2B8H

a/nws/whale/maine/1/84 (h1n9) reassortant influenza virus neuraminidase

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: B-C
  • Int. Res.: 155
  • Norm. En. per Res.: -3.868
• Hub Node: A(3)

All Interactions

Chains	Hydro. Bond Ener. (kJ/mol)	Elec. Ener. (kJ/mol)	VDW. Ener. (kJ/mol)	Tot. Stab. Ener. (kJ/mol)	#int. res.	# Short cont.	#Hydr. int.	#VDW pairs	#salt bridges	#Pot. fav. elec. int	#Pot. unfav. elec. int
A-B	-75.8691	-12.4206	-498.078	-586.3677	158	14	5	17870	2	47	42
A-C	0.0	0.0	-0.9736	-0.9736	7	0	1	122	0	2	3
A-D	-63.8737	-16.7164	-511.663	-592.2531	156	14	5	18218	2	47	42
B-C	-68.8743	-14.6584	-516.014	-599.5466	155	17	5	17987	2	47	41
B-D	0.0	0.0	-0.8612	-0.8612	8	0	1	124	0	2	3
C-D	-75.4894	-9.1415	-487.194	-571.8249	157	18	5	17910	2	46	41

Interface residues

• A-B: ALA105A, ALA202B, ALA204B, ALA414A, ALA463A, ARG107A, ARG141A, ARG141B, ARG152B, ARG156B, ARG173B, ARG210B, ARG211B, ARG221B, ARG420A, ARG429A, ASN104A, ASN146B, ASN171A, ASN171B, ASN199B, ASN200B, ASN201B, ASN209B, ASN217B, ASN458A, ASP103A, ASP111A, ASP111B, ASP113A, ASP113B, ASP125A, ASP127A, ASP151B, ASP157B, ASP401A, ASP411A, ASP461A, CYS124A, CYS129A, CYS176B, CYS194B, CYS422A, CYS448A, GLN136B, GLN154B, GLN394A, GLN456A, GLU110A, GLU128A, GLU175B, GLU215B, GLU260B, GLU415A, GLU417A, GLU452A, GLU466A, GLY101A, GLY109A, GLY109B, GLY137B, GLY142B, GLY147B, GLY178B, GLY197B, GLY416A, GLY455A, GLY462A, HIS144B, HIS98A, ILE108A, ILE140B, ILE159B, ILE177B, ILE195B, ILE206B, ILE216B, ILE263B, ILE396A, ILE444A, ILE465A, ILE99A, LEU115A, LEU115B, LEU158B, LEU163A, LEU224B, LEU398A, LEU427A, LEU454A, LEU469A, LYS102A, LYS143B, LYS262B, LYS464A, MET447A, PHE131A, PHE409A, PHE453A, PHE468A, PRO126A, PRO162A, PRO166A, PRO167A, PRO198B, PRO212B, PRO460A, SER112A, SER112B, SER135B, SER145B, SER153B, SER164A, SER165A, SER172A, SER172B, SER196B, SER203B, SER443A, SER446A, SER449A, SER450A, SER96A, THR138B, THR139A, THR139B, THR148B, THR168A, THR168B, THR214B, THR218B, THR451A, TRP179B, TRP207B, TRP413A, TRP438B, TRP439A, TRP457A, TRP459A, TRP97A, TYR100A, TYR155B, TYR170A, TYR170B, TYR208B, TYR412A, TYR467A, VAL106A, VAL114A, VAL114B, VAL116B, VAL169A, VAL169B, VAL174B, VAL205B, VAL213B, VAL397A, VAL445A
• A-C: ASP111C, ASP113A, ASP113C, SER112A, SER112C, TYR170A, TYR170C
• A-D: ALA105D, ALA202A, ALA204A, ALA414D, ALA463D, ARG107D, ARG141A, ARG141D, ARG152A, ARG156A, ARG173A, ARG210A, ARG211A, ARG221A, ARG420D, ARG429D, ASN104D, ASN146A, ASN171A, ASN171D, ASN199A, ASN200A, ASN201A, ASN209A, ASN217A, ASN458D, ASP103D, ASP111D, ASP113A, ASP113D, ASP125D, ASP127D, ASP151A, ASP157A, ASP401D, ASP411D, ASP461D, CYS124D, CYS129D, CYS176A, CYS194A, CYS422D, CYS448D, GLN136A, GLN154A, GLN394D, GLN456D, GLU110D, GLU128D, GLU175A, GLU215A, GLU260A, GLU415D, GLU417D, GLU452D, GLU466D, GLY101D, GLY109A, GLY109D, GLY137A, GLY142A, GLY147A, GLY178A, GLY197A, GLY416D, GLY455D, GLY462D, HIS144A, HIS98D, ILE108D, ILE140A, ILE159A, ILE177A, ILE195A, ILE206A, ILE216A, ILE263A, ILE396D, ILE444D, ILE465D, ILE99D, LEU115A, LEU115D, LEU158A, LEU163D, LEU224A, LEU398D, LEU427D, LEU454D, LEU469D, LYS102D, LYS143A, LYS262A, LYS464D, MET447D, PHE131D, PHE409D, PHE453D, PHE468D, PRO126D, PRO162D, PRO166D, PRO167D, PRO198A, PRO212A, PRO460D, SER112A, SER112D, SER135A, SER145A, SER153A, SER164D, SER165D, SER172A, SER172D, SER196A, SER203A, SER446D, SER449D, SER450D, SER96D, THR138A, THR139A, THR139D, THR148A, THR168A, THR168D, THR214A, THR218A, THR451D, TRP179A, TRP207A, TRP413D, TRP438A, TRP439D, TRP457D, TRP459D, TRP97D, TYR100D, TYR155A, TYR170A, TYR170D, TYR208A, TYR412D, TYR467D, VAL106D, VAL114A, VAL114D, VAL116A, VAL169A, VAL169D, VAL174A, VAL205A, VAL213A, VAL397D, VAL445D
