3TZQ

crystal structure of a short-chain type dehydrogenase/reductase from mycobacterium marinum

• Total interactions analyzed: 28
• Total true interactions: 16
• Strongest Interaction:
  • Chains: A-D
  • Int. Res.: 148
  • Norm. En. per Res.: -4.6672
• Hub Node: B(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
B-A	-74.4429	27.8741	-460.987	-507.5558	156	17	13	17499	10	28	53
B-D	-79.3916	-63.3939	-263.689	-406.4745	90	15	18	11454	4	9	11
B-C	-68.9432	-39.4364	-583.697	-692.0766	151	14	17	21165	7	29	17
B-F	-10.7543	-29.6205	-10.3832	-50.758	26	2	0	755	4	12	13
B-H	-6.4751	-1.038	-11.8334	-19.3465	12	2	0	422	0	2	3
A-D	-70.3068	-39.386	-581.05	-690.7429	148	21	17	21110	7	29	17
A-C	-67.6661	-58.8832	-281.884	-408.4333	96	17	17	11944	4	10	13
D-C	-53.0125	27.762	-451.806	-477.0565	156	16	14	17535	9	29	53
C-F	-5.0019	-11.0599	-33.297	-49.3588	43	1	0	1746	3	15	18
C-H	0.0	0.0	-0.1037	-0.1037	3	0	0	29	0	0	1
F-E	-72.6172	37.3328	-446.083	-481.3674	157	21	12	17489	8	28	52
F-H	-70.5215	-63.8798	-285.307	-419.7083	94	12	18	12081	4	8	13
F-G	-77.1066	-57.6522	-569.003	-703.7618	151	26	17	21124	4	29	17
E-H	-73.4502	-28.0846	-569.045	-670.5797	149	22	18	20869	5	28	17
E-G	-72.226	-60.2794	-277.117	-409.6225	91	15	18	11793	4	10	12
H-G	-69.8856	27.1349	-457.477	-500.2277	158	10	14	17554	9	30	53

Interface residues

• B-A: ALA170A, ALA170B, ALA184A, ALA184B, ALA206A, ALA206B, ALA211A, ALA211B, ALA221A, ALA221B, ALA228A, ALA228B, ALA232A, ALA232B, ALA233A, ALA233B, ALA241A, ALA241B, ALA242A, ALA242B, ALA248A, ALA248B, ALA258B, ALA261A, ALA30A, ALA30B, ARG167A, ARG167B, ARG175A, ARG175B, ARG179A, ARG179B, ARG189A, ARG189B, ARG213A, ARG213B, ARG231A, ARG231B, ARG257A, ARG257B, ARG29A, ASN181A, ASN181B, ASP230A, ASP230B, ASP243A, ASP243B, CB9.2425949.02932, CYS180A, CYS180B, CYS225A, CYS225B, GLN172A, GLN172B, GLN238A, GLN238B, GLU216A, GLU216B, GLU219A, GLU219B, GLU222A, GLU222B, GLU4A, GLU4B, GLU4B9, GLY174A, GLY174B, GLY177A, GLY177B, GLY186A, GLY186B, GLY212A, GLY212B, GLY215A, GLY215B, GLY237A, GLY237B, GLY245A, GLY245B, HIS176A, HIS176B, HIS209A, HIS209B, HIS218A, HIS218B, HIS249A, HIS249B, ILE183A, ILE183B, ILE214A, ILE214B, ILE220A, ILE220B, ILE235A, ILE235B, ILE240A, ILE240B, ILE256A, LEU187A, LEU187B, LEU210A, LEU210B, LEU223A, LEU223B, LEU227A, LEU227B, LEU246A, LEU246B, LEU247A, LEU247B, LEU250A, LEU250B, LEU253A, LEU253B, LEU27A, LEU27B, LEU5A, LEU5B, PHE205B, PHE226A, PHE226B, PHE234A, PHE234B, PRO185A, PRO185B, PRO254A, PRO254B, SER229A, SER229B, SER244A, SER244B, THR164A, THR166A, THR166B, THR171A, THR171B, THR236A, THR236B, TYR168A, TYR168B, TYR173A, TYR173B, VAL169A, VAL169B, VAL178A, VAL178B, VAL188A, VAL188B, VAL224A, VAL224B, VAL239A, VAL239B, VAL260A, VAL260B, VAL26A, VAL26B
