data_17807
#######################
# Entry information #
#######################
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 17807
_Entry.Title
;
Solution structure of Ca2+/calmodulin complexed with a peptide representing the calmodulin-binding domain of L-selectin
;
_Entry.Type macromolecule
_Entry.Version_type original
_Entry.Submission_date 2011-07-25
_Entry.Accession_date 2011-07-25
_Entry.Last_release_date .
_Entry.Original_release_date .
_Entry.Origination author
_Entry.NMR_STAR_version 3.1.1.61
_Entry.Original_NMR_STAR_version 3.1
_Entry.Experimental_method NMR
_Entry.Experimental_method_subtype SOLUTION
_Entry.Details .
_Entry.BMRB_internal_directory_name .
loop_
_Entry_author.Ordinal
_Entry_author.Given_name
_Entry_author.Family_name
_Entry_author.First_initial
_Entry_author.Middle_initials
_Entry_author.Family_title
_Entry_author.Entry_ID
1 Jessica Gifford . L. . 17807
2 Hiroaki Ishida . . . 17807
3 Hans Vogel . J. . 17807
stop_
loop_
_SG_project.SG_project_ID
_SG_project.Project_name
_SG_project.Full_name_of_center
_SG_project.Initial_of_center
_SG_project.Entry_ID
1 'not applicable' 'not applicable' . 17807
stop_
loop_
_Struct_keywords.Keywords
_Struct_keywords.Text
_Struct_keywords.Entry_ID
calcium-calmodulin . 17807
L-selectin . 17807
'peptide complex' . 17807
stop_
loop_
_Data_set.Type
_Data_set.Count
_Data_set.Entry_ID
assigned_chemical_shifts 1 17807
stop_
loop_
_Datum.Type
_Datum.Count
_Datum.Entry_ID
'13C chemical shifts' 438 17807
'15N chemical shifts' 144 17807
'1H chemical shifts' 287 17807
stop_
loop_
_Release.Release_number
_Release.Format_type
_Release.Format_version
_Release.Date
_Release.Submission_date
_Release.Type
_Release.Author
_Release.Detail
_Release.Entry_ID
2 . . 2012-08-27 2011-07-25 update BMRB 'update entry citation' 17807
1 . . 2012-06-11 2011-07-25 original author 'original release' 17807
stop_
loop_
_Related_entries.Database_name
_Related_entries.Database_accession_code
_Related_entries.Relationship
_Related_entries.Entry_ID
PDB 2LGF 'BMRB Entry Tracking System' 17807
stop_
save_
###############
# Citations #
###############
save_entry_citation
_Citation.Sf_category citations
_Citation.Sf_framecode entry_citation
_Citation.Entry_ID 17807
_Citation.ID 1
_Citation.Class 'entry citation'
_Citation.CAS_abstract_code .
_Citation.MEDLINE_UI_code .
_Citation.DOI .
_Citation.PubMed_ID 22711531
_Citation.Full_citation .
_Citation.Title 'Structural Insights into Calmodulin-regulated L-selectin Ectodomain Shedding.'
_Citation.Status published
_Citation.Type journal
_Citation.Journal_abbrev 'J. Biol. Chem.'
_Citation.Journal_name_full 'The Journal of biological chemistry'
_Citation.Journal_volume 287
_Citation.Journal_issue 32
_Citation.Journal_ASTM .
_Citation.Journal_ISSN .
_Citation.Journal_CSD .
_Citation.Book_title .
_Citation.Book_chapter_title .
_Citation.Book_volume .
_Citation.Book_series .
_Citation.Book_publisher .
_Citation.Book_publisher_city .
_Citation.Book_ISBN .
_Citation.Conference_title .
_Citation.Conference_site .
_Citation.Conference_state_province .
_Citation.Conference_country .
_Citation.Conference_start_date .
_Citation.Conference_end_date .
_Citation.Conference_abstract_number .
_Citation.Thesis_institution .
_Citation.Thesis_institution_city .
_Citation.Thesis_institution_country .
_Citation.WWW_URL .
_Citation.Page_first 26513
_Citation.Page_last 26527
_Citation.Year 2012
_Citation.Details .
loop_
_Citation_author.Ordinal
_Citation_author.Given_name
_Citation_author.Family_name
_Citation_author.First_initial
_Citation_author.Middle_initials
_Citation_author.Family_title
_Citation_author.Entry_ID
_Citation_author.Citation_ID
1 Jessica Gifford . L. . 17807 1
2 Hiroaki Ishida . . . 17807 1
3 Hans Vogel . J. . 17807 1
stop_
save_
#############################################
# Molecular system (assembly) description #
#############################################
save_assembly
_Assembly.Sf_category assembly
_Assembly.Sf_framecode assembly
_Assembly.Entry_ID 17807
_Assembly.ID 1
_Assembly.Name 'Ca2+/CaM L-selectin peptide complex'
_Assembly.BMRB_code .
_Assembly.Number_of_components 6
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Non_standard_bonds .
_Assembly.Ambiguous_conformational_states .
_Assembly.Ambiguous_chem_comp_sites .
_Assembly.Molecules_in_chemical_exchange .
_Assembly.Paramagnetic no
_Assembly.Thiol_state .
_Assembly.Molecular_mass .
_Assembly.Enzyme_commission_number .
_Assembly.Details .
_Assembly.DB_query_date .
_Assembly.DB_query_revised_last_date .
loop_
_Entity_assembly.ID
_Entity_assembly.Entity_assembly_name
_Entity_assembly.Entity_ID
_Entity_assembly.Entity_label
_Entity_assembly.Asym_ID
_Entity_assembly.PDB_chain_ID
_Entity_assembly.Experimental_data_reported
_Entity_assembly.Physical_state
_Entity_assembly.Conformational_isomer
_Entity_assembly.Chemical_exchange_state
_Entity_assembly.Magnetic_equivalence_group_code
_Entity_assembly.Role
_Entity_assembly.Details
_Entity_assembly.Entry_ID
_Entity_assembly.Assembly_ID
1 Calmodulin 1 $CaM A . yes native no no . . . 17807 1
2 'L-selectin binding domain peptide' 2 $bind_dom B . yes native no no . . . 17807 1
3 'CALCIUM ION_1' 3 $CA C . no native no no . . . 17807 1
4 'CALCIUM ION_2' 3 $CA D . no native no no . . . 17807 1
5 'CALCIUM ION_3' 3 $CA E . no native no no . . . 17807 1
6 'CALCIUM ION_4' 3 $CA F . no native no no . . . 17807 1
stop_
save_
####################################
# Biological polymers and ligands #
####################################
save_CaM
_Entity.Sf_category entity
_Entity.Sf_framecode CaM
_Entity.Entry_ID 17807
_Entity.ID 1
_Entity.BMRB_code .
_Entity.Name Calmodulin
_Entity.Type polymer
_Entity.Polymer_common_type .
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_type_details .
_Entity.Polymer_strand_ID A
_Entity.Polymer_seq_one_letter_code_can .
_Entity.Polymer_seq_one_letter_code
;
DQLTEEQIAEFKEAFSLFDK
DGDGTITTKELGTVMRSLGQ
NPTEAELQDMINEVDADGNG
TIDFPEFLTMMARKMKDTDS
EEEIREAFRVFDKDGNGYIS
AAELRHVMTNLGEKLTDEEV
DEMIREADIDGDGQVNYEEF
VQMMTAK
;
_Entity.Target_identifier .
_Entity.Polymer_author_defined_seq .
_Entity.Polymer_author_seq_details .
_Entity.Ambiguous_conformational_states no
_Entity.Ambiguous_chem_comp_sites no
_Entity.Nstd_monomer no
_Entity.Nstd_chirality no
_Entity.Nstd_linkage no
_Entity.Nonpolymer_comp_ID .
_Entity.Nonpolymer_comp_label .
_Entity.Number_of_monomers 147
_Entity.Number_of_nonpolymer_components .
_Entity.Paramagnetic no
_Entity.Thiol_state 'not present'
_Entity.Src_method man
_Entity.Parent_entity_ID .
_Entity.Fragment .
_Entity.Mutation .
_Entity.EC_number .
_Entity.Calc_isoelectric_point .
_Entity.Formula_weight 16535.299
_Entity.Formula_weight_exptl .
_Entity.Formula_weight_exptl_meth .
_Entity.Details .
_Entity.DB_query_date .
_Entity.DB_query_revised_last_date 2015-11-25
loop_
_Entity_db_link.Ordinal
_Entity_db_link.Author_supplied
_Entity_db_link.Database_code
_Entity_db_link.Accession_code
_Entity_db_link.Entry_mol_code
_Entity_db_link.Entry_mol_name
_Entity_db_link.Entry_experimental_method
_Entity_db_link.Entry_structure_resolution
_Entity_db_link.Entry_relation_type
_Entity_db_link.Entry_details
_Entity_db_link.Chimera_segment_ID
_Entity_db_link.Seq_query_to_submitted_percent
_Entity_db_link.Seq_subject_length
_Entity_db_link.Seq_identity
_Entity_db_link.Seq_positive
_Entity_db_link.Seq_homology_expectation_val
_Entity_db_link.Seq_align_begin
_Entity_db_link.Seq_align_end
_Entity_db_link.Seq_difference_details
_Entity_db_link.Seq_alignment_details
_Entity_db_link.Entry_ID
_Entity_db_link.Entity_ID
1 no BMRB 15184 . calmodulin . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
2 no BMRB 15185 . calmodulin . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
3 no BMRB 15186 . calmodulin . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
4 no BMRB 15187 . calmodulin . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
5 no BMRB 15188 . calmodulin . . . . . 100.00 148 99.32 100.00 6.08e-99 . . . . 17807 1
6 no BMRB 15191 . Calmodulin . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
7 no BMRB 15470 . calmodulin . . . . . 100.00 148 99.32 100.00 8.81e-99 . . . . 17807 1
8 no BMRB 15624 . Calmodulin . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
9 no BMRB 15650 . calmodulin . . . . . 100.00 148 99.32 100.00 1.57e-98 . . . . 17807 1
10 no BMRB 15852 . calmodulin . . . . . 100.00 148 99.32 100.00 1.57e-98 . . . . 17807 1
11 no BMRB 1634 . calmodulin . . . . . 100.00 148 97.28 99.32 1.24e-96 . . . . 17807 1
12 no BMRB 16418 . apoCaM . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
13 no BMRB 16465 . entity_1 . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
14 no BMRB 1648 . calmodulin . . . . . 100.00 148 97.28 99.32 1.24e-96 . . . . 17807 1
15 no BMRB 16764 . CALMODULIN . . . . . 100.00 150 100.00 100.00 2.71e-99 . . . . 17807 1
16 no BMRB 17264 . calmodulin . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
17 no BMRB 17360 . entity_1 . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
18 no BMRB 17771 . Calmodulin . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
19 no BMRB 18027 . CaM . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
20 no BMRB 18028 . CaM . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
21 no BMRB 18556 . Calmodulin . . . . . 100.00 148 98.64 99.32 1.51e-97 . . . . 17807 1
22 no BMRB 19036 . calmodulin . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
23 no BMRB 19238 . Calmodulin_prototypical_calcium_sensor . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
24 no BMRB 19586 . entity_1 . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
25 no BMRB 19604 . calmodulin . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
26 no BMRB 25253 . CaM . . . . . 100.00 148 98.64 99.32 6.17e-97 . . . . 17807 1
27 no BMRB 25257 . CaM . . . . . 100.00 148 98.64 99.32 6.17e-97 . . . . 17807 1
28 no BMRB 26503 . Calmodulin . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
29 no BMRB 26626 . CaM . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
30 no BMRB 26627 . CaM . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
31 no BMRB 4056 . calmodulin . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
32 no BMRB 4270 . calmodulin . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
33 no BMRB 4284 . Calmodulin . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
34 no BMRB 4310 . calmodulin . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
35 no PDB 1A29 . "Calmodulin Complexed With Trifluoperazine (1:2 Complex)" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
36 no PDB 1CFC . "Calcium-Free Calmodulin" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
37 no PDB 1CFD . "Calcium-Free Calmodulin" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
38 no PDB 1CFF . "Nmr Solution Structure Of A Complex Of Calmodulin With A Binding Peptide Of The Ca2+-Pump" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
39 no PDB 1CKK . "CalmodulinRAT CA2+CALMODULIN DEPENDENT PROTEIN KINASE Fragment" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
40 no PDB 1CLL . "Calmodulin Structure Refined At 1.7 Angstroms Resolution" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
41 no PDB 1CM1 . "Motions Of Calmodulin-Single-Conformer Refinement" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
42 no PDB 1CM4 . "Motions Of Calmodulin-four-conformer Refinement" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
43 no PDB 1CTR . "Drug Binding By Calmodulin: Crystal Structure Of A Calmodulin-Trifluoperazine Complex" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
44 no PDB 1DMO . "Calmodulin, Nmr, 30 Structures" . . . . . 100.00 148 99.32 100.00 8.81e-99 . . . . 17807 1
45 no PDB 1G4Y . "1.60 A Crystal Structure Of The Gating Domain From Small Conductance Potassium Channel Complexed With Calcium-Calmodulin" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
46 no PDB 1IQ5 . "CalmodulinNEMATODE CA2+CALMODULIN DEPENDENT KINASE KINASE Fragment" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
47 no PDB 1IWQ . "Crystal Structure Of Marcks Calmodulin Binding Domain Peptide Complexed With Ca2+CALMODULIN" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
48 no PDB 1K90 . "Crystal Structure Of The Adenylyl Cyclase Domain Of Anthrax Edema Factor (Ef) In Complex With Calmodulin And 3' Deoxy-Atp" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
49 no PDB 1K93 . "Crystal Structure Of The Adenylyl Cyclase Domain Of Anthrax Edema Factor (Ef) In Complex With Calmodulin" . . . . . 97.96 144 100.00 100.00 6.36e-97 . . . . 17807 1
