3HD7

helical extension of the neuronal snare complex into the membrane, spacegroup c 1 2 1

• Total interactions analyzed: 28
• Total true interactions: 16
• Strongest Interaction:
  • Chains: G-H
  • Int. Res.: 125
  • Norm. En. per Res.: -4.1245
• Hub Node: A(5)

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	-26.2853	-14.4344	-579.557	-620.2767	170	46	28	23315	3	38	66
A-C	0.0	0.0	-27.1442	-27.1442	51	1	0	1993	0	8	2
A-D	-43.2028	-114.7028	-266.791	-424.6965	109	26	16	12211	9	48	35
A-E	0.0	0.0	-40.6572	-40.6572	30	4	4	2487	0	0	0
A-F	0.0	0.0	-0.2177	-0.2177	7	0	0	47	0	0	0
B-C	-22.1138	-62.7143	-325.824	-410.6521	140	19	17	15122	6	55	69
B-D	0.0	-20.3255	-42.6388	-62.9643	54	1	1	2634	1	10	11
B-E	0.0	0.0	-0.9253	-0.9253	11	0	0	193	0	0	0
B-F	0.0	0.0	-34.1008	-34.1008	28	4	3	1996	0	0	0
C-D	-22.3085	-133.8969	-334.164	-490.3694	126	22	10	14292	8	37	43
E-F	-46.9883	-16.4786	-608.499	-671.9659	171	38	29	23704	3	39	69
E-G	0.0	0.0	-30.1105	-30.1105	53	1	1	2136	0	9	2
E-H	-39.8282	-117.7882	-259.026	-416.6424	112	14	19	12252	7	44	33
F-G	-39.4635	-72.3336	-393.93	-505.7272	145	29	18	16993	6	56	70
F-H	0.0	-25.7291	-43.2284	-68.9575	58	2	0	2702	2	11	12
G-H	-36.768	-143.7793	-335.013	-515.5602	125	39	10	14986	9	39	47

Interface residues

• A-B: ALA104A, ALA220B, ALA240B, ALA247B, ALA254B, ALA261B, ALA37A, ALA67A, ALA69A, ALA72A, ALA74A, ALA81A, ALA82A, ARG198B, ARG210B, ARG232B, ARG246B, ARG262B, ARG263B, ARG31A, ARG47A, ARG56A, ARG66A, ARG86A, ASN207B, ASN236B, ASN49A, ASN92A, ASP214B, ASP218B, ASP231B, ASP242B, ASP250B, ASP40A, ASP44A, ASP51A, ASP57A, ASP64A, ASP65A, ASP68A, CYS103A, CYS271B, CYS272B, GLN226B, GLN258B, GLN33A, GLN34A, GLN36A, GLN38A, GLN58A, GLN71A, GLN76A, GLU194B, GLU196B, GLU201B, GLU206B, GLU211B, GLU224B, GLU228B, GLU234B, GLU238B, GLU245B, GLU41A, GLU55A, GLU62A, GLU78A, GLY100A, GLY227B, GLY26A, GLY276B, GLY73A, HIS199B, HIS213B, HIS239B, HIS28A, ILE102A, ILE105A, ILE106A, ILE109A, ILE110A, ILE195B, ILE202B, ILE203B, ILE209B, ILE230B, ILE233B, ILE266B, ILE268B, ILE269B, ILE270B, ILE274B, ILE278B, ILE279B, ILE45A, ILE97A, ILE98A, LEU107A, LEU205B, LEU212B, LEU222B, LEU275B, LEU32A, LEU54A, LEU60A, LEU63A, LEU70A, LEU84A, LEU93A, LEU99A, LYS204B, LYS252B, LYS253B, LYS256B, LYS260B, LYS264B, LYS265B, LYS52A, LYS59A, LYS83A, LYS85A, LYS87A, LYS91A, LYS94A, MET215B, MET217B, MET219B, MET221B, MET229B, MET267B, MET29A, MET46A, MET95A, MET96A, PHE216B, PHE77A, SER200B, SER208B, SER225B, SER249B, SER259B, SER27A, SER61A, SER75A, SER80A, THR197B, THR251B, THR282B, THR35A, THR79A, TRP89A, TRP90A, TYR113A, TYR235B, TYR243B, TYR257B, TYR88A, VAL101A, VAL223B, VAL237B, VAL241B, VAL244B, VAL248B, VAL255B, VAL273B, VAL39A, VAL42A, VAL43A, VAL48A, VAL50A, VAL53A
