3ZUF

padron off (non-fluorescent) btrans

• Total interactions analyzed: 15
• Total true interactions: 12
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 45
  • Norm. En. per Res.: -2.8125
• Hub Node: A(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	-46.2295	0.3528	-209.133	-255.0097	103	7	0	9090	0	28	24
A-C	-37.2836	-17.0889	-72.1906	-126.5631	45	4	0	2965	2	11	15
A-E	0.0	0.0	-0.1713	-0.1713	3	0	0	25	0	1	2
A-F	0.0	15.686	-1.1327	14.5534	11	0	0	182	0	7	6
B-C	0.0	-10.6837	-2.7114	-13.3951	13	0	0	306	0	23	17
B-D	0.0	0.0	-0.0416	-0.0416	5	0	0	15	0	4	4
C-D	-40.6749	19.6136	-167.49	-188.5513	91	8	2	7503	8	64	61
C-E	0.0	0.0	-0.0863	-0.0863	4	0	0	13	0	4	4
C-F	-41.045	1.6734	-211.204	-250.5756	104	7	0	9055	0	30	24
D-E	-41.4326	9.6578	-212.961	-244.7358	101	8	0	9073	0	29	24
D-F	0.0	0.0	-0.0795	-0.0795	4	0	0	12	0	4	4
E-F	-77.8768	10.9835	-168.315	-235.2084	91	5	3	7382	11	58	55

