E93-T97 PolarHBondContact O-N 3.04Å; E93-T97 PolarHBondContact O-OG1 3Å
94L93.6Very high93.2Very high6 Ų655.7 Ų55.73%0.03129%0.292CS..Hα-helixtrans-58.6-46.2179.4177.761.1000111.6I87 H91 P92 T97 N98 V181 Y184I87-L94 HydrophobicContact CG2-CB 4.49Å; I87-L94 HydrophobicContact CG2-CD2 3.86Å; H91-L94 HydrophobicContact CB-CB 3.96Å; H91-L94 HydrophobicContact CB-CD2 4.08Å; H91-L94 VanDerWaalsContact O-CB 3.32Å; H91-L94 WeakPolarHBondContact O-CB 3.4Å; H91-L94 PolarHBondContact O-N 3.23Å; P92-L94 PolarHBondContact O-N 2.83Å; L94-T97 PolarHBondContact O-OG1 3.31Å; L94-T97 VanDerWaalsContact O-OG1 3.13Å; L94-N98 WeakPolarHBondContact O-CB 3.49Å; L94-N98 PolarHBondContact O-N 2.97Å; L94-V181 HydrophobicContact CD2-CG2 3.73Å; L94-Y184 HydrophobicContact CB-CD2 4.21Å; L94-Y184 HydrophobicContact CB-CE2 4.41Å; L94-Y184 HydrophobicContact CD1-CD2 3.86Å; L94-Y184 HydrophobicContact CD1-CG 4.14Å
95L93.1Very high93.2Very high5 Ų555.2 Ų55.23%0.02629%0.289CS..Hα-helixtrans-78.9-25.9-178.7-59.9-178.1000112.1I84 I87 N88 E93 N98 L101 Y102 L105I84-L95 HydrophobicContact CB-CD1 4.47Å; I84-L95 HydrophobicContact CG2-CD1 3.84Å; I87-L95 HydrophobicContact CB-CD1 4.37Å; I87-L95 HydrophobicContact CG2-CD1 3.98Å; I87-L95 HydrophobicContact CG2-CD2 4.19Å; I87-L95 HydrophobicContact CG2-CG 3.91Å; N88-L95 WeakPolarHBondContact OD1-CD1 3.49Å; E93-L95 VanDerWaalsContact C-N 3.33Å; E93-L95 PolarHBondContact O-N 3.45Å; L95-N98 CarbonylContact O-C 3.6Å; L95-L101 HydrophobicContact CD2-CD2 3.77Å; L95-L101 HydrophobicContact CD2-CG 4.03Å; L95-Y102 HydrophobicContact CB-CD2 3.95Å; L95-Y102 HydrophobicContact CB-CG 4.49Å; L95-Y102 HydrophobicContact CD1-CD2 4.05Å; L95-Y102 HydrophobicContact CG-CD2 4.44Å; L95-L105 HydrophobicContact CD1-CD1 4.29Å; L95-L105 HydrophobicContact CD2-CD1 3.77Å
96D90Very high93.1Very high118 Ų11852.6 Ų52.663%0.63127%0.267SS*.Hα-helixtrans-70.8-37.8174.8-60.3-41.4000111.6E93E93-D96 WeakPolarHBondContact CA-OD2 3.3Å; E93-D96 PolarHBondContact O-N 3.23Å
97T89.7Confident92.9Very high102 Ų10250.9 Ų50.963%0.62626%0.258SS*.Hα-helixtrans-82.6-27.1178.854.60000112.9E93 L94E93-T97 HydrophobicContact CB-CG2 4.5Å; E93-T97 WeakPolarHBondContact O-CB 3.35Å; E93-T97 WeakPolarHBondContact O-CG2 3.28Å; E93-T97 PolarHBondContact O-N 3.04Å; E93-T97 PolarHBondContact O-OG1 3Å; L94-T97 PolarHBondContact O-OG1 3.31Å; L94-T97 VanDerWaalsContact O-OG1 3.13Å
98N91.1Very high93Very high50 Ų5050.9 Ų50.927%0.26726%0.258SS..  trans-115.279.1178.4-167.7-13.5000112L94 L95 Y100 L101 Y102 S180L94-N98 WeakPolarHBondContact O-CB 3.49Å; L94-N98 PolarHBondContact O-N 2.97Å; L95-N98 CarbonylContact O-C 3.6Å; N98-Y100 VanDerWaalsContact C-N 3.3Å; N98-Y100 PolarHBondContact O-N 3.36Å; N98-L101 HydrophobicContact CB-CB 4.09Å; N98-L101 VanDerWaalsContact CG-CB 3.47Å; N98-L101 PolarHBondContact O-N 2.94Å; N98-L101 PolarHBondContact OD1-N 3.03Å; N98-L101 VanDerWaalsContact OD1-N 3.14Å; N98-Y102 PolarHBondContact O-N 2.86Å; N98-Y102 VanDerWaalsContact O-N 3.14Å; N98-S180 PolarHBondContact ND2-OG 3.12Å
99R88.5Confident93Very high137 Ų13749.6 Ų49.652%0.51725%0.249SC..Hα-helixtrans-60.4-35.1-179.3-65-174.7178.4-166-4.2113.9Y102 F103 E136R99-Y102 PolarHBondContact O-N 2.78Å; R99-F103 WeakPolarHBondContact O-CB 3.29Å; R99-F103 PolarHBondContact O-N 3.45Å; R99-E136 WeakPolarHBondContact CD-OE2 3.48Å; R99-E136 IonicContact CZ-OE1 3.53Å; R99-E136 VanDerWaalsContact NH1-CD 3.34Å; R99-E136 IonicContact NH1-OE1 3.6Å; R99-E136 PolarHBondContact NH1-OE1 3.25Å; R99-E136 IonicContact NH1-OE2 3.51Å; R99-E136 PolarHBondContact NH1-OE2 3.03Å
100Y90.4Very high92.9Very high131 Ų13145.2 Ų45.251%0.51422%0.219SC..Hα-helixtrans-65.1-41.9177.7-73.2-74.7000111.9N98 Y102 F103 H104N98-Y100 VanDerWaalsContact C-N 3.3Å; N98-Y100 PolarHBondContact O-N 3.36Å; Y100-Y102 VanDerWaalsContact C-N 3.35Å; Y100-F103 PolarHBondContact O-N 3.26Å; Y100-H104 PolarHBondContact O-CD2 2.92Å; Y100-H104 PolarHBondContact O-N 2.94Å
101L93.8Very high93Very high4 Ų443 Ų432%0.02121%0.207CC..Hα-helixtrans-62.8-44.1174.7179.166.2000111.4L95 N98 F103 H104 L105 E176 V177L95-L101 HydrophobicContact CD2-CD2 3.77Å; L95-L101 HydrophobicContact CD2-CG 4.03Å; N98-L101 HydrophobicContact CB-CB 4.09Å; N98-L101 VanDerWaalsContact CG-CB 3.47Å; N98-L101 PolarHBondContact O-N 2.94Å; N98-L101 PolarHBondContact OD1-N 3.03Å; N98-L101 VanDerWaalsContact OD1-N 3.14Å; L101-F103 VanDerWaalsContact C-N 3.34Å; L101-H104 PolarHBondContact O-N 3.13Å; L101-L105 HydrophobicContact CG-CD1 4.26Å; L101-L105 PolarHBondContact O-N 3.44Å; L101-E176 HydrophobicContact CD1-CB 3.97Å; L101-V177 HydrophobicContact CD1-CB 4.46Å; L101-V177 HydrophobicContact CD1-CG2 3.75Å
102Y92.9Very high93.1Very high58 Ų5843 Ų4323%0.22721%0.207CC..Hα-helixtrans-59.8-46.1176.5-176.1-109.5000111.4I84 L95 N98 R99 Y100 H104 L105 Q106I84-Y102 HydrophobicContact CG2-CE2 4.41Å; L95-Y102 HydrophobicContact CB-CD2 3.95Å; L95-Y102 HydrophobicContact CB-CG 4.49Å; L95-Y102 HydrophobicContact CD1-CD2 4.05Å; L95-Y102 HydrophobicContact CG-CD2 4.44Å; N98-Y102 PolarHBondContact O-N 2.86Å; N98-Y102 VanDerWaalsContact O-N 3.14Å; R99-Y102 PolarHBondContact O-N 2.78Å; Y100-Y102 VanDerWaalsContact C-N 3.35Å; Y102-H104 PolarHBondContact O-N 3.28Å; Y102-L105 PolarHBondContact O-N 3.3Å; Y102-Q106 HydrophobicContact CD1-CG 4.31Å; Y102-Q106 HydrophobicContact CE1-CG 3.95Å; Y102-Q106 HydrophobicContact CE2-CG 4.26Å; Y102-Q106 VanDerWaalsContact CE2-NE2 3.3Å; Y102-Q106 WeakPolarHBondContact O-CG 3.37Å; Y102-Q106 PolarHBondContact O-N 2.91Å; Y102-Q106 PolarHBondContact OH-NE2 2.89Å
103F92.1Very high93.2Very high3 Ų340.3 Ų40.31%0.01319%0.189CC..Hα-helixtrans-56.1-48.1173.9172.3-93.6000112R99 Y100 L101 L105 Q106 Q107 L130 Q133 C140 E143 M144R99-F103 WeakPolarHBondContact O-CB 3.29Å; R99-F103 PolarHBondContact O-N 3.45Å; Y100-F103 PolarHBondContact O-N 3.26Å; L101-F103 VanDerWaalsContact C-N 3.34Å; F103-L105 VanDerWaalsContact C-N 3.31Å; F103-L105 PolarHBondContact O-N 3.42Å; F103-Q106 PolarHBondContact O-N 3.37Å; F103-Q106 VanDerWaalsContact O-N 3.15Å; F103-Q107 HydrophobicContact CE1-CB 4.42Å; F103-Q107 WeakPolarHBondContact O-CB 3.31Å; F103-Q107 PolarHBondContact O-N 3.39Å; F103-L130 HydrophobicContact CD2-CD2 3.89Å; F103-L130 HydrophobicContact CE2-CD2 3.73Å; F103-Q133 HydrophobicContact CD2-CB 4.14Å; F103-C140 HydrophobicContact CD1-CB 4.28Å; F103-C140 HydrophobicContact CD2-CB 4.34Å; F103-C140 HydrophobicContact CE1-CB 3.92Å; F103-C140 HydrophobicContact CE2-CB 3.97Å; F103-C140 HydrophobicContact CG-CB 4.49Å; F103-C140 HydrophobicContact CZ-CB 3.75Å; F103-C140 WeakPolarHBondContact CZ-O 3.44Å; F103-E143 HydrophobicContact CE1-CB 4.37Å; F103-M144 HydrophobicContact CZ-CB 4.42Å
104H94.1Very high93.3Very high35 Ų3534.4 Ų34.416%0.16216%0.161CC..Hα-helixtrans-64.2-34.6179.8-74.2-48.8000113Y100 L101 Y102 Q107 Q108 E176Y100-H104 PolarHBondContact O-CD2 2.92Å; Y100-H104 PolarHBondContact O-N 2.94Å; L101-H104 PolarHBondContact O-N 3.13Å; Y102-H104 PolarHBondContact O-N 3.28Å; H104-Q107 PolarHBondContact ND1-OE1 3.41Å; H104-Q108 WeakPolarHBondContact O-CB 3.33Å; H104-Q108 PolarHBondContact O-N 3.4Å; H104-E176 IonicContact CD2-OE2 3.75Å; H104-E176 PolarHBondContact CD2-OE2 3.38Å; H104-E176 IonicContact CG-OE2 3.98Å; H104-E176 IonicContact NE2-OE2 3.36Å
105L95.6Very high93.2Very high0 Ų037.3 Ų37.30%017%0.172CC..Hα-helixtrans-64.9-45.7171.1-75.2164.4000111.3I75 I80 I84 I87 L95 L101 Y102 F103 Q108 H109 V173 V177I75-L105 HydrophobicContact CD1-CD2 4.34Å; I80-L105 HydrophobicContact CG2-CB 4.27Å; I80-L105 HydrophobicContact CG2-CD2 4.03Å; I80-L105 VanDerWaalsContact CG2-O 3.23Å; I80-L105 WeakPolarHBondContact CG2-O 3.37Å; I84-L105 HydrophobicContact CD1-CB 4Å; I84-L105 HydrophobicContact CG1-CB 4.08Å; I84-L105 HydrophobicContact CG1-CD1 4.09Å; I84-L105 HydrophobicContact CG1-CG 4.48Å; I87-L105 HydrophobicContact CD1-CD1 4.15Å; L95-L105 HydrophobicContact CD1-CD1 4.29Å; L95-L105 HydrophobicContact CD2-CD1 3.77Å; L101-L105 HydrophobicContact CG-CD1 4.26Å; L101-L105 PolarHBondContact O-N 3.44Å; Y102-L105 PolarHBondContact O-N 3.3Å; F103-L105 VanDerWaalsContact C-N 3.31Å; F103-L105 PolarHBondContact O-N 3.42Å; L105-Q108 WeakPolarHBondContact O-CB 3.36Å; L105-Q108 PolarHBondContact O-N 3.03Å; L105-H109 PolarHBondContact O-N 3.5Å; L105-V173 HydrophobicContact CD2-CG1 3.77Å; L105-V173 HydrophobicContact CG-CG1 4.39Å; L105-V177 HydrophobicContact CD1-CG2 4.17Å; L105-V177 HydrophobicContact CD2-CG2 3.89Å; L105-V177 HydrophobicContact CG-CG2 4.23Å
106Q94.4Very high93.2Very high8 Ų842.5 Ų42.54%0.03720%0.199CC..Hα-helixtrans-66.8-38.6177.7-63.7-56.4-2.300112.7Y102 F103 Q108 H109 L110 F125 L130Y102-Q106 HydrophobicContact CD1-CG 4.31Å; Y102-Q106 HydrophobicContact CE1-CG 3.95Å; Y102-Q106 HydrophobicContact CE2-CG 4.26Å; Y102-Q106 VanDerWaalsContact CE2-NE2 3.3Å; Y102-Q106 WeakPolarHBondContact O-CG 3.37Å; Y102-Q106 PolarHBondContact O-N 2.91Å; Y102-Q106 PolarHBondContact OH-NE2 2.89Å; F103-Q106 PolarHBondContact O-N 3.37Å; F103-Q106 VanDerWaalsContact O-N 3.15Å; Q106-Q108 VanDerWaalsContact C-N 3.31Å; Q106-Q108 PolarHBondContact O-N 2.95Å; Q106-H109 WeakPolarHBondContact O-CB 3.3Å; Q106-H109 PolarHBondContact O-N 3.04Å; Q106-L110 PolarHBondContact O-N 3.41Å; Q106-F125 HydrophobicContact CB-CE1 4.28Å; Q106-F125 HydrophobicContact CB-CZ 3.95Å; Q106-F125 HydrophobicContact CG-CZ 4.3Å; Q106-F125 WeakPolarHBondContact O-CE1 3.33Å; Q106-L130 HydrophobicContact CB-CD2 4.08Å
107Q93.9Very high93.3Very high3 Ų342.5 Ų42.51%0.01419%0.19CC..Hα-helixtrans-58.3-44.6170.7-173.6-168.28.600110.6F103 H104 H109 L110 I111 E143 T147F103-Q107 HydrophobicContact CE1-CB 4.42Å; F103-Q107 WeakPolarHBondContact O-CB 3.31Å; F103-Q107 PolarHBondContact O-N 3.39Å; H104-Q107 PolarHBondContact ND1-OE1 3.41Å; Q107-H109 VanDerWaalsContact C-N 3.32Å; Q107-H109 PolarHBondContact O-N 3.39Å; Q107-L110 WeakPolarHBondContact O-CB 3.44Å; Q107-L110 PolarHBondContact O-N 3.5Å; Q107-I111 HydrophobicContact CG-CD1 4.34Å; Q107-I111 WeakPolarHBondContact O-CG1 3.31Å; Q107-I111 PolarHBondContact O-N 3.4Å; Q107-E143 PolarHBondContact NE2-O 2.58Å; Q107-E143 PolarHBondContact NE2-OE2 3.17Å; Q107-T147 PolarHBondContact NE2-OG1 2.98Å