50 no PDB 1L7Z . "Crystal Structure Of Ca2+/calmodulin Complexed With Myristoylated Cap-23/nap-22 Peptide" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
51 no PDB 1LIN . "Calmodulin Complexed With Trifluoperazine (1:4 Complex)" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
52 no PDB 1LVC . "Crystal Structure Of The Adenylyl Cyclase Domain Of Anthrax Edema Factor (Ef) In Complex With Calmodulin And 2' Deoxy, 3' Anthr" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
53 no PDB 1MUX . "Solution Nmr Structure Of CalmodulinW-7 Complex: The Basis Of Diversity In Molecular Recognition, 30 Structures" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
54 no PDB 1MXE . "Structure Of The Complex Of Calmodulin With The Target Sequence Of Camki" . . . . . 100.00 148 97.96 99.32 3.82e-97 . . . . 17807 1
55 no PDB 1NWD . "Solution Structure Of Ca2+CALMODULIN BOUND TO THE C- Terminal Domain Of Petunia Glutamate Decarboxylase" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
56 no PDB 1OOJ . "Structural Genomics Of Caenorhabditis Elegans : Calmodulin" . . . . . 100.00 149 97.96 98.64 1.02e-96 . . . . 17807 1
57 no PDB 1PRW . "Crystal Structure Of Bovine Brain Ca++ Calmodulin In A Compact Form" . . . . . 100.00 149 99.32 99.32 2.54e-98 . . . . 17807 1
58 no PDB 1QIV . "Calmodulin Complexed With N-(3,3,-Diphenylpropyl)-N'-[1-R-( 3,4-Bis-Butoxyphenyl)-Ethyl]-Propylenediamine (Dpd), 1:2 Complex" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
59 no PDB 1QIW . "Calmodulin Complexed With N-(3,3,-Diphenylpropyl)-N'-[1-R-( 3,4-Bis-Butoxyphenyl)-Ethyl]-Propylenediamine (Dpd)" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
60 no PDB 1QX5 . "Crystal Structure Of Apocalmodulin" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
61 no PDB 1S26 . "Structure Of Anthrax Edema Factor-calmodulin-alpha,beta- Methyleneadenosine 5'-triphosphate Complex Reveals An Alternative Mode" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
62 no PDB 1SK6 . "Crystal Structure Of The Adenylyl Cyclase Domain Of Anthrax Edema Factor (Ef) In Complex With Calmodulin, 3',5' Cyclic Amp (Cam" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
63 no PDB 1SY9 . "Structure Of Calmodulin Complexed With A Fragment Of The Olfactory Cng Channel" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
64 no PDB 1UP5 . "Chicken Calmodulin" . . . . . 100.00 148 99.32 99.32 2.46e-98 . . . . 17807 1
65 no PDB 1WRZ . "Calmodulin Complexed With A Peptide From A Human Death-Associated Protein Kinase" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
66 no PDB 1X02 . "Solution Structure Of Stereo Array Isotope Labeled (Sail) Calmodulin" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
67 no PDB 1XA5 . "Structure Of Calmodulin In Complex With Kar-2, A Bis-Indol Alkaloid" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
68 no PDB 1XFU . "Crystal Structure Of Anthrax Edema Factor (ef) Truncation Mutant, Ef-delta 64 In Complex With Calmodulin" . . . . . 100.00 149 99.32 100.00 5.22e-99 . . . . 17807 1
69 no PDB 1XFV . "Crystal Structure Of Anthrax Edema Factor (Ef) In Complex With Calmodulin And 3' Deoxy-Atp" . . . . . 100.00 149 99.32 100.00 5.22e-99 . . . . 17807 1
70 no PDB 1XFW . "Crystal Structure Of Anthrax Edema Factor (Ef) In Complex With Calmodulin And 3'5' Cyclic Amp (Camp)" . . . . . 100.00 149 99.32 100.00 5.22e-99 . . . . 17807 1
71 no PDB 1XFY . "Crystal Structure Of Anthrax Edema Factor (Ef) In Complex With Calmodulin" . . . . . 100.00 149 99.32 100.00 5.22e-99 . . . . 17807 1
72 no PDB 1XFZ . "Crystal Structure Of Anthrax Edema Factor (ef) In Complex With Calmodulin In The Presence Of 1 Millimolar Exogenously Added Cal" . . . . . 100.00 149 99.32 100.00 5.22e-99 . . . . 17807 1
73 no PDB 1Y0V . "Crystal Structure Of Anthrax Edema Factor (Ef) In Complex With Calmodulin And Pyrophosphate" . . . . . 97.96 146 100.00 100.00 3.31e-97 . . . . 17807 1
74 no PDB 1YR5 . "1.7-A Structure Of Calmodulin Bound To A Peptide From Dap Kinase" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
75 no PDB 2BBM . "Solution Structure Of A Calmodulin-Target Peptide Complex By Multidimensional Nmr" . . . . . 100.00 148 97.96 99.32 3.82e-97 . . . . 17807 1
76 no PDB 2BBN . "Solution Structure Of A Calmodulin-Target Peptide Complex By Multidimensional Nmr" . . . . . 100.00 148 97.96 99.32 3.82e-97 . . . . 17807 1
77 no PDB 2BCX . "Crystal Structure Of Calmodulin In Complex With A Ryanodine Receptor Peptide" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
78 no PDB 2BKH . "Myosin Vi Nucleotide-Free (Mdinsert2) Crystal Structure" . . . . . 100.00 149 97.96 99.32 4.26e-97 . . . . 17807 1
79 no PDB 2BKI . "Myosin Vi Nucleotide-free (mdinsert2-iq) Crystal Structure" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
80 no PDB 2DFS . "3-D Structure Of Myosin-V Inhibited State" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
81 no PDB 2F2O . "Structure Of Calmodulin Bound To A Calcineurin Peptide: A New Way Of Making An Old Binding Mode" . . . . . 100.00 179 100.00 100.00 4.13e-99 . . . . 17807 1
82 no PDB 2F2P . "Structure Of Calmodulin Bound To A Calcineurin Peptide: A New Way Of Making An Old Binding Mode" . . . . . 100.00 179 100.00 100.00 4.13e-99 . . . . 17807 1
83 no PDB 2F3Y . "CalmodulinIQ DOMAIN COMPLEX" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
84 no PDB 2F3Z . "CalmodulinIQ-Aa Domain Complex" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
85 no PDB 2FOT . "Crystal Structure Of The Complex Between Calmodulin And Alphaii-Spectrin" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
86 no PDB 2HQW . "Crystal Structure Of Ca2+CALMODULIN BOUND TO NMDA RECEPTOR NR1C1 Peptide" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
87 no PDB 2JZI . "Structure Of Calmodulin Complexed With The Calmodulin Binding Domain Of Calcineurin" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
88 no PDB 2K0E . "A Coupled Equilibrium Shift Mechanism In Calmodulin- Mediated Signal Transduction" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
89 no PDB 2K0F . "Calmodulin Complexed With Calmodulin-Binding Peptide From Smooth Muscle Myosin Light Chain Kinase" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
90 no PDB 2K0J . "Solution Structure Of Cam Complexed To Drp1p" . . . . . 100.00 148 99.32 100.00 1.57e-98 . . . . 17807 1
91 no PDB 2K61 . "Solution Structure Of Cam Complexed To Dapk Peptide" . . . . . 100.00 148 99.32 100.00 1.57e-98 . . . . 17807 1
92 no PDB 2KDU . "Structural Basis Of The Munc13-1CA2+-Calmodulin Interaction: A Novel 1-26 Calmodulin Binding Motif With A Bipartite Binding Mod" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
93 no PDB 2KNE . "Calmodulin Wraps Around Its Binding Domain In The Plasma Membrane Ca2+ Pump Anchored By A Novel 18-1 Motif" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
94 no PDB 2L53 . "Solution Nmr Structure Of Apo-Calmodulin In Complex With The Iq Motif Of Human Cardiac Sodium Channel Nav1.5" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
95 no PDB 2L7L . "Solution Structure Of Ca2+CALMODULIN COMPLEXED WITH A PEPTIDE Representing The Calmodulin-Binding Domain Of Calmodulin Kinase I" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
96 no PDB 2LGF . "Solution Structure Of Ca2+CALMODULIN COMPLEXED WITH A PEPTIDE Representing The Calmodulin-Binding Domain Of L-Selectin" . . . . . 99.32 146 100.00 100.00 1.77e-98 . . . . 17807 1
97 no PDB 2LL6 . "Solution Nmr Structure Of Cam Bound To Inos Cam Binding Domain Peptide" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
98 no PDB 2LL7 . "Solution Nmr Structure Of Cam Bound To The Enos Cam Binding Domain Peptide" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
99 no PDB 2LV6 . "The Complex Between Ca-calmodulin And Skeletal Muscle Myosin Light Chain Kinase From Combination Of Nmr And Aqueous And Contras" . . . . . 100.00 148 98.64 99.32 1.51e-97 . . . . 17807 1
100 no PDB 2M0J . "3d Structure Of Calmodulin And Calmodulin Binding Domain Of Olfactory Cyclic Nucleotide-gated Ion Channel Complex" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
101 no PDB 2M0K . "3d Structure Of Calmodulin And Calmodulin Binding Domain Of Rat Olfactory Cyclic Nucleotide-gated Ion Channel" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
102 no PDB 2M55 . "Nmr Structure Of The Complex Of An N-terminally Acetylated Alpha- Synuclein Peptide With Calmodulin" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
103 no PDB 2MG5 . "Solution Structure Of Calmodulin Bound To The Target Peptide Of Endothelial Nitrogen Oxide Synthase Phosphorylated At Thr495" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
104 no PDB 2MGU . "Structure Of The Complex Between Calmodulin And The Binding Domain Of Hiv-1 Matrix Protein" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
105 no PDB 2O5G . "Calmodulin-Smooth Muscle Light Chain Kinase Peptide Complex" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
106 no PDB 2O60 . "Calmodulin Bound To Peptide From Neuronal Nitric Oxide Synthase" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
107 no PDB 2R28 . "The Complex Structure Of Calmodulin Bound To A Calcineurin Peptide" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
108 no PDB 2V01 . "Recombinant Vertebrate Calmodulin Complexed With Pb" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
109 no PDB 2V02 . "Recombinant Vertebrate Calmodulin Complexed With Ba" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
110 no PDB 2VAS . "Myosin Vi (Md-Insert2-Cam, Delta-Insert1) Post-Rigor State" . . . . . 100.00 149 97.96 99.32 4.26e-97 . . . . 17807 1
111 no PDB 2VAY . "Calmodulin Complexed With Cav1.1 Iq Peptide" . . . . . 99.32 146 100.00 100.00 1.77e-98 . . . . 17807 1
112 no PDB 2VB6 . "Myosin Vi (Md-Insert2-Cam, Delta Insert1) Post-Rigor State ( Crystal Form 2)" . . . . . 100.00 149 97.28 99.32 1.26e-96 . . . . 17807 1
113 no PDB 2W73 . "High-Resolution Structure Of The Complex Between Calmodulin And A Peptide From Calcineurin A" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
114 no PDB 2WEL . "Crystal Structure Of Su6656-Bound CalciumCALMODULIN- Dependent Protein Kinase Ii Delta In Complex With Calmodulin" . . . . . 100.00 150 100.00 100.00 2.30e-99 . . . . 17807 1
115 no PDB 2X0G . "X-ray Structure Of A Dap-kinase Calmodulin Complex" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
116 no PDB 2X51 . "M6 Delta Insert1" . . . . . 100.00 149 97.96 99.32 4.26e-97 . . . . 17807 1
117 no PDB 2Y4V . "Crystal Structure Of Human Calmodulin In Complex With A Dap Kinase-1 Mutant (W305y) Peptide" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
118 no PDB 2YGG . "Complex Of Cambr And Cam" . . . . . 100.00 150 100.00 100.00 2.40e-99 . . . . 17807 1
119 no PDB 3BXK . "Crystal Structure Of The PQ-Type Calcium Channel (Cav2.1) Iq Domain And Ca2+calmodulin Complex" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
120 no PDB 3BXL . "Crystal Structure Of The R-Type Calcium Channel (Cav2.3) Iq Domain And Ca2+calmodulin Complex" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
121 no PDB 3BYA . "Structure Of A Calmodulin Complex" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
122 no PDB 3CLN . "Structure Of Calmodulin Refined At 2.2 Angstroms Resolution" . . . . . 100.00 148 99.32 100.00 8.81e-99 . . . . 17807 1
123 no PDB 3DVE . "Crystal Structure Of Ca2+CAM-Cav2.2 Iq Domain Complex" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
124 no PDB 3DVJ . "Crystal Structure Of Ca2+CAM-Cav2.2 Iq Domain (Without Cloning Artifact, Hm To Tv) Complex" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
125 no PDB 3DVK . "Crystal Structure Of Ca2+CAM-Cav2.3 Iq Domain Complex" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
126 no PDB 3DVM . "Crystal Structure Of Ca2+CAM-Cav2.1 Iq Domain Complex" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
127 no PDB 3EK4 . "Calcium-saturated Gcamp2 Monomer" . . . . . 100.00 449 100.00 100.00 1.38e-95 . . . . 17807 1
128 no PDB 3EK7 . "Calcium-Saturated Gcamp2 Dimer" . . . . . 100.00 449 100.00 100.00 1.38e-95 . . . . 17807 1
129 no PDB 3EK8 . "Calcium-Saturated Gcamp2 T116vG87R MUTANT MONOMER" . . . . . 100.00 449 100.00 100.00 1.41e-95 . . . . 17807 1
130 no PDB 3EKH . "Calcium-Saturated Gcamp2 T116vK378W MUTANT MONOMER" . . . . . 100.00 449 99.32 99.32 1.07e-94 . . . . 17807 1
131 no PDB 3EVU . "Crystal Structure Of Calcium Bound Dimeric Gcamp2, (#1)" . . . . . 100.00 449 100.00 100.00 1.38e-95 . . . . 17807 1
