Modelling text:
Alcohol oxidase shows little sequence homology with any known PDB file. A
BLAST search (ref) revealed a marginal homology with glucose oxidase (~25%
sequence identity; PDB file 1gal (ref)). Threading programs such as TOPITS (ref)
revealed no other structures that would be a better candidate template file. At this
level of sequence identity homology modelling is generally considered
difficult. Consequently the sequence alignment had to be optimised by hand.
This was done in an iterative manner, using model characteristics
such as buried charged residues, too long gap distances, etc., as guidelines.
The details of the sequence alignment procedure are available (ref).
The homology modelling of AO using glucose oxidase was performed using the
WHAT IF program, using the protocoll as described by Chinea et al. (ref).
The WHAT IF homology modelling facility is available as a WWW-based
server (ref).
Ref BLAST: Altschul, Stephen F., Warren Gish, Webb Miller, Eugene W. Myers, and David J.
Lipman (1990). Basic local alignment search tool. J. Mol. Biol. 215:403-10.
Ref 1gal:
JRNL AUTH H.J.HECHT,H.M.KALISZ,J.HENDLE,R.D.SCHMID, 1GAL 7 JRNL AUTH 2 D.SCHOMBURG 1GAL 8 JRNL TITL CRYSTAL STRUCTURE OF GLUCOSE OXIDASE FROM 1GAL 9 JRNL TITL 2 ASPERGILLUS NIGER: REFINED AT 2.3 ANGSTROMS 1GAL 10 JRNL TITL 3 RESOLUTION 1GAL 11 JRNL REF J.MOL.BIOL. V. 229 153 1993 1GAL 12 JRNL REFN ASTM JMOBAK UK ISSN 0022-2836 070 1GAL 13
ref TOPITS:
B Rost: TOPITS: Threading One-dimensional Predictions Into
Three-dimensional Structures. In: C Rawlings, D Clark, R Altman, L
Hunter, T Lengauer & S Wodak (eds.) "The third international conference
on Intelligent Systems for Molecular Biology (ISMB)", Cambridge, U.K.,
Jul 16-19, 1995, Menlo Park, CA: AAAI Press, 1995, 314-321.
alignment details ref:
/service/gal/
Ref for the modelling server:
Homollogy modelling, model and software evaluation: three related resources.
R.Rodriguez, G.Chinea, N.Lopez, T,Pons, G.Vriend CABIOS (1998) In Press.
De accession nr van alcohol oxidase (embl): X02425 glucose oxidase(genbank): J05242 HPOX (Hansenula polymorpha alcohol oxidase). Total number of residues: 664. GLUOX.(Aspergillus niger glucose oxidase) Total number of residues: 583. Comparison matrix : Structure-genetic matrix. Open gap cost : 10 Unit gap cost : 2 The character to show that two aligned residues are identical is '|' HPOX - MAIPDE-------------FDIIVVGGGSTGCCIAGRLANLDDQNLTVAL -37 | | ||| || | || | | GLUOX - SNGIEASLLTDPKDVSGRTVDYIIAGGGLTGLTTAARLT--ENPNISVLV -48 HPOX - IEGGENNINNPWVYLPGVYPRNMRLDSKTATFYSSRPSKALNGRRAIVPC -87 || | | | | | | GLUOX - IESG-SYESDRGPIIEDLNAYGDIFGSSVDHAYET-VELATNNQTALIRS -96 HPOX - ANILGGGSSINFLMYTRASASDYDDWES----EGWSTDELLPLIKKIETY -133 | ||| | || | || ||| | | GLUOX - GNGLGGSTLVNGGTWTRPHKAQVDSWETVFGNEGWNWDNVAAYSLQAER- -145 HPOX - QRPCNNRDL----------HGFDGPIKVSF---GNYTYPTCQDFLRAAES -170 | | || | | | | | GLUOX - ARAPNAKQIAAGHYFNASCHGVNGTVHAGPRDTGDDYSPIVKALMSAVED -195 HPOX - QGIPVVDDLEDFKTSHGAEHWLKWINRDLGRRSDSAHAYVHPTMRNKQSL -220 | | | || | | || | | | GLUOX - RGVPTKKDFG-CGDPHGVSMFPNTLHEDQVR-SDAAREWLLPNYQ-RPNL -242 HPOX - FLITSTKCDKVIIEDGKAVAVRTVPMKPLNPKKPVSRTFRARKQIVISCG -270 | || | | | GLUOX - QVLTGQYVGKVLL--SQNGTTPRAVGVEFGTHKGNTHNVYAKHEVLLAAG -290 HPOX - TISSPLVLQRSGIGAAHHLRSVGVKPIVDLPGVGENFQDHYCFFTPYYVK -320 || | |||| | | |||| || | || | | GLUOX - SAVSPTILEYSGIGMKSILEPLGIDTVVDLP-VGLNLQDQ----TTATVR -335 HPOX - PDVPTFDDFVRGDPVAQKAAFDQWYSNKDGPLTTNGIEAGVKIRPTEEEL -370 | | | || GLUOX - SRITSAG--AGQGQAAWFATFNETFGDYSE--KAHELLNTKLEQWAEEAV -381 HPOX - ATADEDFRRGYAEYFENKPDKPLMHYSVISGFFGDHTKIPNGKFMTMFHF -420 | || | | | | | GLUOX - ARGGFHNTTALLIQYENYRDWIVNHNVAYSELFLDTAGVASFDVWDLL-- -429 HPOX - LEYPFSRGFVRITSANPY-DAPDFDPGFLNDERDLWPMVWAYKKSRETAR -469 || || | | || || | || | | GLUOX - ---PFTRGYVHILDKDPYLHHFAYDPQYFLNELDLLGQAAATQLARNIS- -475 HPOX - RMESFAGEVTSHHPLFKVDSPARARDLDLETCSAYAGPKHLTANLYHGSW -519 | GLUOX - --------------------------------------NSGAMQTYFAGE -487 HPOX - TVPIDKPTPKNDFHVTSNQVQLHSDIEYTEEDDEAIVNYIKEHTETTWHC -569 | | | | | | | GLUOX - TIPGDNLAYDADLSAWTEYIPYHFRPNY--------------------HG -517 HPOX - LGTCSMAPREGSKIAPKGGVLDARLNVYGVQNLKVADLSVCPDNVGCNTY -619 ||||| | | ||| | ||||| | | | | | GLUOX - VGTCSMMPKEM------GGVVDNAARVYGVQGLRVIDGSIPPTQMSSHVM -561 HPOX - STALTIGEKAATLVAEDLGYSGSDLDMTIPNFRLGTYEETGLARF -664 | || GLUOX - TVFYAMALKISDAILEDYASMQ -583 Identity : 142 (24.36%) Number of gaps inserted in HPOX: 5 Number of gaps inserted in GLUOX: 16 Glucose oxidase (+ N-terminaal target. signaal!) >gi|166511 glucose oxidase precursor (EC 1.1.3.4) MQTLLVSSLVVSLAAALPHYIRSNGIEASLLTDPKDVSGRTVDYIIAGGGLTGLTTAARLTENPNISVLV IESGSYESDRGPIIEDLNAYGDIFGSSVDHAYETVELATNNQTALIRSGNGLGGSTLVNGGTWTRPHKAQ VDSWETVFGNEGWNWDNVAAYSLQAERARAPNAKQIAAGHYFNASCHGVNGTVHAGPRDTGDDYSPIVKA LMSAVEDRGVPTKKDFGCGDPHGVSMFPNTLHEDQVRSDAAREWLLPNYQRPNLQVLTGQYVGKVLLSQN GTTPRAVGVEFGTHKGNTHNVYAKHEVLLAAGSAVSPTILEYSGIGMKSILEPLGIDTVVDLPVGLNLQD QTTATVRSRITSAGAGQGQAAWFATFNETFGDYSEKAHELLNTKLEQWAEEAVARGGFHNTTALLIQYEN YRDWIVNHNVAYSELFLDTAGVASFDVWDLLPFTRGYVHILDKDPYLHHFAYDPQYFLNELDLLGQAAAT QLARNISNSGAMQTYFAGETIPGDNLAYDADLSAWTEYIPYHFRPNYHGVGTCSMMPKEMGGVVDNAARV YGVQGLRVIDGSIPPTQMSSHVMTVFYAMALKISDAILEDYASMQ Hp alcohol oxidase: >gi|113652|sp|P04841|ALOX_HANPO ALCOHOL OXIDASE (AOX) (METHANOL >OXIDASE) (MOX) MAIPDEFDIIVVGGGSTGCCIAGRLANLDDQNLTVALIEGGENNINNPWVYLPGVYPRNMRLDSKTATFY SSRPSKALNGRRAIVPCANILGGGSSINFLMYTRASASDYDDWESEGWSTDELLPLIKKIETYQRPCNNR DLHGFDGPIKVSFGNYTYPTCQDFLRAAESQGIPVVDDLEDFKTSHGAEHWLKWINRDLGRRSDSAHAYV HPTMRNKQSLFLITSTKCDKVIIEDGKAVAVRTVPMKPLNPKKPVSRTFRARKQIVISCGTISSPLVLQR SGIGAAHHLRSVGVKPIVDLPGVGENFQDHYCFFTPYYVKPDVPTFDDFVRGDPVAQKAAFDQWYSNKDG PLTTNGIEAGVKIRPTEEELATADEDFRRGYAEYFENKPDKPLMHYSVISGFFGDHTKIPNGKFMTMFHF LEYPFSRGFVRITSANPYDAPDFDPGFLNDERDLWPMVWAYKKSRETARRMESFAGEVTSHHPLFKVDSP ARARDLDLETCSAYAGPKHLTANLYHGSWTVPIDKPTPKNDFHVTSNQVQLHSDIEYTEEDDEAIVNYIK EHTETTWHCLGTCSMAPREGSKIAPKGGVLDARLNVYGVQNLKVADLSVCPDNVGCNTYSTALTIGEKAA TLVAEDLGYSGSDLDMTIPNFRLGTYEETGLARF
>P1;1GAL GIEASLLTDPKDVSGRTVDYIIAGGGLTGLTTAARLT--ENP NISVLVIESGSYESDRGPIIEDLNAY--GDIFGSSVDHAYET -VELATNNQTALIRSGNGLGGSTLVNGGTWTRPHKAQVDSWE TVFGNEGWNWDNVAAYSLQAERARAPNAKQIAAGHYFNASCH GVNGTVHAGPRDTGDDYSPIVKALMSAVEDRGVPTKKDF-GC GDPHGVSMFPNTLHEDQVR-SDAAREWLLPNYQ-RPNLQVLT GQYVGKVLLSQN-GTTPRAVGVE-FGTHKGNTHNVYAKHEVL LAAGSAVSPTILEYSGIGMKSILEPLGIDTVVDLP-VGLNLQ DQ----TTATVRSRI-TSAGAGQGQ-AAWFATFNETFGDYSE KAHELLNTKLEQWA-----EEAVARGGFHNTTALLIQYENYR DWIVNHNVAYSELFLDTAGVAS---FDVWDLL--PFTRGYVH ILDKDPYLHHFAYDPQYFLNELDLLGQAAATQLARN >P1;MODEL -----------MAIPDEFDIIVVGGGSTGCCIAGRLANLDDQ NLTVALIEGGE-NNINNPWVYLPGVYPRNMRLDSKTATFYSS RPSKALNGRRAIVPCANILGGGSSINFLMYTRASASDYDDWE S----EGWSTDELLPLIKKIETYQRPCN---------NRDLH GFDGPIKVS---FGNYTYPTCQDFLRAAESQGIPVVDDLEDF KTSHGAEHWLKWINRDLGRRSDSAHAYVHPTMRNKQSLFLIT STKCDKVIIEDGKAVAVRTVPMKPLNPKKPVSRTFRARKQIV ISCGTISSPLVLQRSGIGAAHHLRSVGVKPIVDLPGVGENFQ DHYCFFTPYYVKPDVPTFDDFVRGDPVAQKAAFDQW---YSN KDGPLTTNGIEAGVKIRPTEEELATADEDFRRGYAEYFENKP DKPLMHYSVISGFFGDHTKIPNGKFMTMFHFLEYPFSRGFVR ITSANPY-DAPDFDPGFLNDERDLWPMVWAYKKSRE
This leads to the model pictured below. The long lines indicate bonds over gaps. Obviously, some of these gaps are a bit too long. We therefore corrected the alignment manually to get better closing gaps.
Bad Gaps.
The gap shifting results in:
Good Gaps.
Insertions cannot be modelled reliably.
