3M30

structural insight into methyl-coenzyme m reductase chemistry using coenzyme b analogues

• Total interactions analyzed: 15
• Total true interactions: 14
• Strongest Interaction:
  • Chains: E-F
  • Int. Res.: 213
  • Norm. En. per Res.: -5.6128
• 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	-12.4922	-14.2201	-305.438	-332.1502	125	11	3	11946	4	31	34
A-C	-121.057	-97.3079	-759.171	-977.5359	199	41	6	27495	10	63	74
A-D	-313.4701	-128.9328	-1618.31	-2060.713	393	62	38	58233	12	116	101
A-E	-86.4886	-49.6555	-663.268	-799.4122	216	20	16	24901	3	31	21
A-F	-36.1579	-44.3777	-133.418	-213.9535	67	5	2	6173	6	34	36
B-C	-215.4345	-274.0556	-673.927	-1163.4171	210	27	23	26342	22	72	55
B-D	-89.3063	-49.7406	-645.775	-784.8219	218	20	17	24424	3	31	21
B-E	-107.5855	30.6929	-551.832	-628.7247	196	19	22	24018	0	55	43
B-F	0.0	0.0	-30.293	-30.293	22	0	1	1032	0	0	0
C-D	-37.0578	-45.0493	-123.53	-205.6371	66	5	2	5767	6	31	32
C-E	0.0	0.0	-29.7128	-29.7128	22	0	1	1036	0	0	0
D-E	-13.1726	-13.4724	-307.632	-334.277	125	11	3	12005	4	31	34
D-F	-144.2252	-104.2429	-762.352	-1010.8201	200	38	6	27831	12	62	71
E-F	-262.7714	-230.7512	-702.01	-1195.5326	213	38	24	27502	23	73	55

Interface residues

• A-B: ALA229B, ALA232B, ALA272A, ALA356B, ALA454A, ALA479A, ARG193B, ARG270A, ARG383B, ARG440A, ARG461A, ASN194B, ASN335B, ASN376B, ASN378B, ASN456A, ASN474A, ASN477A, ASN481A, ASP180B, ASP228B, ASP336B, ASP348B, ASP447A, ASP450A, ASP463A, GLN183B, GLN325B, GLN449A, GLN451A, GLU169B, GLU186B, GLU234B, GLU339B, GLU353B, GLU436A, GLU464A, GLY187B, GLY227B, GLY231B, GLY321A, GLY326A, GLY327A, GLY329A, GLY350B, GLY354B, GLY358B, GLY368B, GLY369B, GLY387B, GLY442A, GLY453A, GLY462A, GLY465A, HIS237B, HIS364B, HIS379B, HIS384B, ILE181B, ILE366B, ILE374B, ILE380B, ILE460A, LEU185B, LEU320A, LEU332B, LEU337B, LEU433A, LEU441A, LEU448A, LYS184B, LYS351B, LYS386B, LYS435A, MET223B, MET226B, MET236B, MET324A, MET480A, PHE233B, PHE330A, PHE340B, PHE349B, PHE359B, PHE361B, PHE362B, PHE375B, PHE388B, PHE443A, PHE458A, PRO182B, PRO188B, PRO268A, PRO345B, PRO473A, PRO476A, SER325A, SER328B, SER329B, SER346B, SER360B, SER363B, SER365B, SER385B, SER455A, SER459A, THR355B, THR382B, TYR190B, TYR333A, TYR333B, TYR367B, TYR432A, TYR444A, TYR446A, TYR475A, TYR478A, VAL168B, VAL230B, VAL269A, VAL328A, VAL352B, VAL357B, VAL381B, VAL482A