108Q96.6Very high93.4Very high0 Ų042.1 Ų42.10%018%0.181CC..Hα-helixtrans-62.4-41176.5-169.659.339.400111.7I80 H104 L105 Q106 L110 I111 E112 V173I80-Q108 HydrophobicContact CD1-CB 4.29Å; I80-Q108 HydrophobicContact CD1-CG 3.59Å; I80-Q108 HydrophobicContact CG1-CB 4.19Å; I80-Q108 HydrophobicContact CG1-CG 3.79Å; H104-Q108 WeakPolarHBondContact O-CB 3.33Å; H104-Q108 PolarHBondContact O-N 3.4Å; L105-Q108 WeakPolarHBondContact O-CB 3.36Å; L105-Q108 PolarHBondContact O-N 3.03Å; Q106-Q108 VanDerWaalsContact C-N 3.31Å; Q106-Q108 PolarHBondContact O-N 2.95Å; Q108-L110 VanDerWaalsContact C-N 3.33Å; Q108-L110 PolarHBondContact O-N 2.86Å; Q108-I111 WeakPolarHBondContact O-CB 3.42Å; Q108-I111 PolarHBondContact O-N 3.18Å; Q108-E112 PolarHBondContact NE2-OE1 2.85Å; Q108-E112 WeakPolarHBondContact O-CG 3.4Å; Q108-E112 PolarHBondContact O-N 3.22Å; Q108-V173 HydrophobicContact CB-CG1 4.4Å; Q108-V173 HydrophobicContact CB-CG2 4.09Å; Q108-V173 HydrophobicContact CG-CG2 4.24Å
109H96.1Very high93.4Very high36 Ų3643.1 Ų43.117%0.16719%0.189CC..Hα-helixtrans-59.9-44.1175.5-179.754.9000112I80 Q81 L105 Q106 Q107 I111 E112 L113 F125I80-H109 HydrophobicContact CB-CB 4.05Å; I80-H109 HydrophobicContact CG2-CB 4.16Å; Q81-H109 PolarHBondContact NE2-CD2 3Å; L105-H109 PolarHBondContact O-N 3.5Å; Q106-H109 WeakPolarHBondContact O-CB 3.3Å; Q106-H109 PolarHBondContact O-N 3.04Å; Q107-H109 VanDerWaalsContact C-N 3.32Å; Q107-H109 PolarHBondContact O-N 3.39Å; H109-I111 VanDerWaalsContact C-N 3.31Å; H109-I111 PolarHBondContact O-N 3.04Å; H109-E112 WeakPolarHBondContact O-CB 3.29Å; H109-E112 PolarHBondContact O-N 3.32Å; H109-L113 PolarHBondContact O-N 3.14Å; H109-F125 AromaticContact CD2-CD2 3.96Å; H109-F125 AromaticContact CD2-CE2 3.75Å; H109-F125 AromaticContact CD2-CZ 3.87Å
110L94.6Very high93.5Very high1 Ų144.5 Ų44.51%0.00520%0.202CC..Hα-helixtrans-58.4-43.3174.2177.561000111.8Q106 Q107 Q108 E112 L113 I114 A122 F125 A126 L130 T147 L148Q106-L110 PolarHBondContact O-N 3.41Å; Q107-L110 WeakPolarHBondContact O-CB 3.44Å; Q107-L110 PolarHBondContact O-N 3.5Å; Q108-L110 VanDerWaalsContact C-N 3.33Å; Q108-L110 PolarHBondContact O-N 2.86Å; L110-E112 VanDerWaalsContact C-N 3.26Å; L110-E112 PolarHBondContact O-N 3.14Å; L110-L113 PolarHBondContact O-N 3Å; L110-I114 HydrophobicContact CD1-CD1 4.26Å; L110-I114 HydrophobicContact CD1-CG1 4.49Å; L110-I114 HydrophobicContact CG-CD1 4.02Å; L110-I114 VanDerWaalsContact O-CG1 3.3Å; L110-I114 WeakPolarHBondContact O-CG1 3.31Å; L110-I114 PolarHBondContact O-N 2.8Å; L110-A122 HydrophobicContact CD1-CB 3.65Å; L110-A122 VanDerWaalsContact CD1-O 3.28Å; L110-A122 WeakPolarHBondContact CD1-O 3.4Å; L110-F125 HydrophobicContact CB-CD1 4.12Å; L110-F125 HydrophobicContact CB-CE1 4.28Å; L110-F125 HydrophobicContact CD1-CD1 4.37Å; L110-A126 HydrophobicContact CD1-CB 4.47Å; L110-A126 HydrophobicContact CD2-CB 4.28Å; L110-L130 HydrophobicContact CB-CD1 4.09Å; L110-L130 HydrophobicContact CD2-CD1 3.61Å; L110-L130 HydrophobicContact CG-CD1 4.41Å; L110-T147 HydrophobicContact CB-CG2 4.41Å; L110-T147 HydrophobicContact CD2-CG2 3.65Å; L110-T147 HydrophobicContact CG-CG2 3.87Å; L110-L148 HydrophobicContact CD2-CD2 4.17Å
111I95.1Very high93.6Very high0 Ų039.9 Ų39.90%019%0.191CC..Hα-helixtrans-58.4-39.5174.6-68.2166.9000110.9Q107 Q108 H109 I114 R115 T147 L164 L165 Q169Q107-I111 HydrophobicContact CG-CD1 4.34Å; Q107-I111 WeakPolarHBondContact O-CG1 3.31Å; Q107-I111 PolarHBondContact O-N 3.4Å; Q108-I111 WeakPolarHBondContact O-CB 3.42Å; Q108-I111 PolarHBondContact O-N 3.18Å; H109-I111 VanDerWaalsContact C-N 3.31Å; H109-I111 PolarHBondContact O-N 3.04Å; I111-I114 PolarHBondContact O-N 2.96Å; I111-R115 WeakPolarHBondContact O-CB 3.47Å; I111-R115 PolarHBondContact O-N 2.9Å; I111-T147 HydrophobicContact CD1-CG2 4.45Å; I111-T147 HydrophobicContact CG1-CG2 3.63Å; I111-L164 HydrophobicContact CD1-CB 4.13Å; I111-L164 WeakPolarHBondContact CG2-O 3.49Å; I111-L165 HydrophobicContact CG2-CD2 3.83Å; I111-Q169 HydrophobicContact CD1-CG 4.17Å
112E96Very high93.5Very high10 Ų1039.7 Ų39.75%0.04719%0.19CC..Hα-helixtrans-68.7-38.2176.9-59.8-47.715300112.9I80 Q108 H109 L110 I114 R115 L116 R170I80-E112 HydrophobicContact CG1-CG 4.14Å; Q108-E112 PolarHBondContact NE2-OE1 2.85Å; Q108-E112 WeakPolarHBondContact O-CG 3.4Å; Q108-E112 PolarHBondContact O-N 3.22Å; H109-E112 WeakPolarHBondContact O-CB 3.29Å; H109-E112 PolarHBondContact O-N 3.32Å; L110-E112 VanDerWaalsContact C-N 3.26Å; L110-E112 PolarHBondContact O-N 3.14Å; E112-I114 VanDerWaalsContact C-N 3.33Å; E112-I114 PolarHBondContact O-N 3.34Å; E112-R115 WeakPolarHBondContact O-CB 3.43Å; E112-R115 PolarHBondContact O-N 3.42Å; E112-R115 WeakPolarHBondContact OE2-CD 3.41Å; E112-R115 IonicContact OE2-CZ 2.74Å; E112-R115 IonicContact OE2-NE 3.95Å; E112-R115 PolarHBondContact OE2-NE 2.92Å; E112-L116 WeakPolarHBondContact O-CG 3.46Å; E112-L116 PolarHBondContact O-N 3.24Å; E112-R170 IonicContact OE1-CZ 3.94Å; E112-R170 IonicContact OE1-NE 3.65Å; E112-R170 PolarHBondContact OE1-NE 3.02Å; E112-R170 IonicContact OE1-NH2 3.52Å; E112-R170 PolarHBondContact OE1-NH2 3.34Å; E112-R170 IonicContact OE2-CZ 3.41Å; E112-R170 IonicContact OE2-NE 2.82Å; E112-R170 IonicContact OE2-NH2 3.1Å; E112-R170 PolarHBondContact OE2-NH2 2.93Å
113L94.8Very high93.4Very high13 Ų1341 Ų417%0.06820%0.2CC..Hα-helixtrans-61.1-43172.8-65.3173.4000111.4H109 L110 R115 L116 R117 E118 A121 A122 F125H109-L113 PolarHBondContact O-N 3.14Å; L110-L113 PolarHBondContact O-N 3Å; L113-R115 VanDerWaalsContact C-N 3.34Å; L113-R115 PolarHBondContact O-N 2.99Å; L113-L116 CarbonylContact O-C 3.59Å; L113-L116 PolarHBondContact O-N 3.37Å; L113-R117 PolarHBondContact O-N 3.07Å; L113-R117 VanDerWaalsContact O-N 3.17Å; L113-E118 HydrophobicContact CD2-CB 4.46Å; L113-E118 WeakPolarHBondContact CD2-OE2 3.37Å; L113-E118 PolarHBondContact O-N 3.24Å; L113-A121 HydrophobicContact CD2-CB 4.3Å; L113-A122 HydrophobicContact CB-CB 3.89Å; L113-A122 HydrophobicContact CD1-CB 4.47Å; L113-F125 HydrophobicContact CD1-CB 4.02Å; L113-F125 HydrophobicContact CD1-CG 4.26Å
114I93.3Very high93.4Very high3 Ų347.4 Ų47.42%0.01523%0.23CC..Hα-helixtrans-63-41175.9-66164.6000111.1L110 I111 E112 L116 R117 A122 T147 L150 L151 P156 L165L110-I114 HydrophobicContact CD1-CD1 4.26Å; L110-I114 HydrophobicContact CD1-CG1 4.49Å; L110-I114 HydrophobicContact CG-CD1 4.02Å; L110-I114 VanDerWaalsContact O-CG1 3.3Å; L110-I114 WeakPolarHBondContact O-CG1 3.31Å; L110-I114 PolarHBondContact O-N 2.8Å; I111-I114 PolarHBondContact O-N 2.96Å; E112-I114 VanDerWaalsContact C-N 3.33Å; E112-I114 PolarHBondContact O-N 3.34Å; I114-L116 VanDerWaalsContact C-N 3.32Å; I114-L116 PolarHBondContact O-N 2.99Å; I114-R117 PolarHBondContact O-N 2.99Å; I114-R117 VanDerWaalsContact O-N 3.13Å; I114-R117 PolarHBondContact O-NH1 2.79Å; I114-A122 HydrophobicContact CG1-CB 4.2Å; I114-T147 HydrophobicContact CD1-CG2 3.99Å; I114-T147 WeakPolarHBondContact CD1-O 3.18Å; I114-L150 HydrophobicContact CD1-CB 4.25Å; I114-L150 HydrophobicContact CD1-CD1 4.33Å; I114-L150 HydrophobicContact CG2-CB 3.97Å; I114-L150 HydrophobicContact CG2-CD1 4.41Å; I114-L151 HydrophobicContact CD1-CD2 4.41Å; I114-L151 HydrophobicContact CD1-CG 4.2Å; I114-L151 HydrophobicContact CG1-CD2 3.76Å; I114-L151 HydrophobicContact CG1-CG 4.09Å; I114-P156 HydrophobicContact CG2-CB 4.29Å; I114-P156 HydrophobicContact CG2-CG 4.29Å; I114-L165 HydrophobicContact CG2-CD2 4.5Å
115R92.3Very high93.3Very high66 Ų6647 Ų4725%0.24923%0.228CC..Hα-helixtrans-61.5-40.7175.9-172-168-61.2-85.1-0.8111.6I111 E112 L113 R117 L165I111-R115 WeakPolarHBondContact O-CB 3.47Å; I111-R115 PolarHBondContact O-N 2.9Å; E112-R115 WeakPolarHBondContact O-CB 3.43Å; E112-R115 PolarHBondContact O-N 3.42Å; E112-R115 WeakPolarHBondContact OE2-CD 3.41Å; E112-R115 IonicContact OE2-CZ 2.74Å; E112-R115 IonicContact OE2-NE 3.95Å; E112-R115 PolarHBondContact OE2-NE 2.92Å; L113-R115 VanDerWaalsContact C-N 3.34Å; L113-R115 PolarHBondContact O-N 2.99Å; R115-R117 PolarHBondContact O-N 3.38Å; R115-L165 HydrophobicContact CB-CD2 4.09Å; R115-L165 PolarHBondContact NH1-O 3.04Å; R115-L165 VanDerWaalsContact NH2-C 3.31Å; R115-L165 PolarHBondContact NH2-O 3.41Å
116L92.4Very high93Very high114 Ų11447.4 Ų47.460%0.59723%0.231SC*.THydrogen-bonded Turntrans-76.7-2.1177.4-66.9174.6000113.7E112 L113 I114 E118E112-L116 WeakPolarHBondContact O-CG 3.46Å; E112-L116 PolarHBondContact O-N 3.24Å; L113-L116 CarbonylContact O-C 3.59Å; L113-L116 PolarHBondContact O-N 3.37Å; I114-L116 VanDerWaalsContact C-N 3.32Å; I114-L116 PolarHBondContact O-N 2.99Å; L116-E118 HydrophobicContact CB-CG 3.99Å; L116-E118 PolarHBondContact O-N 3.26Å
117R91.3Very high92.6Very high118 Ų11854 Ų5445%0.44526%0.262SS..THydrogen-bonded Turntrans61.625.2-175.5-58.1-69.9-169.2-103.8-3.7113.3L113 I114 R115 T119L113-R117 PolarHBondContact O-N 3.07Å; L113-R117 VanDerWaalsContact O-N 3.17Å; I114-R117 PolarHBondContact O-N 2.99Å; I114-R117 VanDerWaalsContact O-N 3.13Å; I114-R117 PolarHBondContact O-NH1 2.79Å; R115-R117 PolarHBondContact O-N 3.38Å; R117-T119 VanDerWaalsContact C-N 3.25Å; R117-T119 PolarHBondContact O-N 3.15Å
118E93.1Very high92.1Very high95 Ų9556.7 Ų56.744%0.44428%0.281SS..  trans-85.266.7174.9-63.6-175.9-174.800109.9L113 L116 E120 A121 A122L113-E118 HydrophobicContact CD2-CB 4.46Å; L113-E118 WeakPolarHBondContact CD2-OE2 3.37Å; L113-E118 PolarHBondContact O-N 3.24Å; L116-E118 HydrophobicContact CB-CG 3.99Å; L116-E118 PolarHBondContact O-N 3.26Å; E118-E120 PolarHBondContact O-N 3.28Å; E118-A121 HydrophobicContact CB-CB 4.14Å; E118-A121 PolarHBondContact O-N 2.94Å; E118-A122 WeakPolarHBondContact O-CB 3.37Å; E118-A122 PolarHBondContact O-N 3.43Å
119T89.7Confident91.2Very high71 Ų7161.1 Ų61.144%0.43630%0.302SS..Hα-helixtrans-62.9-39.9-171.951.90000113.5R117 A122 L123 L151R117-T119 VanDerWaalsContact C-N 3.25Å; R117-T119 PolarHBondContact O-N 3.15Å; T119-A122 PolarHBondContact O-N 2.97Å; T119-L123 WeakPolarHBondContact O-CB 3.36Å; T119-L123 WeakPolarHBondContact O-CG 3.38Å; T119-L123 PolarHBondContact O-N 3.36Å; T119-L151 HydrophobicContact CG2-CD2 4.07Å
120E91.3Very high90.1Very high165 Ų16559.5 Ų59.577%0.77129%0.294SS*.Hα-helixtrans-63-48.6177.6-67.8-178.117500111E118 A122 L123 E124E118-E120 PolarHBondContact O-N 3.28Å; E120-A122 VanDerWaalsContact C-N 3.34Å; E120-A122 PolarHBondContact O-N 2.77Å; E120-L123 PolarHBondContact O-N 3.4Å; E120-E124 WeakPolarHBondContact O-CB 3.48Å; E120-E124 PolarHBondContact O-N 3.4Å
121A92.6Very high88.9Confident35 Ų3561.6 Ų61.629%0.28931%0.312SS..Hα-helixtrans-63.1-40.717700000111.7L113 E118 L123 E124 F125L113-A121 HydrophobicContact CD2-CB 4.3Å; E118-A121 HydrophobicContact CB-CB 4.14Å; E118-A121 PolarHBondContact O-N 2.94Å; A121-L123 PolarHBondContact O-N 3.43Å; A121-E124 PolarHBondContact O-N 2.96Å; A121-F125 WeakPolarHBondContact O-CB 3.42Å; A121-F125 PolarHBondContact O-N 3.19Å
