3LGV

h198p mutant of the degs-deltapdz protease

• Total interactions analyzed: 36
• Total true interactions: 14
• Strongest Interaction:
  • Chains: D-E
  • Int. Res.: 95
  • Norm. En. per Res.: -3.8142
• Hub Node: E(4)

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	-88.0649	20.2415	-328.939	-396.7624	119	14	5	12711	4	12	13
A-C	-70.4754	22.1666	-269.35	-317.6588	107	14	7	11078	0	10	13
B-C	-76.8053	31.2753	-306.277	-351.807	108	13	5	12028	2	14	13
B-D	0.0	0.0	-7.2697	-7.2697	29	0	0	679	0	2	3
C-D	-20.7594	-7.768	-112.817	-141.3444	42	5	2	4061	0	9	4
D-E	-100.5793	20.4203	-282.188	-362.347	95	19	7	11162	3	8	10
D-F	-82.253	26.1738	-272.554	-328.6332	96	18	6	10907	3	9	10
E-F	-78.1604	21.9587	-324.208	-380.4097	109	16	5	12394	3	13	12
E-G	0.0	0.0	-0.0109	-0.0109	6	0	0	20	0	3	3
E-H	-8.5976	-6.5219	-39.1148	-54.2342	21	4	0	1557	0	4	4
E-I	-8.5799	-14.388	-29.5165	-52.4845	28	1	0	1450	0	12	7
G-H	-60.7738	-0.9422	-312.032	-373.748	110	19	5	12149	4	14	13
G-I	-50.8652	18.6962	-311.562	-343.731	112	21	5	12204	3	14	15
H-I	-63.8065	21.0037	-266.998	-309.8009	95	11	5	10320	0	8	10

Interface residues

• A-B: ALA157A, ALA175B, ALA194A, ALA194B, ALA45A, ALA50A, ALA54B, ALA55A, ALA57B, ARG146B, ARG147B, ARG178B, ARG52A, ARG53B, ASN144B, ASN160A, ASN163A, ASN182B, ASN197A, ASN200A, ASN207B, ASN48A, ASN60A, ASP110A, ASP153B, ASP193A, ASP193B, ASP221B, ASP38A, ASP41A, ASP86B, GLN109A, GLN166A, GLN170A, GLN170B, GLN191B, GLN36A, GLN87B, GLU211B, GLU230A, GLU230B, GLU42A, GLY111A, GLY152B, GLY159A, GLY165A, GLY171A, GLY171B, GLY177B, GLY180B, GLY185B, GLY210B, GLY231A, GLY231B, GLY233A, GLY233B, HIS150B, ILE141B, ILE143B, ILE151B, ILE158A, ILE168A, ILE172B, ILE173B, ILE179B, ILE196A, ILE232A, ILE232B, ILE84B, LEU108A, LEU138B, LEU156A, LEU164A, LEU181B, LEU209B, LEU49A, LEU49B, MET213B, MET85B, PHE220B, PHE234B, PHE37A, PRO139B, PRO142B, PRO149B, PRO161A, PRO183B, PRO198A, PRO229A, PRO229B, PRO44A, PRO56B, SER174B, SER195A, SER195B, SER208B, SER219A, SER39A, SER46A, THR140B, THR167A, THR169A, THR176B, THR184B, THR192A, THR192B, THR228A, THR228B, THR40A, THR43A, TYR162A, TYR47A, TYR47B, VAL148B, VAL154A, VAL154B, VAL155A, VAL155B, VAL51A
• A-C: ALA157C, ALA175A, ALA194A, ALA194C, ALA45C, ALA50C, ALA55C, ARG146A, ARG147A, ARG178A, ARG52C, ARG53A, ASN144A, ASN160C, ASN163C, ASN197C, ASN200C, ASN207A, ASN224A, ASN48C, ASN60C, ASP153A, ASP193A, ASP193C, ASP221A, ASP225A, ASP41C, GLN109C, GLN166C, GLN170A, GLN170C, GLN191A, GLU211A, GLU227A, GLU227C, GLU230A, GLU230C, GLU42C, GLY152A, GLY159C, GLY165C, GLY171A, GLY171C, GLY180A, GLY199C, GLY210A, GLY226A, GLY231A, GLY231C, GLY233A, GLY233C, HIS150A, ILE151A, ILE158C, ILE168C, ILE172A, ILE173