(Be prepared to scroll a lot) GIEASLLTDPKDVSGRTVDYIIAGGGLTGLTTAARLT--ENPNISVLVIESGSYESDRGPIIEDLNAY--GDIFGSSVDHAYET-VELATNNQTALIRSGNGLGGSTLVNGGTWTRPHKAQVDSWETVFGNEGWNWDNVAAYSLQAERARAPNAKQIAAGHYFNASCHGVNGTVHAGPRDTGDDYSPIVKALMSAVEDRGVPTKKDF-GCGDPHGVSMFPNTLHEDQVR-SDAAREWLLPNYQ-RPNLQVLTGQYVGKVLLSQN-GTTPRAVGVE-FGTHKGNTHNVYAKHEVLLAAGSAVSPTILEYSGIGMKSILEPLGIDTVVDLP-VGLNLQDQ----TTATVRSRI-TSAGAGQGQ-AAWFATFNETFGDYSEKAHELLNTKLEQWA-----EEAVARGGFHNTTALLIQYENYRDWIVNHNVAYSELFLDTAGVAS---FDVWDLL--PFTRGYVHILDKDPYLHHFAYDPQYFLNELDLLGQAAATQLARN -----------MAIPDEFDIIVVGGGSTGCCIAGRLANLDDQNLTVALIEGGE-NNINNPWVYLPGVYPRNMRLDSKTATFYSSRPSKALNGRRAIVPCANILGGGSSINFLMYTRASASDYDDWES----EGWSTDELLPLIKKIETYQRPCN---------NRDLHGFDGPIKVS---FGNYTYPTCQDFLRAAESQGIPVVDDLEDFKTSHGAEHWLKWINRDLGRRSDSAHAYVHPTMRNKQSLFLITSTKCDKVIIEDGKAVAVRTVPMKPLNPKKPVSRTFRARKQIVISCGTISSPLVLQRSGIGAAHHLRSVGVKPIVDLPGVGENFQDHYCFFTPYYVKPDVPTFDDFVRGDPVAQKAAFDQW---YSNKDGPLTTNGIEAGVKIRPTEEELATADEDFRRGYAEYFENKPDKPLMHYSVISGFFGDHTKIPNGKFMTMFHFLEYPFSRGFVRITSANPY-DAPDFDPGFLNDERDLWPMVWAYKKSRE XXXX XXXXX XXXXXXXXXXX XXXXXXX XXXX ? GIEASLLTDPKDVSGRTVDYIIAGGGLTGLTTAARLT--ENPNISVLVIESGSYESDRGPIIEDLNAY--GDIFGSSVDHAYET-VELATNNQTALIRSGNGLGGSTLVNGGTWTRPHKAQVDSWETVFGNEGWNWDNVAAYSLQAERARAPNAKQIAAGHYFNASCHGVNGTVHAGPRDTGDDYSPIVKALMSAVEDRGVPTKKDF-GCGDPHGVSMFPNTLHEDQVR-SDAAREWLLPNYQ-RPNLQVLTGQYVGKVLLSQN-GTTPRAVGVE-FGTHKGNTHNVYAKHEVLLAAGSAVSPTILEYSGIGMKSILEPLGIDTVVDLP-VGLNLQDQ----TTATVRSRI-TSAGAGQGQ-AAWFATFNETFGDYSEKAHELLNTKLEQWA-----EEAVARGGFHNTTALLIQYENYRDWIVNHNVAYSELFLDTAGVAS---FDVWDLL--PFTRGYVHILDKDPYLHHFAYDPQYFLNELDLLGQAAATQLARN -----------MAIPDEFDIIVVGGGSTGCCIAGRLANLDDQNLTVALIEGGENNI-NNPWVYLPGVYPRNMRLDSKTATFYSSRPSKALNGRRAIVPCANILGGGSSINFLMYTRASASDYDDWE----SEGWSTDELLPLIKKIETYQRP---------CNNRDLHGFDGPIKVSFGNY---TYPTCQDFLRAAESQGIPVVDDLEDFKTSHGAEHWLKWINRDLGRRSDSAHAYVHPTMRNKQSLFLITSTKCDKVIIEDGKAVAVRTVPMKPLNPKKPVSRTFRARKQIVISCGTISSPLVLQRSGIGAAHHLRSVGVKPIVDLPGVGENFQDHYCFFTPYYVKPDVPTFDDFVRGDPVAQKAAFDQWY---SNKDGPLTTNGIEAGVKIRPTEEELATADEDFRRGYAEYFENKPDKPLMHYSVISGFFGDHTKIPNGKFMTMFHFLEYPFSRGFVRITSANPY-DAPDFDPGFLNDERDLWPMVWAYKKSRE
This alignment was modelled. The totally rough model is available.
You can view or get this model.
This model is very rough and the cofactors from 1gal are in there (all of them).
Also available is the validation report for 1gal. (At least if you type 1gal in that page). The report for the model is also worth studying, although the Xray specific checks in this model are of very little value.
1- 10 GLY ILE GLU ALA SER LEU LEU THR ASP PRO 11- 20 LYS ASP VAL SER GLY ARG THR VAL ASP TYR 21- 30 ILE ILE ALA GLY GLY GLY LEU THR GLY LEU 31- 40 THR THR ALA ALA ARG LEU THR GLU ASN PRO 41- 50 ASN ILE SER VAL LEU VAL ILE GLU SER GLY 51- 60 SER TYR GLU SER ASP ARG GLY PRO ILE ILE 61- 70 GLU ASP LEU ASN ALA TYR GLY ASP ILE PHE 71- 80 GLY SER SER VAL ASP HIS ALA TYR GLU THR 81- 90 VAL GLU LEU ALA THR ASN ASN GLN THR ALA 91- 100 LEU ILE ARG SER GLY ASN GLY LEU GLY GLY 101- 110 SER THR LEU VAL ASN GLY GLY THR TRP THR 111- 120 ARG PRO HIS LYS ALA GLN VAL ASP SER TRP 121- 130 GLU THR VAL PHE GLY ASN GLU GLY TRP ASN 131- 140 TRP ASP ASN VAL ALA ALA TYR SER LEU GLN 141- 150 ALA GLU ARG ALA ARG ALA PRO ASN ALA LYS 151- 160 GLN ILE ALA ALA GLY HIS TYR PHE ASN ALA 161- 170 SER CYS HIS GLY VAL ASN GLY THR VAL HIS 171- 180 ALA GLY PRO ARG ASP THR GLY ASP ASP TYR 181- 190 SER PRO ILE VAL LYS ALA LEU MET SER ALA 191- 200 VAL GLU ASP ARG GLY VAL PRO THR LYS LYS 201- 210 ASP PHE GLY CYS GLY ASP PRO HIS GLY VAL 211- 220 SER MET PHE PRO ASN THR LEU HIS GLU ASP 221- 230 GLN VAL ARG SER ASP ALA ALA ARG GLU TRP 231- 240 LEU LEU PRO ASN TYR GLN ARG PRO ASN LEU 241- 250 GLN VAL LEU THR GLY GLN TYR VAL GLY LYS 251- 260 VAL LEU LEU SER GLN ASN GLY THR THR PRO 261- 270 ARG ALA VAL GLY VAL GLU PHE GLY THR HIS 271- 280 LYS GLY ASN THR HIS ASN VAL TYR ALA LYS 281- 290 HIS GLU VAL LEU LEU ALA ALA GLY SER ALA 291- 300 VAL SER PRO THR ILE LEU GLU TYR SER GLY 301- 310 ILE GLY MET LYS SER ILE LEU GLU PRO LEU 311- 320 GLY ILE ASP THR VAL VAL ASP LEU PRO VAL 321- 330 GLY LEU ASN LEU GLN ASP GLN THR THR ALA 331- 340 THR VAL ARG SER ARG ILE THR SER ALA GLY 341- 350 ALA GLY GLN GLY GLN ALA ALA TRP PHE ALA 351- 360 THR PHE ASN GLU THR PHE GLY ASP TYR SER 361- 370 GLU LYS ALA HIS GLU LEU LEU ASN THR LYS 371- 380 LEU GLU GLN TRP ALA GLU GLU ALA VAL ALA 381- 390 ARG GLY GLY PHE HIS ASN THR THR ALA LEU 391- 400 LEU ILE GLN TYR GLU ASN TYR ARG ASP TRP 401- 410 ILE VAL ASN HIS ASN VAL ALA TYR SER GLU 411- 420 LEU PHE LEU ASP THR ALA GLY VAL ALA SER 421- 430 PHE ASP VAL TRP ASP LEU LEU PRO PHE THR 431- 440 ARG GLY TYR VAL HIS ILE LEU ASP LYS ASP 441- 450 PRO TYR LEU HIS HIS PHE ALA TYR ASP PRO 451- 460 GLN TYR PHE LEU ASN GLU LEU ASP LEU LEU 461- 470 GLY GLN ALA ALA ALA THR GLN LEU ALA ARG 471- 480 ASN ILE SER ASN SER GLY ALA MET GLN THR 481- 490 TYR PHE ALA GLY GLU THR ILE PRO GLY ASP 491- 500 ASN LEU ALA TYR ASP ALA ASP LEU SER ALA 501- 510 TRP THR GLU TYR ILE PRO TYR HIS PHE ARG 511- 520 PRO ASN TYR HIS GLY VAL GLY THR CYS SER 521- 530 MET MET PRO LYS GLU MET GLY GLY VAL VAL 531- 540 ASP ASN ALA ALA ARG VAL TYR GLY VAL GLN 541- 550 GLY LEU ARG VAL ILE ASP GLY SER ILE PRO 551- 560 PRO THR GLN MET SER SER HIS VAL MET THR 561- 570 VAL PHE TYR ALA MET ALA LEU LYS ILE SER 571- 580 ASP ALA ILE LEU GLU ASP TYR ALA SER MET 581- 581 GLN The numbers of the model shift with respect to 1gal like: Res. # : 1 GLY ( 3 ) Set-name:y Res. # : 2 ILE ( 4 ) Set-name:y Res. # : 3 GLU ( 5 ) Set-name:y Res. # : 4 ALA ( 6 ) Set-name:y Res. # : 5 SER ( 7 ) Set-name:y Res. # : 6 LEU ( 8 ) Set-name:y Res. # : 7 LEU ( 9 ) Set-name:y Res. # : 8 THR ( 10 ) Set-name:y Res. # : 9 ASP ( 11 ) Set-name:y Contacts with the FAD (assuming that AO and 1gal have the FAD at the same position): Column explanation 1 number of contact (useless) 2 serial number van contacterende residue in model 3 residue numbering 'inherited' van 1gal.pdb 4 5 atoom in contacterende residue 6,7,8 FAD 9 atoom in FAD 10 contact distance 11 useless 12 useless 1 2 3 4 5 6 7 8 9 10 11 12 1 12 VAL ( 25 ) C <> 550 FAD ( 600 ) AC2 D= 4.531 H-ene= -- (B-S) 2 12 VAL ( 25 ) C <> 550 FAD ( 600 ) AN3 D= 4.508 H-ene= -- (B-S) 3 12 VAL ( 25 ) CG1 <> 550 FAD ( 600 ) AC6 D= 4.548 H-ene= -- (S-S) 4 12 VAL ( 25 ) CG1 <> 550 FAD ( 600 ) AN1 D= 4.034 H-ene= -- (S-S) 5 12 VAL ( 25 ) CG1 <> 550 FAD ( 600 ) AC2 D= 4.192 H-ene= -- (S-S) 6 13 GLY ( 26 ) N <> 550 FAD ( 600 ) AC2 D= 3.920 H-ene= -- (B-S) 7 13 GLY ( 26 ) N <> 550 FAD ( 600 ) AN3 D= 3.741 H-ene= -- (B-S) 8 13 GLY ( 26 ) CA <> 550 FAD ( 600 ) AC4* D= 4.040 H-ene= -- (B-S) 9 13 GLY ( 26 ) CA <> 550 FAD ( 600 ) AO4* D= 3.480 H-ene= -- (B-S) 10 13 GLY ( 26 ) CA <> 550 FAD ( 600 ) AC1* D= 3.898 H-ene= -- (B-S) 11 13 GLY ( 26 ) CA <> 550 FAD ( 600 ) AN9 D= 4.423 H-ene= -- (B-S) 12 13 GLY ( 26 ) CA <> 550 FAD ( 600 ) AC2 D= 4.075 H-ene= -- (B-S) 13 13 GLY ( 26 ) CA <> 550 FAD ( 600 ) AN3 D= 3.424 H-ene= -- (B-S) 14 13 GLY ( 26 ) CA <> 550 FAD ( 600 ) AC4 D= 4.160 H-ene= -- (B-S) 15 13 GLY ( 26 ) C <> 550 FAD ( 600 ) AC4* D= 4.218 H-ene= -- (B-S) 16 13 GLY ( 26 ) C <> 550 FAD ( 600 ) AO4* D= 4.172 H-ene= -- (B-S) 17 14 GLY ( 27 ) N <> 550 FAD ( 600 ) AC4* D= 4.379 H-ene= -- (B-S) 18 14 GLY ( 27 ) N <> 550 FAD ( 600 ) AO4* D= 4.480 H-ene= -- (B-S) 19 14 GLY ( 27 ) N <> 550 FAD ( 600 ) AO3* D= 4.430 H-ene= -- (B-S) 20 14 GLY ( 27 ) C <> 550 FAD ( 600 ) AC4* D= 4.288 H-ene= -- (B-S) 21 14 GLY ( 27 ) C <> 550 FAD ( 600 ) AC3* D= 4.430 H-ene= -- (B-S) 22 14 GLY ( 27 ) C <> 550 FAD ( 600 ) AO3* D= 3.639 H-ene= -- (B-S) 23 14 GLY ( 27 ) O <> 550 FAD ( 600 ) AC3* D= 4.197 H-ene= -- (B-S) 24 14 GLY ( 27 ) O <> 550 FAD ( 600 ) AO3* D= 3.111 H-ene= -- (B-S) 25 15 GLY ( 28 ) N <> 550 FAD ( 600 ) AO5* D= 4.071 H-ene= -- (B-B) 26 15 GLY ( 28 ) N <> 550 FAD ( 600 ) AC4* D= 3.949 H-ene= -- (B-S) 27 15 GLY ( 28 ) N <> 550 FAD ( 600 ) AC3* D= 4.407 H-ene= -- (B-S) 28 15 GLY ( 28 ) N <> 550 FAD ( 600 ) AO3* D= 3.935 H-ene= -- (B-S) 29 15 GLY ( 28 ) CA <> 550 FAD ( 600 ) AP D= 4.061 H-ene= -- (B-B) 30 15 GLY ( 28 ) CA <> 550 FAD ( 600 ) AO2 D= 3.625 H-ene= -- (B-B) 31 15 GLY ( 28 ) CA <> 550 FAD ( 600 ) AO5* D= 3.272 H-ene= -- (B-B) 32 15 GLY ( 28 ) CA <> 550 FAD ( 600 ) AC5* D= 4.239 H-ene= -- (B-S) 33 15 GLY ( 28 ) CA <> 550 FAD ( 600 ) AC4* D= 3.921 H-ene= -- (B-S) 34 15 GLY ( 28 ) CA <> 550 FAD ( 600 ) AC3* D= 4.226 H-ene= -- (B-S) 35 15 GLY ( 28 ) CA <> 550 FAD ( 600 ) AO3* D= 3.845 H-ene= -- (B-S) 36 15 GLY ( 28 ) C <> 550 FAD ( 600 ) AO2 D= 3.922 H-ene= -- (B-B) 37 15 GLY ( 28 ) C <> 550 FAD ( 600 ) AO5* D= 4.209 H-ene= -- (B-B) 38 15 GLY ( 28 ) C <> 550 FAD ( 600 ) OP1 D= 3.956 H-ene= -- (B-S) 39 16 SER ( 29 ) N <> 550 FAD ( 600 ) AP D= 4.192 H-ene= -- (B-B) 40 16 SER ( 29 ) N <> 550 FAD ( 600 ) AO2 D= 3.256 H-ene= -- (B-B) 41 16 SER ( 29 ) N <> 550 FAD ( 600 ) AO5* D= 4.239 H-ene= -- (B-B) 42 16 SER ( 29 ) N <> 550 FAD ( 600 ) O5* D= 4.094 H-ene= -- (B-S) 43 16 SER ( 29 ) N <> 550 FAD ( 600 ) P D= 4.374 H-ene= -- (B-S) 44 16 SER ( 29 ) N <> 550 FAD ( 600 ) OP1 D= 3.582 H-ene= -- (B-S) 45 16 SER ( 29 ) CA <> 550 FAD ( 600 ) AO2 D= 4.289 H-ene= -- (B-B) 46 16 SER ( 29 ) CA <> 550 FAD ( 600 ) OP1 D= 3.970 H-ene= -- (B-S) 47 16 SER ( 29 ) C <> 550 FAD ( 600 ) OP1 D= 3.916 H-ene= -- (B-S) 48 16 SER ( 29 ) CB <> 550 FAD ( 600 ) AO2 D= 4.119 H-ene= -- (S-B) 49 16 SER ( 29 ) CB <> 550 FAD ( 600 ) C4* D= 4.035 H-ene= -- (S-S) 50 16 SER ( 29 ) CB <> 550 FAD ( 600 ) O4* D= 3.724 H-ene= -- (S-S) 51 16 SER ( 29 ) CB <> 550 FAD ( 600 ) C5* D= 4.363 H-ene= -- (S-S) 52 16 SER ( 29 ) CB <> 550 FAD ( 600 ) O5* D= 3.327 H-ene= -- (S-S) 53 16 SER ( 29 ) CB <> 550 FAD ( 600 ) P D= 4.274 H-ene= -- (S-S) 54 16 SER ( 29 ) CB <> 550 FAD ( 600 ) OP1 D= 3.851 H-ene= -- (S-S) 55 16 SER ( 29 ) OG <> 550 FAD ( 600 ) AP D= 4.073 H-ene= -- (S-B) 56 16 SER ( 29 ) OG <> 550 FAD ( 600 ) AO2 D= 3.320 H-ene= -- (S-B) 57 16 SER ( 29 ) OG <> 550 FAD ( 600 ) O3 D= 3.717 H-ene= -- (S-S) 58 16 SER ( 29 ) OG <> 550 FAD ( 600 ) C4* D= 3.206 H-ene= -- (S-S) 59 16 SER ( 29 ) OG <> 550 FAD ( 600 ) O4* D= 3.124 H-ene= -- (S-S) 60 16 SER ( 29 ) OG <> 550 FAD ( 600 ) C5* D= 3.138 H-ene= -- (S-S) 61 16 SER ( 29 ) OG <> 550 FAD ( 600 ) O5* D= 1.928 H-ene= -- (S-S) 62 16 SER ( 29 ) OG <> 550 FAD ( 600 ) P D= 2.897 H-ene= -- (S-S) 63 16 SER ( 29 ) OG <> 550 FAD ( 600 ) OP1 D= 2.752 H-ene= -- (S-S) 64 17 THR ( 30 ) N <> 550 FAD ( 600 ) P D= 4.315 H-ene= -- (B-S) 65 17 THR ( 30 ) N <> 550 FAD ( 600 ) OP1 D= 3.066 H-ene= -- (B-S) 66 17 THR ( 30 ) CA <> 550 FAD ( 600 ) OP1 D= 3.782 H-ene= -- (B-S) 67 17 THR ( 30 ) CB <> 550 FAD ( 600 ) P D= 4.601 H-ene= -- (S-S) 68 17 THR ( 30 ) CB <> 550 FAD ( 600 ) OP1 D= 3.376 H-ene= -- (S-S) 69 17 THR ( 30 ) OG1 <> 550 FAD ( 600 ) P D= 3.692 H-ene= -- (S-S) 70 17 THR ( 30 ) OG1 <> 550 FAD ( 600 ) OP1 D= 2.385 H-ene= -- (S-S) 71 17 THR ( 30 ) CG2 <> 550 FAD ( 600 ) P D= 4.424 H-ene= -- (S-S) 72 17 THR ( 30 ) CG2 <> 550 FAD ( 600 ) OP1 D= 3.621 H-ene= -- (S-S) 73 36 ILE ( 49 ) C <> 550 FAD ( 600 ) AC2 D= 4.066 H-ene= -- (B-S) 74 36 ILE ( 49 ) C <> 550 FAD ( 600 ) AN3 D= 4.313 H-ene= -- (B-S) 75 36 ILE ( 49 ) O <> 550 FAD ( 600 ) AC2 D= 3.116 H-ene= -- (B-S) 76 36 ILE ( 49 ) O <> 550 FAD ( 600 ) AN3 D= 3.363 H-ene= -- (B-S) 77 36 ILE ( 49 ) CG2 <> 550 FAD ( 600 ) AC2 D= 4.532 H-ene= -- (S-S) 78 37 GLU ( 50 ) CA <> 550 FAD ( 600 ) AC2 D= 4.157 H-ene= -- (B-S) 79 37 GLU ( 50 ) CA <> 550 FAD ( 600 ) AN3 D= 3.843 H-ene= -- (B-S) 80 37 GLU ( 50 ) C <> 550 FAD ( 600 ) AC2 D= 4.262 H-ene= -- (B-S) 81 37 GLU ( 50 ) C <> 550 FAD ( 600 ) AN3 D= 4.064 H-ene= -- (B-S) 82 37 GLU ( 50 ) CG <> 550 FAD ( 600 ) AO3* D= 4.590 H-ene= -- (S-S) 83 37 GLU ( 50 ) CD <> 550 FAD ( 600 ) AO4* D= 4.540 H-ene= -- (S-S) 84 37 GLU ( 50 ) CD <> 550 FAD ( 600 ) AC3* D= 4.103 H-ene= -- (S-S) 85 37 GLU ( 50 ) CD <> 550 FAD ( 600 ) AO3* D= 3.421 H-ene= -- (S-S) 86 37 GLU ( 50 ) CD <> 550 FAD ( 600 ) AC2* D= 3.941 H-ene= -- (S-S) 87 37 GLU ( 50 ) CD <> 550 FAD ( 600 ) AO2* D= 3.509 H-ene= -- (S-S) 88 37 GLU ( 50 ) CD <> 550 FAD ( 600 ) AC1* D= 3.471 H-ene= -- (S-S) 89 37 GLU ( 50 ) CD <> 550 FAD ( 600 ) AN9 D= 4.465 H-ene= -- (S-S) 90 37 GLU ( 50 ) CD <> 550 FAD ( 600 ) AN3 D= 4.053 H-ene= -- (S-S) 91 37 GLU ( 50 ) OE1 <> 550 FAD ( 600 ) AC4* D= 3.764 H-ene= -- (S-S) 92 37 GLU ( 50 ) OE1 <> 550 FAD ( 600 ) AO4* D= 3.639 H-ene= -- (S-S) 93 37 GLU ( 50 ) OE1 <> 550 FAD ( 600 ) AC3* D= 3.461 H-ene= -- (S-S) 94 37 GLU ( 50 ) OE1 <> 550 FAD ( 600 ) AO3* D= 2.907 H-ene= -- (S-S) 95 37 GLU ( 50 ) OE1 <> 550 FAD ( 600 ) AC2* D= 3.543 H-ene= -- (S-S) 96 37 GLU ( 50 ) OE1 <> 550 FAD ( 600 ) AO2* D= 3.605 H-ene= -- (S-S) 97 37 GLU ( 50 ) OE1 <> 550 FAD ( 600 ) AC1* D= 2.871 H-ene= -- (S-S) 98 37 GLU ( 50 ) OE1 <> 550 FAD ( 600 ) AN9 D= 4.034 H-ene= -- (S-S) 99 37 GLU ( 50 ) OE1 <> 550 FAD ( 600 ) AN3 D= 3.664 H-ene= -- (S-S) 100 37 GLU ( 50 ) OE2 <> 550 FAD ( 600 ) AC3* D= 4.040 H-ene= -- (S-S) 101 37 GLU ( 50 ) OE2 <> 550 FAD ( 600 ) AO3* D= 3.540 H-ene= -- (S-S) 102 37 GLU ( 50 ) OE2 <> 550 FAD ( 600 ) AC2* D= 3.521 H-ene= -- (S-S) 103 37 GLU ( 50 ) OE2 <> 550 FAD ( 600 ) AO2* D= 2.681 H-ene= -- (S-S) 104 37 GLU ( 50 ) OE2 <> 550 FAD ( 600 ) AC1* D= 3.313 H-ene= -- (S-S) 105 37 GLU ( 50 ) OE2 <> 550 FAD ( 600 ) AN9 D= 4.120 H-ene= -- (S-S) 106 37 GLU ( 50 ) OE2 <> 550 FAD ( 600 ) AN3 D= 4.132 H-ene= -- (S-S) 107 38 GLY ( 51 ) N <> 550 FAD ( 600 ) AN1 D= 4.489 H-ene= -- (B-S) 108 38 GLY ( 51 ) N <> 550 FAD ( 600 ) AC2 D= 3.635 H-ene= -- (B-S) 109 38 GLY ( 51 ) N <> 550 FAD ( 600 ) AN3 D= 3.335 H-ene= -- (B-S) 110 38 GLY ( 51 ) N <> 550 FAD ( 600 ) AC4 D= 4.080 H-ene= -- (B-S) 111 38 GLY ( 51 ) CA <> 550 FAD ( 600 ) AC2 D= 4.408 H-ene= -- (B-S) 112 38 GLY ( 51 ) CA <> 550 FAD ( 600 ) AN3 D= 4.243 H-ene= -- (B-S) 113 54 TYR ( 68 ) CE1 <> 550 FAD ( 600 ) C6 D= 4.345 H-ene= -- (S-S) 114 54 TYR ( 68 ) CE1 <> 550 FAD ( 600 ) C7 D= 4.588 H-ene= -- (S-S) 115 54 TYR ( 68 ) CE1 <> 550 FAD ( 600 ) C7M D= 4.077 H-ene= -- (S-S) 116 54 TYR ( 68 ) CZ <> 550 FAD ( 600 ) C6 D= 4.230 H-ene= -- (S-S) 117 54 TYR ( 68 ) CZ <> 550 FAD ( 600 ) C7M D= 4.150 H-ene= -- (S-S) 118 54 TYR ( 68 ) OH <> 550 FAD ( 600 ) C6 D= 3.343 H-ene= -- (S-S) 119 54 TYR ( 68 ) OH <> 550 FAD ( 600 ) C7 D= 3.740 H-ene= -- (S-S) 120 54 TYR ( 68 ) OH <> 550 FAD ( 600 ) C7M D= 3.283 H-ene= -- (S-S) 121 66 TYR ( 80 ) OH <> 550 FAD ( 600 ) AC8 D= 3.834 H-ene= -- (S-S) 122 66 TYR ( 80 ) OH <> 550 FAD ( 600 ) AN7 D= 4.005 H-ene= -- (S-S) 123 81 PRO ( 95 ) C <> 550 FAD ( 600 ) C8M D= 3.866 H-ene= -- (B-S) 124 81 PRO ( 95 ) O <> 550 FAD ( 600 ) C8M D= 2.881 H-ene= -- (B-S) 125 81 PRO ( 95 ) CB <> 550 FAD ( 600 ) C7M D= 4.481 H-ene= -- (S-S) 126 82 CYS ( 96 ) CA <> 550 FAD ( 600 ) C8M D= 4.386 H-ene= -- (B-S) 127 82 CYS ( 96 ) SG <> 550 FAD ( 600 ) AO1 D= 3.587 H-ene= -- (S-B) 128 83 ALA ( 97 ) C <> 550 FAD ( 600 ) AO2* D= 4.269 H-ene= -- (B-S) 129 83 ALA ( 97 ) O <> 550 FAD ( 600 ) AC3* D= 3.655 H-ene= -- (B-S) 130 83 ALA ( 97 ) O <> 550 FAD ( 600 ) AO3* D= 3.811 H-ene= -- (B-S) 131 83 ALA ( 97 ) O <> 550 FAD ( 600 ) AC2* D= 3.701 H-ene= -- (B-S) 132 83 ALA ( 97 ) O <> 550 FAD ( 600 ) AO2* D= 3.443 H-ene= -- (B-S) 133 84 ASN ( 98 ) N <> 550 FAD ( 600 ) AO2* D= 4.300 H-ene= -- (B-S) 134 84 ASN ( 98 ) CA <> 550 FAD ( 600 ) AC2* D= 4.557 H-ene= -- (B-S) 135 84 ASN ( 98 ) CA <> 550 FAD ( 600 ) AO2* D= 3.381 H-ene= -- (B-S) 136 84 ASN ( 98 ) C <> 550 FAD ( 600 ) AO2* D= 3.923 H-ene= -- (B-S) 137 84 ASN ( 98 ) CB <> 550 FAD ( 600 ) AO2* D= 4.070 H-ene= -- (S-S) 138 84 ASN ( 98 ) CG <> 550 FAD ( 600 ) AO2* D= 4.172 H-ene= -- (S-S) 139 84 ASN ( 98 ) OD1 <> 550 FAD ( 600 ) AO2* D= 3.428 H-ene= -- (S-S) 140 85 ILE ( 99 ) N <> 550 FAD ( 600 ) AO3* D= 3.826 H-ene= -- (B-S) 141 85 ILE ( 99 ) N <> 550 FAD ( 600 ) AO2* D= 3.721 H-ene= -- (B-S) 142 85 ILE ( 99 ) CA <> 550 FAD ( 600 ) AO3* D= 4.401 H-ene= -- (B-S) 143 85 ILE ( 99 ) C <> 550 FAD ( 600 ) AO3* D= 3.812 H-ene= -- (B-S) 144 85 ILE ( 99 ) O <> 550 FAD ( 600 ) AC3* D= 4.113 H-ene= -- (B-S) 145 85 ILE ( 99 ) O <> 550 FAD ( 600 ) AO3* D= 2.777 H-ene= -- (B-S) 146 87 GLY ( 101 ) C <> 550 FAD ( 600 ) AO2 D= 4.567 H-ene= -- (B-B) 147 88 GLY ( 102 ) N <> 550 FAD ( 600 ) AO2 D= 3.920 H-ene= -- (B-B) 148 88 GLY ( 102 ) N <> 550 FAD ( 600 ) AO5* D= 4.366 H-ene= -- (B-B) 149 88 GLY ( 102 ) N <> 550 FAD ( 600 ) AC3* D= 4.301 H-ene= -- (B-S) 150 88 GLY ( 102 ) N <> 550 FAD ( 600 ) AO3* D= 3.432 H-ene= -- (B-S) 151 88 GLY ( 102 ) CA <> 550 FAD ( 600 ) AP D= 3.617 H-ene= -- (B-B) 152 88 GLY ( 102 ) CA <> 550 FAD ( 600 ) AO1 D= 4.117 H-ene= -- (B-B) 153 88 GLY ( 102 ) CA <> 550 FAD ( 600 ) AO2 D= 2.863 H-ene= -- (B-B) 154 88 GLY ( 102 ) CA <> 550 FAD ( 600 ) AO5* D= 3.497 H-ene= -- (B-B) 155 88 GLY ( 102 ) CA <> 550 FAD ( 600 ) AC4* D= 4.548 H-ene= -- (B-S) 156 88 GLY ( 102 ) CA <> 550 FAD ( 600 ) AC3* D= 3.786 H-ene= -- (B-S) 157 88 GLY ( 102 ) CA <> 550 FAD ( 600 ) AO3* D= 3.336 H-ene= -- (B-S) 158 88 GLY ( 102 ) C <> 550 FAD ( 600 ) AP D= 4.464 H-ene= -- (B-B) 159 88 GLY ( 102 ) C <> 550 FAD ( 600 ) AO1 D= 4.528 H-ene= -- (B-B) 160 88 GLY ( 102 ) C <> 550 FAD ( 600 ) AO2 D= 3.768 H-ene= -- (B-B) 161 88 GLY ( 102 ) C <> 550 FAD ( 600 ) AO5* D= 4.585 H-ene= -- (B-B) 162 88 GLY ( 102 ) C <> 550 FAD ( 600 ) AC3* D= 4.533 H-ene= -- (B-S) 163 88 GLY ( 102 ) C <> 550 FAD ( 600 ) AO3* D= 4.121 H-ene= -- (B-S) 164 88 GLY ( 102 ) O <> 550 FAD ( 600 ) AO3* D= 4.196 H-ene= -- (B-S) 165 89 GLY ( 103 ) N <> 550 FAD ( 600 ) AP D= 4.396 H-ene= -- (B-B) 166 89 GLY ( 103 ) N <> 550 FAD ( 600 ) AO1 D= 4.253 H-ene= -- (B-B) 167 89 GLY ( 103 ) N <> 550 FAD ( 600 ) AO2 D= 3.670 H-ene= -- (B-B) 168 89 GLY ( 103 ) CA <> 550 FAD ( 600 ) AP D= 3.766 H-ene= -- (B-B) 169 89 GLY ( 103 ) CA <> 550 FAD ( 600 ) AO1 D= 3.802 H-ene= -- (B-B) 170 89 GLY ( 103 ) CA <> 550 FAD ( 600 ) AO2 D= 2.859 H-ene= -- (B-B) 171 89 GLY ( 103 ) CA <> 550 FAD ( 600 ) O2* D= 3.903 H-ene= -- (B-S) 172 89 GLY ( 103 ) CA <> 550 FAD ( 600 ) C4* D= 4.262 H-ene= -- (B-S) 173 89 GLY ( 103 ) CA <> 550 FAD ( 600 ) O4* D= 2.943 H-ene= -- (B-S) 174 89 GLY ( 103 ) C <> 550 FAD ( 600 ) AO2 D= 3.938 H-ene= -- (B-B) 175 89 GLY ( 103 ) C <> 550 FAD ( 600 ) C2* D= 4.389 H-ene= -- (B-S) 176 89 GLY ( 103 ) C <> 550 FAD ( 600 ) O2* D= 3.122 H-ene= -- (B-S) 177 89 GLY ( 103 ) C <> 550 FAD ( 600 ) C4* D= 4.258 H-ene= -- (B-S) 178 89 GLY ( 103 ) C <> 550 FAD ( 600 ) O4* D= 2.928 H-ene= -- (B-S) 179 89 GLY ( 103 ) O <> 550 FAD ( 600 ) C2* D= 3.306 H-ene= -- (B-S) 180 89 GLY ( 103 ) O <> 550 FAD ( 600 ) O2* D= 1.958 H-ene= -- (B-S) 181 89 GLY ( 103 ) O <> 550 FAD ( 600 ) C3* D= 3.809 H-ene= -- (B-S) 182 89 GLY ( 103 ) O <> 550 FAD ( 600 ) C4* D= 3.763 H-ene= -- (B-S) 183 89 GLY ( 103 ) O <> 550 FAD ( 600 ) O4* D= 2.682 H-ene= -- (B-S) 184 90 SER ( 104 ) N <> 550 FAD ( 600 ) O4* D= 3.961 H-ene= -- (B-S) 185 92 ILE ( 106 ) CG1 <> 550 FAD ( 600 ) C7M D= 4.450 H-ene= -- (S-S) 186 92 ILE ( 106 ) CG1 <> 550 FAD ( 600 ) C8 D= 4.563 H-ene= -- (S-S) 187 92 ILE ( 106 ) CG1 <> 550 FAD ( 600 ) C8M D= 4.070 H-ene= -- (S-S) 188 92 ILE ( 106 ) CD1 <> 550 FAD ( 600 ) C7M D= 4.076 H-ene= -- (S-S) 189 92 ILE ( 106 ) CD1 <> 550 FAD ( 600 ) C8 D= 4.407 H-ene= -- (S-S) 190 92 ILE ( 106 ) CD1 <> 550 FAD ( 600 ) C8M D= 3.527 H-ene= -- (S-S) 191 93 ASN ( 107 ) CA <> 550 FAD ( 600 ) C4A D= 4.540 H-ene= -- (B-S) 192 93 ASN ( 107 ) CA <> 550 FAD ( 600 ) N5 D= 4.066 H-ene= -- (B-S) 193 93 ASN ( 107 ) CA <> 550 FAD ( 600 ) C5A D= 3.839 H-ene= -- (B-S) 194 93 ASN ( 107 ) CA <> 550 FAD ( 600 ) C6 D= 3.740 H-ene= -- (B-S) 195 93 ASN ( 107 ) CA <> 550 FAD ( 600 ) C7 D= 4.065 H-ene= -- (B-S) 196 93 ASN ( 107 ) CA <> 550 FAD ( 600 ) C9A D= 4.417 H-ene= -- (B-S) 197 93 ASN ( 107 ) CB <> 550 FAD ( 600 ) C4 D= 3.992 H-ene= -- (S-S) 198 93 ASN ( 107 ) CB <> 550 FAD ( 600 ) C4A D= 3.515 H-ene= -- (S-S) 199 93 ASN ( 107 ) CB <> 550 FAD ( 600 ) N5 D= 3.426 H-ene= -- (S-S) 200 93 ASN ( 107 ) CB <> 550 FAD ( 600 ) C5A D= 3.294 H-ene= -- (S-S) 201 93 ASN ( 107 ) CB <> 550 FAD ( 600 ) C6 D= 3.772 H-ene= -- (S-S) 202 93 ASN ( 107 ) CB <> 550 FAD ( 600 ) C7 D= 4.246 H-ene= -- (S-S) 203 93 ASN ( 107 ) CB <> 550 FAD ( 600 ) C8 D= 4.432 H-ene= -- (S-S) 204 93 ASN ( 107 ) CB <> 550 FAD ( 600 ) C9 D= 4.153 H-ene= -- (S-S) 205 93 ASN ( 107 ) CB <> 550 FAD ( 600 ) C9A D= 3.548 H-ene= -- (S-S) 206 93 ASN ( 107 ) CB <> 550 FAD ( 600 ) N10 D= 3.907 H-ene= -- (S-S) 207 93 ASN ( 107 ) CB <> 550 FAD ( 600 ) C10 D= 3.829 H-ene= -- (S-S) 208 93 ASN ( 107 ) CB <> 550 FAD ( 600 ) O2* D= 4.049 H-ene= -- (S-S) 209 93 ASN ( 107 ) CG <> 550 FAD ( 600 ) C4 D= 4.237 H-ene= -- (S-S) 210 93 ASN ( 107 ) CG <> 550 FAD ( 600 ) C4A D= 4.161 H-ene= -- (S-S) 211 93 ASN ( 107 ) CG <> 550 FAD ( 600 ) N5 D= 4.477 H-ene= -- (S-S) 212 93 ASN ( 107 ) CG <> 550 FAD ( 600 ) C10 D= 4.340 H-ene= -- (S-S) 213 93 ASN ( 107 ) ND2 <> 550 FAD ( 600 ) C10 D= 4.345 H-ene= -- (S-S) 214 93 ASN ( 107 ) ND2 <> 550 FAD ( 600 ) O2* D= 3.484 H-ene= -- (S-S) 215 94 PHE ( 108 ) N <> 550 FAD ( 600 ) C4 D= 3.987 H-ene= -- (B-S) 216 94 PHE ( 108 ) N <> 550 FAD ( 600 ) O4 D= 3.375 H-ene= -- (B-S) 217 94 PHE ( 108 ) N <> 550 FAD ( 600 ) C4A D= 4.272 H-ene= -- (B-S) 218 94 PHE ( 108 ) N <> 550 FAD ( 600 ) N5 D= 3.927 H-ene= -- (B-S) 219 94 PHE ( 108 ) N <> 550 FAD ( 600 ) C5A D= 4.472 H-ene= -- (B-S) 220 94 PHE ( 108 ) N <> 550 FAD ( 600 ) C6 D= 4.488 H-ene= -- (B-S) 221 94 PHE ( 108 ) CA <> 550 FAD ( 600 ) C4 D= 4.592 H-ene= -- (B-S) 222 94 PHE ( 108 ) CA <> 550 FAD ( 600 ) O4 D= 3.655 H-ene= -- (B-S) 223 94 PHE ( 108 ) C <> 550 FAD ( 600 ) O4 D= 3.779 H-ene= -- (B-S) 224 94 PHE ( 108 ) CB <> 550 FAD ( 600 ) C4 D= 4.510 H-ene= -- (S-S) 225 94 PHE ( 108 ) CB <> 550 FAD ( 600 ) O4 D= 3.363 H-ene= -- (S-S) 226 95 LEU ( 109 ) N <> 550 FAD ( 600 ) C4 D= 4.129 H-ene= -- (B-S) 227 95 LEU ( 109 ) N <> 550 FAD ( 600 ) O4 D= 3.538 H-ene= -- (B-S) 228 96 MET ( 110 ) N <> 550 FAD ( 600 ) N3 D= 3.582 H-ene= -- (B-S) 229 96 MET ( 110 ) N <> 550 FAD ( 600 ) C4 D= 3.843 H-ene= -- (B-S) 230 96 MET ( 110 ) N <> 550 FAD ( 600 ) O4 D= 3.319 H-ene= -- (B-S) 231 96 MET ( 110 ) CA <> 550 FAD ( 600 ) N3 D= 3.937 H-ene= -- (B-S) 232 96 MET ( 110 ) CA <> 550 FAD ( 600 ) C4 D= 4.422 H-ene= -- (B-S) 233 96 MET ( 110 ) CA <> 550 FAD ( 600 ) O4 D= 3.951 H-ene= -- (B-S) 234 96 MET ( 110 ) C <> 550 FAD ( 600 ) N3 D= 4.017 H-ene= -- (B-S) 235 96 MET ( 110 ) O <> 550 FAD ( 600 ) C2 D= 3.779 H-ene= -- (B-S) 236 96 MET ( 110 ) O <> 550 FAD ( 600 ) O2 D= 3.331 H-ene= -- (B-S) 237 96 MET ( 110 ) O <> 550 FAD ( 600 ) N3 D= 3.275 H-ene= -- (B-S) 238 96 MET ( 110 ) CB <> 550 FAD ( 600 ) N3 D= 3.629 H-ene= -- (S-S) 239 96 MET ( 110 ) CB <> 550 FAD ( 600 ) C4 D= 3.931 H-ene= -- (S-S) 240 96 MET ( 110 ) CB <> 550 FAD ( 600 ) O4 D= 3.396 H-ene= -- (S-S) 241 218 THR ( 248 ) O <> 550 FAD ( 600 ) AN1 D= 4.142 H-ene= -- (B-S) 242 218 THR ( 248 ) O <> 550 FAD ( 600 ) AC2 D= 3.938 H-ene= -- (B-S) 243 219 LYS ( 249 ) CA <> 550 FAD ( 600 ) AC6 D= 4.308 H-ene= -- (B-S) 244 219 LYS ( 249 ) CA <> 550 FAD ( 600 ) AN6 D= 4.254 H-ene= -- (B-S) 245 219 LYS ( 249 ) CA <> 550 FAD ( 600 ) AN1 D= 3.911 H-ene= -- (B-S) 246 219 LYS ( 249 ) CA <> 550 FAD ( 600 ) AC2 D= 4.572 H-ene= -- (B-S) 247 219 LYS ( 249 ) C <> 550 FAD ( 600 ) AC6 D= 4.506 H-ene= -- (B-S) 248 219 LYS ( 249 ) C <> 550 FAD ( 600 ) AN6 D= 4.283 H-ene= -- (B-S) 249 219 LYS ( 249 ) C <> 550 FAD ( 600 ) AN1 D= 4.022 H-ene= -- (B-S) 250 219 LYS ( 249 ) CB <> 550 FAD ( 600 ) AN6 D= 4.239 H-ene= -- (S-S) 251 219 LYS ( 249 ) CG <> 550 FAD ( 600 ) AN6 D= 4.428 H-ene= -- (S-S) 252 220 CYS ( 250 ) N <> 550 FAD ( 600 ) AC6 D= 3.711 H-ene= -- (B-S) 253 220 CYS ( 250 ) N <> 550 FAD ( 600 ) AN6 D= 3.546 H-ene= -- (B-S) 