• A-C: ALA114C, ALA223C, ALA230C, ALA374A, ALA390A, ALA402A, ALA454A, ALA94C, ALA96C, ARG101C, ARG103C, ARG120C, ARG147C, ARG151C, ARG15C, ARG161C, ARG173C, ARG174C, ARG218C, ARG225C, ARG236C, ARG241C, ARG401A, ARG440A, ARG461A, ARG67A, ASN247C, ASN456A, ASP113C, ASP163C, ASP165C, ASP170C, ASP220C, ASP226C, ASP227C, ASP368A, ASP372A, ASP394A, ASP447A, ASP450A, ASP89C, GLN121C, GLN175C, GLN235C, GLN243C, GLN332A, GLN384A, GLN395A, GLN437A, GLN449A, GLN451A, GLN66A, GLN86C, GLN97C, GLU124C, GLU15A, GLU164C, GLU16A, GLU19A, GLU207C, GLU20A, GLU222C, GLU232C, GLU376A, GLU383A, GLU386A, GLU387A, GLU393A, GLU436A, GLU464A, GLY115C, GLY119C, GLY157C, GLY166C, GLY192C, GLY221C, GLY244C, GLY245C, GLY381A, GLY397A, GLY398A, GLY426A, GLY442A, GLY453A, GLY61A, GLY65A, HIS156C, HIS158C, HIS238C, HIS434A, HIS438A, ILE122C, ILE123C, ILE176C, ILE191C, ILE216C, ILE233C, ILE237C, ILE460A, LEU10A, LEU117C, LEU160C, LEU162C, LEU172C, LEU240C, LEU28A, LEU371A, LEU382A, LEU391A, LEU392A, LEU424A, LEU429A, LEU433A, LEU441A, LEU448A, LEU64A, LEU69A, LYS13A, LYS153C, LYS188C, LYS21A, LYS22A, LYS435A, MET167C, MET168C, MET171C, MET234C, MET367A, MET431A, MET70A, MET91C, PHE14A, PHE169C, PHE246C, PHE25A, PHE349A, PHE379A, PHE396A, PHE443A, PHE458A, PHE87C, PHE93C, PRO18A, PRO389A, PRO63A, PRO6C, PRO98C, SER102C, SER118C, SER154C, SER159C, SER17A, SER242C, SER399A, SER425A, SER430A, SER439A, SER455A, SER459A, SER90C, THR116C, THR215C, THR23A, THR24A, THR27A, THR375A, THR378A, THR413A, THR422A, THR62A, THR88C, TRP427A, TYR217C, TYR224C, TYR26A, TYR333A, TYR353A, TYR380A, TYR385A, TYR388A, TYR428A, TYR432A, TYR444A, TYR446A, TYR5C, TYR92C, TYR99C, VAL100C, VAL11C, VAL155C, VAL219C, VAL228C, VAL231C, VAL239C, VAL370A, VAL373A, VAL377A, VAL457A, VAL68A
• A-D: ALA139A, ALA139D, ALA143A, ALA143D, ALA144A, ALA144D, ALA156A, ALA156D, ALA159A, ALA159D, ALA179A, ALA179D, ALA221A, ALA221D, ALA228A, ALA228D, ALA238A, ALA238D, ALA243A, ALA243D, ALA246A, ALA246D, ALA272A, ALA272D, ALA43A, ALA43D, ALA48A, ALA48D, ALA533A, ALA533D, ALA540A, ALA540D, ALA544A, ALA544D, ALA549A, ALA549D, ALA92A, ALA92D, ALA93A, ALA93D, ARG102A, ARG102D, ARG103A, ARG103D, ARG209A, ARG209D, ARG216A, ARG216D, ARG225A, ARG225D, ARG270A, ARG270D, ARG273A, ARG273D, ARG36A, ARG36D, ARG51A, ARG51D, ARG535A, ARG535D, ARG543A, ARG543D, ARG67A, ARG67D, ASN137A, ASN137D, ASN42A, ASN42D, ASN517A, ASN517D, ASN57A, ASN57D, ASN90A, ASN90D, ASN91A, ASN91D, ASP160A, ASP160D, ASP177A, ASP177D, ASP219A, ASP219D, ASP394A, ASP394D, ASP515A, ASP515D, ASP516A, ASP516D, ASP59A, ASP59D, ASP84A, ASP84D, ASP85A, ASP85D, ASP99A, ASP99D, CYS218A, CYS218D, GLN147A, GLN147D, GLN230A, GLN230D, GLN317A, GLN317D, GLN332A, GLN332D, GLN33A, GLN33D, GLN55A, GLN55D, GLN66A, GLN66D, GLN95A, GLN95D, GLN96A, GLN96D, GLU134A, GLU134D, GLU148A, GLU148D, GLU152A, GLU152D, GLU245A, GLU245D, GLU275A, GLU275D, GLU277A, GLU277D, GLU393A, GLU393D, GLU39A, GLU39D, GLU46A, GLU46D, GLU536A, GLU536D, GLU538A, GLU538D, GLU542A, GLU542D, GLU82A, GLU82D, GLY142A, GLY142D, GLY220A, GLY220D, GLY244A, GLY244D, GLY274A, GLY274D, GLY30A, GLY30D, GLY321A, GLY321D, GLY326A, GLY326D, GLY327A, GLY327D, GLY329A, GLY329D, GLY397A, GLY397D, GLY44A, GLY44D, GLY52A, GLY52D, GLY532A, GLY532D, GLY541A, GLY541D, GLY61A, GLY61D, GLY65A, GLY65D, GLY83A, GLY83D, HIS131A, HIS131D, HIS138A, HIS138D, HIS149A, HIS149D, HIS154A, HIS154D, HIS87A, HIS87D, ILE210A, ILE210D, ILE213A, ILE213D, ILE318A, ILE318D, ILE53A, ILE53D, ILE546A, ILE546D, ILE60A, ILE60D, LEU133A, LEU133D, LEU157A, LEU157D, LEU267A, LEU267D, LEU314A, LEU314D, LEU320A, LEU320D, LEU518A, LEU518D, LEU534A, LEU534D, LEU545A, LEU545D, LEU64A, LEU64D, LEU69A, LEU69D, LEU86A, LEU86D, LYS13A, LYS13D, LYS164A, LYS164D, LYS256A, LYS256D, LYS37A, LYS37D, LYS45A, LYS45D, LYS50A, LYS50D, LYS531A, LYS531D, MET140A, MET140D, MET150A, MET150D, MET229A, MET229D, MET233A, MET233D, MET324A, MET324D, MET70A, MET70D, MET94A, MET94D, MET97A, MET97D, PHE14A, PHE14D, PHE180A, PHE180D, PHE25A, PHE25D, PHE330A, PHE330D, PHE396A, PHE396D, PHE40A, PHE40D, PHE537A, PHE537D, PHE88A, PHE88D, PRO141A, PRO141D, PRO155A, PRO155D, PRO178A, PRO178D, PRO211A, PRO211D, PRO268A, PRO268D, PRO278A, PRO278D, PRO539A, PRO539D, PRO548A, PRO548D, PRO54A, PRO54D, PRO58A, PRO58D, PRO63A, PRO63D, PRO71A, PRO71D, SER161A, SER161D, SER215A, SER215D, SER224A, SER224D, SER227A, SER227D, SER234A, SER234D, SER237A, SER237D, SER322A, SER322D, SER325A, SER325D, SER34A, THR130A, THR130D, THR135A, THR135D, THR153A, THR153D, THR212A, THR212D, THR217A, THR217D, THR222A, THR222D, THR223A, THR223D, THR248A, THR248D, THR265A, THR265D, THR331A, THR331D, THR335A, THR335D, THR547A, THR547D, THR62A, THR62D, TRP226A, TRP226D, TRP319A, TRP319D, TRP31A, TRP31D, TRP98A, TRP98D, TYR132A, TYR132D, TYR162A, TYR162D, TYR253A, TYR253D, TYR266A, TYR266D, TYR26A, TYR26D, TYR323A, TYR323D, TYR333A, TYR333D, TYR444A, TYR444D, TYR56A, TYR56D, TYR72A, TYR72D, VAL136A, VAL136D, VAL145A, VAL145D, VAL146A, VAL146D, VAL151A, VAL151D, VAL158A, VAL158D, VAL163A, VAL163D, VAL181A, VAL181D, VAL214A, VAL214D, VAL269A, VAL269D, VAL328A, VAL328D, VAL41A, VAL41D, VAL47A, VAL47D, VAL519A, VAL519D, VAL68A, VAL68D, VAL81A, VAL81D, VAL89A, VAL89D
• A-E: ALA112A, ALA114A, ALA135E, ALA137E, ALA153E, ALA158E, ALA159E, ALA198A, ALA228A, ALA242A, ALA243A, ALA246A, ALA247A, ALA252A, ALA254A, ALA255A, ALA258A, ALA272A, ALA323E, ALA324E, ALA410E, ALA420A, ALA454A, ALA479A, ALA502A, ALA60E, ALA66E, ARG119A, ARG163E, ARG225A, ARG273A, ARG461A, ARG471A, ARG499A, ARG72E, ASN110A, ASN154E, ASN198E, ASN365A, ASN366A, ASN376E, ASN419A, ASN456A, ASN474A, ASN477A, ASN506A, ASP152E, ASP180E, ASP191A, ASP250A, ASP288A, ASP368A, ASP400E