132 no PDB 3EVV . "Crystal Structure Of Calcium Bound Dimeric Gcamp2 (#2)" . . . . . 100.00 449 100.00 100.00 1.38e-95 . . . . 17807 1
133 no PDB 3EWT . "Crystal Structure Of Calmodulin Complexed With A Peptide" . . . . . 100.00 154 100.00 100.00 1.35e-99 . . . . 17807 1
134 no PDB 3EWV . "Crystal Structure Of Calmodulin Complexed With A Peptide" . . . . . 100.00 154 100.00 100.00 1.35e-99 . . . . 17807 1
135 no PDB 3G43 . "Crystal Structure Of The Calmodulin-Bound Cav1.2 C-Terminal Regulatory Domain Dimer" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
136 no PDB 3GN4 . "Myosin Lever Arm" . . . . . 100.00 149 97.96 99.32 4.26e-97 . . . . 17807 1
137 no PDB 3GOF . "Calmodulin Bound To Peptide From Macrophage Nitric Oxide Synthase" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
138 no PDB 3HR4 . "Human Inos Reductase And Calmodulin Complex" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
139 no PDB 3IF7 . "Structure Of Calmodulin Complexed With Its First Endogenous Inhibitor, Sphingosylphosphorylcholine" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
140 no PDB 3J41 . "Pseudo-atomic Model Of The Aquaporin-0/calmodulin Complex Derived From Electron Microscopy" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
141 no PDB 3L9I . "Myosin Vi Nucleotide-Free (Mdinsert2) L310g Mutant Crystal Structure" . . . . . 100.00 149 97.96 99.32 4.26e-97 . . . . 17807 1
142 no PDB 3O77 . "The Structure Of Ca2+ Sensor (Case-16)" . . . . . 100.00 415 100.00 100.00 7.11e-96 . . . . 17807 1
143 no PDB 3O78 . "The Structure Of Ca2+ Sensor (Case-12)" . . . . . 100.00 415 100.00 100.00 8.74e-96 . . . . 17807 1
144 no PDB 3OXQ . "Crystal Structure Of Ca2+CAM-Cav1.2 Pre-IqIQ DOMAIN COMPLEX" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
145 no PDB 3SG2 . "Crystal Structure Of Gcamp2-t116v,d381y" . . . . . 100.00 449 99.32 99.32 1.84e-94 . . . . 17807 1
146 no PDB 3SG3 . "Crystal Structure Of Gcamp3-d380y" . . . . . 100.00 449 98.64 99.32 1.50e-93 . . . . 17807 1
147 no PDB 3SG4 . "Crystal Structure Of Gcamp3-d380y, Lp(linker 2)" . . . . . 100.00 448 98.64 99.32 1.32e-93 . . . . 17807 1
148 no PDB 3SG5 . "Crystal Structure Of Dimeric Gcamp3-d380y, Qp(linker 1), Lp(linker 2)" . . . . . 100.00 448 98.64 99.32 1.28e-93 . . . . 17807 1
149 no PDB 3SG6 . "Crystal Structure Of Dimeric Gcamp2-lia(linker 1)" . . . . . 100.00 450 100.00 100.00 1.08e-95 . . . . 17807 1
150 no PDB 3SG7 . "Crystal Structure Of Gcamp3-kf(linker 1)" . . . . . 100.00 448 99.32 100.00 1.16e-94 . . . . 17807 1
151 no PDB 3SJQ . "Crystal Structure Of A Small Conductance Potassium Channel Splice Variant Complexed With Calcium-Calmodulin" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
152 no PDB 3SUI . "Crystal Structure Of Ca2+-Calmodulin In Complex With A Trpv1 C- Terminal Peptide" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
153 no PDB 3U0K . "Crystal Structure Of The Genetically Encoded Calcium Indicator Rcamp" . . . . . 100.00 440 98.64 99.32 2.29e-94 . . . . 17807 1
154 no PDB 3WFN . "Crystal Structure Of Nav1.6 Iq Motif In Complex With Apo-cam" . . . . . 100.00 182 100.00 100.00 4.57e-99 . . . . 17807 1
155 no PDB 4ANJ . "Myosin Vi (Mdinsert2-Gfp Fusion) Pre-Powerstroke State (Mg.Adp.Alf4)" . . . . . 100.00 149 97.96 99.32 4.26e-97 . . . . 17807 1
156 no PDB 4BW7 . "Calmodulin In Complex With Strontium" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
157 no PDB 4BW8 . "Calmodulin With Small Bend In Central Helix" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
158 no PDB 4BYF . "Crystal Structure Of Human Myosin 1c In Complex With Calmodulin In The Pre-power Stroke State" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
159 no PDB 4CLN . "Structure Of A Recombinant Calmodulin From Drosophila Melanogaster Refined At 2.2-Angstroms Resolution" . . . . . 100.00 148 97.96 99.32 3.82e-97 . . . . 17807 1
160 no PDB 4DBP . "Myosin Vi Nucleotide-free (mdinsert2) D179y Crystal Structure" . . . . . 100.00 149 97.96 99.32 4.26e-97 . . . . 17807 1
161 no PDB 4DBQ . "Myosin Vi D179y (md-insert2-cam, Delta-insert1) Post-rigor State" . . . . . 100.00 149 97.96 99.32 4.26e-97 . . . . 17807 1
162 no PDB 4DCK . "Crystal Structure Of The C-Terminus Of Voltage-Gated Sodium Channel In Complex With Fgf13 And Cam" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
163 no PDB 4DJC . "1.35 A Crystal Structure Of The Nav1.5 Diii-Iv-CaCAM COMPLEX" . . . . . 100.00 152 100.00 100.00 1.85e-99 . . . . 17807 1
164 no PDB 4E50 . "Calmodulin And Ng Peptide Complex" . . . . . 100.00 185 100.00 100.00 1.13e-99 . . . . 17807 1
165 no PDB 4EHQ . "Crystal Structure Of Calmodulin Binding Domain Of Orai1 In Complex With Ca2+CALMODULIN DISPLAYS A UNIQUE BINDING MODE" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
166 no PDB 4G27 . "Calcium-Calmodulin Complexed With The Calmodulin Binding Domain From A Small Conductance Potassium Channel Splice Variant And P" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
167 no PDB 4G28 . "Calcium-Calmodulin Complexed With The Calmodulin Binding Domain From A Small Conductance Potassium Channel Splice Variant And E" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
168 no PDB 4HEX . "A Novel Conformation Of Calmodulin" . . . . . 100.00 156 100.00 100.00 1.16e-99 . . . . 17807 1
169 no PDB 4IK1 . "High Resolution Structure Of Gcampj At Ph 8.5" . . . . . 100.00 448 98.64 99.32 1.36e-93 . . . . 17807 1
170 no PDB 4IK3 . "High Resolution Structure Of Gcamp3 At Ph 8.5" . . . . . 100.00 448 99.32 100.00 1.04e-94 . . . . 17807 1
171 no PDB 4IK4 . "High Resolution Structure Of Gcamp3 At Ph 5.0" . . . . . 100.00 448 99.32 100.00 1.04e-94 . . . . 17807 1
172 no PDB 4IK5 . "High Resolution Structure Of Delta-rest-gcamp3" . . . . . 100.00 414 99.32 100.00 4.31e-95 . . . . 17807 1
173 no PDB 4IK8 . "High Resolution Structure Of Gcamp3 Dimer Form 1 At Ph 7.5" . . . . . 100.00 448 99.32 100.00 1.04e-94 . . . . 17807 1
174 no PDB 4IK9 . "High Resolution Structure Of Gcamp3 Dimer Form 2 At Ph 7.5" . . . . . 100.00 448 99.32 100.00 1.04e-94 . . . . 17807 1
175 no PDB 4J9Y . "Calcium-calmodulin Complexed With The Calmodulin Binding Domain From A Small Conductance Potassium Channel Splice Variant" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
176 no PDB 4J9Z . "Calcium-calmodulin Complexed With The Calmodulin Binding Domain From A Small Conductance Potassium Channel Splice Variant And N" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
177 no PDB 4JPZ . "Voltage-gated Sodium Channel 1.2 C-terminal Domain In Complex With Fgf13u And Ca2+/calmodulin" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
178 no PDB 4JQ0 . "Voltage-gated Sodium Channel 1.5 C-terminal Domain In Complex With Fgf12b And Ca2+/calmodulin" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
179 no PDB 4L79 . "Crystal Structure Of Nucleotide-free Myosin 1b Residues 1-728 With Bound Calmodulin" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
180 no PDB 4LZX . "Complex Of Iqcg And Ca2+-free Cam" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
181 no PDB 4M1L . "Complex Of Iqcg And Ca2+-bound Cam" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
182 no PDB 4PJJ . "Myosin Vi (md-insert2-cam, Delta-insert1) Post-rigor State - Long Soaking With Po4" . . . . . 100.00 149 97.28 99.32 1.26e-96 . . . . 17807 1
183 no PDB 4Q5U . "Structure Of Calmodulin Bound To Its Recognition Site From Calcineurin" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
184 no PDB 4QNH . "Calcium-calmodulin (t79d) Complexed With The Calmodulin Binding Domain From A Small Conductance Potassium Channel Sk2-a" . . . . . 100.00 149 99.32 99.32 2.87e-98 . . . . 17807 1
185 no PDB 4R8G . "Crystal Structure Of Myosin-1c Tail In Complex With Calmodulin" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
186 no PDB 4UMO . "Crystal Structure Of The Kv7.1 Proximal C-terminal Domain In Complex With Calmodulin" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
187 no PDB 4UPU . "Crystal Structure Of Ip3 3-k Calmodulin Binding Region In Complex With Calmodulin" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
188 no PDB 4V0C . "Crystal Structure Of The Kv7.1 Proximal C-terminal Domain In Complex With Calmodulin" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
189 no DBJ BAA08302 . "calmodulin [Homo sapiens]" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
190 no DBJ BAA11896 . "calmodulin [Anas platyrhynchos]" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
191 no DBJ BAA19786 . "calmodulin [Branchiostoma lanceolatum]" . . . . . 100.00 149 97.96 99.32 4.26e-97 . . . . 17807 1
192 no DBJ BAA19787 . "calmodulin [Branchiostoma floridae]" . . . . . 100.00 149 97.96 99.32 4.26e-97 . . . . 17807 1
193 no DBJ BAA19788 . "calmodulin [Halocynthia roretzi]" . . . . . 100.00 149 97.96 99.32 4.26e-97 . . . . 17807 1
194 no EMBL CAA10601 . "calmodulin [Caenorhabditis elegans]" . . . . . 100.00 149 97.96 98.64 1.02e-96 . . . . 17807 1
195 no EMBL CAA32050 . "calmodulin [Rattus norvegicus]" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
196 no EMBL CAA32062 . "calmodulin II [Rattus norvegicus]" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
197 no EMBL CAA32119 . "calmodulin [Rattus norvegicus]" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
198 no EMBL CAA32120 . "calmodulin [Rattus norvegicus]" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
199 no GB AAA35635 . "calmodulin [Homo sapiens]" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
200 no GB AAA35641 . "calmodulin [Homo sapiens]" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
201 no GB AAA37365 . "calmodulin synthesis [Mus musculus]" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
202 no GB AAA40862 . "calmodulin [Rattus norvegicus]" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
203 no GB AAA40863 . "calmodulin [Rattus norvegicus]" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
204 no PIR JC1305 . "calmodulin - Japanese medaka" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
205 no PIR MCON . "calmodulin - salmon" . . . . . 100.00 148 100.00 100.00 2.54e-99 . . . . 17807 1
206 no PRF 0409298A . "troponin C-like protein" . . . . . 100.00 148 97.28 100.00 1.76e-97 . . . . 17807 1
207 no PRF 0608335A . calmodulin . . . . . 100.00 148 97.96 99.32 1.40e-96 . . . . 17807 1
208 no REF NP_001008160 . "calmodulin [Xenopus (Silurana) tropicalis]" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
209 no REF NP_001009759 . "calmodulin [Ovis aries]" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
210 no REF NP_001027633 . "calmodulin [Ciona intestinalis]" . . . . . 100.00 149 97.28 98.64 1.71e-96 . . . . 17807 1
211 no REF NP_001039714 . "calmodulin [Bos taurus]" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
212 no REF NP_001040234 . "calmodulin [Bombyx mori]" . . . . . 100.00 149 97.96 99.32 4.26e-97 . . . . 17807 1
213 no SP O02367 . "RecName: Full=Calmodulin; Short=CaM; AltName: Full=Ci-CaM" . . . . . 100.00 149 97.28 98.64 1.71e-96 . . . . 17807 1
214 no SP O16305 . "RecName: Full=Calmodulin; Short=CaM" . . . . . 100.00 149 97.96 98.64 1.02e-96 . . . . 17807 1
215 no SP O96081 . "RecName: Full=Calmodulin-B; Short=CaM B" . . . . . 100.00 149 97.28 98.64 2.17e-96 . . . . 17807 1
216 no SP P02594 . "RecName: Full=Calmodulin; Short=CaM" . . . . . 100.00 149 99.32 100.00 8.72e-99 . . . . 17807 1
217 no SP P05932 . "RecName: Full=Calmodulin-beta; Short=Cam B" . . . . . 93.88 138 97.10 99.28 5.88e-90 . . . . 17807 1
218 no TPG DAA13808 . "TPA: calmodulin 2-like [Bos taurus]" . . . . . 100.00 216 98.64 98.64 1.55e-97 . . . . 17807 1
219 no TPG DAA18029 . "TPA: calmodulin [Bos taurus]" . . . . . 100.00 149 98.64 99.32 5.71e-98 . . . . 17807 1
220 no TPG DAA19590 . "TPA: calmodulin 3 [Bos taurus]" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
221 no TPG DAA24777 . "TPA: calmodulin 2-like [Bos taurus]" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
222 no TPG DAA24988 . "TPA: calmodulin 2-like isoform 1 [Bos taurus]" . . . . . 100.00 149 100.00 100.00 3.02e-99 . . . . 17807 1
stop_
loop_
_Entity_comp_index.ID
_Entity_comp_index.Auth_seq_ID
_Entity_comp_index.Comp_ID
_Entity_comp_index.Comp_label
_Entity_comp_index.Entry_ID
_Entity_comp_index.Entity_ID
1 2 ASP . 17807 1
2 3 GLN . 17807 1
3 4 LEU . 17807 1
4 5 THR . 17807 1
5 6 GLU . 17807 1
6 7 GLU . 17807 1
7 8 GLN . 17807 1
8 9 ILE . 17807 1
9 10 ALA . 17807 1
10 11 GLU . 17807 1
11 12 PHE . 17807 1
12 13 LYS . 17807 1
13 14 GLU . 17807 1