254 220 CYS ( 250 ) N <> 550 FAD ( 600 ) AN1 D= 3.150 H-ene= -- (B-S) 255 220 CYS ( 250 ) N <> 550 FAD ( 600 ) AC2 D= 4.012 H-ene= -- (B-S) 256 220 CYS ( 250 ) CA <> 550 FAD ( 600 ) AC6 D= 4.529 H-ene= -- (B-S) 257 220 CYS ( 250 ) CA <> 550 FAD ( 600 ) AN6 D= 4.216 H-ene= -- (B-S) 258 220 CYS ( 250 ) CA <> 550 FAD ( 600 ) AN1 D= 4.023 H-ene= -- (B-S) 259 220 CYS ( 250 ) C <> 550 FAD ( 600 ) AN6 D= 4.024 H-ene= -- (B-S) 260 220 CYS ( 250 ) O <> 550 FAD ( 600 ) AC6 D= 4.025 H-ene= -- (B-S) 261 220 CYS ( 250 ) O <> 550 FAD ( 600 ) AN6 D= 3.121 H-ene= -- (B-S) 262 220 CYS ( 250 ) CB <> 550 FAD ( 600 ) AC6 D= 4.526 H-ene= -- (S-S) 263 220 CYS ( 250 ) CB <> 550 FAD ( 600 ) AN6 D= 4.476 H-ene= -- (S-S) 264 220 CYS ( 250 ) CB <> 550 FAD ( 600 ) AN1 D= 3.856 H-ene= -- (S-S) 265 220 CYS ( 250 ) CB <> 550 FAD ( 600 ) AC2 D= 4.476 H-ene= -- (S-S) 266 258 SER ( 288 ) C <> 550 FAD ( 600 ) AC5* D= 4.339 H-ene= -- (B-S) 267 258 SER ( 288 ) C <> 550 FAD ( 600 ) AO4* D= 4.480 H-ene= -- (B-S) 268 258 SER ( 288 ) O <> 550 FAD ( 600 ) AO5* D= 4.102 H-ene= -- (B-B) 269 258 SER ( 288 ) O <> 550 FAD ( 600 ) AC5* D= 3.401 H-ene= -- (B-S) 270 258 SER ( 288 ) O <> 550 FAD ( 600 ) AC4* D= 3.722 H-ene= -- (B-S) 271 258 SER ( 288 ) O <> 550 FAD ( 600 ) AO4* D= 3.759 H-ene= -- (B-S) 272 259 CYS ( 289 ) N <> 550 FAD ( 600 ) AO4* D= 4.405 H-ene= -- (B-S) 273 259 CYS ( 289 ) CA <> 550 FAD ( 600 ) AC5* D= 3.825 H-ene= -- (B-S) 274 259 CYS ( 289 ) CA <> 550 FAD ( 600 ) AC4* D= 4.162 H-ene= -- (B-S) 275 259 CYS ( 289 ) CA <> 550 FAD ( 600 ) AO4* D= 3.379 H-ene= -- (B-S) 276 259 CYS ( 289 ) CA <> 550 FAD ( 600 ) AC1* D= 4.561 H-ene= -- (B-S) 277 259 CYS ( 289 ) CA <> 550 FAD ( 600 ) AN9 D= 4.209 H-ene= -- (B-S) 278 259 CYS ( 289 ) CA <> 550 FAD ( 600 ) AC8 D= 4.264 H-ene= -- (B-S) 279 259 CYS ( 289 ) CA <> 550 FAD ( 600 ) AN7 D= 4.541 H-ene= -- (B-S) 280 259 CYS ( 289 ) CA <> 550 FAD ( 600 ) AC4 D= 4.500 H-ene= -- (B-S) 281 259 CYS ( 289 ) C <> 550 FAD ( 600 ) AC5* D= 3.306 H-ene= -- (B-S) 282 259 CYS ( 289 ) C <> 550 FAD ( 600 ) AC4* D= 4.123 H-ene= -- (B-S) 283 259 CYS ( 289 ) C <> 550 FAD ( 600 ) AO4* D= 3.650 H-ene= -- (B-S) 284 259 CYS ( 289 ) C <> 550 FAD ( 600 ) AN9 D= 4.570 H-ene= -- (B-S) 285 259 CYS ( 289 ) C <> 550 FAD ( 600 ) AC8 D= 4.320 H-ene= -- (B-S) 286 259 CYS ( 289 ) O <> 550 FAD ( 600 ) AC5* D= 3.081 H-ene= -- (B-S) 287 259 CYS ( 289 ) O <> 550 FAD ( 600 ) AC4* D= 3.845 H-ene= -- (B-S) 288 259 CYS ( 289 ) O <> 550 FAD ( 600 ) AO4* D= 3.350 H-ene= -- (B-S) 289 259 CYS ( 289 ) O <> 550 FAD ( 600 ) AN9 D= 3.990 H-ene= -- (B-S) 290 259 CYS ( 289 ) O <> 550 FAD ( 600 ) AC8 D= 3.520 H-ene= -- (B-S) 291 259 CYS ( 289 ) O <> 550 FAD ( 600 ) AN7 D= 4.130 H-ene= -- (B-S) 292 259 CYS ( 289 ) CB <> 550 FAD ( 600 ) AO4* D= 4.094 H-ene= -- (S-S) 293 259 CYS ( 289 ) CB <> 550 FAD ( 600 ) AN9 D= 4.134 H-ene= -- (S-S) 294 259 CYS ( 289 ) CB <> 550 FAD ( 600 ) AC8 D= 3.960 H-ene= -- (S-S) 295 259 CYS ( 289 ) CB <> 550 FAD ( 600 ) AN7 D= 3.781 H-ene= -- (S-S) 296 259 CYS ( 289 ) CB <> 550 FAD ( 600 ) AC5 D= 3.840 H-ene= -- (S-S) 297 259 CYS ( 289 ) CB <> 550 FAD ( 600 ) AC6 D= 4.361 H-ene= -- (S-S) 298 259 CYS ( 289 ) CB <> 550 FAD ( 600 ) AC4 D= 4.085 H-ene= -- (S-S) 299 260 GLY ( 290 ) N <> 550 FAD ( 600 ) AC5* D= 3.854 H-ene= -- (B-S) 300 260 GLY ( 290 ) CA <> 550 FAD ( 600 ) AO1 D= 4.592 H-ene= -- (B-B) 301 260 GLY ( 290 ) CA <> 550 FAD ( 600 ) AC5* D= 4.191 H-ene= -- (B-S) 302 260 GLY ( 290 ) CA <> 550 FAD ( 600 ) O3 D= 3.962 H-ene= -- (B-S) 303 260 GLY ( 290 ) CA <> 550 FAD ( 600 ) P D= 4.618 H-ene= -- (B-S) 304 260 GLY ( 290 ) CA <> 550 FAD ( 600 ) OP2 D= 3.915 H-ene= -- (B-S) 305 263 SER ( 293 ) CB <> 550 FAD ( 600 ) AN7 D= 4.086 H-ene= -- (S-S) 306 263 SER ( 293 ) OG <> 550 FAD ( 600 ) AN7 D= 3.954 H-ene= -- (S-S) 307 481 TYR ( 515 ) C <> 550 FAD ( 600 ) C9 D= 4.513 H-ene= -- (B-S) 308 481 TYR ( 515 ) O <> 550 FAD ( 600 ) C8 D= 3.978 H-ene= -- (B-S) 309 481 TYR ( 515 ) O <> 550 FAD ( 600 ) C9 D= 3.461 H-ene= -- (B-S) 310 481 TYR ( 515 ) O <> 550 FAD ( 600 ) C9A D= 3.986 H-ene= -- (B-S) 311 481 TYR ( 515 ) O <> 550 FAD ( 600 ) C1* D= 4.069 H-ene= -- (B-S) 312 481 TYR ( 515 ) CB <> 550 FAD ( 600 ) C7 D= 4.000 H-ene= -- (S-S) 313 481 TYR ( 515 ) CB <> 550 FAD ( 600 ) C7M D= 4.295 H-ene= -- (S-S) 314 481 TYR ( 515 ) CB <> 550 FAD ( 600 ) C8 D= 3.662 H-ene= -- (S-S) 315 481 TYR ( 515 ) CB <> 550 FAD ( 600 ) C8M D= 3.685 H-ene= -- (S-S) 316 481 TYR ( 515 ) CB <> 550 FAD ( 600 ) C9 D= 4.119 H-ene= -- (S-S) 317 481 TYR ( 515 ) CG <> 550 FAD ( 600 ) C7 D= 4.195 H-ene= -- (S-S) 318 481 TYR ( 515 ) CG <> 550 FAD ( 600 ) C7M D= 4.036 H-ene= -- (S-S) 319 481 TYR ( 515 ) CG <> 550 FAD ( 600 ) C8 D= 4.344 H-ene= -- (S-S) 320 481 TYR ( 515 ) CG <> 550 FAD ( 600 ) C8M D= 4.361 H-ene= -- (S-S) 321 481 TYR ( 515 ) CD2 <> 550 FAD ( 600 ) C6 D= 4.020 H-ene= -- (S-S) 322 481 TYR ( 515 ) CD2 <> 550 FAD ( 600 ) C7 D= 3.495 H-ene= -- (S-S) 323 481 TYR ( 515 ) CD2 <> 550 FAD ( 600 ) C7M D= 3.121 H-ene= -- (S-S) 324 481 TYR ( 515 ) CD2 <> 550 FAD ( 600 ) C8 D= 4.114 H-ene= -- (S-S) 325 481 TYR ( 515 ) CD2 <> 550 FAD ( 600 ) C8M D= 4.379 H-ene= -- (S-S) 326 481 TYR ( 515 ) CE2 <> 550 FAD ( 600 ) C7 D= 4.433 H-ene= -- (S-S) 327 481 TYR ( 515 ) CE2 <> 550 FAD ( 600 ) C7M D= 3.708 H-ene= -- (S-S) 328 482 HIS ( 516 ) CD2 <> 550 FAD ( 600 ) C4A D= 4.514 H-ene= -- (S-S) 329 482 HIS ( 516 ) CD2 <> 550 FAD ( 600 ) C5A D= 4.484 H-ene= -- (S-S) 330 482 HIS ( 516 ) CD2 <> 550 FAD ( 600 ) C9A D= 4.187 H-ene= -- (S-S) 331 482 HIS ( 516 ) CD2 <> 550 FAD ( 600 ) N10 D= 3.849 H-ene= -- (S-S) 332 482 HIS ( 516 ) CD2 <> 550 FAD ( 600 ) C10 D= 4.119 H-ene= -- (S-S) 333 482 HIS ( 516 ) CD2 <> 550 FAD ( 600 ) C1* D= 3.969 H-ene= -- (S-S) 334 482 HIS ( 516 ) CE1 <> 550 FAD ( 600 ) N1 D= 4.274 H-ene= -- (S-S) 335 482 HIS ( 516 ) CE1 <> 550 FAD ( 600 ) C2 D= 4.544 H-ene= -- (S-S) 336 482 HIS ( 516 ) CE1 <> 550 FAD ( 600 ) C10 D= 4.294 H-ene= -- (S-S) 337 482 HIS ( 516 ) CE1 <> 550 FAD ( 600 ) C1* D= 4.590 H-ene= -- (S-S) 338 482 HIS ( 516 ) NE2 <> 550 FAD ( 600 ) N1 D= 3.747 H-ene= -- (S-S) 339 482 HIS ( 516 ) NE2 <> 550 FAD ( 600 ) C2 D= 4.199 H-ene= -- (S-S) 340 482 HIS ( 516 ) NE2 <> 550 FAD ( 600 ) C4A D= 3.733 H-ene= -- (S-S) 341 482 HIS ( 516 ) NE2 <> 550 FAD ( 600 ) N5 D= 4.074 H-ene= -- (S-S) 342 482 HIS ( 516 ) NE2 <> 550 FAD ( 600 ) C5A D= 4.419 H-ene= -- (S-S) 343 482 HIS ( 516 ) NE2 <> 550 FAD ( 600 ) C9A D= 4.223 H-ene= -- (S-S) 344 482 HIS ( 516 ) NE2 <> 550 FAD ( 600 ) N10 D= 3.561 H-ene= -- (S-S) 345 482 HIS ( 516 ) NE2 <> 550 FAD ( 600 ) C10 D= 3.380 H-ene= -- (S-S) 346 482 HIS ( 516 ) NE2 <> 550 FAD ( 600 ) C1* D= 3.856 H-ene= -- (S-S) 347 514 ASP ( 548 ) CA <> 550 FAD ( 600 ) P D= 4.673 H-ene= -- (B-S) 348 514 ASP ( 548 ) CA <> 550 FAD ( 600 ) OP2 D= 3.929 H-ene= -- (B-S) 349 514 ASP ( 548 ) C <> 550 FAD ( 600 ) OP2 D= 4.034 H-ene= -- (B-S) 350 514 ASP ( 548 ) CB <> 550 FAD ( 600 ) P D= 3.889 H-ene= -- (S-S) 351 514 ASP ( 548 ) CB <> 550 FAD ( 600 ) OP1 D= 3.805 H-ene= -- (S-S) 352 514 ASP ( 548 ) CB <> 550 FAD ( 600 ) OP2 D= 3.174 H-ene= -- (S-S) 353 514 ASP ( 548 ) CG <> 550 FAD ( 600 ) OP2 D= 4.110 H-ene= -- (S-S) 354 515 GLY ( 549 ) N <> 550 FAD ( 600 ) P D= 4.392 H-ene= -- (B-S) 355 515 GLY ( 549 ) N <> 550 FAD ( 600 ) OP2 D= 3.154 H-ene= -- (B-S) 356 515 GLY ( 549 ) CA <> 550 FAD ( 600 ) OP2 D= 3.969 H-ene= -- (B-S) 357 525 HIS ( 559 ) CA <> 550 FAD ( 600 ) C2 D= 4.196 H-ene= -- (B-S) 358 525 HIS ( 559 ) CA <> 550 FAD ( 600 ) O2 D= 3.725 H-ene= -- (B-S) 359 525 HIS ( 559 ) C <> 550 FAD ( 600 ) C2 D= 4.238 H-ene= -- (B-S) 360 525 HIS ( 559 ) C <> 550 FAD ( 600 ) O2 D= 3.457 H-ene= -- (B-S) 361 525 HIS ( 559 ) CB <> 550 FAD ( 600 ) C2 D= 3.476 H-ene= -- (S-S) 362 525 HIS ( 559 ) CB <> 550 FAD ( 600 ) O2 D= 3.106 H-ene= -- (S-S) 363 525 HIS ( 559 ) CB <> 550 FAD ( 600 ) N3 D= 3.578 H-ene= -- (S-S) 364 525 