, ASP463A, ASP501A, CYS67E, GLN140E, GLN147A, GLN166E, GLN183E, GLN192A, GLN230A, GLN241A, GLN325E, GLN404E, GLN421A, GLU117A, GLU169E, GLU199A, GLU245A, GLU259A, GLU275A, GLU277A, GLU464A, GLU469A, GLU73E, GLY162E, GLY172E, GLY232A, GLY244A, GLY249A, GLY264A, GLY279A, GLY280A, GLY284A, GLY326E, GLY368E, GLY369E, GLY370E, GLY371E, GLY402E, GLY418A, GLY423A, GLY462A, GLY465A, GLY472A, GLY500A, GLY63E, GLY64E, GLY71E, HIS111A, HIS113A, HIS262A, HIS364E, HIS379E, HIS496A, ILE106A, ILE116A, ILE143E, ILE181E, ILE231A, ILE236A, ILE261A, ILE366E, ILE374E, ILE380E, ILE460A, ILE491A, ILE69E, LEU120A, LEU132E, LEU161E, LEU196A, LEU267A, LEU424A, LEU466A, LEU468A, LEU470A, LEU508A, LEU74E, LYS118A, LYS157E, LYS184E, LYS256A, LYS61E, LYS68E, MET150E, MET155E, MET171E, MET196E, MET229A, MET233A, MET235A, MET263A, MET367A, MET405E, MET70E, PHE166A, PHE251A, PHE283A, PHE361E, PHE362E, PHE375E, PHE406E, PHE458A, PHE503A, PHE505A, PRO165E, PRO268A, PRO278A, PRO282A, PRO372E, PRO467A, PRO473A, PRO476A, PRO495A, PRO507A, PRO65E, SER149E, SER167E, SER234A, SER328E, SER360E, SER363E, SER365E, SER425A, SER459A, SER492A, THR136E, THR195A, THR248A, THR265A, THR369A, THR403E, THR411E, THR417A, THR422A, THR59E, TRP205A, TRP226A, TYR151E, TYR164E, TYR170E, TYR253A, TYR266A, TYR285A, TYR315A, TYR367E, TYR475A, TYR478A, VAL115A, VAL139E, VAL146A, VAL148E, VAL156E, VAL160E, VAL168E, VAL200A, VAL260A, VAL269A, VAL281A, VAL370A, VAL457A, VAL504A, VAL509A, VAL62E
• A-F: ALA144A, ALA238A, ALA242A, ALA243A, ALA246A, ALA247A, ARG119A, ARG120F, ARG151F, ARG174F, ARG81F, ARG83F, ASN189F, ASP113F, ASP170F, ASP193F, GLN147A, GLN190F, GLN241A, GLN86F, GLU117A, GLU124F, GLU148A, GLU194F, GLU245A, GLU47F, GLY119F, GLY121A, GLY152F, GLY157F, GLY192F, GLY244A, GLY41F, HIS149A, HIS156F, HIS42F, HIS53F, ILE116A, ILE122F, ILE191F, ILE236A, ILE85F, LEU117F, LEU120A, LEU160F, LEU172F, LYS118A, LYS122A, LYS153F, LYS240A, MET150A, MET171F, MET233A, PHE169F, PRO50F, SER154F, SER237A, SER51F, THR248A, TYR239A, TYR84F, VAL115A, VAL145A, VAL146A, VAL155F, VAL52F, VAL82F
• B-C: ALA104C, ALA112C, ALA114C, ALA211B, ALA212B, ALA230C, ALA232B, ALA258B, ALA270B, ALA2C, ALA312B, ALA313B, ALA320B, ALA321B, ALA323B, ALA324B, ALA395B, ALA398B, ALA401B, ALA65C, ALA76C, ARG103C, ARG108C, ARG110C, ARG120C, ARG126C, ARG14B, ARG15C, ARG16C, ARG236C, ARG241C, ARG322B, ARG67C, ARG81C, ARG83C, ASN16B, ASN207B, ASN247B, ASN247C, ASN250B, ASN259B, ASN317B, ASN335B, ASP113C, ASP129C, ASP12B, ASP13B, ASP227C, ASP254B, ASP271B, ASP290B, ASP336B, ASP348B, ASP400B, ASP64C, ASP74C, ASP80C, CYS107C, CYS19C, GLN121C, GLN13C, GLN210B, GLN235C, GLN243C, GLN318B, GLN325B, GLN3C, GLN404B, GLU124C, GLU229C, GLU232C, GLU262B, GLU274B, GLU285B, GLU287B, GLU339B, GLU341B, GLU353B, GLU57C, GLU61C, GLU63C, GLU68C, GLU71C, GLY111C, GLY115C, GLY15B, GLY244C, GLY245C, GLY260B, GLY263B, GLY266B, GLY295B, GLY319B, GLY326B, GLY343B, GLY350B, GLY354B, GLY402B, GLY75C, GLY79C, GLY7C, HIS238C, HIS364B, HIS53C, ILE122C, ILE123C, ILE233C, ILE237C, ILE269B, ILE338B, ILE366B, ILE66C, ILE73C, LEU106C, LEU117C, LEU205B, LEU209B, LEU240C, LEU255B, LEU288B, LEU299B, LEU331B, LEU332B, LEU337B, LEU344B, LEU399B, LEU56C, LYS206B, LYS257B, LYS261B, LYS283B, LYS286B, LYS292B, LYS351B, LYS416B, LYS77C, MET234C, MET236B, MET311B, MET315B, MET405B, MET59C, MET69C, PHE233B, PHE246C, PHE253B, PHE340B, PHE349B, PHE361B, PRO21C, PRO345B, PRO54C, PRO55C, PRO62C, PRO6C, PRO72C, PRO98C, SER102C, SER242C, SER267B, SER328B, SER329B, SER346B, SER360B, SER363B, SER365B, THR116C, THR125C, THR204B, THR208B, THR264B, THR289B, THR296B, THR314B, THR330B, THR342B, THR403B, THR8C, TRP302B, TYR105C, TYR109C, TYR224C, TYR291B, TYR294B, TYR333B, TYR334B, TYR367B, TYR4C, TYR5C, TYR84C, TYR99C, VAL100C, VAL228C, VAL231C, VAL239C, VAL252B, VAL256B, VAL265B, VAL268B, VAL273B, VAL284B, VAL293B, VAL316B, VAL327B, VAL347B, VAL352B, VAL357B, VAL52C, VAL70C, VAL82C
• B-D: ALA112D, ALA114D, ALA135B, ALA137B, ALA153B, ALA158B, ALA159B, ALA198D, ALA228D, ALA242D, ALA243D, ALA246D, ALA247D, ALA252D, ALA254D, ALA255D, ALA258D, ALA272D, ALA323B, ALA324B, ALA410B, ALA420D, ALA454D, ALA479D, ALA502D, ALA60B, ALA66B, ARG119D, ARG163B, ARG225D, ARG273D, ARG461D, ARG471D, ARG499D, ARG72B, ASN110D, ASN154B, ASN198B, ASN365D, ASN366D, ASN376B, ASN419D, ASN456D, ASN474D, ASN477D, ASN506D, ASP152B, ASP180B, ASP191D, ASP250D, ASP288D, ASP368D, ASP400B, ASP463D, ASP501D, CYS67B, GLN140B, GLN147D, GLN166B, GLN183B, GLN192D, GLN230D, GLN241D, GLN325B, GLN404B, GLN421D, GLN485D, GLU117D, GLU169B, GLU199D, GLU245D, GLU259D, GLU275D, GLU277D, GLU464D, GLU469D, GLU73B, GLY162B, GLY172B, GLY232D, GLY244D, GLY249D, GLY264D, GLY279D, GLY280D, GLY284D, GLY326B, GLY368B, GLY369B, GLY370B, GLY371B, GLY402B, GLY418D, GLY423D, GLY462D, GLY465D, GLY472D, GLY500D, GLY63B, GLY64B, GLY71B, HIS111D, HIS113D, HIS262D, HIS364B, HIS379B, HIS496D, ILE106D, ILE116D, ILE143B, ILE181B, ILE231D, ILE236D, ILE261D, ILE366B, ILE374B, ILE380B, ILE460D, ILE491D, ILE69B, LEU120D, LEU132B, LEU161B, LEU196D, LEU267D, LEU424D, LEU466D, LEU468D, LEU470D, LEU508D, LEU74B, LYS118D, LYS157B, LYS184B, LYS256D, LYS61B, LYS68B, MET150B, MET155B, MET171B, MET196B, MET229D, MET233D, MET235D, MET263D, MET367D, MET405B, MET70B, PHE166D, PHE251D, PHE283D, PHE361B, PHE362B, PHE375B, PHE406B, PHE458D, PHE503D, PHE505D, PRO165B, PRO268D