• A-C: ALA67A, ALA74A, ALA74C, ALA81A, ARG56A, ARG66A, ASN49A, ASN77C, ASP51C, ASP70C, ASP80C, GLN53C, GLN56C, GLN71A, GLU61C, GLU73C, GLU75C, GLY43C, GLY54C, GLY82C, ILE67C, LEU32A, LEU47C, LEU50C, LEU57C, LEU60A, LEU63A, LEU70A, LEU78C, LEU81C, LEU84A, LYS59A, LYS85A, LYS87A, MET32C, MET46A, MET49C, MET64C, MET71C, PHE77A, SER25C, SER39C, SER80A, THR35A, THR46C, TYR88A, VAL36C, VAL39A, VAL42A, VAL53A, VAL60C
• A-D: ALA164D, ALA185D, ALA195D, ALA199D, ALA37A, ALA67A, ALA69A, ALA72A, ALA74A, ALA81A, ARG161D, ARG176D, ARG180D, ARG191D, ARG198D, ARG31A, ARG47A, ARG56A, ARG66A, ASN144D, ASN159D, ASN169D, ASN175D, ASN188D, ASN196D, ASN49A, ASP147D, ASP166D, ASP172D, ASP179D, ASP186D, ASP193D, ASP40A, ASP44A, ASP51A, ASP57A, ASP64A, ASP65A, GLN152D, GLN174D, GLN177D, GLN197D, GLN34A, GLN36A, GLN38A, GLN58A, GLN71A, GLN76A, GLU143D, GLU148D, GLU151D, GLU170D, GLU183D, GLU194D, GLU41A, GLU55A, GLU62A, GLU78A, GLY155D, GLY158D, GLY168D, GLY73A, HIS162D, HIS28A, ILE156D, ILE157D, ILE171D, ILE178D, ILE181D, ILE192D, ILE45A, LEU150D, LEU160D, LEU165D, LEU32A, LEU54A, LEU60A, LEU63A, LEU70A, LEU84A, LYS184D, LYS189D, LYS52A, LYS59A, LYS83A, LYS87A, MET146D, MET163D, MET167D, MET182D, MET46A, PHE77A, SER154D, SER187D, SER61A, SER75A, SER80A, THR173D, THR190D, THR200D, THR35A, THR79A, VAL153D, VAL39A, VAL42A, VAL43A, VAL48A, VAL50A, VAL53A
• A-E: ALA104A, ALA104E, GLY100E, ILE102A, ILE102E, ILE105A, ILE105E, ILE106A, ILE108A, ILE108E, ILE109A, ILE110A, ILE111A, ILE97E, ILE98A, ILE98E, LEU93E, LEU99E, LYS87E, LYS91E, LYS94E, MET95E, PHE114A, SER115A, THR116A, TRP90E, TYR113A, VAL101A, VAL101E, VAL112A
• A-F: CYS272F, ILE105A, ILE268F, LEU275F, LYS265F, TYR113A, VAL112A
• B-C: ALA18C, ALA191B, ALA220B, ALA22C, ALA240B, ALA247B, ALA254B, ALA42C, ALA74C, ARG16C, ARG17C, ARG198B, ARG210B, ARG232B, ARG246B, ARG262B, ARG31C, ARG45C, ARG59C, ASN207B, ASN236B, ASN65C, ASN68C, ASN77C, ASP19C, ASP214B, ASP218B, ASP231B, ASP242B, ASP250B, ASP41C, ASP51C, ASP58C, ASP70C, ASP80C, GLN15C, GLN190B, GLN20C, GLN226B, GLN258B, GLN34C, GLN53C, GLN56C, GLN69C, GLU13C, GLU196B, GLU201B, GLU206B, GLU211B, GLU224B, GLU228B, GLU234B, GLU238B, GLU245B, GLU24C, GLU27C, GLU37C, GLU38C, GLU52C, GLU55C, GLU61C, GLU62C, GLU73C, GLU75C, GLY227B, GLY43C, GLY54C, GLY63C, GLY82C, HIS199B, HIS213B, HIS239B, HIS66C, ILE195B, ILE202B, ILE203B, ILE209B, ILE230B, ILE233B, ILE44C, ILE67C, LEU11C, LEU192B, LEU205B, LEU212B, LEU21C, LEU222B, LEU26C, LEU33C, LEU35C, LEU47C, LEU50C, LEU57C, LEU78C, LEU81C, LYS189B, LYS204B, LYS252B, LYS253B, LYS256B, LYS40C, LYS72C, LYS76C, LYS79C, MET14C, MET215B, MET217B, MET219B, MET221B, MET229B, MET32C, MET49C, MET64C, MET71C, PHE216B, SER193B, SER200B, SER208B, SER225B, SER249B, SER259B, SER25C, SER28C, SER39C, THR197B, THR251B, THR29C, THR46C, TYR235B, TYR243B, TYR257B, VAL223B, VAL237B, VAL241B, VAL244B, VAL248B, VAL255B, VAL36C, VAL48C, VAL60C