122A92.6Very high87.7Confident0 Ų069.2 Ų69.20%035%0.348CS..Hα-helixtrans-60.5-43.3175.900000112.2L110 L113 I114 E118 T119 E120 A126 L151L110-A122 HydrophobicContact CD1-CB 3.65Å; L110-A122 VanDerWaalsContact CD1-O 3.28Å; L110-A122 WeakPolarHBondContact CD1-O 3.4Å; L113-A122 HydrophobicContact CB-CB 3.89Å; L113-A122 HydrophobicContact CD1-CB 4.47Å; I114-A122 HydrophobicContact CG1-CB 4.2Å; E118-A122 WeakPolarHBondContact O-CB 3.37Å; E118-A122 PolarHBondContact O-N 3.43Å; T119-A122 PolarHBondContact O-N 2.97Å; E120-A122 VanDerWaalsContact C-N 3.34Å; E120-A122 PolarHBondContact O-N 2.77Å; A122-A126 VanDerWaalsContact O-CB 3.31Å; A122-A126 WeakPolarHBondContact O-CB 3.24Å; A122-A126 PolarHBondContact O-N 3.12Å; A122-L151 HydrophobicContact CB-CD1 4.49Å; A122-L151 HydrophobicContact CB-CD2 4.14Å
123L90.6Very high86.4Confident84 Ų8470.6 Ų70.644%0.4435%0.354SS..Hα-helixtrans-68.3-45.6178.2-74.6170.8000112T119 E120 A121 F125 A126 Q127 L151T119-L123 WeakPolarHBondContact O-CB 3.36Å; T119-L123 WeakPolarHBondContact O-CG 3.38Å; T119-L123 PolarHBondContact O-N 3.36Å; E120-L123 PolarHBondContact O-N 3.4Å; A121-L123 PolarHBondContact O-N 3.43Å; L123-F125 VanDerWaalsContact C-N 3.32Å; L123-F125 PolarHBondContact O-N 2.96Å; L123-A126 PolarHBondContact O-N 2.99Å; L123-Q127 WeakPolarHBondContact O-CB 3.47Å; L123-Q127 VanDerWaalsContact O-CG 3.29Å; L123-Q127 WeakPolarHBondContact O-CG 3.35Å; L123-Q127 PolarHBondContact O-N 3.37Å; L123-L151 HydrophobicContact CD2-CD1 3.74Å; L123-L151 HydrophobicContact CG-CD1 4.12Å
124E92.1Very high84.7Confident139 Ų13970 Ų7065%0.6535%0.351SS*.Hα-helixtrans-60.4-44.5176.6-176.9176.8-170.400111.1E120 A121 Q127 S128E120-E124 WeakPolarHBondContact O-CB 3.48Å; E120-E124 PolarHBondContact O-N 3.4Å; A121-E124 PolarHBondContact O-N 2.96Å; E124-Q127 PolarHBondContact O-N 3.08Å; E124-S128 WeakPolarHBondContact O-CB 3.46Å; E124-S128 PolarHBondContact O-N 3.2Å; E124-S128 PolarHBondContact O-OG 3.15Å
125F91.1Very high83.3Confident26 Ų2678 Ų7811%0.11439%0.388CS..Hα-helixtrans-62.5-45.9177.2-177.6-96.8000111.8Q106 H109 L110 L113 A121 L123 Q127 S128 Q129 L130Q106-F125 HydrophobicContact CB-CE1 4.28Å; Q106-F125 HydrophobicContact CB-CZ 3.95Å; Q106-F125 HydrophobicContact CG-CZ 4.3Å; Q106-F125 WeakPolarHBondContact O-CE1 3.33Å; H109-F125 AromaticContact CD2-CD2 3.96Å; H109-F125 AromaticContact CD2-CE2 3.75Å; H109-F125 AromaticContact CD2-CZ 3.87Å; L110-F125 HydrophobicContact CB-CD1 4.12Å; L110-F125 HydrophobicContact CB-CE1 4.28Å; L110-F125 HydrophobicContact CD1-CD1 4.37Å; L113-F125 HydrophobicContact CD1-CB 4.02Å; L113-F125 HydrophobicContact CD1-CG 4.26Å; A121-F125 WeakPolarHBondContact O-CB 3.42Å; A121-F125 PolarHBondContact O-N 3.19Å; L123-F125 VanDerWaalsContact C-N 3.32Å; L123-F125 PolarHBondContact O-N 2.96Å; F125-Q127 VanDerWaalsContact C-N 3.35Å; F125-Q127 PolarHBondContact O-N 2.93Å; F125-S128 PolarHBondContact O-N 3.14Å; F125-S128 PolarHBondContact O-OG 3.28Å; F125-Q129 HydrophobicContact CD2-CB 4.27Å; F125-Q129 HydrophobicContact CD2-CG 3.97Å; F125-Q129 HydrophobicContact CE1-CB 4.46Å; F125-Q129 HydrophobicContact CE2-CB 3.81Å; F125-Q129 HydrophobicContact CE2-CG 3.66Å; F125-Q129 HydrophobicContact CZ-CB 3.88Å; F125-Q129 HydrophobicContact CZ-CG 4.25Å; F125-Q129 PolarHBondContact O-N 3.03Å; F125-L130 HydrophobicContact CD1-CD1 3.91Å; F125-L130 HydrophobicContact CE1-CD1 3.58Å; F125-L130 HydrophobicContact CE1-CG 4.01Å
126A88.6Confident82.2Confident8 Ų879.9 Ų79.97%0.06640%0.4CS..Iπ-helixtrans-62.8-40.4178.800000112.9L110 A122 L123 L130 A131 L148L110-A126 HydrophobicContact CD1-CB 4.47Å; L110-A126 HydrophobicContact CD2-CB 4.28Å; A122-A126 VanDerWaalsContact O-CB 3.31Å; A122-A126 WeakPolarHBondContact O-CB 3.24Å; A122-A126 PolarHBondContact O-N 3.12Å; L123-A126 PolarHBondContact O-N 2.99Å; A126-L130 PolarHBondContact O-N 3.26Å; A126-A131 PolarHBondContact O-N 3.14Å; A126-A131 VanDerWaalsContact O-N 3.12Å; A126-L148 HydrophobicContact CB-CD2 3.68Å
127Q86.2Confident81.5Confident147 Ų14775 Ų7569%0.68738%0.375SS*.Iπ-helixtrans-70.5-36.8179.1-72.3174.74.600112.9L123 E124 F125 A131L123-Q127 WeakPolarHBondContact O-CB 3.47Å; L123-Q127 VanDerWaalsContact O-CG 3.29Å; L123-Q127 WeakPolarHBondContact O-CG 3.35Å; L123-Q127 PolarHBondContact O-N 3.37Å; E124-Q127 PolarHBondContact O-N 3.08Å; F125-Q127 VanDerWaalsContact C-N 3.35Å; F125-Q127 PolarHBondContact O-N 2.93Å; Q127-A131 WeakPolarHBondContact O-CB 3.4Å
128S84.2Confident81.1Confident59 Ų5978.7 Ų78.741%0.41339%0.389SS..Iπ-helixtrans-88-41.9-17457.20000113.8E124 F125E124-S128 WeakPolarHBondContact O-CB 3.46Å; E124-S128 PolarHBondContact O-N 3.2Å; E124-S128 PolarHBondContact O-OG 3.15Å; F125-S128 PolarHBondContact O-N 3.14Å; F125-S128 PolarHBondContact O-OG 3.28Å
129Q77.4Confident80.7Confident93 Ų9380.4 Ų80.444%0.43540%0.397SS..Iπ-helixtrans-106.3-34.3-169.6-63.8-63.8-36.600113.2F125F125-Q129 HydrophobicContact CD2-CB 4.27Å; F125-Q129 HydrophobicContact CD2-CG 3.97Å; F125-Q129 HydrophobicContact CE1-CB 4.46Å; F125-Q129 HydrophobicContact CE2-CB 3.81Å; F125-Q129 HydrophobicContact CE2-CG 3.66Å; F125-Q129 HydrophobicContact CZ-CB 3.88Å; F125-Q129 HydrophobicContact CZ-CG 4.25Å; F125-Q129 PolarHBondContact O-N 3.03Å
130L73.1Confident80.5Confident2 Ų277.4 Ų77.41%0.0138%0.379CS..Iπ-helixtrans-95.7-25.6-172.8-76.3161.7000113.5F103 Q106 L110 F125 A126 E132 Q133 G134 M144F103-L130 HydrophobicContact CD2-CD2 3.89Å; F103-L130 HydrophobicContact CE2-CD2 3.73Å; Q106-L130 HydrophobicContact CB-CD2 4.08Å; L110-L130 HydrophobicContact CB-CD1 4.09Å; L110-L130 HydrophobicContact CD2-CD1 3.61Å; L110-L130 HydrophobicContact CG-CD1 4.41Å; F125-L130 HydrophobicContact CD1-CD1 3.91Å; F125-L130 HydrophobicContact CE1-CD1 3.58Å; F125-L130 HydrophobicContact CE1-CG 4.01Å; A126-L130 PolarHBondContact O-N 3.26Å; L130-E132 VanDerWaalsContact C-N 3.34Å; L130-E132 PolarHBondContact O-N 3.01Å; L130-Q133 PolarHBondContact O-N 3.26Å; L130-G134 PolarHBondContact O-N 3.26Å; L130-M144 HydrophobicContact CB-SD 3.92Å
131A69.8Low80.1Confident46 Ų4672.3 Ų72.338%0.3836%0.357SS..Hα-helixtrans-59.6-42.2179.100000112.7A126 Q127A126-A131 PolarHBondContact O-N 3.14Å; A126-A131 VanDerWaalsContact O-N 3.12Å; Q127-A131 WeakPolarHBondContact O-CB 3.4Å
132E70.4Confident79.9Confident159 Ų15973.9 Ų73.974%0.74336%0.363SS*.Hα-helixtrans-70.4-31.3178.2-64-174.2171.900112.5L130L130-E132 VanDerWaalsContact C-N 3.34Å; L130-E132 PolarHBondContact O-N 3.01Å
133Q67.1Low79.7Confident40 Ų4075.7 Ų75.719%0.18737%0.371CS..Hα-helixtrans-83.5-29.3-178.5-63.6-118.2-46.600112.9F103 L130 E135 E136F103-Q133 HydrophobicContact CD2-CB 4.14Å; L130-Q133 PolarHBondContact O-N 3.26Å; Q133-E135 VanDerWaalsContact C-N 3.29Å; Q133-E135 PolarHBondContact O-N 3.03Å; Q133-E136 PolarHBondContact O-N 2.99Å
134G60.7Low79.5Confident0 Ų073 Ų730%036%0.356CS..Hα-helixtrans-61.3-36.2178.500000112.4L130 E136 L141L130-G134 PolarHBondContact O-N 3.26Å; G134-E136 PolarHBondContact O-N 3.27Å; G134-E136 VanDerWaalsContact O-N 3.13Å; G134-L141 WeakPolarHBondContact O-CD2 3.5Å; G134-L141 WeakPolarHBondContact O-CG 3.36Å
135E63.7Low79.4Confident170 Ų17072.3 Ų72.379%0.79435%0.354SS*.THydrogen-bonded Turntrans-67.5-14.8-176.8-65.4-172.7174.700114.3Q133Q133-E135 VanDerWaalsContact C-N 3.29Å; Q133-E135 PolarHBondContact O-N 3.03Å
136E68.9Low79.5Confident106 Ų10674.1 Ų74.150%0.49536%0.359SS..THydrogen-bonded Turntrans-77.6-26.7-175.5-60-163.5162.500113.6R99 Q133 G134R99-E136 WeakPolarHBondContact CD-OE2 3.48Å; R99-E136 IonicContact CZ-OE1 3.53Å; R99-E136 VanDerWaalsContact NH1-CD 3.34Å; R99-E136 IonicContact NH1-OE1 3.6Å; R99-E136 PolarHBondContact NH1-OE1 3.25Å; R99-E136 IonicContact NH1-OE2 3.51Å; R99-E136 PolarHBondContact NH1-OE2 3.03Å; Q133-E136 PolarHBondContact O-N 2.99Å; G134-E136 PolarHBondContact O-N 3.27Å; G134-E136 VanDerWaalsContact O-N 3.13Å
137S77.9Confident79.6Confident11 Ų1173.7 Ų73.78%0.07736%0.356CS..  trans-150.2137-176.8159.50000112.3E139 C140 L141S137-E139 VanDerWaalsContact C-N 3.27Å; S137-E139 PolarHBondContact O-N 3.5Å; S137-E139 PolarHBondContact OG-N 3.29Å; S137-E139 PolarHBondContact OG-OE2 3.48Å; S137-C140 WeakPolarHBondContact O-CB 3.39Å; S137-C140 PolarHBondContact O-N 3.14Å; S137-C140 PolarHBondContact OG-N 3.37Å; S137-L141 PolarHBondContact O-N 2.71Å
138R82.2Confident79.9Confident197 Ų19769.3 Ų69.374%0.74334%0.337SS*.Hα-helixtrans-66.8-31.1179.6-169.315366.3136.60.5112.6T142R138-T142 PolarHBondContact O-N 3.1Å; R138-T142 VanDerWaalsContact O-N 3.12Å; R138-T142 PolarHBondContact O-OG1 2.84Å
139E84.8Confident80.2Confident130 Ų13067.9 Ų67.961%0.60733%0.329SS*.Hα-helixtrans-65.2-45.9173.3-62.473.1-161.800110.8S137 L141 T142 E143S137-E139 VanDerWaalsContact C-N 3.27Å; S137-E139 PolarHBondContact O-N 3.5Å; S137-E139 PolarHBondContact OG-N 3.29Å; S137-E139 PolarHBondContact OG-OE2 3.48Å; E139-L141 PolarHBondContact O-N 3.3Å; E139-T142 PolarHBondContact O-N 3.28Å; E139-E143 PolarHBondContact O-N 3.27Å
140C84.4Confident81Confident8 Ų863.4 Ų63.45%0.05431%0.308CS..Hα-helixtrans-60.9-41.4175.2-69.30000112.1F103 S137 T142 E143 M144F103-C140 HydrophobicContact CD1-CB 4.28Å; F103-C140 HydrophobicContact CD2-CB 4.34Å; F103-C140 HydrophobicContact CE1-CB 3.92Å; F103-C140 HydrophobicContact CE2-CB 3.97Å; F103-C140 HydrophobicContact CG-CB 4.49Å; F103-C140 HydrophobicContact CZ-CB 3.75Å; F103-C140 WeakPolarHBondContact CZ-O 3.44Å; S137-C140 WeakPolarHBondContact O-CB 3.39Å; S137-C140 PolarHBondContact O-N 3.14Å; S137-C140 PolarHBondContact OG-N 3.37Å; C140-T142 PolarHBondContact O-N 2.98Å; C140-E143 PolarHBondContact O-N 2.7Å; C140-M144 WeakPolarHBondContact O-CB 3.2Å; C140-M144 PolarHBondContact O-N 2.74Å
141L84.7Confident81.8Confident59 Ų5965.4 Ų65.431%0.30932%0.318SS..Hα-helixtrans-58.3-47.5173.5-70.5175.2000112.1G134 S137 E139 E143 M144 E145G134-L141 WeakPolarHBondContact O-CD2 3.5Å; G134-L141 WeakPolarHBondContact O-CG 3.36Å; S137-L141 PolarHBondContact O-N 2.71Å; E139-L141 PolarHBondContact O-N 3.3Å; L141-E143 VanDerWaalsContact C-N 3.32Å; L141-E143 PolarHBondContact O-N 3.45Å; L141-M144 HydrophobicContact CD2-CE 3.93Å; L141-M144 PolarHBondContact O-N 3.42Å; L141-E145 WeakPolarHBondContact O-CB 3.34Å; L141-E145 WeakPolarHBondContact O-CG 3.47Å; L141-E145 PolarHBondContact O-N 3.06Å
142T87.9Confident82.8Confident67 Ų6767.4 Ų67.441%0.41134%0.335SS..Hα-helixtrans-62.3-43.1-178.2-58.70000110.8R138 E139 C140 M144 E145 R146R138-T142 PolarHBondContact O-N 3.1Å; R138-T142 VanDerWaalsContact O-N 3.12Å; R138-T142 PolarHBondContact O-OG1 2.84Å; E139-T142 PolarHBondContact O-N 3.28Å; C140-T142 PolarHBondContact O-N 2.98Å; T142-M144 VanDerWaalsContact C-N 3.35Å; T142-E145 PolarHBondContact O-N 2.98Å; T142-R146 VanDerWaalsContact O-CG 3.28Å; T142-R146 WeakPolarHBondContact O-CG 3.45Å; T142-R146 PolarHBondContact O-N 3.18Å; T142-R146 VanDerWaalsContact O-N 3.08Å