HIS ( 559 ) CB <> 550 FAD ( 600 ) C4 D= 4.540 H-ene= -- (S-S) 365 525 HIS ( 559 ) CG <> 550 FAD ( 600 ) C2 D= 4.067 H-ene= -- (S-S) 366 525 HIS ( 559 ) CG <> 550 FAD ( 600 ) O2 D= 4.099 H-ene= -- (S-S) 367 525 HIS ( 559 ) CG <> 550 FAD ( 600 ) N3 D= 3.733 H-ene= -- (S-S) 368 525 HIS ( 559 ) CG <> 550 FAD ( 600 ) C4 D= 4.287 H-ene= -- (S-S) 369 525 HIS ( 559 ) ND1 <> 550 FAD ( 600 ) C2 D= 3.728 H-ene= -- (S-S) 370 525 HIS ( 559 ) ND1 <> 550 FAD ( 600 ) N3 D= 3.063 H-ene= -- (S-S) 371 525 HIS ( 559 ) ND1 <> 550 FAD ( 600 ) C4 D= 3.215 H-ene= -- (S-S) 372 525 HIS ( 559 ) ND1 <> 550 FAD ( 600 ) O4 D= 3.354 H-ene= -- (S-S) 373 525 HIS ( 559 ) ND1 <> 550 FAD ( 600 ) C4A D= 4.004 H-ene= -- (S-S) 374 525 HIS ( 559 ) CE1 <> 550 FAD ( 600 ) N3 D= 4.198 H-ene= -- (S-S) 375 525 HIS ( 559 ) CE1 <> 550 FAD ( 600 ) C4 D= 4.036 H-ene= -- (S-S) 376 525 HIS ( 559 ) CE1 <> 550 FAD ( 600 ) O4 D= 3.841 H-ene= -- (S-S) 377 526 VAL ( 560 ) N <> 550 FAD ( 600 ) N1 D= 4.353 H-ene= -- (B-S) 378 526 VAL ( 560 ) N <> 550 FAD ( 600 ) C2 D= 4.088 H-ene= -- (B-S) 379 526 VAL ( 560 ) N <> 550 FAD ( 600 ) O2 D= 3.447 H-ene= -- (B-S) 380 526 VAL ( 560 ) C <> 550 FAD ( 600 ) O2 D= 4.063 H-ene= -- (B-S) 381 526 VAL ( 560 ) CG2 <> 550 FAD ( 600 ) N1 D= 3.990 H-ene= -- (S-S) 382 526 VAL ( 560 ) CG2 <> 550 FAD ( 600 ) C1* D= 3.879 H-ene= -- (S-S) 383 526 VAL ( 560 ) CG2 <> 550 FAD ( 600 ) C2* D= 4.023 H-ene= -- (S-S) 384 526 VAL ( 560 ) CG2 <> 550 FAD ( 600 ) C3* D= 4.189 H-ene= -- (S-S) 385 526 VAL ( 560 ) CG2 <> 550 FAD ( 600 ) O3* D= 3.129 H-ene= -- (S-S) 386 527 MET ( 561 ) N <> 550 FAD ( 600 ) N1 D= 4.162 H-ene= -- (B-S) 387 527 MET ( 561 ) N <> 550 FAD ( 600 ) C2 D= 4.006 H-ene= -- (B-S) 388 527 MET ( 561 ) N <> 550 FAD ( 600 ) O2 D= 3.044 H-ene= -- (B-S) 389 527 MET ( 561 ) CA <> 550 FAD ( 600 ) O2 D= 3.699 H-ene= -- (B-S) 390 527 MET ( 561 ) CB <> 550 FAD ( 600 ) N1 D= 4.391 H-ene= -- (S-S) 391 527 MET ( 561 ) CB <> 550 FAD ( 600 ) C2 D= 4.053 H-ene= -- (S-S) 392 527 MET ( 561 ) CB <> 550 FAD ( 600 ) O2 D= 3.175 H-ene= -- (S-S) 393 527 MET ( 561 ) CG <> 550 FAD ( 600 ) N1 D= 3.647 H-ene= -- (S-S) 394 527 MET ( 561 ) CG <> 550 FAD ( 600 ) C2 D= 3.658 H-ene= -- (S-S) 395 527 MET ( 561 ) CG <> 550 FAD ( 600 ) O2 D= 3.210 H-ene= -- (S-S) 396 527 MET ( 561 ) CG <> 550 FAD ( 600 ) C2* D= 4.284 H-ene= -- (S-S) 397 527 MET ( 561 ) SD <> 550 FAD ( 600 ) N1 D= 4.599 H-ene= -- (S-S) 398 527 MET ( 561 ) SD <> 550 FAD ( 600 ) C2 D= 4.495 H-ene= -- (S-S) 399 527 MET ( 561 ) SD <> 550 FAD ( 600 ) O2 D= 4.282 H-ene= -- (S-S) 400 527 MET ( 561 ) CE <> 550 FAD ( 600 ) N1 D= 4.423 H-ene= -- (S-S) 401 527 MET ( 561 ) CE <> 550 FAD ( 600 ) C2 D= 3.865 H-ene= -- (S-S) 402 527 MET ( 561 ) CE <> 550 FAD ( 600 ) O2 D= 3.706 H-ene= -- (S-S) 403 527 MET ( 561 ) CE <> 550 FAD ( 600 ) N3 D= 3.842 H-ene= -- (S-S) 404 530 PHE ( 564 ) CD2 <> 550 FAD ( 600 ) C3* D= 4.557 H-ene= -- (S-S) 405 530 PHE ( 564 ) CD2 <> 550 FAD ( 600 ) O3* D= 3.874 H-ene= -- (S-S) 406 530 PHE ( 564 ) CD2 <> 550 FAD ( 600 ) C4* D= 4.069 H-ene= -- (S-S) 407 530 PHE ( 564 ) CD2 <> 550 FAD ( 600 ) C5* D= 3.804 H-ene= -- (S-S) 408 530 PHE ( 564 ) CD2 <> 550 FAD ( 600 ) O5* D= 3.984 H-ene= -- (S-S) 409 530 PHE ( 564 ) CE2 <> 550 FAD ( 600 ) C3* D= 4.504 H-ene= -- (S-S) 410 530 PHE ( 564 ) CE2 <> 550 FAD ( 600 ) O3* D= 3.525 H-ene= -- (S-S) 411 530 PHE ( 564 ) CE2 <> 550 FAD ( 600 ) C4* D= 4.347 H-ene= -- (S-S) 412 530 PHE ( 564 ) CE2 <> 550 FAD ( 600 ) C5* D= 3.825 H-ene= -- (S-S) Numbering in the model: Res. # : 1 MET ( 14 ) Set-name:x Res. # : 2 ALA ( 15 ) Set-name:x Res. # : 3 ILE ( 16 ) Set-name:x Res. # : 4 PRO ( 17 ) Set-name:x Res. # : 5 ASP ( 18 ) Set-name:x Res. # : 6 GLU ( 19 ) Set-name:x Res. # : 7 PHE ( 20 ) Set-name:x Res. # : 8 ASP ( 21 ) Set-name:x Res. # : 9 ILE ( 22 ) Set-name:x Res. # : 10 ILE ( 23 ) Set-name:x Res. # : 11 VAL ( 24 ) Set-name:x Res. # : 12 VAL ( 25 ) Set-name:x Res. # : 13 GLY ( 26 ) Set-name:x Res. # : 14 GLY ( 27 ) Set-name:x Res. # : 15 GLY ( 28 ) Set-name:x Res. # : 16 SER ( 29 ) Set-name:x Res. # : 17 THR ( 30 ) Set-name:x Res. # : 18 GLY ( 31 ) Set-name:x Res. # : 19 CYS ( 32 ) Set-name:x Res. # : 20 CYS ( 33 ) Set-name:x Res. # : 21 ILE ( 34 ) Set-name:x Res. # : 22 ALA ( 35 ) Set-name:x Res. # : 23 GLY ( 36 ) Set-name:x Res. # : 24 ARG ( 37 ) Set-name:x Res. # : 25 LEU ( 38 ) Set-name:x Res. # : 26 ALA ( 39 ) Set-name:x Res. # : 27 ASP ( 40 ) Set-name:x Res. # : 28 ASP ( 41 ) Set-name:x Res. # : 29 GLN ( 42 ) Set-name:x Res. # : 30 ASN ( 43 ) Set-name:x Res. # : 31 LEU ( 44 ) Set-name:x Res. # : 32 THR ( 45 ) Set-name:x Res. # : 33 VAL ( 46 ) Set-name:x Res. # : 34 ALA ( 47 ) Set-name:x Res. # : 35 LEU ( 48 ) Set-name:x Res. # : 36 ILE ( 49 ) Set-name:x Res. # : 37 GLU ( 50 ) Set-name:x Res. # : 38 GLY ( 51 ) Set-name:x Res. # : 39 GLY ( 52 ) Set-name:x Res. # : 40 GLU ( 53 ) Set-name:x Res. # : 41 ASN ( 54 ) Set-name:x Res. # : 42 ASN ( 55 ) Set-name:x Res. # : 43 ILE ( 56 ) Set-name:x Res. # : 44 ASN ( 58 ) Set-name:x Res. # : 45 ASN ( 59 ) Set-name:x Res. # : 46 PRO ( 60 ) Set-name:x Res. # : 47 TRP ( 61 ) Set-name:x Res. # : 48 VAL ( 62 ) Set-name:x Res. # : 49 TYR ( 63 ) Set-name:x Res. # : 50 LEU ( 64 ) Set-name:x Res. # : 51 PRO ( 65 ) Set-name:x Res. # : 52 GLY ( 66 ) Set-name:x Res. # : 53 VAL ( 67 ) Set-name:x Res. # : 54 TYR ( 68 ) Set-name:x Res. # : 55 ASN ( 69 ) Set-name:x Res. # : 56 MET ( 70 ) Set-name:x Res. # : 57 ARG ( 71 ) Set-name:x Res. # : 58 LEU ( 72 ) Set-name:x Res. # : 59 ASP ( 73 ) Set-name:x Res. # : 60 SER ( 74 ) Set-name:x Res. # : 61 LYS ( 75 ) Set-name:x Res. # : 62 THR ( 76 ) Set-name:x Res. # : 63 ALA ( 77 ) Set-name:x Res. # : 64 THR ( 78 ) Set-name:x Res. # : 65 PHE ( 79 ) Set-name:x Res. # : 66 TYR ( 80 ) Set-name:x Res. # : 67 SER ( 81 ) Set-name:x Res. # : 68 SER ( 82 ) Set-name:x Res. # : 69 PRO ( 83 ) Set-name:x Res. # : 70 SER ( 84 ) Set-name:x Res. # : 71 LYS ( 85 ) Set-name:x Res. # : 72 ALA ( 86 ) Set-name:x Res. # : 73 LEU ( 87 ) Set-name:x Res. # : 74 ASN ( 88 ) Set-name:x Res. # : 75 GLY ( 89 ) Set-name:x Res. # : 76 ARG ( 90 ) Set-name:x Res. # : 77 ARG ( 91 ) Set-name:x Res. # : 78 ALA ( 92 ) Set-name:x Res. # : 79 ILE ( 93 ) Set-name:x Res. # : 80 VAL ( 94 ) Set-name:x Res. # : 81 PRO ( 95 ) Set-name:x Res. # : 82 CYS ( 96 ) Set-name:x Res. # : 83 ALA ( 97 ) Set-name:x Res. # : 84 ASN ( 98 ) Set-name:x Res. # : 85 ILE ( 99 ) Set-name:x Res. # : 86 LEU ( 100 ) Set-name:x Res. # : 87 GLY ( 101 ) Set-name:x Res. # : 88 GLY ( 102 ) Set-name:x Res. # : 89 GLY ( 103 ) Set-name:x Res. # : 90 SER ( 104 ) Set-name:x Res. # : 91 SER ( 105 ) Set-name:x Res. # : 92 ILE ( 106 ) Set-name:x Res. # : 93 ASN ( 107 ) Set-name:x Res. # : 94 PHE ( 108 ) Set-name:x Res. # : 95 LEU ( 109 ) Set-name:x Res. # : 96 MET ( 110 ) Set-name:x Res. # : 97 TYR ( 111 ) Set-name:x Res. # : 98 THR ( 112 ) Set-name:x Res. # : 99 ARG ( 113 ) Set-name:x Res. # : 100 ALA ( 114 ) Set-name:x Res. # : 101 SER ( 115 ) Set-name:x Res. # : 102 ALA ( 116 ) Set-name:x Res. # : 103 SER ( 117 ) Set-name:x Res. # : 104 ASP ( 118 ) Set-name:x Res. # : 105 TYR ( 119 ) Set-name:x Res. # : 106 ASP ( 120 ) Set-name:x Res. # : 107 ASP ( 121 ) Set-name:x Res. # : 108 TRP ( 122 ) Set-name:x Res. # : 109 GLU ( 123 ) Set-name:x Res. # : 110 SER ( 128 ) Set-name:x Res. # : 111 GLU ( 129 ) Set-name:x Res. # : 112 GLY ( 130 ) Set-name:x Res. # : 113 TRP ( 131 ) Set-name:x Res. # : 114 SER ( 132 ) Set-name:x Res. # : 115 THR ( 133 ) Set-name:x Res. # : 116 ASP ( 134 ) Set-name:x Res. # : 117 GLU ( 135 ) Set-name:x Res. # : 118 LEU ( 136 ) Set-name:x Res. # : 119 LEU ( 137 ) Set-name:x Res. # : 120 PRO ( 138 ) Set-name:x Res. # : 121 LEU ( 139 ) Set-name:x Res. # : 122 ILE ( 140 ) Set-name:x Res. # : 123 LYS ( 141 ) Set-name:x Res. # : 124 LYS ( 142 ) Set-name:x Res. # : 125 ILE ( 143 ) Set-name:x Res. # : 126 GLU ( 