A, ILE179A, ILE196C, ILE232A, ILE232C, LEU156C, LEU164C, LEU209A, LEU218C, LEU49A, LEU49C, LEU79C, LYS222A, MET213A, PHE220A, PHE220C, PHE234A, PRO149A, PRO161C, PRO198C, PRO229A, PRO229C, PRO44C, SER174A, SER195A, SER195C, SER208A, SER219C, SER223A, SER39C, SER46A, SER46C, THR167C, THR169C, THR176A, THR192A, THR192C, THR228A, THR228C, THR40C, THR43C, THR78C, TYR162C, TYR47A, TYR47C, VAL148A, VAL154A, VAL154C, VAL155A, VAL155C, VAL51C
• B-C: ALA145C, ALA157B, ALA175C, ALA194B, ALA194C, ALA45B, ALA50B, ALA55B, ARG146C, ARG147C, ARG178C, ARG52B, ARG53C, ASN144C, ASN160B, ASN163B, ASN182C, ASN197B, ASN200B, ASN207C, ASN48B, ASN60B, ASP110B, ASP153C, ASP193B, ASP193C, ASP221B, ASP38B, ASP41B, GLN109B, GLN166B, GLN170B, GLN170C, GLN191C, GLU211C, GLU227C, GLU230B, GLU230C, GLU42B, GLY111B, GLY152C, GLY159B, GLY165B, GLY171B, GLY171C, GLY177C, GLY180C, GLY185C, GLY210C, GLY231B, GLY231C, GLY233C, HIS150C, ILE143C, ILE151C, ILE158B, ILE168B, ILE172C, ILE173C, ILE179C, ILE196B, ILE232B, ILE232C, LEU156B, LEU164B, LEU181C, LEU209C, LEU212C, LEU49B, LEU49C, LEU79B, MET213C, PHE220B, PHE220C, PHE234C, PRO142C, PRO149C, PRO161B, PRO183C, PRO198B, PRO229B, PRO229C, PRO44B, SER174C, SER195B, SER195C, SER208C, SER219B, SER39B, SER46B, THR167B, THR169B, THR176C, THR184C, THR192C, THR228B, THR228C, THR40B, THR43B, TYR162B, TYR47B, TYR47C, VAL148C, VAL154B, VAL154C, VAL155B, VAL155C, VAL51B
• B-D: ALA101D, ALA134D, ARG250D, ARG253D, ARG64B, ASN133D, ASN163B, ASN67B, ASN69B, ASP102D, ASP251D, GLN73B, GLU115D, GLU75B, GLY120D, GLY252D, ILE255D, ILE76B, LEU117D, LEU118D, LEU164B, LEU248D, LEU74B, LEU79B, SER121D, THR135D, THR68B, TYR162B, VAL119D
• C-D: ALA107D, ALA116D, ALA134D, ARG112D, ARG186C, ARG64D, ASN133D, ASN182C, ASP110D, ASP126C, GLN103D, GLN109D, GLN187C, GLU115D, GLY111D, GLY136D, GLY137D, GLY180C, GLY185C, ILE104D, ILE105D, ILE132D, ILE232C, LEU108D, LEU124C, LEU138D, LEU181C, LEU218C, LEU74D, PHE114D, PHE189C, PHE220C, PHE234C, PRO183C, PRO229C, SER123C, SER219C, THR125C, THR135D, THR184C, VAL106D, VAL113D
• D-E: ALA145E, ALA157D, ALA175E, ALA194D, ALA194E, ALA45D, ALA50D, ALA55D, ARG146E, ARG147E, ARG178E, ARG52D, ARG53E, ASN144E, ASN160D, ASN163D, ASN197D, ASN200D, ASN207E, ASN48D, ASN60D, ASP153E, ASP193D, ASP193E, ASP221E, ASP41D, GLN109D, GLN166D, GLN170D, GLN170E, GLN191E, GLU211E, GLU230D, GLU230E, GLU42D, GLY152E, GLY159D, GLY165D, GLY171D, GLY171E, GLY210E, GLY231D, GLY231E, GLY233E, HIS150E, ILE143E, ILE151E, ILE158D, ILE168D, ILE172E, ILE173E, ILE179E, ILE196D, ILE232D, ILE232E, LEU156D, LEU164D, LEU209E, LEU49D, LEU49E, LYS222E, MET213E, PHE220D, PHE220E, PHE234E, PRO142E, PRO149E, PRO161D, PRO198D, PRO229D, PRO229E, PRO44D, SER174E, SER195D, SER195E, SER208E, SER219D, SER39D, SER46D, THR167D, THR169D, THR176E, THR192E, THR228E, THR40D, THR43D, TYR162D, TYR47D, TYR47E, VAL148E, VAL154D, VAL154E, VAL155D, VAL155E, VAL51D