143E87.9Confident83.7Confident38 Ų3864 Ų6418%0.17832%0.318CS..Hα-helixtrans-65.7-37.2176.9-74-63.6125.800112.4F103 Q107 E139 C140 L141 R146 T147F103-E143 HydrophobicContact CE1-CB 4.37Å; Q107-E143 PolarHBondContact NE2-O 2.58Å; Q107-E143 PolarHBondContact NE2-OE2 3.17Å; E139-E143 PolarHBondContact O-N 3.27Å; C140-E143 PolarHBondContact O-N 2.7Å; L141-E143 VanDerWaalsContact C-N 3.32Å; L141-E143 PolarHBondContact O-N 3.45Å; E143-R146 IonicContact OE1-CZ 2.78Å; E143-R146 IonicContact OE1-NH1 3.94Å; E143-R146 PolarHBondContact OE1-NH1 3.15Å; E143-R146 IonicContact OE2-NH1 2.9Å; E143-T147 PolarHBondContact O-N 3.49Å; E143-T147 VanDerWaalsContact O-N 3.07Å; E143-T147 PolarHBondContact O-OG1 3.22Å
144M87.3Confident84.6Confident27 Ų2769.6 Ų69.613%0.13335%0.349CS..Hα-helixtrans-66.8-45.9174.9-174177.469.900112F103 L130 C140 L141 T142 R146 T147 L148F103-M144 HydrophobicContact CZ-CB 4.42Å; L130-M144 HydrophobicContact CB-SD 3.92Å; C140-M144 WeakPolarHBondContact O-CB 3.2Å; C140-M144 PolarHBondContact O-N 2.74Å; L141-M144 HydrophobicContact CD2-CE 3.93Å; L141-M144 PolarHBondContact O-N 3.42Å; T142-M144 VanDerWaalsContact C-N 3.35Å; M144-R146 VanDerWaalsContact C-N 3.33Å; M144-R146 PolarHBondContact O-N 3.03Å; M144-T147 PolarHBondContact O-N 3.49Å; M144-T147 VanDerWaalsContact O-N 3.14Å; M144-L148 HydrophobicContact CG-CD1 3.95Å; M144-L148 HydrophobicContact CG-CG 4.42Å; M144-L148 WeakPolarHBondContact O-CB 3.45Å; M144-L148 WeakPolarHBondContact O-CG 3.24Å; M144-L148 PolarHBondContact O-N 3.14Å
145E89.3Confident86Confident126 Ų12673.6 Ų73.659%0.58937%0.371SS*.Hα-helixtrans-58.3-44.5176.5-74.6174.7163.400111.4L141 T142 T147 L148 A149L141-E145 WeakPolarHBondContact O-CB 3.34Å; L141-E145 WeakPolarHBondContact O-CG 3.47Å; L141-E145 PolarHBondContact O-N 3.06Å; T142-E145 PolarHBondContact O-N 2.98Å; E145-T147 VanDerWaalsContact C-N 3.32Å; E145-T147 PolarHBondContact O-N 2.82Å; E145-L148 PolarHBondContact O-N 2.88Å; E145-A149 VanDerWaalsContact O-CB 3.27Å; E145-A149 WeakPolarHBondContact O-CB 3.33Å; E145-A149 PolarHBondContact O-N 3.38Å
146R92.2Very high87.2Confident63 Ų6365.8 Ų65.824%0.23834%0.335CS..Hα-helixtrans-60.2-42.8175-70.8175.867.4-162.6-0111.9T142 E143 M144 F161 D163 L164T142-R146 VanDerWaalsContact O-CG 3.28Å; T142-R146 WeakPolarHBondContact O-CG 3.45Å; T142-R146 PolarHBondContact O-N 3.18Å; T142-R146 VanDerWaalsContact O-N 3.08Å; E143-R146 IonicContact OE1-CZ 2.78Å; E143-R146 IonicContact OE1-NH1 3.94Å; E143-R146 PolarHBondContact OE1-NH1 3.15Å; E143-R146 IonicContact OE2-NH1 2.9Å; M144-R146 VanDerWaalsContact C-N 3.33Å; M144-R146 PolarHBondContact O-N 3.03Å; R146-F161 HydrophobicContact CB-CD1 4.11Å; R146-F161 HydrophobicContact CB-CE1 4.3Å; R146-F161 HydrophobicContact CB-CG 4.25Å; R146-F161 HydrophobicContact CG-CD1 3.97Å; R146-F161 HydrophobicContact CG-CE1 3.73Å; R146-F161 HydrophobicContact CG-CZ 4.13Å; R146-D163 IonicContact NH2-OD1 2.62Å; R146-D163 IonicContact NH2-OD2 3.56Å; R146-D163 PolarHBondContact NH2-OD2 2.84Å; R146-L164 HydrophobicContact CB-CD1 4.22Å
147T92.4Very high88.2Confident0 Ų066.9 Ų66.90%034%0.34CS..Hα-helixtrans-67.4-44.7180-52.70000111.1Q107 L110 I111 I114 E143 M144 E145 A149 L150Q107-T147 PolarHBondContact NE2-OG1 2.98Å; L110-T147 HydrophobicContact CB-CG2 4.41Å; L110-T147 HydrophobicContact CD2-CG2 3.65Å; L110-T147 HydrophobicContact CG-CG2 3.87Å; I111-T147 HydrophobicContact CD1-CG2 4.45Å; I111-T147 HydrophobicContact CG1-CG2 3.63Å; I114-T147 HydrophobicContact CD1-CG2 3.99Å; I114-T147 WeakPolarHBondContact CD1-O 3.18Å; E143-T147 PolarHBondContact O-N 3.49Å; E143-T147 VanDerWaalsContact O-N 3.07Å; E143-T147 PolarHBondContact O-OG1 3.22Å; M144-T147 PolarHBondContact O-N 3.49Å; M144-T147 VanDerWaalsContact O-N 3.14Å; E145-T147 VanDerWaalsContact C-N 3.32Å; E145-T147 PolarHBondContact O-N 2.82Å; T147-A149 VanDerWaalsContact C-N 3.35Å; T147-A149 PolarHBondContact O-N 3.48Å; T147-L150 VanDerWaalsContact O-CB 3.24Å; T147-L150 WeakPolarHBondContact O-CB 3.4Å; T147-L150 WeakPolarHBondContact O-CG 3.41Å; T147-L150 PolarHBondContact O-N 2.98Å
148L90.6Very high88.8Confident54 Ų5474 Ų7428%0.28337%0.372SS..Hα-helixtrans-68.7-32.7178.1-74.2172.8000112.8L110 A126 M144 E145 L150 L151L110-L148 HydrophobicContact CD2-CD2 4.17Å; A126-L148 HydrophobicContact CB-CD2 3.68Å; M144-L148 HydrophobicContact CG-CD1 3.95Å; M144-L148 HydrophobicContact CG-CG 4.42Å; M144-L148 WeakPolarHBondContact O-CB 3.45Å; M144-L148 WeakPolarHBondContact O-CG 3.24Å; M144-L148 PolarHBondContact O-N 3.14Å; E145-L148 PolarHBondContact O-N 2.88Å; L148-L150 PolarHBondContact O-N 3.23Å; L148-L150 VanDerWaalsContact O-N 3.15Å; L148-L151 HydrophobicContact CD2-CD1 3.9Å; L148-L151 WeakPolarHBondContact O-CB 3.28Å; L148-L151 PolarHBondContact O-N 3.1Å
149A92.4Very high89.2Confident29 Ų2965.1 Ų65.124%0.2434%0.34CS..Hα-helixtrans-58.1-27.6175.400000112.2E145 T147 L151 A152 F153 F161E145-A149 VanDerWaalsContact O-CB 3.27Å; E145-A149 WeakPolarHBondContact O-CB 3.33Å; E145-A149 PolarHBondContact O-N 3.38Å; T147-A149 VanDerWaalsContact C-N 3.35Å; T147-A149 PolarHBondContact O-N 3.48Å; A149-L151 PolarHBondContact O-N 3.19Å; A149-A152 WeakPolarHBondContact O-CB 3.41Å; A149-A152 PolarHBondContact O-N 2.89Å; A149-F153 WeakPolarHBondContact O-CD2 3.48Å; A149-F153 VanDerWaalsContact O-CE2 3.28Å; A149-F153 WeakPolarHBondContact O-CE2 3.13Å; A149-F161 HydrophobicContact CB-CD2 3.72Å; A149-F161 HydrophobicContact CB-CE2 3.57Å
150L92.5Very high89.5Confident0 Ų063.7 Ų63.70%034%0.342CS..G310 helixtrans-57.4-33.2173.9-65.5173.5000112.8I114 T147 L148 A152 F153 P156 S159 F161 L164 L165I114-L150 HydrophobicContact CD1-CB 4.25Å; I114-L150 HydrophobicContact CD1-CD1 4.33Å; I114-L150 HydrophobicContact CG2-CB 3.97Å; I114-L150 HydrophobicContact CG2-CD1 4.41Å; T147-L150 VanDerWaalsContact O-CB 3.24Å; T147-L150 WeakPolarHBondContact O-CB 3.4Å; T147-L150 WeakPolarHBondContact O-CG 3.41Å; T147-L150 PolarHBondContact O-N 2.98Å; L148-L150 PolarHBondContact O-N 3.23Å; L148-L150 VanDerWaalsContact O-N 3.15Å; L150-A152 PolarHBondContact O-N 3.37Å; L150-F153 PolarHBondContact O-N 3.39Å; L150-P156 HydrophobicContact CB-CB 4.27Å; L150-P156 HydrophobicContact CD2-CB 4.24Å; L150-P156 WeakPolarHBondContact O-CG 3.46Å; L150-S159 WeakPolarHBondContact CD2-OG 3.48Å; L150-F161 HydrophobicContact CD2-CB 3.79Å; L150-F161 HydrophobicContact CG-CB 4.34Å; L150-L164 HydrophobicContact CD1-CB 4.31Å; L150-L164 HydrophobicContact CD1-CD1 4.3Å; L150-L165 HydrophobicContact CD1-CD1 4.49Å; L150-L165 HydrophobicContact CD1-CG 4.28Å; L150-L165 HydrophobicContact CD2-CD1 4.38Å
151L90.3Very high89.9Confident43 Ų4366 Ų6623%0.22535%0.351CS..G310 helixtrans-67.5-18.9178.7-68168.3000112.9I114 T119 A122 L123 L148 A149 F153I114-L151 HydrophobicContact CD1-CD2 4.41Å; I114-L151 HydrophobicContact CD1-CG 4.2Å; I114-L151 HydrophobicContact CG1-CD2 3.76Å; I114-L151 HydrophobicContact CG1-CG 4.09Å; T119-L151 HydrophobicContact CG2-CD2 4.07Å; A122-L151 HydrophobicContact CB-CD1 4.49Å; A122-L151 HydrophobicContact CB-CD2 4.14Å; L123-L151 HydrophobicContact CD2-CD1 3.74Å; L123-L151 HydrophobicContact CG-CD1 4.12Å; L148-L151 HydrophobicContact CD2-CD1 3.9Å; L148-L151 WeakPolarHBondContact O-CB 3.28Å; L148-L151 PolarHBondContact O-N 3.1Å; A149-L151 PolarHBondContact O-N 3.19Å; L151-F153 VanDerWaalsContact C-N 3.3Å
152A90.4Very high90.1Very high88 Ų8863.9 Ų63.973%0.72734%0.344SS*.G310 helixtrans-82.4-7.1179.700000113.5A149 L150A149-A152 WeakPolarHBondContact O-CB 3.41Å; A149-A152 PolarHBondContact O-N 2.89Å; L150-A152 PolarHBondContact O-N 3.37Å
153F90.4Very high90.3Very high88 Ų8864.9 Ų64.939%0.38635%0.346SS..  trans-108.1135.5-178.9-62.5-88.3000111A149 L150 L151 N155 P156A149-F153 WeakPolarHBondContact O-CD2 3.48Å; A149-F153 VanDerWaalsContact O-CE2 3.28Å; A149-F153 WeakPolarHBondContact O-CE2 3.13Å; L150-F153 PolarHBondContact O-N 3.39Å; L151-F153 VanDerWaalsContact C-N 3.3Å; F153-N155 PolarHBondContact O-N 3.21Å; F153-P156 WeakPolarHBondContact O-CD 3.47Å
154D86.5Confident90.5Very high158 Ų15863.1 Ų63.185%0.84534%0.338SS*.SBendtrans-61.4-36.5173.2-62.3-42.5000111.7P156D154-P156 WeakPolarHBondContact O-CD 3.35Å
155N88.9Confident90.7Very high84 Ų8462.2 Ų62.245%0.44933%0.334SS..SBendtrans-117.187.3173-68.5-24.9000110.7F153 E157 E158F153-N155 PolarHBondContact O-N 3.21Å; N155-E157 PolarHBondContact O-N 2.91Å; N155-E157 VanDerWaalsContact O-N 3.14Å; N155-E158 HydrophobicContact CB-CB 4.25Å; N155-E158 HydrophobicContact CB-CG 4.2Å; N155-E158 PolarHBondContact ND2-OE2 3.04Å; N155-E158 PolarHBondContact O-N 2.74Å; N155-E158 VanDerWaalsContact O-N 3.1Å
156P89.3Confident90.8Very high6 Ų660.6 Ų60.64%0.03933%0.329CS..G310 helixtrans-55.4-29.8178.9-31.538.5000115.1I114 L150 F153 D154 E158 S159 G162 L165I114-P156 HydrophobicContact CG2-CB 4.29Å; I114-P156 HydrophobicContact CG2-CG 4.29Å; L150-P156 HydrophobicContact CB-CB 4.27Å; L150-P156 HydrophobicContact CD2-CB 4.24Å; L150-P156 WeakPolarHBondContact O-CG 3.46Å; F153-P156 WeakPolarHBondContact O-CD 3.47Å; D154-P156 WeakPolarHBondContact O-CD 3.35Å; P156-E158 VanDerWaalsContact C-N 3.32Å; P156-E158 PolarHBondContact O-N 3.41Å; P156-S159 VanDerWaalsContact O-CB 3.28Å; P156-S159 WeakPolarHBondContact O-CB 3.47Å; P156-S159 PolarHBondContact O-N 3.31Å; P156-S159 PolarHBondContact O-OG 3.2Å; P156-G162 WeakPolarHBondContact O-CA 2.99Å; P156-L165 HydrophobicContact CB-CD1 3.53Å
157E89.8Confident90.7Very high128 Ų12861 Ų6160%0.59834%0.339SS*.G310 helixtrans-70.3-27.5179.6-63.3-175.4178.700113.2N155 S159 L165N155-E157 PolarHBondContact O-N 2.91Å; N155-E157 VanDerWaalsContact O-N 3.14Å; E157-S159 VanDerWaalsContact C-N 3.31Å; E157-L165 HydrophobicContact CG-CD1 3.92Å
158E90.9Very high90.7Very high160 Ų16066.6 Ų66.675%0.74837%0.367SS*.G310 helixtrans-89.8-0.9177.7-61.5-178.7150.100112.1N155 P156N155-E158 HydrophobicContact CB-CB 4.25Å; N155-E158 HydrophobicContact CB-CG 4.2Å; N155-E158 PolarHBondContact ND2-OE2 3.04Å; N155-E158 PolarHBondContact O-N 2.74Å; N155-E158 VanDerWaalsContact O-N 3.1Å; P156-E158 VanDerWaalsContact C-N 3.32Å; P156-E158 PolarHBondContact O-N 3.41Å