14 15 ALA . 17807 1
15 16 PHE . 17807 1
16 17 SER . 17807 1
17 18 LEU . 17807 1
18 19 PHE . 17807 1
19 20 ASP . 17807 1
20 21 LYS . 17807 1
21 22 ASP . 17807 1
22 23 GLY . 17807 1
23 24 ASP . 17807 1
24 25 GLY . 17807 1
25 26 THR . 17807 1
26 27 ILE . 17807 1
27 28 THR . 17807 1
28 29 THR . 17807 1
29 30 LYS . 17807 1
30 31 GLU . 17807 1
31 32 LEU . 17807 1
32 33 GLY . 17807 1
33 34 THR . 17807 1
34 35 VAL . 17807 1
35 36 MET . 17807 1
36 37 ARG . 17807 1
37 38 SER . 17807 1
38 39 LEU . 17807 1
39 40 GLY . 17807 1
40 41 GLN . 17807 1
41 42 ASN . 17807 1
42 43 PRO . 17807 1
43 44 THR . 17807 1
44 45 GLU . 17807 1
45 46 ALA . 17807 1
46 47 GLU . 17807 1
47 48 LEU . 17807 1
48 49 GLN . 17807 1
49 50 ASP . 17807 1
50 51 MET . 17807 1
51 52 ILE . 17807 1
52 53 ASN . 17807 1
53 54 GLU . 17807 1
54 55 VAL . 17807 1
55 56 ASP . 17807 1
56 57 ALA . 17807 1
57 58 ASP . 17807 1
58 59 GLY . 17807 1
59 60 ASN . 17807 1
60 61 GLY . 17807 1
61 62 THR . 17807 1
62 63 ILE . 17807 1
63 64 ASP . 17807 1
64 65 PHE . 17807 1
65 66 PRO . 17807 1
66 67 GLU . 17807 1
67 68 PHE . 17807 1
68 69 LEU . 17807 1
69 70 THR . 17807 1
70 71 MET . 17807 1
71 72 MET . 17807 1
72 73 ALA . 17807 1
73 74 ARG . 17807 1
74 75 LYS . 17807 1
75 76 MET . 17807 1
76 77 LYS . 17807 1
77 78 ASP . 17807 1
78 79 THR . 17807 1
79 80 ASP . 17807 1
80 81 SER . 17807 1
81 82 GLU . 17807 1
82 83 GLU . 17807 1
83 84 GLU . 17807 1
84 85 ILE . 17807 1
85 86 ARG . 17807 1
86 87 GLU . 17807 1
87 88 ALA . 17807 1
88 89 PHE . 17807 1
89 90 ARG . 17807 1
90 91 VAL . 17807 1
91 92 PHE . 17807 1
92 93 ASP . 17807 1
93 94 LYS . 17807 1
94 95 ASP . 17807 1
95 96 GLY . 17807 1
96 97 ASN . 17807 1
97 98 GLY . 17807 1
98 99 TYR . 17807 1
99 100 ILE . 17807 1
100 101 SER . 17807 1
101 102 ALA . 17807 1
102 103 ALA . 17807 1
103 104 GLU . 17807 1
104 105 LEU . 17807 1
105 106 ARG . 17807 1
106 107 HIS . 17807 1
107 108 VAL . 17807 1
108 109 MET . 17807 1
109 110 THR . 17807 1
110 111 ASN . 17807 1
111 112 LEU . 17807 1
112 113 GLY . 17807 1
113 114 GLU . 17807 1
114 115 LYS . 17807 1
115 116 LEU . 17807 1
116 117 THR . 17807 1
117 118 ASP . 17807 1
118 119 GLU . 17807 1
119 120 GLU . 17807 1
120 121 VAL . 17807 1
121 122 ASP . 17807 1
122 123 GLU . 17807 1
123 124 MET . 17807 1
124 125 ILE . 17807 1
125 126 ARG . 17807 1
126 127 GLU . 17807 1
127 128 ALA . 17807 1
128 129 ASP . 17807 1
129 130 ILE . 17807 1
130 131 ASP . 17807 1
131 132 GLY . 17807 1
132 133 ASP . 17807 1
133 134 GLY . 17807 1
134 135 GLN . 17807 1
135 136 VAL . 17807 1
136 137 ASN . 17807 1
137 138 TYR . 17807 1
138 139 GLU . 17807 1
139 140 GLU . 17807 1
140 141 PHE . 17807 1
141 142 VAL . 17807 1
142 143 GLN . 17807 1
143 144 MET . 17807 1
144 145 MET . 17807 1
145 146 THR . 17807 1
146 147 ALA . 17807 1
147 148 LYS . 17807 1
stop_
loop_
_Entity_poly_seq.Hetero
_Entity_poly_seq.Mon_ID
_Entity_poly_seq.Num
_Entity_poly_seq.Comp_index_ID
_Entity_poly_seq.Entry_ID
_Entity_poly_seq.Entity_ID
. ASP 1 1 17807 1
. GLN 2 2 17807 1
. LEU 3 3 17807 1
. THR 4 4 17807 1
. GLU 5 5 17807 1
. GLU 6 6 17807 1
. GLN 7 7 17807 1
. ILE 8 8 17807 1
. ALA 9 9 17807 1
. GLU 10 10 17807 1
. PHE 11 11 17807 1
. LYS 12 12 17807 1
. GLU 13 13 17807 1
. ALA 14 14 17807 1
. PHE 15 15 17807 1
. SER 16 16 17807 1
. LEU 17 17 17807 1
. PHE 18 18 17807 1
. ASP 19 19 17807 1
. LYS 20 20 17807 1
. ASP 21 21 17807 1
. GLY 22 22 17807 1
. ASP 23 23 17807 1
. GLY 24 24 17807 1
. THR 25 25 17807 1
. ILE 26 26 17807 1
. THR 27 27 17807 1
. THR 28 28 17807 1
. LYS 29 29 17807 1
. GLU 30 30 17807 1
. LEU 31 31 17807 1
. GLY 32 32 17807 1
. THR 33 33 17807 1
. VAL 34 34 17807 1
. MET 35 35 17807 1
. ARG 36 36 17807 1
. SER 37 37 17807 1
. LEU 38 38 17807 1
. GLY 39 39 17807 1
. GLN 40 40 17807 1
. ASN 41 41 17807 1
. PRO 42 42 17807 1
. THR 43 43 17807 1
. GLU 44 44 17807 1
. ALA 45 45 17807 1
. GLU 46 46 17807 1
. LEU 47 47 17807 1
. GLN 48 48 17807 1
. ASP 49 49 17807 1
. MET 50 50 17807 1
. ILE 51 51 17807 1
. ASN 52 52 17807 1
. GLU 53 53 17807 1
. VAL 54 54 17807 1
. ASP 55 55 17807 1
. ALA 56 56 17807 1
. ASP 57 57 17807 1
. GLY 58 58 17807 1
. ASN 59 59 17807 1
. GLY 60 60 17807 1
. THR 61 61 17807 1
. ILE 62 62 17807 1
. ASP 63 63 17807 1
. PHE 64 64 17807 1
. PRO 65 65 17807 1
. GLU 66 66 17807 1
. PHE 67 67 17807 1
. LEU 68 68 17807 1
. THR 69 69 17807 1
. MET 70 70 17807 1
. MET 71 71 17807 1
. ALA 72 72 17807 1
. ARG 73 73 17807 1
. LYS 74 74 17807 1
. MET 75 75 17807 1
. LYS 76 76 17807 1
. ASP 77 77 17807 1
. THR 78 78 17807 1
. ASP 79 79 17807 1
. SER 80 80 17807 1
. GLU 81 81 17807 1
. GLU 82 82 17807 1
. GLU 83 83 17807 1
. ILE 84 84 17807 1
. ARG 85 85 17807 1
. GLU 86 86 17807 1
. ALA 87 87 17807 1
. PHE 88 88 17807 1
. ARG 89 89 17807 1
. VAL 90 90 17807 1
. PHE 91 91 17807 1
. ASP 92 92 17807 1
. LYS 93 93 17807 1
. ASP 94 94 17807 1
. GLY 95 95 17807 1
. ASN 96 96 17807 1
. GLY 97 97 17807 1
. TYR 98 98 17807 1
. ILE 99 99 17807 1
. SER 100 100 17807 1
. ALA 101 101 17807 1
. ALA 102 102 17807 1
. GLU 103 103 17807 1
. LEU 104 104 17807 1
. ARG 105 105 17807 1
. HIS 106 106 17807 1
. VAL 107 107 17807 1
. MET 108 108 17807 1
. THR 109 109 17807 1
. ASN 110 110 17807 1
. LEU 111 111 17807 1
. GLY 112 112 17807 1
. GLU 113 113 17807 1
. LYS 114 114 17807 1
. LEU 115 115 17807 1
. THR 116 116 17807 1
. ASP 117 117 17807 1
. GLU 118 118 17807 1
. GLU 119 119 17807 1
. VAL 120 120 17807 1
. ASP 121 121 17807 1
. GLU 122 122 17807 1
. MET 123 123 17807 1
. ILE 124 124 17807 1
. ARG 125 125 17807 1
. GLU 126 126 17807 1
. ALA 127 127 17807 1
. ASP 128 128 17807 1
. ILE 129 129 17807 1
. ASP 130 130 17807 1
. GLY 131 131 17807 1
. ASP 132 132 17807 1
. GLY 133 133 17807 1
. GLN 134 134 17807 1
. VAL 135 135 17807 1
. ASN 136 136 17807 1
. TYR 137 137 17807 1
. GLU 138 138 17807 1
. GLU 139 139 17807 1
. PHE 140 140 17807 1
. VAL 141 141 17807 1
. GLN 142 142 17807 1
. MET 143 143 17807 1
. MET 144 144 17807 1
. THR 145 145 17807 1
. ALA 146 146 17807 1
. LYS 147 147 17807 1
stop_
save_
save_bind_dom
_Entity.Sf_category entity
_Entity.Sf_framecode bind_dom
_Entity.Entry_ID 17807
_Entity.ID 2
_Entity.BMRB_code .
_Entity.Name 'L-selectin binding domain peptide'
_Entity.Type polymer
_Entity.Polymer_common_type .
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_type_details .
_Entity.Polymer_strand_ID B
_Entity.Polymer_seq_one_letter_code_can .
_Entity.Polymer_seq_one_letter_code AFIIWLARRLKKGKK
_Entity.Target_identifier .
_Entity.Polymer_author_defined_seq .
_Entity.Polymer_author_seq_details .
_Entity.Ambiguous_conformational_states no
_Entity.Ambiguous_chem_comp_sites no
_Entity.Nstd_monomer no
_Entity.Nstd_chirality no
_Entity.Nstd_linkage no
_Entity.Nonpolymer_comp_ID .
_Entity.Nonpolymer_comp_label .
_Entity.Number_of_monomers 15
_Entity.Number_of_nonpolymer_components .
_Entity.Paramagnetic no
_Entity.Thiol_state 'not present'
_Entity.Src_method man
_Entity.Parent_entity_ID .
_Entity.Fragment .
_Entity.Mutation .
_Entity.EC_number .
_Entity.Calc_isoelectric_point .
_Entity.Formula_weight 1834.365
_Entity.Formula_weight_exptl .
_Entity.Formula_weight_exptl_meth .
_Entity.Details .
_Entity.DB_query_date .
_Entity.DB_query_revised_last_date 2015-01-30
loop_
_Entity_db_link.Ordinal
_Entity_db_link.Author_supplied
_Entity_db_link.Database_code
_Entity_db_link.Accession_code
_Entity_db_link.Entry_mol_code
_Entity_db_link.Entry_mol_name
_Entity_db_link.Entry_experimental_method
_Entity_db_link.Entry_structure_resolution
_Entity_db_link.Entry_relation_type
_Entity_db_link.Entry_details
_Entity_db_link.Chimera_segment_ID
_Entity_db_link.Seq_query_to_submitted_percent
_Entity_db_link.Seq_subject_length
_Entity_db_link.Seq_identity
_Entity_db_link.Seq_positive
_Entity_db_link.Seq_homology_expectation_val
_Entity_db_link.Seq_align_begin
_Entity_db_link.Seq_align_end
_Entity_db_link.Seq_difference_details
_Entity_db_link.Seq_alignment_details
_Entity_db_link.Entry_ID
_Entity_db_link.Entity_ID
1 no PDB 2LGF . "Solution Structure Of Ca2+CALMODULIN COMPLEXED WITH A PEPTIDE Representing The Calmodulin-Binding Domain Of L-Selectin" . . . . . 100.00 15 100.00 100.00 9.28e+00 . . . . 17807 2
2 no DBJ BAA01613 . "LECAM-1 [Rattus norvegicus]" . . . . . 100.00 372 100.00 100.00 1.31e+00 . . . . 17807 2
3 no DBJ BAF46391 . "selectin L [Felis catus]" . . . . . 100.00 376 100.00 100.00 9.13e-01 . . . . 17807 2
4 no DBJ BAG35555 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 372 100.00 100.00 1.14e+00 . . . . 17807 2
5 no DBJ BAG60862 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 325 100.00 100.00 7.35e-01 . . . . 17807 2
6 no DBJ BAI47122 . "selectin L [synthetic construct]" . . . . . 100.00 385 100.00 100.00 1.32e+00 . . . . 17807 2
7 no EMBL CAA34203 . "pln homing receptor [Homo sapiens]" . . . . . 100.00 372 100.00 100.00 1.17e+00 . . . . 17807 2
8 no EMBL CAA34275 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 372 100.00 100.00 1.08e+00 . . . . 17807 2
9 no EMBL CAB43536 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 385 100.00 100.00 1.33e+00 . . . . 17807 2
10 no EMBL CAB55488 . "L-selectin [Homo sapiens]" . . . . . 100.00 385 100.00 100.00 1.32e+00 . . . . 17807 2
11 no GB AAA67896 . "L-selectin precursor [Oryctolagus cuniculus]" . . . . . 100.00 376 100.00 100.00 1.31e+00 . . . . 17807 2
12 no GB AAB18246 . "L-selectin [Macaca mulatta]" . . . . . 100.00 372 100.00 100.00 7.94e-01 . . . . 17807 2
13 no GB AAB18247 . "L-selectin [Pongo pygmaeus]" . . . . . 100.00 372 100.00 100.00 9.08e-01 . . . . 17807 2
14 no GB AAB18248 . "L-selectin [Pan troglodytes]" . . . . . 100.00 372 100.00 100.00 1.14e+00 . . . . 17807 2
15 no GB AAB40903 . "L-selectin precursor [Papio anubis]" . . . . . 100.00 372 100.00 100.00 7.94e-01 . . . . 17807 2
16 no PRF 1516348A . "antigen Leu8" . . . . . 100.00 385 100.00 100.00 1.33e+00 . . . . 17807 2
17 no REF NP_000646 . "L-selectin precursor [Homo sapiens]" . . . . . 100.00 385 100.00 100.00 1.32e+00 . . . . 17807 2
18 no REF NP_001009074 . "L-selectin precursor [Pan troglodytes]" . . . . . 100.00 372 100.00 100.00 1.14e+00 . . . . 17807 2
19 no REF NP_001036228 . "L-selectin precursor [Macaca mulatta]" . . . . . 100.00 372 100.00 100.00 7.94e-01 . . . . 17807 2
20 no REF NP_001075821 . "L-selectin precursor [Oryctolagus cuniculus]" . . . . . 100.00 376 100.00 100.00 1.31e+00 . . . . 17807 2
21 no REF NP_001082779 . "L-selectin [Felis catus]" . . . . . 100.00 376 100.00 100.00 9.13e-01 . . . . 17807 2
22 no SP P14151 . "RecName: Full=L-selectin; AltName: Full=CD62 antigen-like family member L; AltName: Full=Leukocyte adhesion molecule 1; Short=L" . . . . . 100.00 372 100.00 100.00 1.14e+00 . . . . 17807 2
23 no SP P30836 . "RecName: Full=L-selectin; AltName: Full=CD62 antigen-like family member L; AltName: Full=Leukocyte adhesion molecule 1; Short=L" . . . . . 100.00 372 100.00 100.00 1.31e+00 . . . . 17807 2
24 no SP Q28768 . "RecName: Full=L-selectin; AltName: Full=CD62 antigen-like family member L; AltName: Full=Leukocyte adhesion molecule 1; Short=L" . . . . . 100.00 372 100.00 100.00 7.94e-01 . . . . 17807 2
25 no SP Q95198 . "RecName: Full=L-selectin; AltName: Full=CD62 antigen-like family member L; AltName: Full=Leukocyte adhesion molecule 1; Short=L" . . . . . 100.00 372 100.00 100.00 7.94e-01 . . . . 17807 2
26 no SP Q95235 . "RecName: Full=L-selectin; AltName: Full=CD62 antigen-like family member L; AltName: Full=Leukocyte adhesion molecule 1; Short=L" . . . . . 100.00 372 100.00 100.00 9.08e-01 . . . . 17807 2
stop_
loop_
_Entity_comp_index.ID
_Entity_comp_index.Auth_seq_ID
_Entity_comp_index.Comp_ID
_Entity_comp_index.Comp_label
_Entity_comp_index.Entry_ID
_Entity_comp_index.Entity_ID
1 349 ALA . 17807 2
2 350 PHE . 17807 2
3 351 ILE . 17807 2
4 352 ILE . 17807 2
5 353 TRP . 17807 2
6 354 LEU . 17807 2
7 355 ALA . 17807 2
8 356 ARG . 17807 2
9 357 ARG . 17807 2
10 358 LEU . 17807 2
11 359 LYS . 17807 2
12 360 LYS . 17807 2
13 361 GLY . 17807 2
14 362 LYS . 17807 2
15 363 LYS . 17807 2
stop_
loop_
_Entity_poly_seq.Hetero
_Entity_poly_seq.Mon_ID
_Entity_poly_seq.Num
_Entity_poly_seq.Comp_index_ID
_Entity_poly_seq.Entry_ID
_Entity_poly_seq.Entity_ID
. ALA 1 1 17807 2
. PHE 2 2 17807 2
. ILE 3 3 17807 2
. ILE 4 4 17807 2
. TRP 5 5 17807 2
. LEU 6 6 17807 2
. ALA 7 7 17807 2
. ARG 8 8 17807 2
. ARG 9 9 17807 2
. LEU 10 10 17807 2
. LYS 11 11 17807 2
. LYS 12 12 17807 2
. GLY 13 13 17807 2
. LYS 14 14 17807 2
. LYS 15 15 17807 2
stop_
save_
save_CA
_Entity.Sf_category entity
_Entity.Sf_framecode CA
_Entity.Entry_ID 17807
_Entity.ID 3
_Entity.BMRB_code .