• B-C: ALA105B, ALA202C, ALA204C, ALA414B, ALA463B, ARG107B, ARG141B, ARG141C, ARG152C, ARG156C, ARG173C, ARG210C, ARG211C, ARG221C, ARG420B, ARG429B, ASN104B, ASN146C, ASN171B, ASN171C, ASN199C, ASN200C, ASN201C, ASN209C, ASN217C, ASN458B, ASP103B, ASP111B, ASP113B, ASP113C, ASP125B, ASP127B, ASP151C, ASP157C, ASP401B, ASP411B, ASP461B, CYS124B, CYS129B, CYS176C, CYS194C, CYS422B, CYS448B, GLN136C, GLN154C, GLN394B, GLN456B, GLU110B, GLU128B, GLU175C, GLU215C, GLU260C, GLU415B, GLU417B, GLU452B, GLU466B, GLY101B, GLY109B, GLY109C, GLY137C, GLY142C, GLY147C, GLY178C, GLY197C, GLY416B, GLY455B, GLY462B, HIS144C, HIS98B, ILE108B, ILE140C, ILE159C, ILE177C, ILE195C, ILE206C, ILE216C, ILE263C, ILE396B, ILE444B, ILE465B, ILE99B, LEU115B, LEU115C, LEU158C, LEU163B, LEU224C, LEU398B, LEU427B, LEU454B, LEU469B, LYS102B, LYS143C, LYS262C, LYS464B, MET447B, PHE131B, PHE409B, PHE453B, PHE468B, PRO126B, PRO162B, PRO166B, PRO167B, PRO198C, PRO212C, PRO460B, SER112B, SER112C, SER135C, SER145C, SER153C, SER164B, SER165B, SER172B, SER172C, SER196C, SER203C, SER446B, SER449B, SER450B, SER96B, THR138C, THR139B, THR139C, THR148C, THR168B, THR168C, THR214C, THR218C, THR451B, TRP179C, TRP207C, TRP413B, TRP439B, TRP457B, TRP459B, TRP97B, TYR100B, TYR155C, TYR170B, TYR170C, TYR208C, TYR412B, TYR467B, VAL106B, VAL114B, VAL114C, VAL116C, VAL169B, VAL169C, VAL174C, VAL205C, VAL213C, VAL397B, VAL445B
• B-D: ASN171B, ASN171D, ASP113B, ASP113D, SER112B, SER112D, TYR170B, TYR170D
• C-D: ALA105C, ALA202D, ALA204D, ALA414C, ALA463C, ARG107C, ARG141C, ARG141D, ARG152D, ARG156D, ARG173D, ARG210D, ARG211D, ARG221D, ARG420C, ARG429C, ASN104C, ASN146D, ASN171C, ASN171D, ASN199D, ASN200D, ASN201D, ASN209D, ASN217D, ASN458C, ASP103C, ASP111C, ASP111D, ASP113C, ASP113D, ASP125C, ASP127C, ASP151D, ASP157D, ASP401C, ASP411C, ASP461C, CYS124C, CYS129C, CYS176D, CYS194D, CYS422C, CYS448C, GLN136D, GLN154D, GLN394C, GLN456C, GLU110C, GLU128C, GLU175D, GLU215D, GLU260D, GLU415C, GLU417C, GLU452C, GLU466C, GLY101C, GLY109C, GLY109D, GLY137D, GLY142D, GLY147D, GLY178D, GLY197D, GLY416C, GLY455C, GLY462C, HIS144D, HIS98C, ILE108C, ILE140D, ILE159D, ILE177D, ILE195D, ILE206D, ILE216D, ILE263D, ILE396C, ILE444C, ILE465C, ILE99C, LEU115C, LEU115D, LEU158D, LEU163C, LEU224D, LEU398C, LEU427C, LEU454C, LEU469C, LYS102C, LYS143D, LYS262D, LYS464C, MET447C, PHE131C, PHE409C, PHE453C, PHE468C, PRO126C, PRO162C, PRO166C, PRO167C, PRO198D, PRO212D, PRO460C, SER112C, SER112D, SER135D, SER145D, SER153D, SER164C, SER165C, SER172C, SER172D, SER196D, SER203D, SER446C, SER449C, SER450C, SER96C, THR138D, THR139C, THR139D, THR148D, THR168C, THR168D, THR214D, THR218D, THR451C, TRP179D, TRP207D, TRP413C, TRP438D, TRP439C, TRP457C, TRP459C, TRP97C, TYR100C, TYR155D, TYR170C, TYR170D, TYR208D, TYR412C, TYR467C, VAL106C, VAL114C, VAL114D, VAL116D, VAL169C, VAL169D, VAL174D, VAL205D, VAL213D, VAL397C, VAL445C