159S91Very high90.8Very high12 Ų1265 Ų658%0.08436%0.358CS..SBendtrans-74.3163.8-18080.10000112L150 P156 E157 F161 G162L150-S159 WeakPolarHBondContact CD2-OG 3.48Å; P156-S159 VanDerWaalsContact O-CB 3.28Å; P156-S159 WeakPolarHBondContact O-CB 3.47Å; P156-S159 PolarHBondContact O-N 3.31Å; P156-S159 PolarHBondContact O-OG 3.2Å; E157-S159 VanDerWaalsContact C-N 3.31Å; S159-F161 PolarHBondContact O-N 3.07Å; S159-F161 PolarHBondContact OG-N 3.45Å; S159-G162 PolarHBondContact O-N 3.14Å; S159-G162 PolarHBondContact OG-N 3.33Å
160P90.8Very high91Very high99 Ų9965.3 Ų65.364%0.64335%0.353SS*.THydrogen-bonded Turntrans-57.3-15.3171.8-24.335000114.7
161F92.3Very high91Very high56 Ų5669.9 Ų69.925%0.24637%0.374CS..THydrogen-bonded Turntrans-114.414.1-179.3-48.8-56.4000112.6R146 A149 L150 S159 D163 L164R146-F161 HydrophobicContact CB-CD1 4.11Å; R146-F161 HydrophobicContact CB-CE1 4.3Å; R146-F161 HydrophobicContact CB-CG 4.25Å; R146-F161 HydrophobicContact CG-CD1 3.97Å; R146-F161 HydrophobicContact CG-CE1 3.73Å; R146-F161 HydrophobicContact CG-CZ 4.13Å; A149-F161 HydrophobicContact CB-CD2 3.72Å; A149-F161 HydrophobicContact CB-CE2 3.57Å; L150-F161 HydrophobicContact CD2-CB 3.79Å; L150-F161 HydrophobicContact CG-CB 4.34Å; S159-F161 PolarHBondContact O-N 3.07Å; S159-F161 PolarHBondContact OG-N 3.45Å; F161-D163 VanDerWaalsContact CA-OD1 3.28Å; F161-D163 WeakPolarHBondContact CA-OD1 3.39Å; F161-D163 PolarHBondContact O-N 3.34Å; F161-D163 VanDerWaalsContact O-N 3.08Å; F161-L164 HydrophobicContact CB-CD1 4.22Å; F161-L164 WeakPolarHBondContact O-CB 3.5Å; F161-L164 PolarHBondContact O-N 3.42Å
162G89.9Confident91.2Very high15 Ų1572.5 Ų72.516%0.15538%0.383CS..G310 helixtrans-60.1-17.7178.600000113.6P156 S159 L164 L165P156-G162 WeakPolarHBondContact O-CA 2.99Å; S159-G162 PolarHBondContact O-N 3.14Å; S159-G162 PolarHBondContact OG-N 3.33Å; G162-L164 PolarHBondContact O-N 3.43Å; G162-L165 WeakPolarHBondContact O-CB 3.42Å; G162-L165 PolarHBondContact O-N 3.08Å
163D91.8Very high91.4Very high88 Ų8868.4 Ų68.447%0.47135%0.349SS..G310 helixtrans-58.3-33.1171.964.4-47.7000112.8R146 F161 L165 N166R146-D163 IonicContact NH2-OD1 2.62Å; R146-D163 IonicContact NH2-OD2 3.56Å; R146-D163 PolarHBondContact NH2-OD2 2.84Å; F161-D163 VanDerWaalsContact CA-OD1 3.28Å; F161-D163 WeakPolarHBondContact CA-OD1 3.39Å; F161-D163 PolarHBondContact O-N 3.34Å; F161-D163 VanDerWaalsContact O-N 3.08Å; D163-L165 PolarHBondContact O-N 3.46Å; D163-N166 WeakPolarHBondContact O-CB 2.85Å; D163-N166 PolarHBondContact O-N 3.05Å
164L92.2Very high91.6Very high2 Ų264.7 Ų64.71%0.0133%0.333CS..G310 helixtrans-62.8-26.2175.2-64.1178.3000112.5I111 R146 L150 F161 G162 N166 Q169I111-L164 HydrophobicContact CD1-CB 4.13Å; I111-L164 WeakPolarHBondContact CG2-O 3.49Å; R146-L164 HydrophobicContact CB-CD1 4.22Å; L150-L164 HydrophobicContact CD1-CB 4.31Å; L150-L164 HydrophobicContact CD1-CD1 4.3Å; F161-L164 HydrophobicContact CB-CD1 4.22Å; F161-L164 WeakPolarHBondContact O-CB 3.5Å; F161-L164 PolarHBondContact O-N 3.42Å; G162-L164 PolarHBondContact O-N 3.43Å; L164-N166 VanDerWaalsContact C-N 3.3Å; L164-Q169 WeakPolarHBondContact O-CB 3.33Å; L164-Q169 WeakPolarHBondContact O-CG 3.47Å
165L91.3Very high92Very high8 Ų859.8 Ų59.84%0.04231%0.311CS..G310 helixtrans-86.31.1176.9-63165.5000112.4I111 I114 R115 L150 P156 E157 G162 D163I111-L165 HydrophobicContact CG2-CD2 3.83Å; I114-L165 HydrophobicContact CG2-CD2 4.5Å; R115-L165 HydrophobicContact CB-CD2 4.09Å; R115-L165 PolarHBondContact NH1-O 3.04Å; R115-L165 VanDerWaalsContact NH2-C 3.31Å; R115-L165 PolarHBondContact NH2-O 3.41Å; L150-L165 HydrophobicContact CD1-CD1 4.49Å; L150-L165 HydrophobicContact CD1-CG 4.28Å; L150-L165 HydrophobicContact CD2-CD1 4.38Å; P156-L165 HydrophobicContact CB-CD1 3.53Å; E157-L165 HydrophobicContact CG-CD1 3.92Å; G162-L165 WeakPolarHBondContact O-CB 3.42Å; G162-L165 PolarHBondContact O-N 3.08Å; D163-L165 PolarHBondContact O-N 3.46Å
166N92Very high92.2Very high92 Ų9258 Ų5849%0.49230%0.3SS..SBendtrans-76.4150.5175.1-163.4-29.9000111.4D163 L164 M168 Q169D163-N166 WeakPolarHBondContact O-CB 2.85Å; D163-N166 PolarHBondContact O-N 3.05Å; L164-N166 VanDerWaalsContact C-N 3.3Å; N166-M168 HydrophobicContact CB-CB 4.43Å; N166-M168 PolarHBondContact O-N 3.32Å; N166-M168 VanDerWaalsContact O-N 3.14Å; N166-M168 PolarHBondContact OD1-N 3.36Å; N166-Q169 WeakPolarHBondContact O-CB 3.43Å; N166-Q169 PolarHBondContact O-N 3.08Å
167T89.6Confident92.5Very high72 Ų7257.8 Ų57.844%0.44230%0.298SS..Hα-helixtrans-55.5-27170-47.40000112.5Q169 R170 Q171T167-Q169 PolarHBondContact O-N 3.15Å; T167-R170 PolarHBondContact O-N 2.87Å; T167-R170 VanDerWaalsContact O-N 3.15Å; T167-Q171 PolarHBondContact O-N 2.98Å; T167-Q171 VanDerWaalsContact O-N 3.14Å
168M91.4Very high92.7Very high117 Ų11751.8 Ų51.858%0.57627%0.27SS*.Hα-helixtrans-57.4-34.8174.9-167.762.568.600112.6N166 Q171 K172N166-M168 HydrophobicContact CB-CB 4.43Å; N166-M168 PolarHBondContact O-N 3.32Å; N166-M168 VanDerWaalsContact O-N 3.14Å; N166-M168 PolarHBondContact OD1-N 3.36Å; M168-Q171 WeakPolarHBondContact O-CB 3.46Å; M168-Q171 PolarHBondContact O-N 3.2Å; M168-K172 PolarHBondContact O-N 3.49Å
169Q93.9Very high92.8Very high21 Ų2148 Ų4810%0.09825%0.253CS..Hα-helixtrans-64.7-42.6177.3-177.96510.100111.3I111 L164 N166 T167 Q171 K172 V173I111-Q169 HydrophobicContact CD1-CG 4.17Å; L164-Q169 WeakPolarHBondContact O-CB 3.33Å; L164-Q169 WeakPolarHBondContact O-CG 3.47Å; N166-Q169 WeakPolarHBondContact O-CB 3.43Å; N166-Q169 PolarHBondContact O-N 3.08Å; T167-Q169 PolarHBondContact O-N 3.15Å; Q169-Q171 VanDerWaalsContact C-N 3.28Å; Q169-Q171 PolarHBondContact O-N 2.91Å; Q169-K172 WeakPolarHBondContact O-CB 3.23Å; Q169-K172 PolarHBondContact O-N 3.43Å; Q169-V173 WeakPolarHBondContact O-CG2 3.44Å; Q169-V173 PolarHBondContact O-N 3.35Å; Q169-V173 VanDerWaalsContact O-N 3.08Å
170R95.1Very high92.9Very high35 Ų3548.1 Ų48.113%0.13225%0.253CS..Hα-helixtrans-61.3-37.5173.3-63.6-179.2-175168.40.3112.1L76 E112 T167 W174L76-R170 HydrophobicContact CD2-CB 4.2Å; L76-R170 VanDerWaalsContact O-CD 3.28Å; L76-R170 WeakPolarHBondContact O-CD 3.21Å; L76-R170 PolarHBondContact O-NH1 3.2Å; E112-R170 IonicContact OE1-CZ 3.94Å; E112-R170 IonicContact OE1-NE 3.65Å; E112-R170 PolarHBondContact OE1-NE 3.02Å; E112-R170 IonicContact OE1-NH2 3.52Å; E112-R170 PolarHBondContact OE1-NH2 3.34Å; E112-R170 IonicContact OE2-CZ 3.41Å; E112-R170 IonicContact OE2-NE 2.82Å; E112-R170 IonicContact OE2-NH2 3.1Å; E112-R170 PolarHBondContact OE2-NH2 2.93Å; T167-R170 PolarHBondContact O-N 2.87Å; T167-R170 VanDerWaalsContact O-N 3.15Å; R170-W174 WeakPolarHBondContact O-CB 3.33Å; R170-W174 PolarHBondContact O-N 3.03Å
171Q93.4Very high93Very high95 Ų9543.5 Ų43.544%0.44422%0.223SC..Hα-helixtrans-66.2-38.9176.6-66.9-177.517.900112.1L76 T167 M168 Q169 W174 S175L76-Q171 HydrophobicContact CD2-CG 3.91Å; T167-Q171 PolarHBondContact O-N 2.98Å; T167-Q171 VanDerWaalsContact O-N 3.14Å; M168-Q171 WeakPolarHBondContact O-CB 3.46Å; M168-Q171 PolarHBondContact O-N 3.2Å; Q169-Q171 VanDerWaalsContact C-N 3.28Å; Q169-Q171 PolarHBondContact O-N 2.91Å; Q171-W174 PolarHBondContact O-N 3.25Å; Q171-S175 PolarHBondContact O-N 2.96Å
172K94Very high92.9Very high98 Ų9841 Ų4143%0.42621%0.213SC..Hα-helixtrans-60.9-50.9175.1-177.3-174170.4-166.60111.1M168 Q169 W174 S175 E176M168-K172 PolarHBondContact O-N 3.49Å; Q169-K172 WeakPolarHBondContact O-CB 3.23Å; Q169-K172 PolarHBondContact O-N 3.43Å; K172-W174 VanDerWaalsContact C-N 3.32Å; K172-W174 PolarHBondContact O-N 3.5Å; K172-S175 WeakPolarHBondContact O-CB 3.34Å; K172-S175 PolarHBondContact O-N 2.74Å; K172-E176 VanDerWaalsContact CE-OE1 3.23Å; K172-E176 WeakPolarHBondContact CE-OE1 3.47Å; K172-E176 PolarHBondContact O-N 3.45Å; K172-E176 VanDerWaalsContact O-N 3.07Å
173V95.8Very high93Very high2 Ų243.8 Ų43.81%0.01222%0.224CC..Hα-helixtrans-59.2-44.2177.5175.10000111I75 L105 Q108 Q169 S175 E176 V177I75-V173 HydrophobicContact CG2-CB 4.5Å; I75-V173 HydrophobicContact CG2-CG1 4.32Å; L105-V173 HydrophobicContact CD2-CG1 3.77Å; L105-V173 HydrophobicContact CG-CG1 4.39Å; Q108-V173 HydrophobicContact CB-CG1 4.4Å; Q108-V173 HydrophobicContact CB-CG2 4.09Å; Q108-V173 HydrophobicContact CG-CG2 4.24Å; Q169-V173 WeakPolarHBondContact O-CG2 3.44Å; Q169-V173 PolarHBondContact O-N 3.35Å; Q169-V173 VanDerWaalsContact O-N 3.08Å; V173-S175 VanDerWaalsContact C-N 3.33Å; V173-S175 PolarHBondContact O-N 3.31Å; V173-E176 PolarHBondContact O-N 3.05Å; V173-V177 WeakPolarHBondContact O-CG2 3.48Å; V173-V177 PolarHBondContact O-N 3.21Å
174W94.7Very high92.8Very high10 Ų1044 Ų444%0.03822%0.219CC..Hα-helixtrans-57.7-44.4173162.6-110.1000112.4R68 I71 R72 I75 R170 Q171 K172 E176 V177 N178R68-W174 HydrophobicContact CB-CH2 4.22Å; R68-W174 VanDerWaalsContact O-CH2 3.24Å; R68-W174 WeakPolarHBondContact O-CH2 3.5Å; I71-W174 HydrophobicContact CB-CZ3 4.21Å; I71-W174 HydrophobicContact CG2-CE3 4.44Å; I71-W174 HydrophobicContact CG2-CZ3 3.94Å; R72-W174 VanDerWaalsContact CA-CE3 3.46Å; R72-W174 HydrophobicContact CB-CD2 3.7Å; R72-W174 HydrophobicContact CB-CE3 3.69Å; R72-W174 HydrophobicContact CB-CH2 3.63Å; R72-W174 HydrophobicContact CB-CZ2 3.65Å; R72-W174 HydrophobicContact CB-CZ3 3.65Å; R72-W174 HydrophobicContact CG-CD2 3.61Å; R72-W174 HydrophobicContact CG-CE3 4.12Å; R72-W174 HydrophobicContact CG-CG 3.99Å; R72-W174 HydrophobicContact CG-CH2 4.37Å; R72-W174 HydrophobicContact CG-CZ2 3.91Å; R72-W174 HydrophobicContact CG-CZ3 4.47Å; I75-W174 HydrophobicContact CD1-CE3 4.06Å; I75-W174 HydrophobicContact CG2-CB 4Å; R170-W174 WeakPolarHBondContact O-CB 3.33Å; R170-W174 PolarHBondContact O-N 3.03Å; Q171-W174 PolarHBondContact O-N 3.25Å; K172-W174 VanDerWaalsContact C-N 3.32Å; K172-W174 PolarHBondContact O-N 3.5Å; W174-E176 VanDerWaalsContact C-N 3.28Å; W174-E176 PolarHBondContact O-N 3.25Å; W174-V177 HydrophobicContact CE3-CB 4.43Å; W174-V177 HydrophobicContact CE3-CG1 4.4Å; W174-V177 HydrophobicContact CZ3-CG1 4.3Å; W174-V177 PolarHBondContact O-N 3.48Å; W174-N178 HydrophobicContact CD2-CB 4.29Å; W174-N178 HydrophobicContact CE3-CB 4.44Å; W174-N178 HydrophobicContact CH2-CB 3.84Å; W174-N178 HydrophobicContact CZ2-CB 3.63Å; W174-N178 HydrophobicContact CZ3-CB 4.24Å; W174-N178 WeakPolarHBondContact O-CB 3.37Å; W174-N178 PolarHBondContact O-N 3.13Å
175S92.9Very high92.7Very high55 Ų5546.3 Ų46.339%0.38523%0.23SC..Hα-helixtrans-59.9-40.3179.3-173.10000111.8Q171 K172 V173 Q179Q171-S175 PolarHBondContact O-N 2.96Å; K172-S175 WeakPolarHBondContact O-CB 3.34Å; K172-S175 PolarHBondContact O-N 2.74Å; V173-S175 VanDerWaalsContact C-N 3.33Å; V173-S175 PolarHBondContact O-N 3.31Å; S175-Q179 WeakPolarHBondContact O-CB 3.28Å; S175-Q179 PolarHBondContact O-N 3.41Å