_Entity.Name CA
_Entity.Type non-polymer
_Entity.Polymer_common_type .
_Entity.Polymer_type .
_Entity.Polymer_type_details .
_Entity.Polymer_strand_ID .
_Entity.Polymer_seq_one_letter_code_can .
_Entity.Polymer_seq_one_letter_code .
_Entity.Target_identifier .
_Entity.Polymer_author_defined_seq .
_Entity.Polymer_author_seq_details .
_Entity.Ambiguous_conformational_states no
_Entity.Ambiguous_chem_comp_sites no
_Entity.Nstd_monomer .
_Entity.Nstd_chirality no
_Entity.Nstd_linkage no
_Entity.Nonpolymer_comp_ID CA
_Entity.Nonpolymer_comp_label $chem_comp_CA
_Entity.Number_of_monomers .
_Entity.Number_of_nonpolymer_components .
_Entity.Paramagnetic .
_Entity.Thiol_state .
_Entity.Src_method .
_Entity.Parent_entity_ID 3
_Entity.Fragment .
_Entity.Mutation .
_Entity.EC_number .
_Entity.Calc_isoelectric_point .
_Entity.Formula_weight .
_Entity.Formula_weight_exptl .
_Entity.Formula_weight_exptl_meth .
_Entity.Details .
_Entity.DB_query_date .
_Entity.DB_query_revised_last_date .
loop_
_Entity_comp_index.ID
_Entity_comp_index.Auth_seq_ID
_Entity_comp_index.Comp_ID
_Entity_comp_index.Comp_label
_Entity_comp_index.Entry_ID
_Entity_comp_index.Entity_ID
1 . CA . 17807 3
stop_
save_
####################
# Natural source #
####################
save_natural_source
_Entity_natural_src_list.Sf_category natural_source
_Entity_natural_src_list.Sf_framecode natural_source
_Entity_natural_src_list.Entry_ID 17807
_Entity_natural_src_list.ID 1
loop_
_Entity_natural_src.ID
_Entity_natural_src.Entity_ID
_Entity_natural_src.Entity_label
_Entity_natural_src.Entity_chimera_segment_ID
_Entity_natural_src.NCBI_taxonomy_ID
_Entity_natural_src.Type
_Entity_natural_src.Common
_Entity_natural_src.Organism_name_scientific
_Entity_natural_src.Organism_name_common
_Entity_natural_src.Organism_acronym
_Entity_natural_src.ICTVdb_decimal_code
_Entity_natural_src.Superkingdom
_Entity_natural_src.Kingdom
_Entity_natural_src.Genus
_Entity_natural_src.Species
_Entity_natural_src.Strain
_Entity_natural_src.Variant
_Entity_natural_src.Subvariant
_Entity_natural_src.Organ
_Entity_natural_src.Tissue
_Entity_natural_src.Tissue_fraction
_Entity_natural_src.Cell_line
_Entity_natural_src.Cell_type
_Entity_natural_src.ATCC_number
_Entity_natural_src.Organelle
_Entity_natural_src.Cellular_location
_Entity_natural_src.Fragment
_Entity_natural_src.Fraction
_Entity_natural_src.Secretion
_Entity_natural_src.Plasmid
_Entity_natural_src.Plasmid_details
_Entity_natural_src.Gene_mnemonic
_Entity_natural_src.Dev_stage
_Entity_natural_src.Details
_Entity_natural_src.Citation_ID
_Entity_natural_src.Citation_label
_Entity_natural_src.Entry_ID
_Entity_natural_src.Entity_natural_src_list_ID
1 1 $CaM . 562 organism . 'Escherichia coli' 'E. coli' . . Bacteria . Escherichia coli . . . . . . . . . . . . . . . . . . . . . 17807 1
stop_
save_
#########################
# Experimental source #
#########################
save_experimental_source
_Entity_experimental_src_list.Sf_category experimental_source
_Entity_experimental_src_list.Sf_framecode experimental_source
_Entity_experimental_src_list.Entry_ID 17807
_Entity_experimental_src_list.ID 1
loop_
_Entity_experimental_src.ID
_Entity_experimental_src.Entity_ID
_Entity_experimental_src.Entity_label
_Entity_experimental_src.Entity_chimera_segment_ID
_Entity_experimental_src.Production_method
_Entity_experimental_src.Host_org_scientific_name
_Entity_experimental_src.Host_org_name_common
_Entity_experimental_src.Host_org_details
_Entity_experimental_src.Host_org_NCBI_taxonomy_ID
_Entity_experimental_src.Host_org_genus
_Entity_experimental_src.Host_org_species
_Entity_experimental_src.Host_org_strain
_Entity_experimental_src.Host_org_variant
_Entity_experimental_src.Host_org_subvariant
_Entity_experimental_src.Host_org_organ
_Entity_experimental_src.Host_org_tissue
_Entity_experimental_src.Host_org_tissue_fraction
_Entity_experimental_src.Host_org_cell_line
_Entity_experimental_src.Host_org_cell_type
_Entity_experimental_src.Host_org_cellular_location
_Entity_experimental_src.Host_org_organelle
_Entity_experimental_src.Host_org_gene
_Entity_experimental_src.Host_org_culture_collection
_Entity_experimental_src.Host_org_ATCC_number
_Entity_experimental_src.Vector_type
_Entity_experimental_src.PDBview_host_org_vector_name
_Entity_experimental_src.PDBview_plasmid_name
_Entity_experimental_src.Vector_name
_Entity_experimental_src.Vector_details
_Entity_experimental_src.Vendor_name
_Entity_experimental_src.Host_org_dev_stage
_Entity_experimental_src.Details
_Entity_experimental_src.Citation_ID
_Entity_experimental_src.Citation_label
_Entity_experimental_src.Entry_ID
_Entity_experimental_src.Entity_experimental_src_list_ID
1 1 $CaM . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pET30b(+) . . . . . . 17807 1
2 2 $bind_dom . 'chemical synthesis' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 17807 1
3 3 $CA . 'obtained from a vendor' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 17807 1
stop_
save_
#################################
# Polymer residues and ligands #
#################################
save_chem_comp_CA
_Chem_comp.Sf_category chem_comp
_Chem_comp.Sf_framecode chem_comp_CA
_Chem_comp.Entry_ID 17807
_Chem_comp.ID CA
_Chem_comp.Provenance .
_Chem_comp.Name 'CALCIUM ION'
_Chem_comp.Type non-polymer
_Chem_comp.BMRB_code .
_Chem_comp.PDB_code CA
_Chem_comp.Ambiguous_flag no
_Chem_comp.Initial_date 1999-07-08
_Chem_comp.Modified_date 2011-06-04
_Chem_comp.Release_status REL
_Chem_comp.Replaced_by .
_Chem_comp.Replaces .
_Chem_comp.One_letter_code .
_Chem_comp.Three_letter_code CA
_Chem_comp.Number_atoms_all .
_Chem_comp.Number_atoms_nh .
_Chem_comp.PubChem_code .
_Chem_comp.Subcomponent_list .
_Chem_comp.InChI_code .
_Chem_comp.Mon_nstd_flag .
_Chem_comp.Mon_nstd_class .
_Chem_comp.Mon_nstd_details .
_Chem_comp.Mon_nstd_parent .
_Chem_comp.Mon_nstd_parent_comp_ID .
_Chem_comp.Std_deriv_one_letter_code .
_Chem_comp.Std_deriv_three_letter_code .
_Chem_comp.Std_deriv_BMRB_code .
_Chem_comp.Std_deriv_PDB_code .
_Chem_comp.Std_deriv_chem_comp_name .
_Chem_comp.Synonyms .
_Chem_comp.Formal_charge 2
_Chem_comp.Paramagnetic .
_Chem_comp.Aromatic no
_Chem_comp.Formula Ca
_Chem_comp.Formula_weight 40.078
_Chem_comp.Formula_mono_iso_wt_nat .
_Chem_comp.Formula_mono_iso_wt_13C .
_Chem_comp.Formula_mono_iso_wt_15N .
_Chem_comp.Formula_mono_iso_wt_13C_15N .
_Chem_comp.Image_file_name .
_Chem_comp.Image_file_format .
_Chem_comp.Topo_file_name .
_Chem_comp.Topo_file_format .
_Chem_comp.Struct_file_name .
_Chem_comp.Struct_file_format .
_Chem_comp.Stereochem_param_file_name .
_Chem_comp.Stereochem_param_file_format .
_Chem_comp.Model_details .
_Chem_comp.Model_erf .
_Chem_comp.Model_source .
_Chem_comp.Model_coordinates_details .
_Chem_comp.Model_coordinates_missing_flag no
_Chem_comp.Ideal_coordinates_details .
_Chem_comp.Ideal_coordinates_missing_flag no
_Chem_comp.Model_coordinates_db_code .
_Chem_comp.Processing_site RCSB
_Chem_comp.Vendor .
_Chem_comp.Vendor_product_code .
_Chem_comp.Details
;
Information obtained from PDB's Chemical Component Dictionary
at http://wwpdb-remediation.rutgers.edu/downloads.html
Downloaded on Wed Jun 15 15:31:50 2011
;
_Chem_comp.DB_query_date .
_Chem_comp.DB_last_query_revised_last_date .
loop_
_Chem_comp_descriptor.Descriptor
_Chem_comp_descriptor.Type
_Chem_comp_descriptor.Program
_Chem_comp_descriptor.Program_version
_Chem_comp_descriptor.Entry_ID
_Chem_comp_descriptor.Comp_ID
BHPQYMZQTOCNFJ-UHFFFAOYSA-N InChIKey InChI 1.03 17807 CA
[Ca++] SMILES CACTVS 3.341 17807 CA
[Ca++] SMILES_CANONICAL CACTVS 3.341 17807 CA
[Ca+2] SMILES ACDLabs 10.04 17807 CA
[Ca+2] SMILES 'OpenEye OEToolkits' 1.5.0 17807 CA
[Ca+2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 17807 CA
InChI=1S/Ca/q+2 InChI InChI 1.03 17807 CA
stop_
loop_
_Chem_comp_identifier.Identifier
_Chem_comp_identifier.Type
_Chem_comp_identifier.Program
_Chem_comp_identifier.Program_version
_Chem_comp_identifier.Entry_ID
_Chem_comp_identifier.Comp_ID
calcium 'SYSTEMATIC NAME' ACDLabs 10.04 17807 CA
'calcium(+2) cation' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 17807 CA
stop_
loop_
_Chem_comp_atom.Atom_ID
_Chem_comp_atom.BMRB_code
_Chem_comp_atom.PDB_atom_ID
_Chem_comp_atom.Alt_atom_ID
_Chem_comp_atom.Auth_atom_ID
_Chem_comp_atom.Type_symbol
_Chem_comp_atom.Isotope_number
_Chem_comp_atom.Chirality
_Chem_comp_atom.Stereo_config
_Chem_comp_atom.Charge
_Chem_comp_atom.Partial_charge
_Chem_comp_atom.Oxidation_number
_Chem_comp_atom.Unpaired_electron_number
_Chem_comp_atom.Align
_Chem_comp_atom.Aromatic_flag
_Chem_comp_atom.Leaving_atom_flag
_Chem_comp_atom.Substruct_code
_Chem_comp_atom.Ionizable
_Chem_comp_atom.Drawing_2D_coord_x
_Chem_comp_atom.Drawing_2D_coord_y
_Chem_comp_atom.Model_Cartn_x
_Chem_comp_atom.Model_Cartn_x_esd
_Chem_comp_atom.Model_Cartn_y
_Chem_comp_atom.Model_Cartn_y_esd
_Chem_comp_atom.Model_Cartn_z
_Chem_comp_atom.Model_Cartn_z_esd
_Chem_comp_atom.Model_Cartn_x_ideal
_Chem_comp_atom.Model_Cartn_y_ideal
_Chem_comp_atom.Model_Cartn_z_ideal
_Chem_comp_atom.PDBX_ordinal
_Chem_comp_atom.Details
_Chem_comp_atom.Entry_ID
_Chem_comp_atom.Comp_ID
CA . CA . . CA . . N 2 . . . . no no . . . . 0.000 . 0.000 . 0.000 . 0.000 0.000 0.000 1 . 17807 CA
stop_
save_
#####################################
# Sample contents and methodology #
#####################################
########################
# Sample description #
########################
save_sample_1
_Sample.Sf_category sample
_Sample.Sf_framecode sample_1
_Sample.Entry_ID 17807
_Sample.ID 1
_Sample.Type solution
_Sample.Sub_type .
_Sample.Details 'Sample for backbone and side chain assignment of CaM in the complex'
_Sample.Aggregate_sample_number .
_Sample.Solvent_system '90% H2O/10% D2O'
_Sample.Preparation_date .