• B-D: ALA143B, ALA143D, ALA145B, ALA145D, ALA147B, ALA147D, ALA148B, ALA148D, ALA156B, ALA156D, ALA248B, ALA248D, ALA258B, ALA258D, ALA261B, ARG257B, ARG257D, ASP150B, ASP150D, ASP243B, ASP243D, GLN199D, GLN255B, GLN255D, GLU262B, GLY186B, GLY186D, GLY245B, GLY245D, GLY252B, GLY252D, HIS146B, HIS146D, HIS208B, HIS208D, HIS209B, HIS209D, HIS249B, HIS249D, ILE201B, ILE201D, ILE204B, ILE204D, ILE256B, ILE256D, LEU187B, LEU187D, LEU197D, LEU210B, LEU210D, LEU246B, LEU246D, LEU247B, LEU247D, LEU250B, LEU250D, LEU253B, LEU253D, LEU263B, LEU98B, LEU98D, MET151B, MET151D, PHE205B, PHE205D, PRO185B, PRO198B, PRO198D, PRO200B, PRO200D, PRO251B, PRO251D, PRO254B, PRO254D, SER142B, SER142D, SER152B, SER152D, SER259B, SER259D, THR144B, THR144D, THR207B, THR207D, TYR149B, TYR149D, VAL202B, VAL202D, VAL260B, VAL260D
• B-C: ALA115B, ALA115C, ALA125B, ALA125C, ALA143B, ALA143C, ALA145B, ALA145C, ALA147B, ALA147C, ALA148B, ALA148C, ALA154B, ALA154C, ALA156B, ALA156C, ALA160B, ALA160C, ALA161B, ALA161C, ALA170B, ALA170C, ARG116B, ARG116C, ARG128B, ARG128C, ARG167B, ARG167C, ARG175B, ARG175C, ASN114B, ASN114C, ASN64B, ASN64C, ASP105B, ASP105C, ASP108B, ASP108C, ASP109B, ASP109C, ASP150B, ASP150C, ASP96B, ASP96C, CYS122B, CYS122C, CYS157B, CYS157C, CYS180B, CYS180C, GLN101B, GLN101C, GLN172B, GLN172C, GLU163B, GLU163C, GLU65B, GLU65C, GLY117B, GLY117C, GLY237B, GLY237C, HIS146B, HIS146C, HIS176B, HIS176C, ILE126B, ILE126C, ILE130B, ILE130C, ILE137B, ILE137C, ILE162B, ILE162C, LEU120B, LEU120C, LEU165B, LEU165C, LEU247B, LEU247C, LEU98B, LEU98C, LYS123B, LYS123C, LYS159B, LYS159C, MET102B, MET102C, MET119B, MET119C, MET121B, MET121C, MET151B, MET151C, MET97B, MET97C, PHE111B, PHE111C, PRO127B, PRO127C, SER141B, SER142B, SER142C, SER152B, SER152C, THR100B, THR100C, THR103B, THR103C, THR112B, THR112C, THR118B, THR118C, THR144B, THR144C, THR153B, THR153C, THR158B, THR158C, THR164B, THR164C, THR166B, THR166C, THR171B, THR171C, THR63B, THR63C, TRP107B, TRP107C, TYR124B, TYR124C, TYR149B, TYR149C, TYR155B, TYR155C, TYR168B, TYR168C, TYR173B, TYR173C, VAL104B, VAL104C, VAL106B, VAL106C, VAL169B, VAL169C, VAL178B, VAL178C, VAL66B, VAL66C, VAL99B, VAL99C
• B-F: ALA258F, ALA261F, ARG116B, ARG189F, ARG213F, ASN64B, ASP105B, ASP108B, ASP109B, ASP203F, GLN199F, GLU194F, GLU216F, GLU262F, GLU41B, GLU65B, ILE204F, ILE214F, PRO200F, PRO40B, THR103B, THR112B, THR63B, VAL104B, VAL106B, VAL202F
• B-H: ALA258H, ALA261H, ARG116B, ARG69B, ASN64B, GLU262H, GLU65B, LEU263H, SER259H, SER67B, THR63B, VAL66B