176E94.6Very high92.4Very high48 Ų4853.3 Ų53.322%0.22427%0.267CS..Hα-helixtrans-67.2-42.3176.9-67.5173-156.900111.8L101 H104 K172 V173 W174 S180L101-E176 HydrophobicContact CD1-CB 3.97Å; H104-E176 IonicContact CD2-OE2 3.75Å; H104-E176 PolarHBondContact CD2-OE2 3.38Å; H104-E176 IonicContact CG-OE2 3.98Å; H104-E176 IonicContact NE2-OE2 3.36Å; K172-E176 VanDerWaalsContact CE-OE1 3.23Å; K172-E176 WeakPolarHBondContact CE-OE1 3.47Å; K172-E176 PolarHBondContact O-N 3.45Å; K172-E176 VanDerWaalsContact O-N 3.07Å; V173-E176 PolarHBondContact O-N 3.05Å; W174-E176 VanDerWaalsContact C-N 3.28Å; W174-E176 PolarHBondContact O-N 3.25Å; E176-S180 WeakPolarHBondContact O-CB 3.28Å; E176-S180 PolarHBondContact O-N 3.46Å; E176-S180 PolarHBondContact O-OG 2.85Å
177V95.6Very high92Very high0 Ų053 Ų530%026%0.259CS..Hα-helixtrans-62.1-49.6174.1171.50000110.9I71 I75 I87 L101 L105 V173 W174 Q179 S180 V181I71-V177 HydrophobicContact CG2-CG1 3.82Å; I75-V177 HydrophobicContact CD1-CB 4.09Å; I75-V177 HydrophobicContact CD1-CG1 4.1Å; I75-V177 HydrophobicContact CD1-CG2 3.79Å; I87-V177 HydrophobicContact CD1-CG1 3.78Å; I87-V177 HydrophobicContact CD1-CG2 4.41Å; I87-V177 HydrophobicContact CG1-CG1 4.47Å; L101-V177 HydrophobicContact CD1-CB 4.46Å; L101-V177 HydrophobicContact CD1-CG2 3.75Å; L105-V177 HydrophobicContact CD1-CG2 4.17Å; L105-V177 HydrophobicContact CD2-CG2 3.89Å; L105-V177 HydrophobicContact CG-CG2 4.23Å; V173-V177 WeakPolarHBondContact O-CG2 3.48Å; V173-V177 PolarHBondContact O-N 3.21Å; W174-V177 HydrophobicContact CE3-CB 4.43Å; W174-V177 HydrophobicContact CE3-CG1 4.4Å; W174-V177 HydrophobicContact CZ3-CG1 4.3Å; W174-V177 PolarHBondContact O-N 3.48Å; V177-Q179 VanDerWaalsContact C-N 3.32Å; V177-Q179 PolarHBondContact O-N 3.38Å; V177-S180 PolarHBondContact O-N 3.47Å; V177-V181 HydrophobicContact CG1-CG2 4.18Å; V177-V181 WeakPolarHBondContact O-CB 3.11Å; V177-V181 WeakPolarHBondContact O-CG2 3.37Å; V177-V181 PolarHBondContact O-N 2.86Å
178N93.8Very high91.7Very high2 Ų252.7 Ų52.71%0.01125%0.253CS..Hα-helixtrans-59.1-45-178.9-175.954.7000111.2T40 R68 W174 S180 L182T40-N178 PolarHBondContact O-ND2 2.89Å; R68-N178 PolarHBondContact NE-OD1 2.93Å; W174-N178 HydrophobicContact CD2-CB 4.29Å; W174-N178 HydrophobicContact CE3-CB 4.44Å; W174-N178 HydrophobicContact CH2-CB 3.84Å; W174-N178 HydrophobicContact CZ2-CB 3.63Å; W174-N178 HydrophobicContact CZ3-CB 4.24Å; W174-N178 WeakPolarHBondContact O-CB 3.37Å; W174-N178 PolarHBondContact O-N 3.13Å; N178-S180 PolarHBondContact O-N 3.04Å; N178-L182 WeakPolarHBondContact O-CB 3.32Å; N178-L182 VanDerWaalsContact O-CG 3.29Å; N178-L182 WeakPolarHBondContact O-CG 3.48Å; N178-L182 PolarHBondContact O-N 3.39Å
179Q92.4Very high91.2Very high81 Ų8147.9 Ų47.938%0.37923%0.231SC..Hα-helixtrans-61.2-46.9177.5-164.8-167.3-5800110.9S175 V177 V181 L182 D183 S189S175-Q179 WeakPolarHBondContact O-CB 3.28Å; S175-Q179 PolarHBondContact O-N 3.41Å; V177-Q179 VanDerWaalsContact C-N 3.32Å; V177-Q179 PolarHBondContact O-N 3.38Å; Q179-V181 PolarHBondContact O-N 3.22Å; Q179-L182 PolarHBondContact O-N 2.9Å; Q179-D183 PolarHBondContact NE2-OD2 3.43Å; Q179-D183 WeakPolarHBondContact O-CB 3.37Å; Q179-D183 VanDerWaalsContact O-CG 3.28Å; Q179-D183 PolarHBondContact O-N 3.5Å; Q179-S189 WeakPolarHBondContact O-CB 3.27Å
180S93.8Very high90.8Very high14 Ų1448.4 Ų48.410%0.09824%0.235CC..Hα-helixtrans-66.9-38.4-177.4-56.60000112.8N98 E176 V177 N178 D183 Y184N98-S180 PolarHBondContact ND2-OG 3.12Å; E176-S180 WeakPolarHBondContact O-CB 3.28Å; E176-S180 PolarHBondContact O-N 3.46Å; E176-S180 PolarHBondContact O-OG 2.85Å; V177-S180 PolarHBondContact O-N 3.47Å; N178-S180 PolarHBondContact O-N 3.04Å; S180-D183 PolarHBondContact O-N 3.08Å; S180-Y184 WeakPolarHBondContact O-CB 3.48Å; S180-Y184 PolarHBondContact O-N 3.11Å
181V92.1Very high90.5Very high2 Ų247 Ų471%0.01223%0.23CC..Hα-helixtrans-62.5-45.4173.2167.40000110.6R68 H91 L94 V177 Q179 Y184 E185R68-V181 HydrophobicContact CG-CG1 4.17Å; H91-V181 VanDerWaalsContact CE1-CG1 3.48Å; H91-V181 WeakPolarHBondContact CE1-CG1 3.39Å; L94-V181 HydrophobicContact CD2-CG2 3.73Å; V177-V181 HydrophobicContact CG1-CG2 4.18Å; V177-V181 WeakPolarHBondContact O-CB 3.11Å; V177-V181 WeakPolarHBondContact O-CG2 3.37Å; V177-V181 PolarHBondContact O-N 2.86Å; Q179-V181 PolarHBondContact O-N 3.22Å; V181-Y184 PolarHBondContact O-N 3.49Å; V181-E185 WeakPolarHBondContact O-CB 3.12Å; V181-E185 WeakPolarHBondContact O-CG 3.33Å; V181-E185 PolarHBondContact O-N 2.89Å
182L90.7Very high90.5Very high4 Ų447.1 Ų47.12%0.02123%0.23CC..Hα-helixtrans-65.6-40.7178.1-72.9169.5000112.3T40 N178 Q179 E185 N186 R187T40-L182 HydrophobicContact CG2-CD1 3.88Å; N178-L182 WeakPolarHBondContact O-CB 3.32Å; N178-L182 VanDerWaalsContact O-CG 3.29Å; N178-L182 WeakPolarHBondContact O-CG 3.48Å; N178-L182 PolarHBondContact O-N 3.39Å; Q179-L182 PolarHBondContact O-N 2.9Å; L182-E185 CarbonylContact O-C 3.57Å; L182-E185 PolarHBondContact O-N 3.5Å; L182-N186 PolarHBondContact O-N 2.85Å; L182-R187 HydrophobicContact CB-CB 4.4Å; L182-R187 HydrophobicContact CD2-CB 3.8Å; L182-R187 PolarHBondContact O-N 2.89Å
183D91.2Very high90.3Very high73 Ų7346 Ų4639%0.3923%0.228SC..Hα-helixtrans-62.1-43.5175.6-73-29.1000110.8Q179 S180 E185 N186 S189Q179-D183 PolarHBondContact NE2-OD2 3.43Å; Q179-D183 WeakPolarHBondContact O-CB 3.37Å; Q179-D183 VanDerWaalsContact O-CG 3.28Å; Q179-D183 PolarHBondContact O-N 3.5Å; S180-D183 PolarHBondContact O-N 3.08Å; D183-E185 VanDerWaalsContact C-N 3.34Å; D183-E185 PolarHBondContact O-N 2.58Å; D183-N186 PolarHBondContact O-N 3.35Å; D183-S189 WeakPolarHBondContact OD1-CB 3.44Å; D183-S189 PolarHBondContact OD1-OG 3.19Å
184Y89.3Confident90Very high94 Ų9447.4 Ų47.437%0.36924%0.24SC..Hα-helixtrans-61.8-39.7175.3-176.7-84000112.6H91 P92 L94 S180 V181 N186H91-Y184 HydrophobicContact CB-CD1 4.13Å; H91-Y184 HydrophobicContact CB-CE1 4.02Å; H91-Y184 AromaticContact CD2-CD1 3.68Å; H91-Y184 AromaticContact CD2-CE1 3.94Å; P92-Y184 WeakPolarHBondContact O-CE2 3.06Å; P92-Y184 PolarHBondContact O-OH 3.33Å; L94-Y184 HydrophobicContact CB-CD2 4.21Å; L94-Y184 HydrophobicContact CB-CE2 4.41Å; L94-Y184 HydrophobicContact CD1-CD2 3.86Å; L94-Y184 HydrophobicContact CD1-CG 4.14Å; S180-Y184 WeakPolarHBondContact O-CB 3.48Å; S180-Y184 PolarHBondContact O-N 3.11Å; V181-Y184 PolarHBondContact O-N 3.49Å; Y184-N186 PolarHBondContact O-N 3.02Å
185E88.2Confident89.9Confident50 Ų5051.1 Ų51.123%0.23426%0.256CS..THydrogen-bonded Turntrans-74.91.8175.2-69.5178.1178.500113.6R68 H91 V181 L182 D183 R187R68-E185 IonicContact NH1-OE2 2.84Å; H91-E185 IonicContact CD2-OE1 3.17Å; H91-E185 IonicContact CE1-OE1 3.9Å; H91-E185 IonicContact NE2-OE1 2.7Å; H91-E185 PolarHBondContact NE2-OE1 3.32Å; V181-E185 WeakPolarHBondContact O-CB 3.12Å; V181-E185 WeakPolarHBondContact O-CG 3.33Å; V181-E185 PolarHBondContact O-N 2.89Å; L182-E185 CarbonylContact O-C 3.57Å; L182-E185 PolarHBondContact O-N 3.5Å; D183-E185 VanDerWaalsContact C-N 3.34Å; D183-E185 PolarHBondContact O-N 2.58Å; E185-R187 HydrophobicContact CB-CB 4.48Å; E185-R187 HydrophobicContact CB-CG 3.96Å; E185-R187 PolarHBondContact O-N 3.37Å; E185-R187 VanDerWaalsContact OE2-CD 3.28Å; E185-R187 WeakPolarHBondContact OE2-CD 3.5Å; E185-R187 IonicContact OE2-CZ 2.9Å; E185-R187 VanDerWaalsContact OE2-CZ 3.27Å; E185-R187 IonicContact OE2-NE 2.73Å; E185-R187 PolarHBondContact OE2-NE 3Å; E185-R187 IonicContact OE2-NH1 3.27Å; E185-R187 PolarHBondContact OE2-NH1 3.39Å
186N86.3Confident89.8Confident154 Ų15452.6 Ų52.682%0.82426%0.259SS*.THydrogen-bonded Turntrans54.534-172.2-61.4-79.9000113.1L182 D183 Y184L182-N186 PolarHBondContact O-N 2.85Å; D183-N186 PolarHBondContact O-N 3.35Å; Y184-N186 PolarHBondContact O-N 3.02Å
187R83.9Confident89.7Confident85 Ų8553.7 Ų53.732%0.32127%0.266SS..SBendtrans-100163.4177.1-68.2-179.3176.8174.1-11110.6L182 E185 S189L182-R187 HydrophobicContact CB-CB 4.4Å; L182-R187 HydrophobicContact CD2-CB 3.8Å; L182-R187 PolarHBondContact O-N 2.89Å; E185-R187 HydrophobicContact CB-CB 4.48Å; E185-R187 HydrophobicContact CB-CG 3.96Å; E185-R187 PolarHBondContact O-N 3.37Å; E185-R187 VanDerWaalsContact OE2-CD 3.28Å; E185-R187 WeakPolarHBondContact OE2-CD 3.5Å; E185-R187 IonicContact OE2-CZ 2.9Å; E185-R187 VanDerWaalsContact OE2-CZ 3.27Å; E185-R187 IonicContact OE2-NE 2.73Å; E185-R187 PolarHBondContact OE2-NE 3Å; E185-R187 IonicContact OE2-NH1 3.27Å; E185-R187 PolarHBondContact OE2-NH1 3.39Å; R187-S189 PolarHBondContact O-N 3.37Å
188E82Confident89.5Confident67 Ų6760.1 Ų60.131%0.31329%0.294SS..  trans-69103175-173.9171-14500110N36 T40 T190 K192 K195N36-E188 PolarHBondContact ND2-OE2 3.02Å; T40-E188 WeakPolarHBondContact CG2-O 3.43Å; E188-T190 WeakPolarHBondContact CG-O 3.28Å; E188-K192 WeakPolarHBondContact OE2-CE 3.5Å; E188-K195 IonicContact OE1-NZ 3.94Å; E188-K195 PolarHBondContact OE1-NZ 2.86Å
189S82Confident89.6Confident16 Ų1664.7 Ų64.711%0.11232%0.318CS..  trans-79.5-18.1-174.659.80000115.1Q179 D183 R187Q179-S189 WeakPolarHBondContact O-CB 3.27Å; D183-S189 WeakPolarHBondContact OD1-CB 3.44Å; D183-S189 PolarHBondContact OD1-OG 3.19Å; R187-S189 PolarHBondContact O-N 3.37Å
190T85.2Confident89.6Confident31 Ų3163.6 Ų63.619%0.1932%0.315CS..SBendtrans-117.9121.6-179.638.20000110.1E188 K192 K195E188-T190 WeakPolarHBondContact CG-O 3.28Å; T190-K192 PolarHBondContact O-N 2.84Å; T190-K195 WeakPolarHBondContact O-CE 3.29Å; T190-K195 WeakPolarHBondContact OG1-CE 3.39Å
191P89.1Confident89.6Confident6 Ų667.1 Ų67.14%0.03933%0.332CS..  trans-56.9141.5178.8-23.730.9000111.6Y37 T40 E41 L193 A194 K195Y37-P191 HydrophobicContact CD2-CB 3.72Å; Y37-P191 HydrophobicContact CD2-CG 3.84Å; Y37-P191 HydrophobicContact CE2-CG 4.3Å; T40-P191 HydrophobicContact CG2-CB 4.42Å; T40-P191 HydrophobicContact CG2-CG 3.64Å; E41-P191 HydrophobicContact CG-CG 4.21Å; E41-P191 VanDerWaalsContact OE1-CG 3.24Å; E41-P191 WeakPolarHBondContact OE1-CG 3.23Å; P191-L193 PolarHBondContact O-N 3.41Å; P191-A194 HydrophobicContact CB-CB 4.29Å; P191-A194 WeakPolarHBondContact O-CA 3.37Å; P191-A194 WeakPolarHBondContact O-CB 3.35Å; P191-A194 PolarHBondContact O-N 3.15Å; P191-K195 PolarHBondContact O-N 3.34Å
192K92.1Very high89.7Confident98 Ų9873.9 Ų73.943%0.42636%0.357SS..Hα-helixtrans-57.4-36.9178-68.6178-174.5-178.30112L33 N36 E188 T190 A194 K195 L196L33-K192 HydrophobicContact CD2-CB 3.6Å; L33-K192 HydrophobicContact CD2-CD 4.44Å; N36-K192 WeakPolarHBondContact OD1-CB 3.4Å; N36-K192 WeakPolarHBondContact OD1-CG 3.48Å; N36-K192 PolarHBondContact OD1-N 3.21Å; E188-K192 WeakPolarHBondContact OE2-CE 3.5Å; T190-K192 PolarHBondContact O-N 2.84Å; K192-A194 PolarHBondContact O-N 2.97Å; K192-K195 WeakPolarHBondContact O-CB 3.29Å; K192-K195 PolarHBondContact O-N 3.38Å; K192-L196 WeakPolarHBondContact O-CG 3.45Å; K192-L196 PolarHBondContact O-N 3.43Å