_Sample.Preparation_expiration_date .
_Sample.Polycrystallization_protocol .
_Sample.Single_crystal_protocol .
_Sample.Crystal_grow_apparatus .
_Sample.Crystal_grow_atmosphere .
_Sample.Crystal_grow_details .
_Sample.Crystal_grow_method .
_Sample.Crystal_grow_method_cit_ID .
_Sample.Crystal_grow_pH .
_Sample.Crystal_grow_pH_range .
_Sample.Crystal_grow_pressure .
_Sample.Crystal_grow_pressure_esd .
_Sample.Crystal_grow_seeding .
_Sample.Crystal_grow_seeding_cit_ID .
_Sample.Crystal_grow_temp .
_Sample.Crystal_grow_temp_details .
_Sample.Crystal_grow_temp_esd .
_Sample.Crystal_grow_time .
_Sample.Oriented_sample_prep_protocol .
_Sample.Lyophilization_cryo_protectant .
_Sample.Storage_protocol .
loop_
_Sample_component.ID
_Sample_component.Mol_common_name
_Sample_component.Isotopic_labeling
_Sample_component.Assembly_ID
_Sample_component.Assembly_label
_Sample_component.Entity_ID
_Sample_component.Entity_label
_Sample_component.Product_ID
_Sample_component.Type
_Sample_component.Concentration_val
_Sample_component.Concentration_val_min
_Sample_component.Concentration_val_max
_Sample_component.Concentration_val_units
_Sample_component.Concentration_val_err
_Sample_component.Vendor
_Sample_component.Vendor_product_name
_Sample_component.Vendor_product_code
_Sample_component.Entry_ID
_Sample_component.Sample_ID
1 Calmodulin '[U-13C; U-15N]' . . 1 $CaM . . . 0.5 0.8 mM . . . . 17807 1
2 'L-selectin binding domain peptide' 'natural abundance' . . 2 $bind_dom . . . 0.5 0.8 mM . . . . 17807 1
3 'CALCIUM ION' 'natural abundance' . . 3 $CA . . 4 . . mM . . . . 17807 1
4 DSS 'natural abundance' . . . . . . 0.5 . . mM . . . . 17807 1
5 'potassium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 17807 1
6 'sodium azide' 'natural abundance' . . . . . . 0.03 . . % . . . . 17807 1
7 Bis-Tris 'natural abundance' . . . . . . 20 . . mM . . . . 17807 1
8 H2O 'natural abundance' . . . . . . 90 . . % . . . . 17807 1
9 D2O 'natural abundance' . . . . . . 10 . . % . . . . 17807 1
stop_
save_
save_sample_2
_Sample.Sf_category sample
_Sample.Sf_framecode sample_2
_Sample.Entry_ID 17807
_Sample.ID 2
_Sample.Type solution
_Sample.Sub_type .
_Sample.Details 'Sample for collecting intrapeptide NOEs to determine the structure of the bound LSEL15'
_Sample.Aggregate_sample_number .
_Sample.Solvent_system '90% H2O/10% D2O'
_Sample.Preparation_date .
_Sample.Preparation_expiration_date .
_Sample.Polycrystallization_protocol .
_Sample.Single_crystal_protocol .
_Sample.Crystal_grow_apparatus .
_Sample.Crystal_grow_atmosphere .
_Sample.Crystal_grow_details .
_Sample.Crystal_grow_method .
_Sample.Crystal_grow_method_cit_ID .
_Sample.Crystal_grow_pH .
_Sample.Crystal_grow_pH_range .
_Sample.Crystal_grow_pressure .
_Sample.Crystal_grow_pressure_esd .
_Sample.Crystal_grow_seeding .
_Sample.Crystal_grow_seeding_cit_ID .
_Sample.Crystal_grow_temp .
_Sample.Crystal_grow_temp_details .
_Sample.Crystal_grow_temp_esd .
_Sample.Crystal_grow_time .
_Sample.Oriented_sample_prep_protocol .
_Sample.Lyophilization_cryo_protectant .
_Sample.Storage_protocol .
loop_
_Sample_component.ID
_Sample_component.Mol_common_name
_Sample_component.Isotopic_labeling
_Sample_component.Assembly_ID
_Sample_component.Assembly_label
_Sample_component.Entity_ID
_Sample_component.Entity_label
_Sample_component.Product_ID
_Sample_component.Type
_Sample_component.Concentration_val
_Sample_component.Concentration_val_min
_Sample_component.Concentration_val_max
_Sample_component.Concentration_val_units
_Sample_component.Concentration_val_err
_Sample_component.Vendor
_Sample_component.Vendor_product_name
_Sample_component.Vendor_product_code
_Sample_component.Entry_ID
_Sample_component.Sample_ID
1 Calmodulin '[U-2H; U-15N]' . . 1 $CaM . . . 0.5 0.8 mM . . . . 17807 2
2 'L-selectin binding domain peptide' 'natural abundance' . . 2 $bind_dom . . . 0.5 0.8 mM . . . . 17807 2
3 'CALCIUM ION' 'natural abundance' . . 3 $CA . . 4 . . mM . . . . 17807 2
4 DSS 'natural abundance' . . . . . . 0.5 . . mM . . . . 17807 2
5 'potassium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 17807 2
6 'sodium azide' 'natural abundance' . . . . . . 0.03 . . % . . . . 17807 2
7 Bis-Tris 'natural abundance' . . . . . . 20 . . mM . . . . 17807 2
8 H2O 'natural abundance' . . . . . . 90 . . % . . . . 17807 2
9 D2O 'natural abundance' . . . . . . 10 . . % . . . . 17807 2
stop_
save_
save_sample_3
_Sample.Sf_category sample
_Sample.Sf_framecode sample_3
_Sample.Entry_ID 17807
_Sample.ID 3
_Sample.Type solution
_Sample.Sub_type .
_Sample.Details 'Methionine methyl-labeled CaM sample for the collection of intermolecular NOEs between CaM and the bound peptide'
_Sample.Aggregate_sample_number .
_Sample.Solvent_system '100% D2O'
_Sample.Preparation_date .
_Sample.Preparation_expiration_date .
_Sample.Polycrystallization_protocol .
_Sample.Single_crystal_protocol .
_Sample.Crystal_grow_apparatus .
_Sample.Crystal_grow_atmosphere .
_Sample.Crystal_grow_details .
_Sample.Crystal_grow_method .
_Sample.Crystal_grow_method_cit_ID .
_Sample.Crystal_grow_pH .
_Sample.Crystal_grow_pH_range .
_Sample.Crystal_grow_pressure .
_Sample.Crystal_grow_pressure_esd .
_Sample.Crystal_grow_seeding .
_Sample.Crystal_grow_seeding_cit_ID .
_Sample.Crystal_grow_temp .
_Sample.Crystal_grow_temp_details .
_Sample.Crystal_grow_temp_esd .
_Sample.Crystal_grow_time .
_Sample.Oriented_sample_prep_protocol .
_Sample.Lyophilization_cryo_protectant .
_Sample.Storage_protocol .
loop_
_Sample_component.ID
_Sample_component.Mol_common_name
_Sample_component.Isotopic_labeling
_Sample_component.Assembly_ID
_Sample_component.Assembly_label
_Sample_component.Entity_ID
_Sample_component.Entity_label
_Sample_component.Product_ID
_Sample_component.Type
_Sample_component.Concentration_val
_Sample_component.Concentration_val_min
_Sample_component.Concentration_val_max
_Sample_component.Concentration_val_units
_Sample_component.Concentration_val_err
_Sample_component.Vendor
_Sample_component.Vendor_product_name
_Sample_component.Vendor_product_code
_Sample_component.Entry_ID
_Sample_component.Sample_ID
1 Calmodulin '[1H/13C-methyl Met; U-2H; U-15N]' . . 1 $CaM . . . 0.5 0.8 mM . . . . 17807 3
2 'L-selectin binding domain peptide' 'natural abundance' . . 2 $bind_dom . . . 0.5 0.8 mM . . . . 17807 3
3 'CALCIUM ION' 'natural abundance' . . 3 $CA . . 4 . . mM . . . . 17807 3
4 DSS 'natural abundance' . . . . . . 0.5 . . mM . . . . 17807 3
5 'potassium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 17807 3
6 'sodium azide' 'natural abundance' . . . . . . 0.03 . . % . . . . 17807 3
7 Bis-Tris 'natural abundance' . . . . . . 20 . . mM . . . . 17807 3
8 D2O 'natural abundance' . . . . . . 100 . . % . . . . 17807 3
stop_
save_
save_sample_4
_Sample.Sf_category sample
_Sample.Sf_framecode sample_4
_Sample.Entry_ID 17807
_Sample.ID 4
_Sample.Type solution
_Sample.Sub_type .
_Sample.Details 'Isotropic U-13;U-15 sample for collection of CaM RDCs'
_Sample.Aggregate_sample_number .
_Sample.Solvent_system '90% H2O/10% D2O'
_Sample.Preparation_date .
_Sample.Preparation_expiration_date .
_Sample.Polycrystallization_protocol .
_Sample.Single_crystal_protocol .
_Sample.Crystal_grow_apparatus .
_Sample.Crystal_grow_atmosphere .
_Sample.Crystal_grow_details .
_Sample.Crystal_grow_method .
_Sample.Crystal_grow_method_cit_ID .
_Sample.Crystal_grow_pH .
_Sample.Crystal_grow_pH_range .
_Sample.Crystal_grow_pressure .
_Sample.Crystal_grow_pressure_esd .
_Sample.Crystal_grow_seeding .
_Sample.Crystal_grow_seeding_cit_ID .
_Sample.Crystal_grow_temp .
_Sample.Crystal_grow_temp_details .
_Sample.Crystal_grow_temp_esd .
_Sample.Crystal_grow_time .
_Sample.Oriented_sample_prep_protocol .
_Sample.Lyophilization_cryo_protectant .
_Sample.Storage_protocol .
loop_
_Sample_component.ID
_Sample_component.Mol_common_name
_Sample_component.Isotopic_labeling
_Sample_component.Assembly_ID
_Sample_component.Assembly_label
_Sample_component.Entity_ID
_Sample_component.Entity_label
_Sample_component.Product_ID
_Sample_component.Type
_Sample_component.Concentration_val
_Sample_component.Concentration_val_min
_Sample_component.Concentration_val_max
_Sample_component.Concentration_val_units
_Sample_component.Concentration_val_err
_Sample_component.Vendor
_Sample_component.Vendor_product_name
_Sample_component.Vendor_product_code
_Sample_component.Entry_ID
_Sample_component.Sample_ID
1 Calmodulin '[U-13C; U-15N]' . . 1 $CaM . . . 0.5 0.8 mM . . . . 17807 4
2 'L-selectin binding domain peptide' 'natural abundance' . . 2 $bind_dom . . . 0.5 0.8 mM . . . . 17807 4
3 'CALCIUM ION' 'natural abundance' . . 3 $CA . . 4 . . mM . . . . 17807 4
4 DSS 'natural abundance' . . . . . . 0.5 . . mM . . . . 17807 4
5 'potassium chloride' 'natural abundance' . . . . . . 300 . . mM . . . . 17807 4
6 'sodium azide' 'natural abundance' . . . . . . 0.03 . . % . . . . 17807 4
7 Bis-Tris 'natural abundance' . . . . . . 20 . . mM . . . . 17807 4
8 H2O 'natural abundance' . . . . . . 90 . . % . . . . 17807 4
9 D2O 'natural abundance' . . . . . . 10 . . % . . . . 17807 4
stop_
save_
save_sample_5
_Sample.Sf_category sample
_Sample.Sf_framecode sample_5
_Sample.Entry_ID 17807
_Sample.ID 5
_Sample.Type solution
_Sample.Sub_type .
_Sample.Details 'Anisotropic U13;U15 sample for the collection of CaM RDCs'
_Sample.Aggregate_sample_number .
_Sample.Solvent_system '90% H2O/10% D2O'
_Sample.Preparation_date .
_Sample.Preparation_expiration_date .
_Sample.Polycrystallization_protocol .
_Sample.Single_crystal_protocol .
_Sample.Crystal_grow_apparatus .
_Sample.Crystal_grow_atmosphere .
_Sample.Crystal_grow_details .
_Sample.Crystal_grow_method .
_Sample.Crystal_grow_method_cit_ID .
_Sample.Crystal_grow_pH .
_Sample.Crystal_grow_pH_range .
_Sample.Crystal_grow_pressure .
_Sample.Crystal_grow_pressure_esd .
_Sample.Crystal_grow_seeding .
_Sample.Crystal_grow_seeding_cit_ID .
_Sample.Crystal_grow_temp .
_Sample.Crystal_grow_temp_details .
_Sample.Crystal_grow_temp_esd .
_Sample.Crystal_grow_time .
_Sample.Oriented_sample_prep_protocol .
_Sample.Lyophilization_cryo_protectant .
_Sample.Storage_protocol .
loop_
_Sample_component.ID
_Sample_component.Mol_common_name
_Sample_component.Isotopic_labeling
_Sample_component.Assembly_ID
_Sample_component.Assembly_label
_Sample_component.Entity_ID
_Sample_component.Entity_label
_Sample_component.Product_ID
_Sample_component.Type
_Sample_component.Concentration_val
_Sample_component.Concentration_val_min
_Sample_component.Concentration_val_max
_Sample_component.Concentration_val_units
_Sample_component.Concentration_val_err
_Sample_component.Vendor
_Sample_component.Vendor_product_name
_Sample_component.Vendor_product_code
_Sample_component.Entry_ID
_Sample_component.Sample_ID
1 Calmodulin '[U-13C; U-15N]' . . 1 $CaM . . . 0.5 0.8 mM . . . . 17807 5
2 'L-selectin binding domain peptide' 'natural abundance' . . 2 $bind_dom . . . 0.5 0.8 mM . . . . 17807 5
3 'CALCIUM ION' 'natural abundance' . . 3 $CA . . 4 . . mM . . . . 17807 5
4 DSS 'natural abundance' . . . . . . 0.5 . . mM . . . . 17807 5
5 'potassium chloride' 'natural abundance' . . . . . . 300 . . mM . . . . 17807 5
6 'sodium azide' 'natural abundance' . . . . . . 0.03 . . % . . . . 17807 5
7 Bis-Tris 'natural abundance' . . . . . . 20 . . mM . . . . 17807 5
8 'Pf1 phage' 'natural abundance' . . . . . . 16 . . w/v . . . . 17807 5
9 D2O 'natural abundance' . . . . . . 10 . . % . . . . 17807 5
10 H2O 'natural abundance' . . . . . . 90 . . % . . . . 17807 5
stop_
save_
#######################
# Sample conditions #
#######################
save_sample_conditions_1
_Sample_condition_list.Sf_category sample_conditions
_Sample_condition_list.Sf_framecode sample_conditions_1
_Sample_condition_list.Entry_ID 17807
_Sample_condition_list.ID 1
_Sample_condition_list.Details .
loop_
_Sample_condition_variable.Type
_Sample_condition_variable.Val
_Sample_condition_variable.Val_err
_Sample_condition_variable.Val_units
_Sample_condition_variable.Entry_ID
_Sample_condition_variable.Sample_condition_list_ID
'ionic strength' 0.1 . M 17807 1
pH 6.8 . pH 17807 1
pressure 1 . atm 17807 1
temperature 303 . K 17807 1
stop_
save_
save_sample_conditions_2
_Sample_condition_list.Sf_category sample_conditions
_Sample_condition_list.Sf_framecode sample_conditions_2
_Sample_condition_list.Entry_ID 17807
_Sample_condition_list.ID 2
_Sample_condition_list.Details .
loop_
_Sample_condition_variable.Type
_Sample_condition_variable.Val
_Sample_condition_variable.Val_err
_Sample_condition_variable.Val_units
_Sample_condition_variable.Entry_ID
_Sample_condition_variable.Sample_condition_list_ID
'ionic strength' 0.3 . M 17807 2
pH 6.8 . pH 17807 2
pressure 1 . atm 17807 2
temperature 303 . K 17807 2
stop_
save_
############################
# Computer software used #
############################
save_NMRPipe
_Software.Sf_category software
_Software.Sf_framecode NMRPipe
_Software.Entry_ID 17807
_Software.ID 1
_Software.Name NMRPipe
_Software.Version .