• A-D: ALA115A, ALA115D, ALA125A, ALA125D, ALA143A, ALA143D, ALA145A, ALA145D, ALA147A, ALA147D, ALA148A, ALA148D, ALA154A, ALA154D, ALA156A, ALA156D, ALA160A, ALA160D, ALA161A, ALA161D, ALA170A, ALA170D, ARG116A, ARG116D, ARG128A, ARG128D, ARG167A, ARG167D, ARG175A, ARG175D, ASN114A, ASN114D, ASN64A, ASN64D, ASP105A, ASP105D, ASP108A, ASP108D, ASP109D, ASP150A, ASP150D, ASP96A, ASP96D, CYS122A, CYS122D, CYS157A, CYS157D, GLN101A, GLN101D, GLN172A, GLN172D, GLU163A, GLU163D, GLU65A, GLU65D, GLY117A, GLY117D, GLY237A, GLY237D, HIS146A, HIS146D, HIS176A, HIS176D, ILE126A, ILE126D, ILE130A, ILE130D, ILE137A, ILE137D, ILE162A, ILE162D, LEU120A, LEU120D, LEU165A, LEU165D, LEU247A, LEU247D, LEU62A, LEU98A, LEU98D, LYS123A, LYS123D, LYS159A, LYS159D, MET102A, MET102D, MET119A, MET119D, MET121A, MET121D, MET151A, MET151D, MET97A, MET97D, PHE111A, PHE111D, PRO127A, PRO127D, SER142A, SER142D, SER152A, SER152D, THR100A, THR100D, THR103A, THR103D, THR112A, THR112D, THR118A, THR118D, THR144A, THR144D, THR153A, THR153D, THR158A, THR158D, THR164A, THR164D, THR166A, THR166D, THR171A, THR171D, THR63A, THR63D, TRP107A, TRP107D, TYR124A, TYR124D, TYR149A, TYR149D, TYR155A, TYR155D, TYR168A, TYR168D, TYR173A, TYR173D, VAL104A, VAL104D, VAL106A, VAL106D, VAL169A, VAL169D, VAL178A, VAL178D, VAL66A, VAL66D, VAL99A, VAL99D
• A-C: ALA143A, ALA143C, ALA145A, ALA145C, ALA147A, ALA147C, ALA148A, ALA148C, ALA156A, ALA156C, ALA206C, ALA248A, ALA248C, ALA258A, ALA258C, ALA261A, ALA261C, ARG257A, ARG257C, ASP150A, ASP150C, ASP203A, ASP203C, ASP243C, GLN199A, GLN255A, GLN255C, GLU262A, GLU262C, GLY186A, GLY186C, GLY245A, GLY245C, GLY252A, GLY252C, HIS146A, HIS146C, HIS208A, HIS208C, HIS209A, HIS209C, HIS249A, HIS249C, ILE201A, ILE201C, ILE204A, ILE204C, ILE256A, ILE256C, LEU187A, LEU187C, LEU197A, LEU197C, LEU210A, LEU210C, LEU246A, LEU246C, LEU247A, LEU247C, LEU250A, LEU250C, LEU253A, LEU253C, LEU263A, LEU263C, LEU98A, LEU98C, MET151A, MET151C, PHE205A, PHE205C, PRO185C, PRO198A, PRO198C, PRO200A, PRO200C, PRO251A, PRO251C, PRO254A, PRO254C, SER142A, SER142C, SER152A, SER152C, SER259A, SER259C, THR144A, THR144C, THR207A, THR207C, TYR149A, TYR149C, VAL202A, VAL202C, VAL260A, VAL260C
• D-C: ALA143C, ALA143D, ALA170C, ALA170D, ALA184C, ALA184D, ALA206C, ALA206D, ALA211C, ALA211D, ALA221C, ALA221D, ALA228C, ALA228D, ALA232C, ALA232D, ALA233C, ALA233D, ALA241C, ALA241D, ALA242C, ALA242D, ALA248C, ALA248D, ALA258D, ALA261C, ALA261D, ALA30C, ALA30D, ARG167C, ARG167D, ARG175C, ARG175D, ARG179C, ARG179D, ARG189C, ARG189D, ARG213C, ARG213D, ARG231C, ARG231D, ARG257C, ARG257D, ASN181C, ASN181D, ASP230C, ASP230D, ASP243C, ASP243D, CYS180C, CYS180D, CYS225C, CYS225D, GLN172C, GLN172D, GLN238C, GLN238D, GLU163D, GLU216C, GLU216D, GLU219C, GLU219D, GLU222C, GLU222D, GLU4C, GLU4D, GLY174C, GLY174D, GLY177C, GLY177D, GLY186C, GLY186D, GLY212C, GLY212D, GLY215C, GLY215D, GLY237C, GLY237D, GLY245C, GLY245D, HIS176C, HIS176D, HIS209C, HIS209D, HIS218C, HIS218