• D-F: ALA145D, ALA157F, ALA175D, ALA194D, ALA194F, ALA45F, ALA50F, ALA55F, ARG146D, ARG147D, ARG178D, ARG52F, ARG53D, ASN144D, ASN160F, ASN163F, ASN197F, ASN200F, ASN207D, ASN48F, ASN60F, ASP153D, ASP193D, ASP193F, ASP41F, GLN109F, GLN166F, GLN170D, GLN170F, GLN191D, GLU211D, GLU230D, GLU230F, GLU42F, GLY152D, GLY159F, GLY165F, GLY171D, GLY171F, GLY180D, GLY210D, GLY231D, GLY231F, GLY233D, GLY233F, HIS150D, ILE143D, ILE151D, ILE158F, ILE168F, ILE172D, ILE173D, ILE179D, ILE196F, ILE232D, ILE232F, LEU156F, LEU164F, LEU209D, LEU212D, LEU49D, LEU49F, MET213D, PHE220D, PHE220F, PHE234D, PRO142D, PRO149D, PRO161F, PRO198F, PRO229D, PRO229F, PRO44F, SER174D, SER195D, SER195F, SER208D, SER219F, SER39F, SER46F, THR167F, THR169F, THR176D, THR192D, THR228F, THR40F, THR43F, TYR162F, TYR47D, TYR47F, VAL148D, VAL154D, VAL154F, VAL155D, VAL155F, VAL51F
• E-F: ALA145F, ALA157E, ALA175F, ALA194E, ALA194F, ALA45E, ALA50E, ALA55E, ARG146F, ARG147F, ARG178F, ARG52E, ARG53F, ASN144F, ASN160E, ASN163E, ASN182F, ASN197E, ASN200E, ASN207F, ASN48E, ASN60E, ASP153F, ASP193E, ASP193F, ASP221E, ASP221F, ASP38E, ASP41E, GLN109E, GLN166E, GLN170E, GLN170F, GLN191F, GLU211F, GLU230E, GLU230F, GLU42E, GLY111E, GLY152F, GLY159E, GLY165E, GLY171E, GLY171F, GLY177F, GLY180F, GLY185F, GLY210F, GLY231E, GLY231F, GLY233E, GLY233F, HIS150F, ILE141F, ILE143F, ILE151F, ILE158E, ILE168E, ILE172F, ILE173F, ILE179F, ILE196E, ILE232E, ILE232F, LEU156E, LEU164E, LEU181F, LEU209F, LEU49E, LEU49F, MET213F, PHE220F, PHE234F, PHE37E, PRO142F, PRO149F, PRO161E, PRO183F, PRO198E, PRO229E, PRO229F, PRO44E, SER174F, SER195E, SER195F, SER208F, SER219E, SER39E, SER46E, THR140F, THR167E, THR169E, THR176F, THR184F, THR192E, THR192F, THR228E, THR228F, THR40E, THR43E, TYR162E, TYR47E, TYR47F, VAL148F, VAL154E, VAL154F, VAL155E, VAL155F, VAL51E
• E-G: ARG147G, ARG250E, ARG88E, ASN144G, ILE249E, LEU209G
• E-H: ALA134E, ALA45H, ARG112E, ASN133E, ASP110E, ASP41H, GLU115E, GLU42H, GLY111E, GLY136E, GLY137E, ILE132E, LEU108E, LEU138E, PHE114E, PRO44H, SER46H, THR135E, THR40H, THR43H, VAL113E
• E-I: ALA134E, ALA45I, ARG250E, ARG52I, ARG53I, ARG88E, ASN133E, ASP246E, ASP38I, ASP41I, GLU115E, GLU42I, ILE132E, ILE249E, LEU117E, LEU209I, LEU49I, LYS131E, LYS247E, MET245E, PRO44I, SER208I, SER39I, THR135E, THR40I, THR43I, TYR47I, TYR90E