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 17807 1
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
processing 17807 1
stop_
save_
save_NMRView
_Software.Sf_category software
_Software.Sf_framecode NMRView
_Software.Entry_ID 17807
_Software.ID 2
_Software.Name NMRView
_Software.Version .
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Johnson, One Moon Scientific' . . 17807 2
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
'chemical shift assignment' 17807 2
'peak picking' 17807 2
stop_
save_
save_CYANA
_Software.Sf_category software
_Software.Sf_framecode CYANA
_Software.Entry_ID 17807
_Software.ID 3
_Software.Name CYANA
_Software.Version .
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Guntert, Mumenthaler and Wuthrich' . . 17807 3
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
'chemical shift assignment' 17807 3
refinement 17807 3
'structure solution' 17807 3
stop_
save_
save_X-PLOR_NIH
_Software.Sf_category software
_Software.Sf_framecode X-PLOR_NIH
_Software.Entry_ID 17807
_Software.ID 4
_Software.Name 'X-PLOR NIH'
_Software.Version .
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Schwieters, Kuszewski, Tjandra and Clore' . . 17807 4
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
refinement 17807 4
'structure solution' 17807 4
stop_
save_
save_ProcheckNMR
_Software.Sf_category software
_Software.Sf_framecode ProcheckNMR
_Software.Entry_ID 17807
_Software.ID 5
_Software.Name ProcheckNMR
_Software.Version .
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Laskowski and MacArthur' . . 17807 5
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
'data analysis' 17807 5
stop_
save_
save_TALOS
_Software.Sf_category software
_Software.Sf_framecode TALOS
_Software.Entry_ID 17807
_Software.ID 6
_Software.Name TALOS
_Software.Version .
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Cornilescu, Delaglio and Bax' . . 17807 6
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
'data analysis' 17807 6
stop_
save_
save_Molmol
_Software.Sf_category software
_Software.Sf_framecode Molmol
_Software.Entry_ID 17807
_Software.ID 7
_Software.Name Molmol
_Software.Version .
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Koradi, Billeter and Wuthrich' . . 17807 7
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
'data analysis' 17807 7
stop_
save_
save_xwinnmr
_Software.Sf_category software
_Software.Sf_framecode xwinnmr
_Software.Entry_ID 17807
_Software.ID 8
_Software.Name xwinnmr
_Software.Version .
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Bruker Biospin' . . 17807 8
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
collection 17807 8
stop_
save_
#########################
# Experimental detail #
#########################
##################################
# NMR Spectrometer definitions #
##################################
save_spectrometer_1
_NMR_spectrometer.Sf_category NMR_spectrometer
_NMR_spectrometer.Sf_framecode spectrometer_1
_NMR_spectrometer.Entry_ID 17807
_NMR_spectrometer.ID 1
_NMR_spectrometer.Details .
_NMR_spectrometer.Manufacturer Bruker
_NMR_spectrometer.Model Avance
_NMR_spectrometer.Serial_number .
_NMR_spectrometer.Field_strength 500
save_
save_NMR_spectrometer_list
_NMR_spectrometer_list.Sf_category NMR_spectrometer_list
_NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list
_NMR_spectrometer_list.Entry_ID 17807
_NMR_spectrometer_list.ID 1
loop_
_NMR_spectrometer_view.ID
_NMR_spectrometer_view.Name
_NMR_spectrometer_view.Manufacturer
_NMR_spectrometer_view.Model
_NMR_spectrometer_view.Serial_number
_NMR_spectrometer_view.Field_strength
_NMR_spectrometer_view.Details
_NMR_spectrometer_view.Citation_ID
_NMR_spectrometer_view.Citation_label
_NMR_spectrometer_view.Entry_ID
_NMR_spectrometer_view.NMR_spectrometer_list_ID
1 spectrometer_1 Bruker Avance . 500 . . . 17807 1
stop_
save_
#############################
# NMR applied experiments #
#############################
save_experiment_list
_Experiment_list.Sf_category experiment_list
_Experiment_list.Sf_framecode experiment_list
_Experiment_list.Entry_ID 17807
_Experiment_list.ID 1
_Experiment_list.Details .
loop_
_Experiment.ID
_Experiment.Name
_Experiment.Raw_data_flag
_Experiment.NMR_spec_expt_ID
_Experiment.NMR_spec_expt_label
_Experiment.MS_expt_ID
_Experiment.MS_expt_label
_Experiment.SAXS_expt_ID
_Experiment.SAXS_expt_label
_Experiment.FRET_expt_ID
_Experiment.FRET_expt_label
_Experiment.EMR_expt_ID
_Experiment.EMR_expt_label
_Experiment.Sample_ID
_Experiment.Sample_label
_Experiment.Sample_state
_Experiment.Sample_volume
_Experiment.Sample_volume_units
_Experiment.Sample_condition_list_ID
_Experiment.Sample_condition_list_label
_Experiment.Sample_spinning_rate
_Experiment.Sample_angle
_Experiment.NMR_tube_type
_Experiment.NMR_spectrometer_ID
_Experiment.NMR_spectrometer_label
_Experiment.NMR_spectrometer_probe_ID
_Experiment.NMR_spectrometer_probe_label
_Experiment.NMR_spectral_processing_ID
_Experiment.NMR_spectral_processing_label
_Experiment.Mass_spectrometer_ID
_Experiment.Mass_spectrometer_label
_Experiment.Xray_instrument_ID
_Experiment.Xray_instrument_label
_Experiment.Fluorescence_instrument_ID
_Experiment.Fluorescence_instrument_label
_Experiment.EMR_instrument_ID
_Experiment.EMR_instrument_label
_Experiment.Chromatographic_system_ID
_Experiment.Chromatographic_system_label
_Experiment.Chromatographic_column_ID
_Experiment.Chromatographic_column_label
_Experiment.Entry_ID
_Experiment.Experiment_list_ID
1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17807 1
2 '2D 1H-13C HSQC' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17807 1
3 '2D 1H-1H COSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17807 1
4 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17807 1
5 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17807 1
6 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17807 1
7 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17807 1
8 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17807 1
9 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17807 1
10 '3D 1H-13C NOESY' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17807 1
11 '3D HN(CA)CO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17807 1
12 '2D HMBC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17807 1
13 '3D LRCH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17807 1
14 'F2-filtered 2D 1H-1H NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17807 1
15 '2D 1H-15N IPAP HSQC' no . . . . . . . . . . 4 $sample_4 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17807 1
16 '2D 1H-15N IPAP HSQC' no . . . . . . . . . . 5 $sample_5 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17807 1
stop_
save_
####################
# NMR parameters #
####################
##############################
# Assigned chemical shifts #
##############################
################################
# Chemical shift referencing #
################################
save_chemical_shift_reference_1
_Chem_shift_reference.Sf_category chem_shift_reference
_Chem_shift_reference.Sf_framecode chemical_shift_reference_1
_Chem_shift_reference.Entry_ID 17807
_Chem_shift_reference.ID 1
_Chem_shift_reference.Details .
loop_
_Chem_shift_ref.Atom_type
_Chem_shift_ref.Atom_isotope_number
_Chem_shift_ref.Mol_common_name
_Chem_shift_ref.Atom_group
_Chem_shift_ref.Concentration_val
_Chem_shift_ref.Concentration_units
_Chem_shift_ref.Solvent
_Chem_shift_ref.Rank
_Chem_shift_ref.Chem_shift_units
_Chem_shift_ref.Chem_shift_val
_Chem_shift_ref.Ref_method
_Chem_shift_ref.Ref_type
_Chem_shift_ref.Indirect_shift_ratio
_Chem_shift_ref.External_ref_loc
_Chem_shift_ref.External_ref_sample_geometry
_Chem_shift_ref.External_ref_axis
_Chem_shift_ref.Indirect_shift_ratio_cit_ID
_Chem_shift_ref.Indirect_shift_ratio_cit_label
_Chem_shift_ref.Ref_correction_type
_Chem_shift_ref.Correction_val
_Chem_shift_ref.Correction_val_cit_ID
_Chem_shift_ref.Correction_val_cit_label
_Chem_shift_ref.Entry_ID
_Chem_shift_ref.Chem_shift_reference_ID
C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . . . . . 17807 1
H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 17807 1
N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 17807 1
stop_
save_
###################################
# Assigned chemical shift lists #
###################################
###################################################################
# Chemical Shift Ambiguity Index Value Definitions #
# #
# The values other than 1 are used for those atoms with different #
# chemical shifts that cannot be assigned to stereospecific atoms #
# or to specific residues or chains. #
# #
# Index Value Definition #
# #
# 1 Unique (including isolated methyl protons, #
# geminal atoms, and geminal methyl #
# groups with identical chemical shifts) #
# (e.g. ILE HD11, HD12, HD13 protons) #
# 2 Ambiguity of geminal atoms or geminal methyl #
# proton groups (e.g. ASP HB2 and HB3 #
# protons, LEU CD1 and CD2 carbons, or #
# LEU HD11, HD12, HD13 and HD21, HD22, #
# HD23 methyl protons) #
# 3 Aromatic atoms on opposite sides of #
# symmetrical rings (e.g. TYR HE1 and HE2 #
# protons) #
# 4 Intraresidue ambiguities (e.g. LYS HG and #
# HD protons or TRP HZ2 and HZ3 protons) #
# 5 Interresidue ambiguities (LYS 12 vs. LYS 27) #
# 6 Intermolecular ambiguities (e.g. ASP 31 CA #
# in monomer 1 and ASP 31 CA in monomer 2 #
# of an asymmetrical homodimer, duplex #
# DNA assignments, or other assignments #
# that may apply to atoms in one or more #
# molecule in the molecular assembly) #
# 9 Ambiguous, specific ambiguity not defined #
# #
###################################################################
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 17807
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-15N HSQC' . . . 17807 1
2 '2D 1H-13C HSQC' . . . 17807 1
3 '2D 1H-1H COSY' . . . 17807 1
4 '3D CBCA(CO)NH' . . . 17807 1
5 '3D C(CO)NH' . . . 17807 1
6 '3D HNCO' . . . 17807 1
7 '3D HNCACB' . . . 17807 1
8 '3D HBHA(CO)NH' . . . 17807 1
9 '3D H(CCO)NH' . . . 17807 1
11 '3D HN(CA)CO' . . . 17807 1
12 '2D HMBC' . . . 17807 1
13 '3D LRCH' . . . 17807 1