D, HIS249C, HIS249D, ILE183C, ILE183D, ILE214C, ILE214D, ILE220C, ILE220D, ILE235C, ILE235D, ILE240C, ILE240D, LEU187C, LEU187D, LEU210C, LEU210D, LEU223C, LEU223D, LEU227C, LEU227D, LEU246C, LEU246D, LEU247C, LEU247D, LEU250C, LEU250D, LEU253C, LEU253D, LEU27C, LEU27D, LEU5C, LEU5D, PHE205C, PHE205D, PHE226C, PHE226D, PHE234C, PHE234D, PRO185C, PRO185D, PRO254C, PRO254D, SER229C, SER229D, SER244C, SER244D, THR164D, THR166C, THR166D, THR171C, THR171D, THR236C, THR236D, TYR168C, TYR168D, TYR173C, TYR173D, VAL169C, VAL169D, VAL178C, VAL178D, VAL188C, VAL188D, VAL224C, VAL224D, VAL239C, VAL239D, VAL260D, VAL26C, VAL26D
• C-F: ALA45F, ALA47F, ALA49F, ALA70C, ARG116C, ARG128C, ARG189F, ARG192F, ARG25F, ARG29F, ARG69C, ASN64C, ASP108C, ASP43F, ASP61C, ASP73C, ASP77C, CYS16F, GLN199F, GLU194F, GLU22F, GLU65C, GLY17F, GLY18F, GLY46F, HIS58C, ILE19F, LEU120C, LEU21F, PHE74C, PRO191F, PRO200F, PRO217F, SER50F, SER67C, THR112C, THR190F, THR63C, VAL104C, VAL195F, VAL51F, VAL59C, VAL66C
• C-H: ASP105C, LEU263H, VAL104C
• F-E: ALA143E, ALA143F, ALA170E, ALA170F, ALA184E, ALA184F, ALA206E, ALA206F, ALA211E, ALA211F, ALA221E, ALA221F, ALA228E, ALA228F, ALA232E, ALA232F, ALA233E, ALA233F, ALA241E, ALA241F, ALA242E, ALA242F, ALA248E, ALA248F, ALA258E, ALA261E, ALA261F, ALA30E, ALA30F, ARG167E, ARG167F, ARG175E, ARG175F, ARG179E, ARG179F, ARG189E, ARG189F, ARG213E, ARG213F, ARG231E, ARG231F, ARG257E, ARG257F, ASN181E, ASN181F, ASP230E, ASP230F, ASP243E, ASP243F, CYS180E, CYS180F, CYS225E, CYS225F, GLN172E, GLN172F, GLN238E, GLN238F, GLU216E, GLU216F, GLU219E, GLU219F, GLU222E, GLU222F, GLU4E, GLU4F, GLY174E, GLY174F, GLY177E, GLY177F, GLY186E, GLY186F, GLY212E, GLY212F, GLY215E, GLY215F, GLY237E, GLY237F, GLY245E, GLY245F, HIS176E, HIS176F, HIS209E, HIS209F, HIS218E, HIS218F, HIS249E, HIS249F, ILE183E, ILE183F, ILE214E, ILE214F, ILE220E, ILE220F, ILE235E, ILE235F, ILE240E, ILE240F, ILE256E, ILE256F, LEU187E, LEU187F, LEU210E, LEU210F, LEU223E, LEU223F, LEU227E, LEU227F, LEU246E, LEU246F, LEU247E, LEU247F, LEU250E, LEU250F, LEU253E, LEU253F, LEU27E, LEU27F, LEU5E, LEU5F, PHE205F, PHE226E, PHE226F, PHE234E, PHE234F, PRO185E, PRO185F, PRO254E, PRO254F, SER229E, SER229F, SER244E, SER244F, THR164E, THR166E, THR166F, THR171E, THR171F, THR236E, THR236F, TYR168E, TYR168F, TYR173E, TYR173F, VAL169E, VAL169F, VAL178E, VAL178F, VAL188E, VAL188F, VAL224E, VAL224F, VAL239E, VAL239F, VAL260E, VAL260F, VAL26E, VAL26F