• G-H: ALA145H, ALA157G, ALA175H, ALA194G, ALA194H, ALA45G, ALA50G, ALA55G, ARG146H, ARG147H, ARG178H, ARG52G, ARG52H, ARG53H, ASN144H, ASN160G, ASN163G, ASN182H, ASN197G, ASN200G, ASN207H, ASN48G, ASN60G, ASP110G, ASP153H, ASP193G, ASP193H, ASP38G, ASP41G, GLN109G, GLN166G, GLN170G, GLN170H, GLN191H, GLU211H, GLU227H, GLU230G, GLU230H, GLU42G, GLY111G, GLY152H, GLY159G, GLY165G, GLY171G, GLY171H, GLY177H, GLY180H, GLY185H, GLY210H, GLY226H, GLY231G, GLY231H, GLY233G, GLY233H, HIS150H, ILE143H, ILE151H, ILE158G, ILE168G, ILE172H, ILE173H, ILE179H, ILE196G, ILE232G, ILE232H, LEU156G, LEU164G, LEU181H, LEU209H, LEU49G, LEU49H, LEU79G, MET213H, PHE220G, PHE220H, PHE234H, PRO142H, PRO149H, PRO161G, PRO183H, PRO198G, PRO229G, PRO229H, PRO44G, SER174H, SER195G, SER195H, SER208H, SER219G, SER39G, SER46G, THR167G, THR169G, THR176H, THR184H, THR192G, THR192H, THR228G, THR228H, THR40G, THR43G, TYR162G, TYR47G, TYR47H, VAL148H, VAL154G, VAL154H, VAL155G, VAL155H, VAL51G
• G-I: ALA145G, ALA157I, ALA175G, ALA194G, ALA194I, ALA45I, ALA50I, ALA55I, ARG146G, ARG147G, ARG178G, ARG52I, ARG53G, ASN144G, ASN160I, ASN163I, ASN182G, ASN197I, ASN200I, ASN207G, ASN48I, ASN60I, ASP110I, ASP153G, ASP193G, ASP193I, ASP221I, ASP38I, ASP41I, GLN109I, GLN166I, GLN170G, GLN170I, GLN191G, GLU211G, GLU227G, GLU227I, GLU230G, GLU230I, GLU42I, GLY111I, GLY152G, GLY159I, GLY165I, GLY171G, GLY171I, GLY177G, GLY180G, GLY185G, GLY210G, GLY226G, GLY231G, GLY231I, GLY233G, GLY233I, HIS150G, ILE143G, ILE151G, ILE158I, ILE168I, ILE172G, ILE173G, ILE179G, ILE196I, ILE232G, ILE232I, LEU156I, LEU164I, LEU181G, LEU209G, LEU212G, LEU49G, LEU49I, LEU79I, MET213G, PHE220G, PHE234G, PRO142G, PRO149G, PRO161I, PRO183G, PRO198I, PRO229G, PRO229I, PRO44I, SER174G, SER195G, SER195I, SER208G, SER219I, SER39I, SER46G, SER46I, THR167I, THR169I, THR176G, THR184G, THR192G, THR192I, THR228G, THR228I, THR40I, THR43I, TYR162I, TYR47G, TYR47I, VAL148G, VAL154G, VAL154I, VAL155G, VAL155I, VAL51I
• H-I: ALA157H, ALA175I, ALA194H, ALA194I, ALA45H, ALA50H, ALA55H, ARG146I, ARG147I, ARG178I, ARG52H, ARG53I, ASN144I, ASN160H, ASN163H, ASN197H, ASN200H, ASN207I, ASN48H, ASN60H, ASP153I, ASP193H, ASP193I, ASP221I, ASP41H, GLN109H, GLN166H, GLN170H, GLN170I, GLN191I, GLU211I, GLU227I, GLU230H, GLU230I, GLU42H, GLY152I, GLY159H, GLY165H, GLY171H, GLY171I, GLY177I, GLY210I, GLY226I, GLY231H, GLY231I, GLY233I, HIS150I, ILE151I, ILE158H, ILE168H, ILE172I, ILE173I, ILE179I, ILE196H, ILE232H, ILE232I, LEU156H, LEU164H, LEU209I, LEU49H, LEU49I, MET213I, PHE220I, PHE234I, PRO149I, PRO161H, PRO198H, PRO229H, PRO229I, PRO44H, SER174I, SER195H, SER195I, SER208I, SER219H, SER46H, SER46I, THR167H, THR169H, THR176I, THR192I, THR228H, THR228I, THR40H, THR43H, TYR162H, TYR47H, TYR47I, VAL148I, VAL154H, VAL154I, VAL155H, VAL155I, VAL206I, VAL51H