193L91.3Very high89.9Confident73 Ų7375.6 Ų75.638%0.38237%0.372SS..Hα-helixtrans-59.7-45.5174.5-177.161.2000111.8P191 K195 L196 L197P191-L193 PolarHBondContact O-N 3.41Å; L193-K195 VanDerWaalsContact C-N 3.35Å; L193-K195 PolarHBondContact O-N 3.33Å; L193-L196 PolarHBondContact O-N 3.38Å; L193-L197 WeakPolarHBondContact O-CG 3.43Å; L193-L197 PolarHBondContact O-N 3.37Å
194A89.6Confident90Very high32 Ų3272.8 Ų72.826%0.26436%0.356SS..Hα-helixtrans-64.5-39.3176.600000111.7P191 K192 L196 L197 K198P191-A194 HydrophobicContact CB-CB 4.29Å; P191-A194 WeakPolarHBondContact O-CA 3.37Å; P191-A194 WeakPolarHBondContact O-CB 3.35Å; P191-A194 PolarHBondContact O-N 3.15Å; K192-A194 PolarHBondContact O-N 2.97Å; A194-L196 PolarHBondContact O-N 2.85Å; A194-L197 PolarHBondContact O-N 2.89Å; A194-K198 WeakPolarHBondContact O-CG 3.35Å; A194-K198 PolarHBondContact O-N 3.02Å
195K91.4Very high90.3Very high88 Ų8871.8 Ų71.838%0.38336%0.357SS..Hα-helixtrans-60.3-43.2173.4-67.7179.9-177.7173.90111.9E188 T190 P191 K192 L193 K198 L199E188-K195 IonicContact OE1-NZ 3.94Å; E188-K195 PolarHBondContact OE1-NZ 2.86Å; T190-K195 WeakPolarHBondContact O-CE 3.29Å; T190-K195 WeakPolarHBondContact OG1-CE 3.39Å; P191-K195 PolarHBondContact O-N 3.34Å; K192-K195 WeakPolarHBondContact O-CB 3.29Å; K192-K195 PolarHBondContact O-N 3.38Å; L193-K195 VanDerWaalsContact C-N 3.35Å; L193-K195 PolarHBondContact O-N 3.33Å; K195-K198 PolarHBondContact O-N 2.89Å; K195-L199 WeakPolarHBondContact O-CB 3.36Å; K195-L199 PolarHBondContact O-N 3.2Å
196L92.3Very high90.6Very high87 Ų8771.9 Ų71.946%0.45536%0.358SS..Hα-helixtrans-63.6-41.6177.3-70.5172.2000111.9L33 K192 L193 A194 L199 L200L33-L196 HydrophobicContact CD1-CD1 3.98Å; L33-L196 HydrophobicContact CD2-CD1 4.1Å; K192-L196 WeakPolarHBondContact O-CG 3.45Å; K192-L196 PolarHBondContact O-N 3.43Å; L193-L196 PolarHBondContact O-N 3.38Å; A194-L196 PolarHBondContact O-N 2.85Å; L196-L199 PolarHBondContact O-N 3.03Å; L196-L200 WeakPolarHBondContact O-CB 3.29Å; L196-L200 PolarHBondContact O-N 2.83Å
197L92Very high90.8Very high70 Ų7067 Ų6737%0.36633%0.332SS..Hα-helixtrans-64.2-43175.3-67.9175000112L193 A194 L199 L200 L201 L220L193-L197 WeakPolarHBondContact O-CG 3.43Å; L193-L197 PolarHBondContact O-N 3.37Å; A194-L197 PolarHBondContact O-N 2.89Å; L197-L199 VanDerWaalsContact C-N 3.34Å; L197-L199 PolarHBondContact O-N 3.46Å; L197-L200 WeakPolarHBondContact O-CB 3.38Å; L197-L200 PolarHBondContact O-N 3.32Å; L197-L201 WeakPolarHBondContact O-CG 3.5Å; L197-L201 PolarHBondContact O-N 3.49Å; L197-L220 HydrophobicContact CD2-CD2 4.36Å
198K91.7Very high91.2Very high135 Ų13566.1 Ų66.159%0.58733%0.333SS*.Hα-helixtrans-62.1-41.8174.3-71.9178-178-177.60111.5A194 K195 L201 W202A194-K198 WeakPolarHBondContact O-CG 3.35Å; A194-K198 PolarHBondContact O-N 3.02Å; K195-K198 PolarHBondContact O-N 2.89Å; K198-L201 PolarHBondContact O-N 3.16Å; K198-W202 WeakPolarHBondContact O-CB 3.32Å; K198-W202 PolarHBondContact O-N 3.31Å
199L94.3Very high91.7Very high98 Ų9868.9 Ų68.951%0.51335%0.346SS..Hα-helixtrans-63.8-40.3176.9-176.766.4000111.8K195 L196 L197 W202 A203K195-L199 WeakPolarHBondContact O-CB 3.36Å; K195-L199 PolarHBondContact O-N 3.2Å; L196-L199 PolarHBondContact O-N 3.03Å; L197-L199 VanDerWaalsContact C-N 3.34Å; L197-L199 PolarHBondContact O-N 3.46Å; L199-W202 HydrophobicContact CD1-CE3 3.87Å; L199-W202 HydrophobicContact CD1-CZ3 4.28Å; L199-W202 PolarHBondContact O-N 2.93Å; L199-A203 WeakPolarHBondContact O-CB 3.38Å; L199-A203 PolarHBondContact O-N 3.49Å
200L93.4Very high92.2Very high59 Ų5975.3 Ų75.331%0.30937%0.372SS..Hα-helixtrans-59.8-52.2173.8173.665.9000110.8L196 L197 W202 A203 Q204 M217 L220L196-L200 WeakPolarHBondContact O-CB 3.29Å; L196-L200 PolarHBondContact O-N 2.83Å; L197-L200 WeakPolarHBondContact O-CB 3.38Å; L197-L200 PolarHBondContact O-N 3.32Å; L200-W202 VanDerWaalsContact C-N 3.29Å; L200-W202 PolarHBondContact O-N 2.89Å; L200-A203 PolarHBondContact O-N 3.35Å; L200-Q204 HydrophobicContact CD1-CG 4.35Å; L200-Q204 WeakPolarHBondContact O-CG 3.32Å; L200-Q204 PolarHBondContact O-N 3.49Å; L200-M217 HydrophobicContact CD2-SD 3.71Å; L200-L220 HydrophobicContact CD2-CD2 3.71Å
201L93.4Very high92.4Very high87 Ų8782.7 Ų82.746%0.45540%0.401SS..Hα-helixtrans-59.4-41.9178.9-70.2176.8000111.9L197 K198 Q204 N205 L220L197-L201 WeakPolarHBondContact O-CG 3.5Å; L197-L201 PolarHBondContact O-N 3.49Å; K198-L201 PolarHBondContact O-N 3.16Å; L201-Q204 PolarHBondContact O-N 2.9Å; L201-N205 WeakPolarHBondContact O-CB 3.46Å; L201-N205 PolarHBondContact O-N 2.91Å; L201-L220 HydrophobicContact CD1-CD1 4.19Å; L201-L220 HydrophobicContact CD2-CD1 4.2Å; L201-L220 HydrophobicContact CG-CD1 4.32Å
202W95.2Very high92.4Very high145 Ų14585.4 Ų85.455%0.54942%0.418SS..Hα-helixtrans-62.1-47.7175.1174.679.6000111.8K198 L199 L200 Q204 N205 E206K198-W202 WeakPolarHBondContact O-CB 3.32Å; K198-W202 PolarHBondContact O-N 3.31Å; L199-W202 HydrophobicContact CD1-CE3 3.87Å; L199-W202 HydrophobicContact CD1-CZ3 4.28Å; L199-W202 PolarHBondContact O-N 2.93Å; L200-W202 VanDerWaalsContact C-N 3.29Å; L200-W202 PolarHBondContact O-N 2.89Å; W202-Q204 VanDerWaalsContact C-N 3.33Å; W202-Q204 PolarHBondContact O-N 3.47Å; W202-N205 WeakPolarHBondContact O-CB 3.26Å; W202-N205 PolarHBondContact O-N 3.04Å; W202-N205 VanDerWaalsContact O-N 3.12Å; W202-E206 HydrophobicContact CD2-CG 3.98Å; W202-E206 VanDerWaalsContact CE2-CG 3.49Å; W202-E206 HydrophobicContact CE3-CG 4.37Å; W202-E206 HydrophobicContact CH2-CG 3.99Å; W202-E206 HydrophobicContact CZ2-CG 3.52Å; W202-E206 HydrophobicContact CZ3-CG 4.38Å; W202-E206 PolarHBondContact NE1-OE1 3.39Å; W202-E206 WeakPolarHBondContact O-CG 3.43Å; W202-E206 PolarHBondContact O-N 3.26Å
203A94.5Very high92.3Very high39 Ų3985 Ų8532%0.32242%0.416SS..Hα-helixtrans-61.1-41.3179.400000112L199 L200 E206 L207L199-A203 WeakPolarHBondContact O-CB 3.38Å; L199-A203 PolarHBondContact O-N 3.49Å; L200-A203 PolarHBondContact O-N 3.35Å; A203-E206 PolarHBondContact O-N 3.12Å; A203-L207 WeakPolarHBondContact O-CG 3.37Å; A203-L207 PolarHBondContact O-N 2.95Å
204Q93.4Very high92.2Very high14 Ų1482.1 Ų82.17%0.06540%0.4CS..Hα-helixtrans-61.5-43.8173.6-67.9-166.2145.200111.7L200 L201 W202 E206 L207 D208 Y214 M217L200-Q204 HydrophobicContact CD1-CG 4.35Å; L200-Q204 WeakPolarHBondContact O-CG 3.32Å; L200-Q204 PolarHBondContact O-N 3.49Å; L201-Q204 PolarHBondContact O-N 2.9Å; W202-Q204 VanDerWaalsContact C-N 3.33Å; W202-Q204 PolarHBondContact O-N 3.47Å; Q204-E206 PolarHBondContact O-N 3.39Å; Q204-L207 PolarHBondContact O-N 2.9Å; Q204-D208 PolarHBondContact O-N 3.15Å; Q204-Y214 WeakPolarHBondContact CA-OH 3.31Å; Q204-Y214 HydrophobicContact CB-CE2 4.15Å; Q204-Y214 WeakPolarHBondContact CB-OH 3.34Å; Q204-Y214 HydrophobicContact CG-CE2 3.85Å; Q204-Y214 PolarHBondContact O-OH 2.83Å; Q204-M217 PolarHBondContact NE2-O 2.95Å
205N94.2Very high92.3Very high74 Ų7480.7 Ų80.740%0.39639%0.388SS..Hα-helixtrans-63.4-39.2176.517770.9000112.7L201 W202 D208 Q209L201-N205 WeakPolarHBondContact O-CB 3.46Å; L201-N205 PolarHBondContact O-N 2.91Å; W202-N205 WeakPolarHBondContact O-CB 3.26Å; W202-N205 PolarHBondContact O-N 3.04Å; W202-N205 VanDerWaalsContact O-N 3.12Å; N205-D208 PolarHBondContact O-N 3.34Å; N205-Q209 PolarHBondContact ND2-NE2 3.02Å; N205-Q209 VanDerWaalsContact ND2-NE2 3.15Å; N205-Q209 WeakPolarHBondContact O-CG 3.47Å; N205-Q209 PolarHBondContact O-N 3.03Å
206E94.9Very high92.3Very high52 Ų5279.8 Ų79.824%0.24338%0.384CS..Hα-helixtrans-63.9-39.8174.3-71.2-62.4132.100112.3W202 A203 Q204 Q209 K210W202-E206 HydrophobicContact CD2-CG 3.98Å; W202-E206 VanDerWaalsContact CE2-CG 3.49Å; W202-E206 HydrophobicContact CE3-CG 4.37Å; W202-E206 HydrophobicContact CH2-CG 3.99Å; W202-E206 HydrophobicContact CZ2-CG 3.52Å; W202-E206 HydrophobicContact CZ3-CG 4.38Å; W202-E206 PolarHBondContact NE1-OE1 3.39Å; W202-E206 WeakPolarHBondContact O-CG 3.43Å; W202-E206 PolarHBondContact O-N 3.26Å; A203-E206 PolarHBondContact O-N 3.12Å; Q204-E206 PolarHBondContact O-N 3.39Å; E206-Q209 PolarHBondContact O-N 3.41Å; E206-K210 WeakPolarHBondContact O-CG 3.45Å; E206-K210 PolarHBondContact O-N 2.66Å; E206-K210 VanDerWaalsContact O-N 3.11Å
207L91.6Very high92.2Very high52 Ų5277.8 Ų77.827%0.27237%0.373SS..Hα-helixtrans-65.6-41.1174.8-68.6172.5000111.5A203 Q204 K210 K211 V212 Y214A203-L207 WeakPolarHBondContact O-CG 3.37Å; A203-L207 PolarHBondContact O-N 2.95Å; Q204-L207 PolarHBondContact O-N 2.9Å; L207-K210 CarbonylContact O-C 3.5Å; L207-K210 PolarHBondContact O-N 3.44Å; L207-K211 PolarHBondContact O-N 2.62Å; L207-V212 HydrophobicContact CB-CB 4.39Å; L207-V212 HydrophobicContact CD2-CB 4.08Å; L207-V212 HydrophobicContact CD2-CG1 4.19Å; L207-V212 HydrophobicContact CD2-CG2 4.15Å; L207-V212 PolarHBondContact O-N 3.24Å; L207-Y214 HydrophobicContact CB-CD1 3.61Å; L207-Y214 HydrophobicContact CB-CE1 3.33Å; L207-Y214 HydrophobicContact CB-CG 4.37Å; L207-Y214 HydrophobicContact CD1-CD1 3.84Å; L207-Y214 HydrophobicContact CD1-CD2 3.78Å; L207-Y214 HydrophobicContact CD1-CE1 4.07Å; L207-Y214 HydrophobicContact CD1-CE2 4Å; L207-Y214 HydrophobicContact CD1-CG 3.72Å; L207-Y214 HydrophobicContact CG-CD1 4.3Å; L207-Y214 HydrophobicContact CG-CE1 4.34Å
208D91.3Very high92.2Very high66 Ų6677.6 Ų77.635%0.35338%0.375SS..Hα-helixtrans-60.5-46.1175.2-66.8-17.8000111.2Q204 N205 K210 K211 Y214 K216Q204-D208 PolarHBondContact O-N 3.15Å; N205-D208 PolarHBondContact O-N 3.34Å; D208-K210 VanDerWaalsContact C-N 3.27Å; D208-K210 PolarHBondContact O-N 2.99Å; D208-K211 WeakPolarHBondContact O-CA 3.32Å; D208-K211 PolarHBondContact O-N 2.91Å; D208-Y214 VanDerWaalsContact OD1-CE1 3.31Å; D208-Y214 WeakPolarHBondContact OD1-CE1 3.5Å; D208-Y214 PolarHBondContact OD1-OH 3.47Å; D208-K216 IonicContact OD1-NZ 3.22Å; D208-K216 IonicContact OD2-NZ 2.83Å; D208-K216 PolarHBondContact OD2-NZ 3.28Å
209Q93.3Very high92.1Very high125 Ų12573.3 Ų73.358%0.58436%0.358SS*.Hα-helixtrans-61.2-36.7177.5-74.2-179.619.300112.5N205 E206 K211N205-Q209 PolarHBondContact ND2-NE2 3.02Å; N205-Q209 VanDerWaalsContact ND2-NE2 3.15Å; N205-Q209 WeakPolarHBondContact O-CG 3.47Å; N205-Q209 PolarHBondContact O-N 3.03Å; E206-Q209 PolarHBondContact O-N 3.41Å; Q209-K211 PolarHBondContact O-N 3.49Å