• F-H: ALA143F, ALA143H, ALA145F, ALA145H, ALA147F, ALA147H, ALA148F, ALA148H, ALA156F, ALA156H, ALA206H, ALA248F, ALA248H, ALA258F, ALA258H, ALA261F, ARG257F, ARG257H, ASP150F, ASP150H, ASP203H, ASP243F, ASP243H, GLN199F, GLN255F, GLN255H, GLU262F, GLU262H, GLY186F, GLY186H, GLY245F, GLY245H, GLY252F, GLY252H, HIS146F, HIS146H, HIS208F, HIS208H, HIS209F, HIS209H, HIS249F, HIS249H, ILE201F, ILE201H, ILE204F, ILE204H, ILE256F, ILE256H, LEU187F, LEU187H, LEU197F, LEU197H, LEU210F, LEU210H, LEU246F, LEU246H, LEU247F, LEU247H, LEU250F, LEU250H, LEU253F, LEU253H, LEU263F, LEU263H, LEU98F, LEU98H, MET151F, MET151H, PHE205F, PHE205H, PRO198F, PRO198H, PRO200F, PRO200H, PRO251F, PRO251H, PRO254F, PRO254H, SER142F, SER142H, SER152F, SER152H, SER259F, SER259H, THR144F, THR144H, THR207F, THR207H, TYR149F, TYR149H, VAL202F, VAL202H, VAL260F, VAL260H
• F-G: ALA115F, ALA115G, ALA125F, ALA125G, ALA143F, ALA143G, ALA145F, ALA145G, ALA147F, ALA147G, ALA148F, ALA148G, ALA154F, ALA154G, ALA156F, ALA156G, ALA160F, ALA160G, ALA161F, ALA161G, ALA170F, ALA170G, ARG116F, ARG116G, ARG128F, ARG128G, ARG167F, ARG167G, ARG175F, ARG175G, ASN114F, ASN114G, ASN64F, ASN64G, ASP105F, ASP105G, ASP108F, ASP108G, ASP109F, ASP109G, ASP150F, ASP150G, ASP96F, ASP96G, CYS122F, CYS122G, CYS157F, CYS157G, CYS180G, GLN101F, GLN101G, GLN172F, GLN172G, GLU163F, GLU163G, GLU65F, GLU65G, GLY117F, GLY117G, GLY174F, GLY237F, GLY237G, HIS146F, HIS146G, HIS176F, HIS176G, ILE126F, ILE126G, ILE130F, ILE130G, ILE137F, ILE137G, ILE162F, ILE162G, LEU120F, LEU120G, LEU165F, LEU165G, LEU247F, LEU62F, LEU62G, LEU98F, LEU98G, LYS123F, LYS123G, LYS159F, LYS159G, MET102F, MET102G, MET119F, MET119G, MET121F, MET121G, MET151F, MET151G, MET97F, MET97G, PHE111F, PHE111G, PRO127F, PRO127G, SER142F, SER142G, SER152F, SER152G, THR100F, THR100G, THR103F, THR103G, THR112F, THR112G, THR118F, THR118G, THR144F, THR144G, THR153F, THR153G, THR158F, THR158G, THR164F, THR164G, THR166F, THR166G, THR171F, THR171G, THR63F, THR63G, TRP107F, TRP107G, TYR124F, TYR124G, TYR149F, TYR149G, TYR155F, TYR155G, TYR168F, TYR168G, TYR173F, TYR173G, VAL104F, VAL104G, VAL106F, VAL106G, VAL169F, VAL169G, VAL178F, VAL178G, VAL66F, VAL66G, VAL99F, VAL99G
• E-H: ALA115E, ALA115H, ALA125E, ALA125H, ALA143E, ALA143H, ALA145E, ALA145H, ALA147E, ALA147H, ALA148E, ALA148H, ALA154E, ALA154H, ALA156E, ALA156H, ALA160E, ALA160H, ALA161E, ALA161H, ALA170E, ALA170H, ARG116E, ARG116H, ARG128E, ARG128H, ARG167E, ARG167H, ARG175E, ARG175H, ASN114E, ASN114H, ASN64E, ASN64H, ASP105E, ASP105H, ASP108E, ASP108H, ASP109E, ASP109H, ASP150E, ASP150H, ASP96E, ASP96H, CYS122E, CYS122H, CYS157E, CYS157H, CYS180H, GLN101E, GLN101H, GLN172E, GLN172H, GLU163E, GLU163H, GLU65E, GLU65H, GLY117E, GLY117H, GLY237E, GLY237H, HIS146E, HIS146H, HIS176E, HIS176H, ILE126E, ILE126H, ILE130E, ILE130H, ILE137E, ILE137H, ILE162E, ILE162H, LEU120E, LEU120H, LEU165E, LEU165H, LEU247E, LEU247H, LEU98E, LEU98H, LYS123E, LYS123H, LYS159E, LYS159H, MET102E, MET102H, MET119E, MET119H, MET121E, MET121H, MET151E, MET151H, MET97E, MET97H, PHE111E, PHE111H, PRO127E, PRO127H, SER142E, SER142H, SER152E, SER152H, THR100E, THR100H, THR103E, THR103H, THR112E, THR112H, THR118E, THR118H, THR144E, THR144H, THR153E, THR153H, THR158E, THR158H, THR164E, THR164H, THR166E, THR166H, THR171E, THR171H, THR63E, THR63H, TRP107E, TRP107H, TYR124E, TYR124H, TYR149E, TYR149H, TYR155E, TYR155H, TYR168E, TYR168H, TYR173E, TYR173H, VAL104E, VAL104H, VAL106E, VAL106H, VAL169E, VAL169H, VAL178E, VAL178H, VAL66E, VAL66H, VAL99E, VAL99H
• E-G: ALA143E, ALA143G, ALA145E, ALA145G, ALA147E, ALA147G, ALA148E, ALA148G, ALA156E, ALA206E, ALA206G, ALA248E, ALA248G, ALA258E, ALA258G, ARG257E, ARG257G, ASP150E, ASP150G, ASP203G, ASP243E, ASP243G, GLN199E, GLN199G, GLN255E, GLN255G, GLU262E, GLY186E, GLY186G, GLY245E, GLY245G, GLY252E, GLY252G, HIS146E, HIS146G, HIS208E, HIS208G, HIS209E, HIS209G, HIS249E, HIS249G, ILE201E, ILE201G, ILE204E, ILE204G, ILE256E, ILE256G, LEU187E, LEU187G, LEU197E, LEU197G, LEU210E, LEU210G, LEU246E, LEU246G, LEU247E, LEU247G, LEU250E, LEU250G, LEU253E, LEU253G, LEU98E, LEU98G, MET151E, MET151G, PHE205E, PHE205G, PRO198E, PRO198G, PRO200E, PRO200G, PRO251E, PRO251G, PRO254E, PRO254G, SER142E, SER142G, SER152E, SER152G, SER259E, SER259G, THR144E, THR144G, THR207E, THR207G, TYR149E, TYR149G, VAL202E, VAL202G, VAL260E, VAL260G
• H-G: ALA143H, ALA170G, ALA170H, ALA184G, ALA184H, ALA206G, ALA206H, ALA211G, ALA211H, ALA221G, ALA221H, ALA228G, ALA228H, ALA232G, ALA232H, ALA233G, ALA233H, ALA241G, ALA241H, ALA242G, ALA242H, ALA248G, ALA248H, ALA258G, ALA258H, ALA261G, ALA30G, ALA30H, ARG167G, ARG167H, ARG175G, ARG175H, ARG179G, ARG179H, ARG189G, ARG189H, ARG213G, ARG213H, ARG231G, ARG231H, ARG257G, ARG257H, ASN181G, ASN181H, ASP230G, ASP230H, ASP243G, ASP243H, CYS180G, CYS180H, CYS225G, CYS225H, GLN172G, GLN172H, GLN238G, GLN238H, GLU163H, GLU216G, GLU216H, GLU219G, GLU219H, GLU222G, GLU222H, GLU4G, GLU4H, GLY174G, GLY174H, GLY177G, GLY177H, GLY186G, GLY186H, GLY212G, GLY212H, GLY215G, GLY215H, GLY237G, GLY237H, GLY245G, GLY245H, HIS176G, HIS176H, HIS209G, HIS209H, HIS218G, HIS218H, HIS249G, HIS249H, ILE183G, ILE183H, ILE214G, ILE214H, ILE220G, ILE220H, ILE235G, ILE235H, ILE240G, ILE240H, ILE256G, LEU187G, LEU187H, LEU210G, LEU210H, LEU223G, LEU223H, LEU227G, LEU227H, LEU246G, LEU246H, LEU247G, LEU247H, LEU250G, LEU250H, LEU253G, LEU253H, LEU27G, LEU27H, LEU5G, LEU5H, PHE205G, PHE205H, PHE226G, PHE226H, PHE234G, PHE234H, PRO185G, PRO185H, PRO254G, PRO254H, SER229G, SER229H, SER244G, SER244H, THR164G, THR164H, THR166G, THR166H, THR171G, THR171H, THR236G, THR236H, TYR168G, TYR168H, TYR173G, TYR173H, VAL169G, VAL169H, VAL178G, VAL178H, VAL188G, VAL188H, VAL224G, VAL224H, VAL239G, VAL239H, VAL260G, VAL260H, VAL26G, VAL26H