144 ) Set-name:x Res. # : 127 THR ( 145 ) Set-name:x Res. # : 128 TYR ( 146 ) Set-name:x Res. # : 129 GLN ( 147 ) Set-name:x Res. # : 130 ARG ( 148 ) Set-name:x Res. # : 131 PRO ( 149 ) Set-name:x Res. # : 132 CYS ( 159 ) Set-name:x Res. # : 133 ASN ( 160 ) Set-name:x Res. # : 134 ASN ( 161 ) Set-name:x Res. # : 135 ARG ( 162 ) Set-name:x Res. # : 136 ASP ( 163 ) Set-name:x Res. # : 137 LEU ( 164 ) Set-name:x Res. # : 138 HIS ( 165 ) Set-name:x Res. # : 139 GLY ( 166 ) Set-name:x Res. # : 140 PHE ( 167 ) Set-name:x Res. # : 141 ASP ( 168 ) Set-name:x Res. # : 142 GLY ( 169 ) Set-name:x Res. # : 143 PRO ( 170 ) Set-name:x Res. # : 144 ILE ( 171 ) Set-name:x Res. # : 145 LYS ( 172 ) Set-name:x Res. # : 146 VAL ( 173 ) Set-name:x Res. # : 147 SER ( 174 ) Set-name:x Res. # : 148 PHE ( 175 ) Set-name:x Res. # : 149 GLY ( 176 ) Set-name:x Res. # : 150 ASN ( 177 ) Set-name:x Res. # : 151 TYR ( 178 ) Set-name:x Res. # : 152 THR ( 182 ) Set-name:x Res. # : 153 TYR ( 183 ) Set-name:x Res. # : 154 PRO ( 184 ) Set-name:x Res. # : 155 THR ( 185 ) Set-name:x Res. # : 156 CYS ( 186 ) Set-name:x Res. # : 157 GLN ( 187 ) Set-name:x Res. # : 158 ASP ( 188 ) Set-name:x Res. # : 159 PHE ( 189 ) Set-name:x Res. # : 160 LEU ( 190 ) Set-name:x Res. # : 161 ARG ( 191 ) Set-name:x Res. # : 162 ALA ( 192 ) Set-name:x Res. # : 163 ALA ( 193 ) Set-name:x Res. # : 164 GLU ( 194 ) Set-name:x Res. # : 165 SER ( 195 ) Set-name:x Res. # : 166 GLN ( 196 ) Set-name:x Res. # : 167 GLY ( 197 ) Set-name:x Res. # : 168 ILE ( 198 ) Set-name:x Res. # : 169 PRO ( 199 ) Set-name:x Res. # : 170 VAL ( 200 ) Set-name:x Res. # : 171 VAL ( 201 ) Set-name:x Res. # : 172 ASP ( 202 ) Set-name:x Res. # : 173 ASP ( 203 ) Set-name:x Res. # : 174 LEU ( 204 ) Set-name:x Res. # : 175 ASP ( 205 ) Set-name:x Res. # : 176 PHE ( 206 ) Set-name:x Res. # : 177 LYS ( 207 ) Set-name:x Res. # : 178 THR ( 208 ) Set-name:x Res. # : 179 SER ( 209 ) Set-name:x Res. # : 180 HIS ( 210 ) Set-name:x Res. # : 181 GLY ( 211 ) Set-name:x Res. # : 182 ALA ( 212 ) Set-name:x Res. # : 183 GLU ( 213 ) Set-name:x Res. # : 184 HIS ( 214 ) Set-name:x Res. # : 185 TRP ( 215 ) Set-name:x Res. # : 186 LEU ( 216 ) Set-name:x Res. # : 187 LYS ( 217 ) Set-name:x Res. # : 188 TRP ( 218 ) Set-name:x Res. # : 189 ILE ( 219 ) Set-name:x Res. # : 190 ASN ( 220 ) Set-name:x Res. # : 191 ARG ( 221 ) Set-name:x Res. # : 192 ASP ( 222 ) Set-name:x Res. # : 193 LEU ( 223 ) Set-name:x Res. # : 194 GLY ( 224 ) Set-name:x Res. # : 195 ARG ( 225 ) Set-name:x Res. # : 196 SER ( 226 ) Set-name:x Res. # : 197 ASP ( 227 ) Set-name:x Res. # : 198 SER ( 228 ) Set-name:x Res. # : 199 ALA ( 229 ) Set-name:x Res. # : 200 HIS ( 230 ) Set-name:x Res. # : 201 ALA ( 231 ) Set-name:x Res. # : 202 TYR ( 232 ) Set-name:x Res. # : 203 VAL ( 233 ) Set-name:x Res. # : 204 HIS ( 234 ) Set-name:x Res. # : 205 PRO ( 235 ) Set-name:x Res. # : 206 THR ( 236 ) Set-name:x Res. # : 207 MET ( 237 ) Set-name:x Res. # : 208 ARG ( 238 ) Set-name:x Res. # : 209 LYS ( 239 ) Set-name:x Res. # : 210 GLN ( 240 ) Set-name:x Res. # : 211 SER ( 241 ) Set-name:x Res. # : 212 LEU ( 242 ) Set-name:x Res. # : 213 PHE ( 243 ) Set-name:x Res. # : 214 LEU ( 244 ) Set-name:x Res. # : 215 ILE ( 245 ) Set-name:x Res. # : 216 THR ( 246 ) Set-name:x Res. # : 217 SER ( 247 ) Set-name:x Res. # : 218 THR ( 248 ) Set-name:x Res. # : 219 LYS ( 249 ) Set-name:x Res. # : 220 CYS ( 250 ) Set-name:x Res. # : 221 ASP ( 251 ) Set-name:x Res. # : 222 LYS ( 252 ) Set-name:x Res. # : 223 VAL ( 253 ) Set-name:x Res. # : 224 ILE ( 254 ) Set-name:x Res. # : 225 ILE ( 255 ) Set-name:x Res. # : 226 GLU ( 256 ) Set-name:x Res. # : 227 ASP ( 257 ) Set-name:x Res. # : 228 GLY ( 258 ) Set-name:x Res. # : 229 ALA ( 259 ) Set-name:x Res. # : 230 VAL ( 260 ) Set-name:x Res. # : 231 ALA ( 261 ) Set-name:x Res. # : 232 VAL ( 262 ) Set-name:x Res. # : 233 ARG ( 263 ) Set-name:x Res. # : 234 THR ( 264 ) Set-name:x Res. # : 235 VAL ( 265 ) Set-name:x Res. # : 236 PRO ( 266 ) Set-name:x Res. # : 237 MET ( 267 ) Set-name:x Res. # : 238 LYS ( 268 ) Set-name:x Res. # : 239 LEU ( 269 ) Set-name:x Res. # : 240 ASN ( 270 ) Set-name:x Res. # : 241 PRO ( 271 ) Set-name:x Res. # : 242 LYS ( 272 ) Set-name:x Res. # : 243 LYS ( 273 ) Set-name:x Res. # : 244 PRO ( 274 ) Set-name:x Res. # : 245 VAL ( 275 ) Set-name:x Res. # : 246 SER ( 276 ) Set-name:x Res. # : 247 ARG ( 277 ) Set-name:x Res. # : 248 THR ( 278 ) Set-name:x Res. # : 249 PHE ( 279 ) Set-name:x Res. # : 250 ARG ( 280 ) Set-name:x Res. # : 251 ALA ( 281 ) Set-name:x Res. # : 252 ARG ( 282 ) Set-name:x Res. # : 253 LYS ( 283 ) Set-name:x Res. # : 254 GLN ( 284 ) Set-name:x Res. # : 255 ILE ( 285 ) Set-name:x Res. # : 256 VAL ( 286 ) Set-name:x Res. # : 257 ILE ( 287 ) Set-name:x Res. # : 258 SER ( 288 ) Set-name:x Res. # : 259 CYS ( 289 ) Set-name:x Res. # : 260 GLY ( 290 ) Set-name:x Res. # : 261 THR ( 291 ) Set-name:x Res. # : 262 ILE ( 292 ) Set-name:x Res. # : 263 SER ( 293 ) Set-name:x Res. # : 264 SER ( 294 ) Set-name:x Res. # : 265 PRO ( 295 ) Set-name:x Res. # : 266 LEU ( 296 ) Set-name:x Res. # : 267 VAL ( 297 ) Set-name:x Res. # : 268 LEU ( 298 ) Set-name:x Res. # : 269 GLN ( 299 ) Set-name:x Res. # : 270 ARG ( 300 ) Set-name:x Res. # : 271 SER ( 301 ) Set-name:x Res. # : 272 GLY ( 302 ) Set-name:x Res. # : 273 ILE ( 303 ) Set-name:x Res. # : 274 GLY ( 304 ) Set-name:x Res. # : 275 ALA ( 305 ) Set-name:x Res. # : 276 ALA ( 306 ) Set-name:x Res. # : 277 HIS ( 307 ) Set-name:x Res. # : 278 HIS ( 308 ) Set-name:x Res. # : 279 LEU ( 309 ) Set-name:x Res. # : 280 ARG ( 310 ) Set-name:x Res. # : 281 SER ( 311 ) Set-name:x Res. # : 282 VAL ( 312 ) Set-name:x Res. # : 283 GLY ( 313 ) Set-name:x Res. # : 284 VAL ( 314 ) Set-name:x Res. # : 285 LYS ( 315 ) Set-name:x Res. # : 286 PRO ( 316 ) Set-name:x Res. # : 287 ILE ( 317 ) Set-name:x Res. # : 288 VAL ( 318 ) Set-name:x Res. # : 289 ASP ( 319 ) Set-name:x Res. # : 290 LEU ( 320 ) Set-name:x Res. # : 291 PRO ( 321 ) Set-name:x Res. # : 292 VAL ( 322 ) Set-name:x Res. # : 293 GLY ( 323 ) Set-name:x Res. # : 294 GLU ( 324 ) Set-name:x Res. # : 295 ASN ( 325 ) Set-name:x Res. # : 296 PHE ( 326 ) Set-name:x Res. # : 297 GLN ( 327 ) Set-name:x Res. # : 298 ASP ( 328 ) Set-name:x Res. # : 299 HIS ( 329 ) Set-name:x Res. # : 300 THR ( 330 ) Set-name:x Res. # : 301 PRO ( 331 ) Set-name:x Res. # : 302 TYR ( 332 ) Set-name:x Res. # : 303 TYR ( 333 ) Set-name:x Res. # : 304 VAL ( 334 ) Set-name:x Res. # : 305 LYS ( 335 ) Set-name:x Res. # : 306 PRO ( 336 ) Set-name:x Res. # : 307 ASP ( 337 ) Set-name:x Res. # : 308 VAL ( 338 ) Set-name:x Res. # : 309 THR ( 339 ) Set-name:x Res. # : 310 PHE ( 340 ) Set-name:x Res. # : 311 ASP ( 341 ) Set-name:x Res. # : 312 ASP ( 342 ) Set-name:x Res. # : 313 PHE ( 343 ) Set-name:x Res. # : 314 VAL ( 344 ) Set-name:x Res. # : 315 ARG ( 345 ) Set-name:x Res. # : 316 GLY ( 346 ) Set-name:x Res. # : 317 ASP ( 347 ) Set-name:x Res. # : 318 VAL ( 348 ) Set-name:x Res. # : 319 ALA ( 349 ) Set-name:x Res. # : 320 GLN ( 350 ) Set-name:x Res. # : 321 LYS ( 351 ) Set-name:x Res. # : 322 ALA ( 352 ) Set-name:x Res. # : 323 ALA ( 353 ) Set-name:x Res. # : 324 PHE ( 354 ) Set-name:x Res. # : 325 ASP ( 355 ) Set-name:x Res. # : 326 GLN ( 356 ) Set-name:x Res. # : 327 TRP ( 357 ) Set-name:x Res. # : 328 TYR ( 358 ) Set-name:x Res. # : 329 SER ( 362 ) Set-name:x Res. # : 330 ASN ( 363 ) Set-name:x Res. # : 331 LYS ( 364 ) Set-name:x Res. # : 332 ASP ( 365 ) Set-name:x Res. # : 333 GLY ( 366 ) Set-name:x Res. # : 334 PRO ( 367 ) Set-name:x Res. # : 335 LEU ( 368 ) Set-name:x Res. # : 336 THR ( 369 ) Set-name:x Res. # : 337 THR ( 370 ) Set-name:x Res. # : 338 ASN ( 371 ) Set-name:x Res. # : 339 GLY ( 372 ) Set-name:x Res. # : 340 ILE ( 373 ) Set-name:x Res. # : 341 GLU ( 374 ) Set-name:x Res. # : 342 ALA ( 375 ) Set-name:x Res. # : 343 