210K91.7Very high91.7Very high150 Ų15072 Ų7265%0.65235%0.352SS*.THydrogen-bonded Turntrans-80.6-0.8175.6-68.7177.1-175.9174.80113.4E206 L207 D208 V212E206-K210 WeakPolarHBondContact O-CG 3.45Å; E206-K210 PolarHBondContact O-N 2.66Å; E206-K210 VanDerWaalsContact O-N 3.11Å; L207-K210 CarbonylContact O-C 3.5Å; L207-K210 PolarHBondContact O-N 3.44Å; D208-K210 VanDerWaalsContact C-N 3.27Å; D208-K210 PolarHBondContact O-N 2.99Å; K210-V212 HydrophobicContact CB-CG2 3.9Å; K210-V212 PolarHBondContact O-N 3.34Å
211K89.8Confident91.3Very high187 Ų18774.2 Ų74.281%0.81337%0.372SS*.THydrogen-bonded Turntrans54.635.1-178.2-53.7-178-174.8-177.90112.7L207 D208 Q209L207-K211 PolarHBondContact O-N 2.62Å; D208-K211 WeakPolarHBondContact O-CA 3.32Å; D208-K211 PolarHBondContact O-N 2.91Å; Q209-K211 PolarHBondContact O-N 3.49Å
212V88.8Confident91.1Very high63 Ų6377.9 Ų77.938%0.38238%0.384SS..  trans-77.4135.8173.6-179.20000107.8L207 K210 Y214L207-V212 HydrophobicContact CB-CB 4.39Å; L207-V212 HydrophobicContact CD2-CB 4.08Å; L207-V212 HydrophobicContact CD2-CG1 4.19Å; L207-V212 HydrophobicContact CD2-CG2 4.15Å; L207-V212 PolarHBondContact O-N 3.24Å; K210-V212 HydrophobicContact CB-CG2 3.9Å; K210-V212 PolarHBondContact O-N 3.34Å; V212-Y214 VanDerWaalsContact O-CD1 3.3Å; V212-Y214 WeakPolarHBondContact O-CD1 3.39Å
213K89.5Confident90.6Very high89 Ų8972.7 Ų72.739%0.38738%0.376SS..  trans-83.9121.5169.7-67.1-169.9-171.3159.40109.2E10 P228E10-K213 HydrophobicContact CG-CD 4.46Å; E10-K213 WeakPolarHBondContact OE1-CD 3.46Å; E10-K213 WeakPolarHBondContact OE1-CE 3.35Å; E10-K213 IonicContact OE1-NZ 2.68Å; E10-K213 PolarHBondContact OE1-NZ 3.22Å; E10-K213 IonicContact OE2-NZ 2.76Å; K213-P228 HydrophobicContact CB-CB 3.96Å
214Y90.3Very high90.4Very high12 Ų1273.6 Ų73.65%0.04738%0.378CS..  trans-150.1153.4178.367.3-76.8000110.7Q204 L207 D208 V212 K216 P228Q204-Y214 WeakPolarHBondContact CA-OH 3.31Å; Q204-Y214 HydrophobicContact CB-CE2 4.15Å; Q204-Y214 WeakPolarHBondContact CB-OH 3.34Å; Q204-Y214 HydrophobicContact CG-CE2 3.85Å; Q204-Y214 PolarHBondContact O-OH 2.83Å; L207-Y214 HydrophobicContact CB-CD1 3.61Å; L207-Y214 HydrophobicContact CB-CE1 3.33Å; L207-Y214 HydrophobicContact CB-CG 4.37Å; L207-Y214 HydrophobicContact CD1-CD1 3.84Å; L207-Y214 HydrophobicContact CD1-CD2 3.78Å; L207-Y214 HydrophobicContact CD1-CE1 4.07Å; L207-Y214 HydrophobicContact CD1-CE2 4Å; L207-Y214 HydrophobicContact CD1-CG 3.72Å; L207-Y214 HydrophobicContact CG-CD1 4.3Å; L207-Y214 HydrophobicContact CG-CE1 4.34Å; D208-Y214 VanDerWaalsContact OD1-CE1 3.31Å; D208-Y214 WeakPolarHBondContact OD1-CE1 3.5Å; D208-Y214 PolarHBondContact OD1-OH 3.47Å; V212-Y214 VanDerWaalsContact O-CD1 3.3Å; V212-Y214 WeakPolarHBondContact O-CD1 3.39Å; Y214-K216 HydrophobicContact CE2-CB 3.93Å; Y214-K216 HydrophobicContact CE2-CG 4.03Å; Y214-K216 PolarHBondContact O-N 3.11Å; Y214-K216 WeakPolarHBondContact OH-CD 3.3Å; Y214-P228 WeakPolarHBondContact O-CA 3.37Å
215P91.4Very high90.3Very high2 Ų273.6 Ų73.61%0.01338%0.378CS..  trans-65.2124.5172.4-22.635.9000110.5R13 W16 I225 E226 P228R13-P215 HydrophobicContact CB-CG 4.24Å; W16-P215 HydrophobicContact CB-CB 4.44Å; W16-P215 HydrophobicContact CB-CG 3.65Å; W16-P215 HydrophobicContact CD2-CB 4.49Å; W16-P215 HydrophobicContact CD2-CG 4.15Å; W16-P215 HydrophobicContact CG-CB 4.12Å; W16-P215 HydrophobicContact CG-CG 3.74Å; P215-I225 HydrophobicContact CB-CG2 3.47Å; P215-I225 VanDerWaalsContact CB-CG2 3.47Å; P215-E226 CarbonylContact C-O 3.54Å; P215-E226 WeakPolarHBondContact CA-O 3.3Å; P215-P228 HydrophobicContact CG-CG 3.97Å
216K91.1Very high90Very high70 Ų7073.5 Ų73.530%0.30438%0.375SS..EExtended strand (participates in β ladder)trans-107.4129.3-170.4-171.8171.5-175166.30111.2D208 Y214 T218 I225 E226D208-K216 IonicContact OD1-NZ 3.22Å; D208-K216 IonicContact OD2-NZ 2.83Å; D208-K216 PolarHBondContact OD2-NZ 3.28Å; Y214-K216 HydrophobicContact CE2-CB 3.93Å; Y214-K216 HydrophobicContact CE2-CG 4.03Å; Y214-K216 PolarHBondContact O-N 3.11Å; Y214-K216 WeakPolarHBondContact OH-CD 3.3Å; K216-T218 PolarHBondContact O-N 3.36Å; K216-I225 CarbonylContact O-C 3.52Å; K216-I225 WeakPolarHBondContact O-CA 3.4Å; K216-E226 PolarHBondContact N-O 3.08Å; K216-E226 PolarHBondContact O-N 3.26Å
217M91.2Very high89.6Confident44 Ų4475 Ų7522%0.21739%0.385CS..EExtended strand (participates in β ladder)trans-72.9115.2169.8-169.3171.3-70.600109.6L200 Q204 L220 T224 I225L200-M217 HydrophobicContact CD2-SD 3.71Å; Q204-M217 PolarHBondContact NE2-O 2.95Å; M217-L220 HydrophobicContact CG-CD2 4.12Å; M217-L220 HydrophobicContact SD-CD2 3.69Å; M217-T224 CarbonylContact C-O 3.58Å; M217-T224 WeakPolarHBondContact CA-O 3.17Å; M217-I225 HydrophobicContact CB-CG1 4.19Å; M217-I225 HydrophobicContact CE-CD1 4.09Å; M217-I225 HydrophobicContact CE-CG1 3.99Å; M217-I225 HydrophobicContact CG-CG1 4.41Å
218T90.8Very high89Confident67 Ų6774.4 Ų74.441%0.41138%0.384SS..EExtended strand (participates in β ladder)trans-104.3-24.4-177.956.30000113K216 T224 E226K216-T218 PolarHBondContact O-N 3.36Å; T218-T224 PolarHBondContact N-O 3.27Å; T218-E226 HydrophobicContact CG2-CB 4.16Å; T218-E226 VanDerWaalsContact CG2-CD 3.47Å; T218-E226 HydrophobicContact CG2-CG 3.98Å; T218-E226 WeakPolarHBondContact CG2-OE1 3.49Å; T218-E226 PolarHBondContact OG1-OE1 3.09Å
219D89.6Confident87.9Confident44 Ų4481.2 Ų81.224%0.23541%0.411CS..EExtended strand (participates in β ladder)trans-125.5102.2174.3-173-20.7000109.8S221 K222 G223 T224D219-S221 PolarHBondContact O-N 2.96Å; D219-S221 WeakPolarHBondContact OD1-CA 3.2Å; D219-S221 WeakPolarHBondContact OD1-CB 3.33Å; D219-S221 PolarHBondContact OD1-N 3.09Å; D219-S221 PolarHBondContact OD1-OG 3.02Å; D219-K222 HydrophobicContact CB-CB 4.43Å; D219-K222 PolarHBondContact OD1-N 3.06Å; D219-K222 VanDerWaalsContact OD1-N 3.08Å; D219-K222 VanDerWaalsContact OD2-CD 3.29Å; D219-K222 WeakPolarHBondContact OD2-CD 3.48Å; D219-K222 WeakPolarHBondContact OD2-CG 3.1Å; D219-G223 CarbonylContact O-C 3.49Å; D219-G223 VanDerWaalsContact O-CA 3.29Å; D219-G223 WeakPolarHBondContact O-CA 3.38Å; D219-G223 PolarHBondContact O-N 3.24Å; D219-T224 PolarHBondContact N-O 3.43Å; D219-T224 PolarHBondContact O-N 2.85Å
220L87Confident87.6Confident71 Ų7179 Ų7937%0.37240%0.402SS..THydrogen-bonded Turntrans-65.3-28.4177.7-63.5178.5000112.6L197 L200 L201 M217L197-L220 HydrophobicContact CD2-CD2 4.36Å; L200-L220 HydrophobicContact CD2-CD2 3.71Å; L201-L220 HydrophobicContact CD1-CD1 4.19Å; L201-L220 HydrophobicContact CD2-CD1 4.2Å; L201-L220 HydrophobicContact CG-CD1 4.32Å; M217-L220 HydrophobicContact CG-CD2 4.12Å; M217-L220 HydrophobicContact SD-CD2 3.69Å
221S84.3Confident87.4Confident106 Ų10675.3 Ų75.374%0.74139%0.389SS*.THydrogen-bonded Turntrans-76.3-34.6-176.173.50000112.1D219D219-S221 PolarHBondContact O-N 2.96Å; D219-S221 WeakPolarHBondContact OD1-CA 3.2Å; D219-S221 WeakPolarHBondContact OD1-CB 3.33Å; D219-S221 PolarHBondContact OD1-N 3.09Å; D219-S221 PolarHBondContact OD1-OG 3.02Å
222K88.9Confident87.2Confident163 Ų16369.1 Ų69.171%0.70937%0.365SS*.THydrogen-bonded Turntrans-100.8-9.1178.2-62.2-178-170.1167.70113.5D219 T224D219-K222 HydrophobicContact CB-CB 4.43Å; D219-K222 PolarHBondContact OD1-N 3.06Å; D219-K222 VanDerWaalsContact OD1-N 3.08Å; D219-K222 VanDerWaalsContact OD2-CD 3.29Å; D219-K222 WeakPolarHBondContact OD2-CD 3.48Å; D219-K222 WeakPolarHBondContact OD2-CG 3.1Å; K222-T224 VanDerWaalsContact C-N 3.27Å; K222-T224 PolarHBondContact O-N 2.97Å
223G86Confident87.1Confident37 Ų3769.4 Ų69.438%0.38136%0.364SS..THydrogen-bonded Turntrans66.428.6-172.200000112.9D219 I225D219-G223 CarbonylContact O-C 3.49Å; D219-G223 VanDerWaalsContact O-CA 3.29Å; D219-G223 WeakPolarHBondContact O-CA 3.38Å; D219-G223 PolarHBondContact O-N 3.24Å; G223-I225 PolarHBondContact O-N 3.12Å
224T89.6Confident87Confident58 Ų5868.2 Ų68.236%0.35636%0.363SS..EExtended strand (participates in β ladder)trans-72.7123.4-177.8-51.90000110M217 T218 D219 K222M217-T224 CarbonylContact C-O 3.58Å; M217-T224 WeakPolarHBondContact CA-O 3.17Å; T218-T224 PolarHBondContact N-O 3.27Å; D219-T224 PolarHBondContact N-O 3.43Å; D219-T224 PolarHBondContact O-N 2.85Å; K222-T224 VanDerWaalsContact C-N 3.27Å; K222-T224 PolarHBondContact O-N 2.97Å
225I90.6Very high86.8Confident14 Ų1471.9 Ų71.97%0.07238%0.384CS..EExtended strand (participates in β ladder)trans-110.9127.7175.4-61.3172.7000108.6R13 M17 P215 K216 M217 G223R13-I225 PolarHBondContact NH1-O 2.98Å; R13-I225 PolarHBondContact NH2-O 2.76Å; M17-I225 HydrophobicContact SD-CD1 3.95Å; P215-I225 HydrophobicContact CB-CG2 3.47Å; P215-I225 VanDerWaalsContact CB-CG2 3.47Å; K216-I225 CarbonylContact O-C 3.52Å; K216-I225 WeakPolarHBondContact O-CA 3.4Å; M217-I225 HydrophobicContact CB-CG1 4.19Å; M217-I225 HydrophobicContact CE-CD1 4.09Å; M217-I225 HydrophobicContact CE-CG1 3.99Å; M217-I225 HydrophobicContact CG-CG1 4.41Å; G223-I225 PolarHBondContact O-N 3.12Å
226E89.1Confident86.4Confident71 Ų7176.9 Ų76.933%0.33241%0.41SS..EExtended strand (participates in β ladder)trans-97.8158175-76.3175.6-152.200111.4P215 K216 T218 K229P215-E226 CarbonylContact C-O 3.54Å; P215-E226 WeakPolarHBondContact CA-O 3.3Å; K216-E226 PolarHBondContact N-O 3.08Å; K216-E226 PolarHBondContact O-N 3.26Å; T218-E226 HydrophobicContact CG2-CB 4.16Å; T218-E226 VanDerWaalsContact CG2-CD 3.47Å; T218-E226 HydrophobicContact CG2-CG 3.98Å; T218-E226 WeakPolarHBondContact CG2-OE1 3.49Å; T218-E226 PolarHBondContact OG1-OE1 3.09Å; E226-K229 WeakPolarHBondContact OE2-CE 3.42Å; E226-K229 IonicContact OE2-NZ 2.93Å; E226-K229 PolarHBondContact OE2-NZ 3.47Å
227D85.8Confident86.1Confident84 Ų8477.5 Ų77.545%0.44942%0.418SS..PPolyproline II helixtrans-61.8152.1177.9-65.5-75000112.6R13 K229R13-D227 VanDerWaalsContact CB-OD1 3.3Å; R13-D227 WeakPolarHBondContact CB-OD1 3.45Å; R13-D227 WeakPolarHBondContact CD-OD1 3.4Å; R13-D227 IonicContact NH1-OD2 3.69Å; R13-D227 PolarHBondContact NH1-OD2 2.96Å; D227-K229 PolarHBondContact O-N 3.1Å
228P79.9Confident85.7Confident40 Ų4080.3 Ų80.326%0.2644%0.435SS..PPolyproline II helixtrans-53.9124.6176-20.529.1000111.8K213 Y214 P215K213-P228 HydrophobicContact CB-CB 3.96Å; Y214-P228 WeakPolarHBondContact O-CA 3.37Å; P215-P228 HydrophobicContact CG-CG 3.97Å
229K66.4Low85.2Confident208 Ų20881.5 Ų81.590%0.90444%0.437SS*.  trans-91.40174.2-68.5-179-175.1163.30111.4E226 D227E226-K229 WeakPolarHBondContact OE2-CE 3.42Å; E226-K229 IonicContact OE2-NZ 2.93Å; E226-K229 PolarHBondContact OE2-NZ 3.47Å; D227-K229 PolarHBondContact O-N 3.1Å

Retrieved 229 of 229 residues in 1235.5 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).