, PRO278D, PRO282D, PRO364D, PRO372B, PRO467D, PRO473D, PRO476D, PRO495D, PRO507D, PRO65B, SER149B, SER167B, SER234D, SER328B, SER360B, SER363B, SER365B, SER425D, SER459D, SER492D, THR136B, THR195D, THR248D, THR265D, THR369D, THR403B, THR411B, THR417D, THR422D, THR59B, TRP205D, TRP226D, TYR151B, TYR164B, TYR170B, TYR253D, TYR266D, TYR285D, TYR315D, TYR367B, TYR475D, TYR478D, VAL115D, VAL139B, VAL146D, VAL148B, VAL156B, VAL160B, VAL168B, VAL200D, VAL260D, VAL269D, VAL281D, VAL370D, VAL457D, VAL504D, VAL509D, VAL62B
• B-E: ALA119B, ALA119E, ALA124B, ALA124E, ALA125B, ALA125E, ALA129B, ALA129E, ALA130B, ALA130E, ALA135B, ALA135E, ALA137B, ALA137E, ALA191B, ALA191E, ALA222B, ALA222E, ALA229B, ALA229E, ALA232B, ALA232E, ALA2B, ALA2E, ALA34B, ALA34E, ALA88E, ALA89B, ALA89E, ARG120B, ARG120E, ARG193B, ARG193E, ARG31B, ARG31E, ARG383B, ARG383E, ASN144B, ASN144E, ASN194E, ASN32B, ASN32E, ASN378B, ASN378E, ASP122B, ASP122E, ASP180B, ASP180E, ASP228B, ASP228E, ASP99E, GLN140B, GLN140E, GLN183B, GLN183E, GLN40B, GLN40E, GLN94B, GLN94E, GLU126B, GLU126E, GLU169B, GLU169E, GLU186B, GLU186E, GLU225B, GLU225E, GLU234B, GLU234E, GLU25B, GLU25E, GLU442B, GLU442E, GLU91B, GLU91E, GLU97B, GLU97E, GLY187B, GLY187E, GLY189B, GLY189E, GLY227B, GLY227E, GLY231B, GLY231E, ILE143B, ILE143E, ILE181B, ILE181E, ILE195B, ILE195E, ILE217B, ILE217E, ILE35B, ILE35E, ILE38B, ILE38E, ILE42B, ILE42E, ILE443B, ILE443E, ILE93B, ILE93E, LEU132B, LEU132E, LEU161B, LEU161E, LEU179B, LEU179E, LEU185B, LEU185E, LEU192B, LEU192E, LEU218B, LEU218E, LEU30B, LEU30E, LYS184B, LYS184E, LYS36B, LYS36E, LYS386B, LYS386E, LYS3B, LYS3E, LYS43B, LYS43E, LYS90B, MET223B, MET223E, MET226B, MET226E, MET92B, MET92E, PHE121B, PHE121E, PHE138B, PHE138E, PHE224B, PHE224E, PHE233B, PHE233E, PRO117B, PRO117E, PRO131B, PRO131E, PRO165B, PRO165E, PRO182B, PRO182E, PRO188B, PRO188E, PRO29B, PRO29E, PRO33B, PRO33E, SER128B, SER128E, SER167B, SER167E, SER28B, SER28E, SER37B, SER37E, THR134B, THR134E, THR136B, THR136E, THR221B, THR221E, THR96B, THR96E, TYR127B, TYR127E, TYR164B, TYR164E, TYR170B, TYR170E, TYR190B, TYR190E, VAL116B, VAL116E, VAL123B, VAL123E, VAL133B, VAL133E, VAL139B, VAL139E, VAL168B, VAL168E, VAL230B, VAL230E, VAL39B, VAL39E, VAL95B, VAL95E
• B-F: ALA153B, ASN144B, ASN154B, ASN247F, ASP147B, ASP152B, GLN140B, GLN243F, GLY244F, GLY245F, HIS238F, ILE143B, LYS157B, MET150B, PHE246F, SER149B, SER242F, TYR151B, VAL139B, VAL148B, VAL156B, VAL239F