• B-D: ALA164D, ALA185D, ALA195D, ALA199D, ALA220B, ALA240B, ALA247B, ARG161D, ARG191D, ARG198B, ASN159D, ASN175D, ASN188D, ASP147D, GLN174D, GLN226B, GLU143D, GLU206B, HIS162D, HIS199B, HIS213B, ILE156D, ILE157D, ILE171D, ILE178D, ILE181D, ILE192D, ILE195B, ILE202B, ILE209B, ILE230B, ILE233B, LEU150D, LEU160D, LEU165D, LEU205B, LEU212B, MET146D, MET163D, MET167D, MET182D, MET215B, MET219B, MET229B, PHE216B, SER154D, SER208B, THR251B, TYR243B, VAL153D, VAL223B, VAL237B, VAL241B, VAL244B
• B-E: ILE102E, ILE105E, ILE106E, ILE109E, ILE278B, ILE279B, ILE283B, ILE98E, LEU275B, THR282B, VAL101E
• B-F: ALA280B, ALA280F, CYS271F, CYS272B, CYS272F, GLY276B, GLY276F, GLY284B, GLY285B, ILE268F, ILE269F, ILE270F, ILE274F, ILE277B, ILE277F, ILE278B, ILE278F, ILE279B, ILE279F, ILE283B, ILE283F, ILE286B, LEU275B, LEU275F, SER281B, THR282B, VAL273B, VAL273F
• C-D: ALA141D, ALA164D, ALA185D, ALA18C, ALA195D, ALA199D, ALA22C, ALA42C, ALA74C, ARG142D, ARG176D, ARG180D, ARG191D, ARG198D, ARG30C, ARG31C, ARG45C, ARG59C, ASN144D, ASN149D, ASN159D, ASN175D, ASN188D, ASN196D, ASN65C, ASN68C, ASN77C, ASP147D, ASP166D, ASP172D, ASP179D, ASP186D, ASP193D, ASP19C, ASP23C, ASP41C, ASP51C, ASP58C, ASP70C, ASP80C, GLN152D, GLN174D, GLN177D, GLN197D, GLN20C, GLN34C, GLN53C, GLN56C, GLN69C, GLU143D, GLU145D, GLU148D, GLU151D, GLU170D, GLU183D, GLU194D, GLU24C, GLU27C, GLU37C, GLU38C, GLU52C, GLU55C, GLU61C, GLU62C, GLU73C, GLU75C, GLY155D, GLY158D, GLY168D, GLY43C, GLY54C, GLY63C, GLY82C, HIS139D, HIS162D, HIS66C, ILE156D, ILE157D, ILE171D, ILE178D, ILE181D, ILE192D, ILE44C, ILE67C, LEU150D, LEU160D, LEU165D, LEU21C, LEU26C, LEU33C, LEU35C, LEU47C, LEU50C, LEU57C, LEU78C, LEU81C, LYS184D, LYS189D, LYS40C, LYS72C, LYS76C, LYS79C, MET140D, MET146D, MET163D, MET167D, MET182D, MET32C, MET49C, MET64C, MET71C, SER138D, SER154D, SER187D, SER25C, SER28C, SER39C, THR173D, THR190D, THR200D, THR29C, THR46C, VAL153D, VAL36C, VAL48C, VAL60C
• E-F: ALA104E, ALA220F, ALA240F, ALA247F, ALA254F, ALA261F, ALA37E, ALA67E, ALA69E, ALA72E, ALA74E, ALA81E, ALA82E, ARG198F, ARG210F, ARG232F, ARG246F, ARG262F, ARG263F, ARG30E, ARG31E, ARG47E, ARG56E, ARG66E, ARG86E, ASN207F, ASN236F, ASN49E, ASN92E, ASP214F, ASP218F, ASP231F, ASP242F, ASP250F, ASP40E, ASP44E, ASP51E, ASP57E, ASP64E, ASP65E, ASP68E, CYS103E, CYS271F, CYS272F, GLN226F, GLN258F, GLN33E, GLN34E, GLN36E, GLN38E, GLN58E, GLN71E, GLN76E, GLU194F, GLU196F, GLU201F, GLU206F, GLU211F, GLU224F, GLU228F, GLU234F, GLU238F, GLU245F, GLU41E, GLU55E, GLU62E, GLU78E, GLY100E, GLY227F, GLY26E, GLY276F, GLY73E, HIS199F, HIS213F, HIS239F, HIS28E, ILE102E, ILE105E, ILE106E, ILE109E, ILE110E, ILE195F, ILE202F, ILE203F, ILE209F, ILE230F, ILE233F, ILE266F, ILE268F, ILE269F, ILE270F, ILE274F, ILE278F, ILE279F, ILE45E, ILE97E, ILE98E, LEU107E, LEU205F, LEU212F, LEU222F, LEU275F, LEU32E, LEU54E, LEU60E, LEU63E, LEU70E, LEU84E, LEU93E, LEU99E, LYS204F, LYS252F, LYS253F, LYS256F, LYS260F, LYS264F, LYS265F, LYS52E, LYS59E, LYS83E, LYS85E, LYS87E, LYS91E, LYS94E, MET215F, MET217F, MET219F, MET221F, MET229F, MET267F, MET29E, MET46E, MET95E, MET96E, PHE216F, PHE77E, SER200F, SER208F, SER225F, SER249F, SER259F, SER27E, SER61E, SER75E, SER80E, THR197F, THR251F, THR282F, THR35E, THR79E, TRP89E, TRP90E, TYR113E, TYR235F, TYR243F, TYR257F, TYR88E, VAL101E, VAL223F, VAL237F, VAL241F, VAL244F, VAL248F, VAL255F, VAL273F, VAL39E, VAL42E, VAL43E, VAL48E, VAL50E, VAL53E
• E-G: ALA67E, ALA74E, ALA74G, ALA81E, ARG56E, ARG66E, ASN49E, ASN77G, ASP51G, ASP70G, ASP80G, GLN53G, GLN56G, GLN71E, GLU61G, GLU73G, GLU75G, GLY43G, GLY54G, GLY73E, GLY82G, ILE67G, LEU32E, LEU47G, LEU50G, LEU57G, LEU60E, LEU63E, LEU70E, LEU78G, LEU81G, LEU84E, LYS59E, LYS85E, LYS87E, MET32G, MET46E, MET49G, MET64G, MET71G, PHE77E, SER25G, SER39G, SER80E, THR29G, THR35E, THR46G, TYR88E, VAL36G, VAL39E, VAL42E, VAL53E, VAL60G
• E-H: ALA164H, ALA185H, ALA195H, ALA199H, ALA37E, ALA67E, ALA69E, ALA72E, ALA74E, ALA81E, ARG161H, ARG176H, ARG180H, ARG191H, ARG198H, ARG31E, ARG47E, ARG56E, ARG66E, ASN144H, ASN149H, ASN159H, ASN169H, ASN175H, ASN188H, ASN196H, ASN49E, ASP147H, ASP166H, ASP172H, ASP179H, ASP186H, ASP193H, ASP40E, ASP44E, ASP51E, ASP57E, ASP64E, ASP65E, GLN152H, GLN174H, GLN177H, GLN197H, GLN34E, GLN36E, GLN38E, GLN58E, GLN71E, GLN76E, GLU143H, GLU145H, GLU148H, GLU151H, GLU170H, GLU183H, GLU194H, GLU41E, GLU55E, GLU62E, GLU78E, GLY155H, GLY158H, GLY168H, GLY26E, GLY73E, HIS162H, HIS28E, ILE156H, ILE157H, ILE171H, ILE178H, ILE181H, ILE192H, ILE45E, LEU150H, LEU160H, LEU165H, LEU32E, LEU54E, LEU60E, LEU63E, LEU70E, LEU84E, LYS184H, LYS189H, LYS52E, LYS59E, LYS83E, LYS87E, MET146H, MET163H, MET167H, MET182H, MET46E, PHE77E, SER154H, SER187H, SER61E, SER75E, SER80E, THR173H, THR190H, THR200H, THR35E, THR79E, VAL153H, VAL39E, VAL42E, VAL43E, VAL48E, VAL50E, VAL53E