Interface residues

• A-B: ALA103A, ALA103B, ALA127A, ALA127B, ALA17A, ALA17B, ARG119A, ARG119B, ARG149A, ARG149B, ARG91A, ARG91B, ASN102A, ASN102B, ASN105A, ASN105B, ASN124A, ASN124B, ASN128A, ASN128B, ASN19A, ASN19B, ASP106A, ASP106B, ASP121A, ASP121B, ASP150A, ASP150B, ASP156A, ASP156B, ASP172A, ASP172B, ASP97A, ASP97B, CYS101A, CYS101B, GLU117A, GLU117B, GLU15A, GLU15B, GLU90A, GLU90B, GLY122A, GLY122B, GLY129B, GLY16A, GLY16B, GLY20A, GLY20B, GLY98A, GLY98B, GLY99A, GLY99B, HIS21A, HIS21B, ILE100A, ILE100B, ILE94A, ILE94B, LYS154A, LYS154B, LYS174A, LYS174B, LYS178A, LYS178B, LYS180A, LYS180B, MET132A, MET132B, MET93A, MET93B, PHE120A, PHE120B, PHE125A, PHE125B, PHE173A, PHE173B, PRO126A, PRO126B, PRO22A, PRO22B, SER155A, SER155B, SER88A, SER88B, SER92A, SER92B, THR104A, THR104B, THR175A, THR175B, THR176A, THR176B, TRP89A, TRP89B, TYR177A, TYR177B, VAL123A, VAL123B, VAL152A, VAL152B, VAL18A, VAL18B
• A-C: ALA127C, ALA17A, ALA24A, ARG119A, ARG135C, ARG13A, ASN128C, ASN206A, ASP201A, ASP203A, ASP203C, GLN133C, GLU15A, GLU164C, GLU46A, GLY129C, GLY165C, GLY166C, GLY16A, GLY20A, GLY47A, GLY48A, HIS21A, HIS21C, ILE25A, LEU163C, LEU50A, LEU50C, LYS134C, LYS202A, LYS202C, LYS43A, LYS45A, MET132C, PHE23A, PHE52C, PRO130C, PRO22A, PRO49A, PRO49C, PRO51A, PRO51C, SER205A, VAL131C, VAL44A
• A-E: GLY165E, GLY166E, LYS202A
• A-F: ASN206A, ASP150F, ASP201A, ASP203A, ASP41A, GLY151F, LYS202A, LYS43A, SER205A, VAL152F, VAL182F
• B-C: ARG119B, ARG13B, ASP110B, ASP201C, GLU117B, GLU15B, GLU196C, HIS200C, ILE115B, LYS11B, LYS198C, LYS202C, SER199C
• B-D: ASP187D, GLN184D, GLU85B, LYS181B, VAL182B
• C-D: ALA160C, ALA160D, ARG149C, ARG149D, ARG170C, ARG170D, ASN158C, ASN158D, ASP150C, ASP150D, ASP156C, ASP156D, ASP172C, ASP172D, ASP187C, ASP187D, ASP192C, ASP192D, ASP97C, ASP97D, CYS171C, CYS171D, GLU140C, GLU140D, GLU144C, GLU144D, GLU218D, GLU96C, GLU96D, GLY151C, GLY151D, GLY157C, GLY157D, GLY166C, GLY166D, GLY167C, GLY167D, HIS168C, HIS168D, HIS189C, HIS189D, HIS193C, HIS193D, HIS194C, HIS216C, HIS216D, LEU141C, LEU141D, LEU146C, LEU146D, LEU161C, LEU161D, LEU163C, LEU163D, LYS138C, LYS138D, LYS145C, LYS145D, LYS154C, LYS154D, LYS174C, LYS174D, PHE173C, PHE173D, PRO130C, PRO186C, PRO186D, SER142C, SER142D, SER155C, SER155D, SER162C, SER162D, SER190C, SER190D, SER217C, SER217D, THR143C, THR143D, TRP139C, TRP139D, TYR147C, TYR147D, TYR159C, TYR159D, TYR169C, TYR169D, TYR188C, TYR188D, VAL148C, VAL148D
• C-E: ASP97C, ASP97E, GLU96C, GLU96E
• C-F: ALA103C, ALA103F, ALA127C, ALA127F, ALA17C, ALA17F, ARG119C, ARG119F, ARG149C, ARG149F, ARG91C, ARG91F, ASN102C, ASN102F, ASN105C, ASN105F, ASN124C, ASN124F, ASN128C, ASN128F, ASN19C, ASN19F, ASP106C, ASP106F, ASP121C, ASP121F, ASP150C, ASP150F, ASP156C, ASP156F, ASP172C, ASP172F, ASP97C, ASP97F, CYS101C, CYS101F, GLU117C, GLU117F, GLU15C, GLU15F, GLU90C, GLU90F, GLU96C, GLY122C, GLY122F, GLY16C, GLY16F, GLY20C, GLY20F, GLY98C, GLY98F, GLY99C, GLY99F, HIS21C, HIS21F, ILE100C, ILE100F, ILE94C, ILE94F, LYS154C, LYS154F, LYS174C, LYS174F, LYS178C, LYS178F, LYS180C, LYS180F, MET132C, MET132F, MET93C, MET93F, PHE120C, PHE120F, PHE125C, PHE125F, PHE173C, PHE173F, PRO126C, PRO126F, PRO22C, PRO22F, SER155C, SER155F, SER88C, SER88F, SER92C, SER92F, THR104C, THR104F, THR175C, THR175F, THR176C, THR176F, TRP89C, TRP89F, TYR177C, TYR177F, TYR95C, VAL123C, VAL123F, VAL152C, VAL152F, VAL18C, VAL18F
• D-E: ALA103D, ALA103E, ALA127D, ALA127E, ALA17D, ALA17E, ARG119D, ARG119E, ARG149D, ARG149E, ARG91D, ARG91E, ASN102D, ASN102E, ASN105D, ASN105E, ASN124D, ASN124E, ASN128D, ASN128E, ASN19D, ASN19E, ASP106D, ASP106E, ASP121D, ASP121E, ASP150D, ASP150E, ASP156D, ASP156E, ASP172D, ASP172E, ASP97D, ASP97E, CYS101D, CYS101E, GLU117D, GLU117E, GLU15D, GLU15E, GLU90D, GLU90E, GLY122D, GLY122E, GLY151D, GLY16D, GLY16E, GLY20D, GLY20E, GLY98D, GLY98E, GLY99D, GLY99E, HIS21D, HIS21E, ILE100D, ILE100E, ILE94D, ILE94E, LYS154D, LYS154E, LYS174D, LYS174E, LYS178D, LYS178E, MET132D, MET132E, MET93D, MET93E, PHE120D, PHE120E, PHE125D, PHE125E, PHE173D, PHE173E, PRO126D, PRO126E, PRO22D, PRO22E, SER155D, SER155E, SER88D, SER88E, SER92D, SER92E, THR104D, THR104E, THR175D, THR175E, THR176D, THR176E, TRP89D, TRP89E, TYR177D, TYR177E, VAL123D, VAL123E, VAL152D, VAL152E, VAL18D, VAL18E
• D-F: ASP97D, ASP97F, GLU96D, GLU96F
• E-F: ALA160E, ALA160F, ARG149E, ARG149F, ARG170E, ARG170F, ASN158E, ASN158F, ASP150E, ASP150F, ASP156E, ASP156F, ASP172E, ASP172F, ASP187E, ASP187F, ASP192E, ASP192F, ASP97E, ASP97F, CYS171E, CYS171F, GLU140E, GLU140F, GLU144E, GLU144F, GLU96E, GLU96F, GLY151E, GLY151F, GLY157E, GLY157F, GLY166E, GLY166F, GLY167E, GLY167F, HIS168E, HIS168F, HIS189E, HIS189F, HIS193E, HIS193F, HIS216E, HIS216F, LEU141E, LEU141F, LEU146E, LEU146F, LEU161E, LEU161F, LEU163E, LEU163F, LYS138E, LYS138F, LYS145E, LYS145F, LYS154E, LYS154F, LYS174E, LYS174F, PHE173E, PHE173F, PRO130E, PRO130F, PRO186E, PRO186F, SER142E, SER142F, SER155E, SER155F, SER162E, SER162F, SER190E, SER190F, SER217E, SER217F, THR143E, THR143F, TRP139E, TRP139F, TYR147E, TYR147F, TYR159E, TYR159F, TYR169E, TYR169F, TYR188E, TYR188F, VAL148E, VAL148F, VAL191E