• C-D: ALA144D, ALA238D, ALA242D, ALA243D, ALA246D, ALA247D, ARG119D, ARG120C, ARG151C, ARG174C, ARG81C, ARG83C, ASN189C, ASP113C, ASP170C, ASP193C, GLN147D, GLN190C, GLN241D, GLN86C, GLU117D, GLU124C, GLU148D, GLU194C, GLU245D, GLU47C, GLY115C, GLY119C, GLY121D, GLY152C, GLY157C, GLY192C, GLY244D, GLY41C, HIS149D, HIS156C, HIS42C, HIS53C, ILE122C, ILE191C, ILE236D, ILE85C, LEU117C, LEU120D, LEU160C, LEU172C, LYS118D, LYS122D, LYS153C, LYS240D, MET150D, MET171C, MET233D, PHE169C, PRO50C, SER154C, SER237D, SER51C, THR248D, TYR239D, TYR84C, VAL145D, VAL146D, VAL155C, VAL52C, VAL82C
• C-E: ALA153E, ASN144E, ASN154E, ASN247C, ASP147E, ASP152E, GLN140E, GLN243C, GLY244C, GLY245C, HIS238C, ILE143E, LYS157E, MET150E, PHE246C, SER149E, SER242C, TYR151E, VAL139E, VAL148E, VAL156E, VAL239C
• D-E: ALA229E, ALA232E, ALA272D, ALA356E, ALA454D, ALA479D, ARG193E, ARG270D, ARG383E, ARG461D, ASN194E, ASN335E, ASN376E, ASN378E, ASN456D, ASN474D, ASN477D, ASN481D, ASP180E, ASP228E, ASP336E, ASP348E, ASP447D, ASP450D, ASP463D, GLN183E, GLN325E, GLN449D, GLN451D, GLU169E, GLU186E, GLU234E, GLU339E, GLU353E, GLU436D, GLU464D, GLY187E, GLY227E, GLY231E, GLY321D, GLY326D, GLY326E, GLY327D, GLY329D, GLY350E, GLY354E, GLY358E, GLY368E, GLY369E, GLY387E, GLY442D, GLY453D, GLY462D, GLY465D, HIS237E, HIS364E, HIS379E, HIS384E, ILE181E, ILE366E, ILE374E, ILE380E, ILE460D, LEU185E, LEU320D, LEU332E, LEU337E, LEU433D, LEU441D, LEU448D, LYS184E, LYS351E, LYS386E, LYS435D, MET223E, MET226E, MET236E, MET324D, MET480D, PHE233E, PHE330D, PHE340E, PHE349E, PHE359E, PHE361E, PHE362E, PHE375E, PHE388E, PHE443D, PHE458D, PRO182E, PRO188E, PRO268D, PRO345E, PRO473D, PRO476D, SER325D, SER328E, SER329E, SER346E, SER360E, SER363E, SER365E, SER385E, SER455D, SER459D, THR355E, THR382E, TYR190E, TYR333D, TYR333E, TYR367E, TYR432D, TYR444D, TYR446D, TYR475D, TYR478D, VAL168E, VAL230E, VAL269D, VAL328D, VAL352E, VAL357E, VAL381E, VAL482D
• D-F: ALA114F, ALA223F, ALA230F, ALA374D, ALA390D, ALA402D, ALA454D, ALA94F, ALA96F, ARG101F, ARG103F, ARG120F, ARG147F, ARG151F, ARG15F, ARG161F, ARG173F, ARG174F, ARG218F, ARG225F, ARG236F, ARG241F, ARG401D, ARG440D, ARG461D, ARG67D, ASN247F, ASN456D, ASP113F, ASP163F, ASP165F, ASP170F, ASP220F, ASP226F, ASP227F, ASP368D, ASP372D, ASP394D, ASP447D, ASP450D, ASP89F, GLN121F, GLN175F, GLN235F, GLN243F, GLN332D, GLN384D, GLN395D, GLN437D, GLN449D, GLN451D, GLN66D, GLN86F, GLN97F, GLU124F, GLU15D, GLU164F, GLU16D, GLU19D, GLU207F, GLU20D, GLU222F, GLU232F, GLU376D, GLU383D, GLU386D, GLU387D, GLU393D, GLU436D, GLU464D, GLY115F, GLY119F, GLY157F, GLY166F, GLY192F, GLY221F, GLY244F, GLY245F, GLY381D, GLY397D, GLY398D, GLY426D, GLY442D, GLY453D, GLY61D, GLY65D, HIS156F, HIS158F, HIS238F, HIS434D, HIS438D, ILE122F, ILE123F, ILE176F, ILE191F, ILE216F, ILE233F, ILE237F, ILE460D, LEU10D, LEU117F, LEU160F, LEU162F, LEU172F, LEU240F, LEU28D, LEU371D, LEU382D, LEU391D, LEU392D, LEU424D, LEU429D, LEU433D, LEU441D, LEU448D, LEU64D, LEU69D, LYS13D, LYS153F, LYS188F, LYS21D, LYS22D, LYS435D, MET167F, MET168F, MET171F, MET211F, MET234F, MET367D, MET431D, MET70D, MET91F, PHE14D, PHE169F, PHE246F, PHE25D, PHE349D, PHE379D, PHE396D, PHE443D, PHE458D, PHE87F, PHE93F, PRO18D, PRO389D, PRO63D, PRO6F, PRO98F, SER102F, SER118F, SER154F, SER159F, SER17D, SER242F, SER399D, SER425D, SER430D, SER439D, SER455D, SER459D, SER90F, THR116F, THR215F, THR23D, THR24D, THR27D, THR375D, THR378D, THR413D, THR422D, THR62D, THR88F, TRP427D, TYR217F, TYR224F, TYR26D, TYR333D, TYR353D, TYR380D, TYR385D, TYR388D, TYR428D, TYR432D, TYR444D, TYR446D, TYR5F, TYR92F, TYR99F, VAL100F, VAL11F, VAL155F, VAL219F, VAL228F, VAL231F, VAL239F, VAL370D, VAL373D, VAL377D, VAL457D, VAL68D
• E-F: ALA104F, ALA112F, ALA114F, ALA12F, ALA211E, ALA212E, ALA230F, ALA232E, ALA258E, ALA270E, ALA2F, ALA312E, ALA313E, ALA320E, ALA321E, ALA323E, ALA324E, ALA395E, ALA396E, ALA398E, ALA401E, ALA65F, ALA76F, ARG101F, ARG103F, ARG108F, ARG110F, ARG120F, ARG126F, ARG14E, ARG15F, ARG16F, ARG236F, ARG241F, ARG322E, ARG67F, ARG81F, ARG83F, ASN207E, ASN247E, ASN247F, ASN250E, ASN259E, ASN317E, ASN335E, ASP113F, ASP129F, ASP12E, ASP13E, ASP254E, ASP271E, ASP290E, ASP336E, ASP348E, ASP400E, ASP64F, ASP74F, ASP80F, CYS107F, CYS19F, GLN121F, GLN13F, GLN210E, GLN235F, GLN243F, GLN318E, GLN325E, GLN3F, GLN404E, GLU124F, GLU229F, GLU232F, GLU262E, GLU274E, GLU285E, GLU287E, GLU339E, GLU341E, GLU353E, GLU57F, GLU61F, GLU63F, GLU68F, GLU71F, GLY111F, GLY115F, GLY15E, GLY244F, GLY245F, GLY260E, GLY263E, GLY266E, GLY295E, GLY319E, GLY326E, GLY343E, GLY350E, GLY354E, GLY402E, GLY75F, GLY79F, GLY7F, HIS238F, HIS364E, HIS53F, ILE122F, ILE123F, ILE233F, ILE237F, ILE269E, ILE338E, ILE366E, ILE66F, ILE73F, LEU106F, LEU117F, LEU205E, LEU209E, LEU240F, LEU255E, LEU288E, LEU299E, LEU331E, LEU332E, LEU337E, LEU344E, LEU399E, LEU56F, LYS206E, LYS257E, LYS261E, LYS283E, LYS286E, LYS292E, LYS351E, LYS416E, LYS77F, MET234F, MET236E, MET311E, MET315E, MET397E, MET405E, MET59F, MET69F, PHE233E, PHE246F, PHE253E, PHE340E, PHE349E, PHE361E, PRO21F, PRO345E, PRO54F, PRO55F, PRO62F, PRO6F, PRO72F, PRO98F, SER102F, SER242F, SER267E, SER328E, SER329E, SER346E, SER360E, SER363E, SER365E, THR116F, THR125F, THR204E, THR208E, THR264E, THR289E, THR296E, THR314E, THR330E, THR342E, THR403E, THR8F, TRP302E, TYR105F, TYR109F, TYR224F, TYR291E, TYR294E, TYR333E, TYR334E, TYR367E, TYR4F, TYR5F, TYR84F, TYR99F, VAL100F, VAL201E, VAL228F, VAL231F, VAL239F, VAL252E, VAL256E, VAL265E, VAL268E, VAL273E, VAL284E, VAL293E, VAL316E, VAL327E, VAL347E, VAL352E, VAL357E, VAL52F, VAL70F, VAL82F