• F-G: ALA18G, ALA191F, ALA220F, ALA22G, ALA240F, ALA247F, ALA254F, ALA42G, ALA74G, ARG16G, ARG17G, ARG198F, ARG210F, ARG232F, ARG246F, ARG262F, ARG30G, ARG31G, ARG45G, ARG59G, ASN207F, ASN236F, ASN65G, ASN68G, ASN77G, ASP19G, ASP214F, ASP218F, ASP231F, ASP23G, ASP242F, ASP250F, ASP41G, ASP51G, ASP58G, ASP70G, ASP80G, GLN15G, GLN190F, GLN20G, GLN226F, GLN258F, GLN34G, GLN53G, GLN56G, GLN69G, GLU10G, GLU12G, GLU13G, GLU194F, GLU196F, GLU201F, GLU206F, GLU211F, GLU224F, GLU228F, GLU234F, GLU238F, GLU245F, GLU24G, GLU27G, GLU37G, GLU38G, GLU52G, GLU55G, GLU61G, GLU62G, GLU73G, GLU75G, GLY227F, GLY43G, GLY54G, GLY63G, GLY82G, HIS199F, HIS213F, HIS239F, HIS66G, ILE195F, ILE202F, ILE203F, ILE209F, ILE230F, ILE233F, ILE44G, ILE67G, LEU11G, LEU192F, LEU205F, LEU212F, LEU21G, LEU222F, LEU26G, LEU33G, LEU35G, LEU47G, LEU50G, LEU57G, LEU78G, LEU81G, LYS189F, LYS252F, LYS253F, LYS256F, LYS40G, LYS72G, LYS76G, LYS79G, MET14G, MET215F, MET217F, MET219F, MET221F, MET229F, MET32G, MET49G, MET64G, MET71G, PHE216F, SER188F, SER193F, SER200F, SER208F, SER225F, SER249F, SER259F, SER25G, SER28G, SER39G, THR197F, THR251F, THR29G, THR46G, TYR235F, TYR243F, TYR257F, VAL223F, VAL237F, VAL241F, VAL244F, VAL248F, VAL255F, VAL36G, VAL48G, VAL60G
• F-H: ALA164H, ALA185H, ALA195H, ALA199H, ALA220F, ALA240F, ALA247F, ARG142H, ARG161H, ARG191H, ARG198F, ARG198H, ASN144H, ASN159H, ASN175H, ASN188H, ASP147H, GLN174H, GLN226F, GLU143H, GLU201F, GLU206F, GLU234F, HIS139H, HIS162H, HIS199F, HIS213F, ILE156H, ILE157H, ILE171H, ILE178H, ILE181H, ILE192H, ILE195F, ILE202F, ILE209F, ILE230F, ILE233F, LEU150H, LEU160H, LEU165H, LEU205F, LEU212F, MET146H, MET163H, MET167H, MET182H, MET215F, MET219F, PHE216F, SER154H, THR251F, TYR243F, VAL153H, VAL223F, VAL237F, VAL241F, VAL244F
• G-H: ALA141H, ALA164H, ALA185H, ALA18G, ALA195H, ALA199H, ALA22G, ALA42G, ALA74G, ARG142H, ARG176H, ARG180H, ARG191H, ARG198H, ARG30G, ARG31G, ARG45G, ARG59G, ASN144H, ASN149H, ASN159H, ASN169H, ASN175H, ASN188H, ASN196H, ASN65G, ASN68G, ASN77G, ASP147H, ASP166H, ASP172H, ASP179H, ASP186H, ASP193H, ASP19G, ASP23G, ASP41G, ASP51G, ASP58G, ASP70G, ASP80G, GLN152H, GLN174H, GLN177H, GLN197H, GLN20G, GLN34G, GLN53G, GLN56G, GLN69G, GLU143H, GLU145H, GLU148H, GLU151H, GLU170H, GLU183H, GLU194H, GLU24G, GLU27G, GLU37G, GLU38G, GLU52G, GLU55G, GLU61G, GLU62G, GLU73G, GLU75G, GLY155H, GLY158H, GLY168H, GLY43G, GLY54G, GLY63G, GLY82G, HIS139H, HIS162H, HIS66G, ILE156H, ILE157H, ILE171H, ILE178H, ILE181H, ILE192H, ILE44G, ILE67G, LEU150H, LEU160H, LEU165H, LEU21G, LEU26G, LEU33G, LEU35G, LEU47G, LEU50G, LEU57G, LEU78G, LEU81G, LYS184H, LYS189H, LYS40G, LYS72G, LYS76G, LYS79G, MET140H, MET146H, MET163H, MET167H, MET182H, MET32G, MET49G, MET64G, MET71G, SER154H, SER187H, SER25G, SER28G, SER39G, THR173H, THR190H, THR29G, THR46G, VAL153H, VAL36G, VAL48G, VAL60G