GLY ( 376 ) Set-name:x Res. # : 344 VAL ( 377 ) Set-name:x Res. # : 345 GLU ( 378 ) Set-name:x Res. # : 346 GLU ( 379 ) Set-name:x Res. # : 347 GLU ( 380 ) Set-name:x Res. # : 348 LEU ( 381 ) Set-name:x Res. # : 349 ALA ( 382 ) Set-name:x Res. # : 350 THR ( 383 ) Set-name:x Res. # : 351 ALA ( 384 ) Set-name:x Res. # : 352 ASP ( 385 ) Set-name:x Res. # : 353 GLU ( 386 ) Set-name:x Res. # : 354 ASP ( 387 ) Set-name:x Res. # : 355 PHE ( 388 ) Set-name:x Res. # : 356 ARG ( 389 ) Set-name:x Res. # : 357 ARG ( 390 ) Set-name:x Res. # : 358 GLY ( 391 ) Set-name:x Res. # : 359 TYR ( 392 ) Set-name:x Res. # : 360 ALA ( 393 ) Set-name:x Res. # : 361 GLU ( 394 ) Set-name:x Res. # : 362 TYR ( 395 ) Set-name:x Res. # : 363 PHE ( 396 ) Set-name:x Res. # : 364 GLU ( 397 ) Set-name:x Res. # : 365 ASN ( 398 ) Set-name:x Res. # : 366 LYS ( 399 ) Set-name:x Res. # : 367 PRO ( 400 ) Set-name:x Res. # : 368 ASP ( 401 ) Set-name:x Res. # : 369 LYS ( 402 ) Set-name:x Res. # : 370 PRO ( 403 ) Set-name:x Res. # : 371 LEU ( 404 ) Set-name:x Res. # : 372 MET ( 405 ) Set-name:x Res. # : 373 HIS ( 406 ) Set-name:x Res. # : 374 TYR ( 407 ) Set-name:x Res. # : 375 SER ( 408 ) Set-name:x Res. # : 376 VAL ( 409 ) Set-name:x Res. # : 377 ILE ( 410 ) Set-name:x Res. # : 378 SER ( 411 ) Set-name:x Res. # : 379 GLY ( 412 ) Set-name:x Res. # : 380 PHE ( 413 ) Set-name:x Res. # : 381 PHE ( 414 ) Set-name:x Res. # : 382 GLY ( 415 ) Set-name:x Res. # : 383 ASP ( 416 ) Set-name:x Res. # : 384 HIS ( 417 ) Set-name:x Res. # : 385 THR ( 418 ) Set-name:x Res. # : 386 LYS ( 419 ) Set-name:x Res. # : 387 ILE ( 420 ) Set-name:x Res. # : 388 PRO ( 421 ) Set-name:x Res. # : 389 ASN ( 422 ) Set-name:x Res. # : 390 MET ( 423 ) Set-name:x Res. # : 391 THR ( 424 ) Set-name:x Res. # : 392 MET ( 425 ) Set-name:x Res. # : 393 PHE ( 426 ) Set-name:x Res. # : 394 HIS ( 427 ) Set-name:x Res. # : 395 PHE ( 428 ) Set-name:x Res. # : 396 LEU ( 429 ) Set-name:x Res. # : 397 PRO ( 430 ) Set-name:x Res. # : 398 PHE ( 431 ) Set-name:x Res. # : 399 SER ( 432 ) Set-name:x Res. # : 400 ARG ( 433 ) Set-name:x Res. # : 401 GLY ( 434 ) Set-name:x Res. # : 402 PHE ( 435 ) Set-name:x Res. # : 403 VAL ( 436 ) Set-name:x Res. # : 404 ARG ( 437 ) Set-name:x Res. # : 405 ILE ( 438 ) Set-name:x Res. # : 406 THR ( 439 ) Set-name:x Res. # : 407 SER ( 440 ) Set-name:x Res. # : 408 ALA ( 441 ) Set-name:x Res. # : 409 ASN ( 442 ) Set-name:x Res. # : 410 PRO ( 443 ) Set-name:x Res. # : 411 TYR ( 444 ) Set-name:x Res. # : 412 ASP ( 446 ) Set-name:x Res. # : 413 ALA ( 447 ) Set-name:x Res. # : 414 PRO ( 448 ) Set-name:x Res. # : 415 ASP ( 449 ) Set-name:x Res. # : 416 PHE ( 450 ) Set-name:x Res. # : 417 ASP ( 451 ) Set-name:x Res. # : 418 PRO ( 452 ) Set-name:x Res. # : 419 GLY ( 453 ) Set-name:x Res. # : 420 PHE ( 454 ) Set-name:x Res. # : 421 LEU ( 455 ) Set-name:x Res. # : 422 ASN ( 456 ) Set-name:x Res. # : 423 ASP ( 457 ) Set-name:x Res. # : 424 GLU ( 458 ) Set-name:x Res. # : 425 ARG ( 459 ) Set-name:x Res. # : 426 ASP ( 460 ) Set-name:x Res. # : 427 LEU ( 461 ) Set-name:x Res. # : 428 TRP ( 462 ) Set-name:x Res. # : 429 PRO ( 463 ) Set-name:x Res. # : 430 MET ( 464 ) Set-name:x Res. # : 431 VAL ( 465 ) Set-name:x Res. # : 432 TRP ( 466 ) Set-name:x Res. # : 433 ALA ( 467 ) Set-name:x Res. # : 434 TYR ( 468 ) Set-name:x Res. # : 435 LYS ( 469 ) Set-name:x Res. # : 436 LYS ( 470 ) Set-name:x Res. # : 437 SER ( 471 ) Set-name:x Res. # : 438 ARG ( 472 ) Set-name:x Res. # : 439 GLU ( 473 ) Set-name:x Res. # : 440 ILE ( 474 ) Set-name:x Res. # : 441 SER ( 475 ) Set-name:x Res. # : 442 ASN ( 476 ) Set-name:x Res. # : 443 SER ( 477 ) Set-name:x Res. # : 444 GLY ( 478 ) Set-name:x Res. # : 445 ALA ( 479 ) Set-name:x Res. # : 446 MET ( 480 ) Set-name:x Res. # : 447 GLN ( 481 ) Set-name:x Res. # : 448 THR ( 482 ) Set-name:x Res. # : 449 TYR ( 483 ) Set-name:x Res. # : 450 PHE ( 484 ) Set-name:x Res. # : 451 ALA ( 485 ) Set-name:x Res. # : 452 GLY ( 486 ) Set-name:x Res. # : 453 GLU ( 487 ) Set-name:x Res. # : 454 THR ( 488 ) Set-name:x Res. # : 455 ILE ( 489 ) Set-name:x Res. # : 456 PRO ( 490 ) Set-name:x Res. # : 457 GLY ( 491 ) Set-name:x Res. # : 458 ASP ( 492 ) Set-name:x Res. # : 459 ASN ( 493 ) Set-name:x Res. # : 460 LEU ( 494 ) Set-name:x Res. # : 461 ALA ( 495 ) Set-name:x Res. # : 462 TYR ( 496 ) Set-name:x Res. # : 463 ASP ( 497 ) Set-name:x Res. # : 464 ALA ( 498 ) Set-name:x Res. # : 465 ASP ( 499 ) Set-name:x Res. # : 466 LEU ( 500 ) Set-name:x Res. # : 467 SER ( 501 ) Set-name:x Res. # : 468 ALA ( 502 ) Set-name:x Res. # : 469 TRP ( 503 ) Set-name:x Res. # : 470 THR ( 504 ) Set-name:x Res. # : 471 GLU ( 505 ) Set-name:x Res. # : 472 TYR ( 506 ) Set-name:x Res. # : 473 ILE ( 507 ) Set-name:x Res. # : 474 PRO ( 508 ) Set-name:x Res. # : 475 TYR ( 509 ) Set-name:x Res. # : 476 HIS ( 510 ) Set-name:x Res. # : 477 PHE ( 511 ) Set-name:x Res. # : 478 ARG ( 512 ) Set-name:x Res. # : 479 PRO ( 513 ) Set-name:x Res. # : 480 ASN ( 514 ) Set-name:x Res. # : 481 TYR ( 515 ) Set-name:x Res. # : 482 HIS ( 516 ) Set-name:x Res. # : 483 GLY ( 517 ) Set-name:x Res. # : 484 VAL ( 518 ) Set-name:x Res. # : 485 GLY ( 519 ) Set-name:x Res. # : 486 THR ( 520 ) Set-name:x Res. # : 487 CYS ( 521 ) Set-name:x Res. # : 488 SER ( 522 ) Set-name:x Res. # : 489 MET ( 523 ) Set-name:x Res. # : 490 MET ( 524 ) Set-name:x Res. # : 491 PRO ( 525 ) Set-name:x Res. # : 492 LYS ( 526 ) Set-name:x Res. # : 493 GLU ( 527 ) Set-name:x Res. # : 494 MET ( 528 ) Set-name:x Res. # : 495 GLY ( 529 ) Set-name:x Res. # : 496 GLY ( 530 ) Set-name:x Res. # : 497 VAL ( 531 ) Set-name:x Res. # : 498 VAL ( 532 ) Set-name:x Res. # : 499 ASP ( 533 ) Set-name:x Res. # : 500 ASN ( 534 ) Set-name:x Res. # : 501 ALA ( 535 ) Set-name:x Res. # : 502 ALA ( 536 ) Set-name:x Res. # : 503 ARG ( 537 ) Set-name:x Res. # : 504 VAL ( 538 ) Set-name:x Res. # : 505 TYR ( 539 ) Set-name:x Res. # : 506 GLY ( 540 ) Set-name:x Res. # : 507 VAL ( 541 ) Set-name:x Res. # : 508 GLN ( 542 ) Set-name:x Res. # : 509 GLY ( 543 ) Set-name:x Res. # : 510 LEU ( 544 ) Set-name:x Res. # : 511 ARG ( 545 ) Set-name:x Res. # : 512 VAL ( 546 ) Set-name:x Res. # : 513 ILE ( 547 ) Set-name:x Res. # : 514 ASP ( 548 ) Set-name:x Res. # : 515 GLY ( 549 ) Set-name:x Res. # : 516 SER ( 550 ) Set-name:x Res. # : 517 ILE ( 551 ) Set-name:x Res. # : 518 PRO ( 552 ) Set-name:x Res. # : 519 PRO ( 553 ) Set-name:x Res. # : 520 THR ( 554 ) Set-name:x Res. # : 521 GLN ( 555 ) Set-name:x Res. # : 522 MET ( 556 ) Set-name:x Res. # : 523 SER ( 557 ) Set-name:x Res. # : 524 SER ( 558 ) Set-name:x Res. # : 525 HIS ( 559 ) Set-name:x Res. # : 526 VAL ( 560 ) Set-name:x Res. # : 527 MET ( 561 ) Set-name:x Res. # : 528 THR ( 562 ) Set-name:x Res. # : 529 VAL ( 563 ) Set-name:x Res. # : 530 PHE ( 564 ) Set-name:x Res. # : 531 TYR ( 565 ) Set-name:x Res. # : 532 ALA ( 566 ) Set-name:x Res. # : 533 MET ( 567 ) Set-name:x Res. # : 534 ALA ( 568 ) Set-name:x Res. # : 535 LEU ( 569 ) Set-name:x Res. # : 536 LYS ( 570 ) Set-name:x Res. # : 537 ILE ( 571 ) Set-name:x Res. # : 538 SER ( 572 ) Set-name:x Res. # : 539 ASP ( 573 ) Set-name:x Res. # : 540 ALA ( 574 ) Set-name:x Res. # : 541 ILE ( 575 ) Set-name:x Res. # : 542 LEU ( 576 ) Set-name:x Res. # : 543 GLU ( 577 ) Set-name:x Res. # : 544 ASP ( 578 ) Set-name:x Res. # : 545 TYR ( 579 ) Set-name:x Res. # : 546 ALA ( 580 ) Set-name:x Res. # : 547 SER ( 581 ) Set-name:x Res. # : 548 MET ( 582 ) Set-name:x Res. # : 549 GLN ( 583 ) Set-name:x
The co-factor in the ribbon.
The right eye view of the Trp s. Postscript.
The left eye view of the Trp s. Postscript.
This tripple stereo figure is not very good, but is shows nicely that the Trp s cluster.
A ribbon view that could be OK for the publication?
A ribbon view that could be OK for the publication?
A ribbon view that could be OK for the publication?