14 'F2-filtered 2D 1H-1H NOESY' . . . 17807 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 1 1 1 ASP C C 13 175.654 . . 1 . . . . 2 ASP C . 17807 1
2 . 1 1 1 1 ASP CA C 13 54.619 . . 1 . . . . 2 ASP CA . 17807 1
3 . 1 1 1 1 ASP CB C 13 41.286 . . 1 . . . . 2 ASP CB . 17807 1
4 . 1 1 2 2 GLN H H 1 8.345 . . 1 . . . A 3 GLN HN . 17807 1
5 . 1 1 2 2 GLN C C 13 175.704 . . 1 . . . A 3 GLN C . 17807 1
6 . 1 1 2 2 GLN CA C 13 55.361 . . 1 . . . A 3 GLN CA . 17807 1
7 . 1 1 2 2 GLN CB C 13 29.712 . . 1 . . . A 3 GLN CB . 17807 1
8 . 1 1 2 2 GLN N N 15 120.103 . . 1 . . . A 3 GLN N . 17807 1
9 . 1 1 3 3 LEU H H 1 8.278 . . 1 . . . A 4 LEU H . 17807 1
10 . 1 1 3 3 LEU C C 13 177.635 . . 1 . . . A 4 LEU C . 17807 1
11 . 1 1 3 3 LEU CA C 13 54.390 . . 1 . . . A 4 LEU CA . 17807 1
12 . 1 1 3 3 LEU CB C 13 43.479 . . 1 . . . A 4 LEU CB . 17807 1
13 . 1 1 3 3 LEU N N 15 123.343 . . 1 . . . A 4 LEU N . 17807 1
14 . 1 1 4 4 THR H H 1 8.667 . . 1 . . . A 5 THR H . 17807 1
15 . 1 1 4 4 THR C C 13 175.382 . . 1 . . . A 5 THR C . 17807 1
16 . 1 1 4 4 THR CA C 13 60.312 . . 1 . . . A 5 THR CA . 17807 1
17 . 1 1 4 4 THR CB C 13 71.027 . . 1 . . . A 5 THR CB . 17807 1
18 . 1 1 4 4 THR N N 15 113.023 . . 1 . . . A 5 THR N . 17807 1
19 . 1 1 5 5 GLU H H 1 8.983 . . 1 . . . A 6 GLU H . 17807 1
20 . 1 1 5 5 GLU C C 13 179.467 . . 1 . . . A 6 GLU C . 17807 1
21 . 1 1 5 5 GLU CA C 13 59.671 . . 1 . . . A 6 GLU CA . 17807 1
22 . 1 1 5 5 GLU CB C 13 29.311 . . 1 . . . A 6 GLU CB . 17807 1
23 . 1 1 5 5 GLU N N 15 120.482 . . 1 . . . A 6 GLU N . 17807 1
24 . 1 1 6 6 GLU H H 1 8.594 . . 1 . . . A 7 GLU H . 17807 1
25 . 1 1 6 6 GLU C C 13 178.972 . . 1 . . . A 7 GLU C . 17807 1
26 . 1 1 6 6 GLU CA C 13 59.782 . . 1 . . . A 7 GLU CA . 17807 1
27 . 1 1 6 6 GLU CB C 13 29.192 . . 1 . . . A 7 GLU CB . 17807 1
28 . 1 1 6 6 GLU N N 15 119.545 . . 1 . . . A 7 GLU N . 17807 1
29 . 1 1 7 7 GLN H H 1 7.682 . . 1 . . . A 8 GLN H . 17807 1
30 . 1 1 7 7 GLN C C 13 178.328 . . 1 . . . A 8 GLN C . 17807 1
31 . 1 1 7 7 GLN CA C 13 58.657 . . 1 . . . A 8 GLN CA . 17807 1
32 . 1 1 7 7 GLN CB C 13 29.081 . . 1 . . . A 8 GLN CB . 17807 1
33 . 1 1 7 7 GLN N N 15 119.853 . . 1 . . . A 8 GLN N . 17807 1
34 . 1 1 8 8 ILE H H 1 8.374 . . 1 . . . A 9 ILE H . 17807 1
35 . 1 1 8 8 ILE C C 13 177.783 . . 1 . . . A 9 ILE C . 17807 1
36 . 1 1 8 8 ILE CA C 13 66.320 . . 1 . . . A 9 ILE CA . 17807 1
37 . 1 1 8 8 ILE CB C 13 37.647 . . 1 . . . A 9 ILE CB . 17807 1
38 . 1 1 8 8 ILE N N 15 119.582 . . 1 . . . A 9 ILE N . 17807 1
39 . 1 1 9 9 ALA H H 1 7.966 . . 1 . . . A 10 ALA H . 17807 1
40 . 1 1 9 9 ALA C C 13 181.175 . . 1 . . . A 10 ALA C . 17807 1
41 . 1 1 9 9 ALA CA C 13 55.318 . . 1 . . . A 10 ALA CA . 17807 1
42 . 1 1 9 9 ALA CB C 13 17.717 . . 1 . . . A 10 ALA CB . 17807 1
43 . 1 1 9 9 ALA N N 15 121.195 . . 1 . . . A 10 ALA N . 17807 1
44 . 1 1 10 10 GLU H H 1 7.804 . . 1 . . . A 11 GLU H . 17807 1
45 . 1 1 10 10 GLU C C 13 180.259 . . 1 . . . A 11 GLU C . 17807 1
46 . 1 1 10 10 GLU CA C 13 59.839 . . 1 . . . A 11 GLU CA . 17807 1
47 . 1 1 10 10 GLU CB C 13 28.891 . . 1 . . . A 11 GLU CB . 17807 1
48 . 1 1 10 10 GLU N N 15 119.326 . . 1 . . . A 11 GLU N . 17807 1
49 . 1 1 11 11 PHE H H 1 8.598 . . 1 . . . A 12 PHE H . 17807 1
50 . 1 1 11 11 PHE C C 13 178.823 . . 1 . . . A 12 PHE C . 17807 1
51 . 1 1 11 11 PHE CA C 13 59.440 . . 1 . . . A 12 PHE CA . 17807 1
52 . 1 1 11 11 PHE CB C 13 37.637 . . 1 . . . A 12 PHE CB . 17807 1
53 . 1 1 11 11 PHE N N 15 119.713 . . 1 . . . A 12 PHE N . 17807 1
54 . 1 1 12 12 LYS H H 1 9.165 . . 1 . . . A 13 LYS H . 17807 1
55 . 1 1 12 12 LYS C C 13 179.170 . . 1 . . . A 13 LYS C . 17807 1
56 . 1 1 12 12 LYS CA C 13 59.882 . . 1 . . . A 13 LYS CA . 17807 1
57 . 1 1 12 12 LYS CB C 13 31.664 . . 1 . . . A 13 LYS CB . 17807 1
58 . 1 1 12 12 LYS N N 15 123.577 . . 1 . . . A 13 LYS N . 17807 1
59 . 1 1 13 13 GLU H H 1 7.796 . . 1 . . . A 14 GLU H . 17807 1
60 . 1 1 13 13 GLU C C 13 179.690 . . 1 . . . A 14 GLU C . 17807 1
61 . 1 1 13 13 GLU CA C 13 59.273 . . 1 . . . A 14 GLU CA . 17807 1
62 . 1 1 13 13 GLU CB C 13 29.028 . . 1 . . . A 14 GLU CB . 17807 1
63 . 1 1 13 13 GLU N N 15 120.016 . . 1 . . . A 14 GLU N . 17807 1
64 . 1 1 14 14 ALA H H 1 7.924 . . 1 . . . A 15 ALA H . 17807 1
65 . 1 1 14 14 ALA C C 13 178.254 . . 1 . . . A 15 ALA C . 17807 1
66 . 1 1 14 14 ALA CA C 13 55.142 . . 1 . . . A 15 ALA CA . 17807 1
67 . 1 1 14 14 ALA CB C 13 17.855 . . 1 . . . A 15 ALA CB . 17807 1
68 . 1 1 14 14 ALA N N 15 121.908 . . 1 . . . A 15 ALA N . 17807 1
69 . 1 1 15 15 PHE H H 1 8.711 . . 1 . . . A 16 PHE H . 17807 1
70 . 1 1 15 15 PHE C C 13 177.759 . . 1 . . . A 16 PHE C . 17807 1
71 . 1 1 15 15 PHE CA C 13 61.843 . . 1 . . . A 16 PHE CA . 17807 1
72 . 1 1 15 15 PHE CB C 13 39.575 . . 1 . . . A 16 PHE CB . 17807 1
73 . 1 1 15 15 PHE N N 15 119.113 . . 1 . . . A 16 PHE N . 17807 1
74 . 1 1 16 16 SER H H 1 8.063 . . 1 . . . A 17 SER H . 17807 1
75 . 1 1 16 16 SER C C 13 174.490 . . 1 . . . A 17 SER C . 17807 1
76 . 1 1 16 16 SER CA C 13 61.584 . . 1 . . . A 17 SER CA . 17807 1
77 . 1 1 16 16 SER CB C 13 63.417 . . 1 . . . A 17 SER CB . 17807 1
78 . 1 1 16 16 SER N N 15 113.397 . . 1 . . . A 17 SER N . 17807 1
79 . 1 1 17 17 LEU H H 1 7.286 . . 1 . . . A 18 LEU H . 17807 1
80 . 1 1 17 17 LEU C C 13 177.338 . . 1 . . . A 18 LEU C . 17807 1
81 . 1 1 17 17 LEU CA C 13 57.304 . . 1 . . . A 18 LEU CA . 17807 1
82 . 1 1 17 17 LEU CB C 13 41.242 . . 1 . . . A 18 LEU CB . 17807 1
83 . 1 1 17 17 LEU N N 15 120.840 . . 1 . . . A 18 LEU N . 17807 1
84 . 1 1 18 18 PHE H H 1 6.965 . . 1 . . . A 19 PHE H . 17807 1
85 . 1 1 18 18 PHE C C 13 176.842 . . 1 . . . A 19 PHE C . 17807 1
86 . 1 1 18 18 PHE CA C 13 59.352 . . 1 . . . A 19 PHE CA . 17807 1
87 . 1 1 18 18 PHE CB C 13 41.531 . . 1 . . . A 19 PHE CB . 17807 1
88 . 1 1 18 18 PHE N N 15 113.198 . . 1 . . . A 19 PHE N . 17807 1
89 . 1 1 19 19 ASP H H 1 7.816 . . 1 . . . A 20 ASP H . 17807 1
90 . 1 1 19 19 ASP C C 13 177.189 . . 1 . . . A 20 ASP C . 17807 1
91 . 1 1 19 19 ASP CA C 13 52.491 . . 1 . . . A 20 ASP CA . 17807 1
92 . 1 1 19 19 ASP CB C 13 39.186 . . 1 . . . A 20 ASP CB . 17807 1
93 . 1 1 19 19 ASP N N 15 117.312 . . 1 . . . A 20 ASP N . 17807 1
94 . 1 1 20 20 LYS H H 1 7.722 . . 1 . . . A 21 LYS H . 17807 1
95 . 1 1 20 20 LYS C C 13 178.155 . . 1 . . . A 21 LYS C . 17807 1
96 . 1 1 20 20 LYS CA C 13 58.325 . . 1 . . . A 21 LYS CA . 17807 1
97 . 1 1 20 20 LYS CB C 13 32.443 . . 1 . . . A 21 LYS CB . 17807 1
98 . 1 1 20 20 LYS N N 15 124.315 . . 1 . . . A 21 LYS N . 17807 1
99 . 1 1 21 21 ASP H H 1 7.977 . . 1 . . . A 22 ASP H . 17807 1
100 . 1 1 21 21 ASP C C 13 177.635 . . 1 . . . A 22 ASP C . 17807 1
101 . 1 1 21 21 ASP CA C 13 52.716 . . 1 . . . A 22 ASP CA . 17807 1
102 . 1 1 21 21 ASP CB C 13 39.367 . . 1 . . . A 22 ASP CB . 17807 1
103 . 1 1 21 21 ASP N N 15 114.017 . . 1 . . . A 22 ASP N . 17807 1
104 . 1 1 22 22 GLY H H 1 7.640 . . 1 . . . A 23 GLY H . 17807 1
105 . 1 1 22 22 GLY C C 13 175.134 . . 1 . . . A 23 GLY C . 17807 1
106 . 1 1 22 22 GLY CA C 13 47.192 . . 1 . . . A 23 GLY CA . 17807 1
107 . 1 1 22 22 GLY N N 15 109.298 . . 1 . . . A 23 GLY N . 17807 1
108 . 1 1 23 23 ASP H H 1 8.408 . . 1 . . . A 24 ASP H . 17807 1
109 . 1 1 23 23 ASP C C 13 177.437 . . 1 . . . A 24 ASP C . 17807 1
110 . 1 1 23 23 ASP CA C 13 53.377 . . 1 . . . A 24 ASP CA . 17807 1
111 . 1 1 23 23 ASP CB C 13 40.425 . . 1 . . . A 24 ASP CB . 17807 1
112 . 1 1 23 23 ASP N N 15 120.794 . . 1 . . . A 24 ASP N . 17807 1
113 . 1 1 24 24 GLY H H 1 10.507 . . 1 . . . A 25 GLY H . 17807 1
114 . 1 1 24 24 GLY C C 13 173.748 . . 1 . . . A 25 GLY C . 17807 1
115 . 1 1 24 24 GLY CA C 13 45.445 . . 1 . . . A 25 GLY CA . 17807 1
116 . 1 1 24 24 GLY N N 15 112.912 . . 1 . . . A 25 GLY N . 17807 1
117 . 1 1 25 25 THR H H 1 8.145 . . 1 . . . A 26 THR H . 17807 1
118 . 1 1 25 25 THR C C 13 173.104 . . 1 . . . A 26 THR C . 17807 1
119 . 1 1 25 25 THR CA C 13 59.503 . . 1 . . . A 26 THR CA . 17807 1
120 . 1 1 25 25 THR CB C 13 72.676 . . 1 . . . A 26 THR CB . 17807 1
121 . 1 1 25 25 THR N N 15 112.621 . . 1 . . . A 26 THR N . 17807 1
122 . 1 1 26 26 ILE H H 1 9.817 . . 1 . . . A 27 ILE H . 17807 1
123 . 1 1 26 26 ILE C C 13 176.075 . . 1 . . . A 27 ILE C . 17807 1
124 . 1 1 26 26 ILE CA C 13 60.764 . . 1 . . . A 27 ILE CA . 17807 1
125 . 1 1 26 26 ILE CB C 13 39.739 . . 1 . . . A 27 ILE CB . 17807 1
126 . 1 1 26 26 ILE N N 15 126.861 . . 1 . . . A 27 ILE N . 17807 1
127 . 1 1 27 27 THR H H 1 8.374 . . 1 . . . A 28 THR H . 17807 1
128 . 1 1 27 27 THR C C 13 176.743 . . 1 . . . A 28 THR C . 17807 1
129 . 1 1 27 27 THR CA C 13 59.347 . . 1 . . . A 28 THR CA . 17807 1
130 . 1 1 27 27 THR CB C 13 72.581 . . 1 . . . A 28 THR CB . 17807 1
131 . 1 1 27 27 THR N N 15 116.559 . . 1 . . . A 28 THR N . 17807 1
132 . 1 1 28 28 THR H H 1 9.208 . . 1 . . . A 29 THR H . 17807 1
133 . 1 1 28 28 THR C C 13 177.412 . . 1 . . . A 29 THR C . 17807 1
134 . 1 1 28 28 THR CA C 13 66.399 . . 1 . . . A 29 THR CA . 17807 1
135 . 1 1 28 28 THR CB C 13 67.576 . . 1 . . . A 29 THR CB . 17807 1
136 . 1 1 28 28 THR N N 15 112.616 . . 1 . . . A 29 THR N . 17807 1
137 . 1 1 29 29 LYS H H 1 7.605 . . 1 . . . A 30 LYS H . 17807 1
138 . 1 1 29 29 LYS C C 13 179.913 . . 1 . . . A 30 LYS C . 17807 1
139 . 1 1 29 29 LYS CA C 13 59.253 . . 1 . . . A 30 LYS CA . 17807 1
140 . 1 1 29 29 LYS CB C 13 32.299 . . 1 . . . A 30 LYS CB . 17807 1
141 . 1 1 29 29 LYS N N 15 121.348 . . 1 . . . A 30 LYS N . 17807 1
142 . 1 1 30 30 GLU H H 1 7.720 . . 1 . . . A 31 GLU H . 17807 1
143 . 1 1 30 30 GLU C C 13 179.516 . . 1 . . . A 31 GLU C . 17807 1
144 . 1 1 30 30 GLU CA C 13 59.475 . . 1 . . . A 31 GLU CA . 17807 1
145 . 1 1 30 30 GLU CB C 13 29.431 . . 1 . . . A 31 GLU CB . 17807 1
146 . 1 1 30 30 GLU N N 15 122.031 . . 1 . . . A 31 GLU N . 17807 1
147 . 1 1 31 31 LEU H H 1 8.592 . . 1 . . . A 32 LEU H . 17807 1
148 . 1 1 31 31 LEU C C 13 178.996 . . 1 . . . A 32 LEU C . 17807 1
149 . 1 1 31 31 LEU CA C 13 58.190 . . 1 . . . A 32 LEU CA . 17807 1
150 . 1 1 31 31 LEU CB C 13 42.767 . . 1 . . . A 32 LEU CB . 17807 1
151 . 1 1 31 31 LEU N N 15 120.339 . . 1 . . . A 32 LEU N . 17807 1
152 . 1 1 32 32 GLY H H 1 8.737 . . 1 . . . A 33 GLY H . 17807 1
153 . 1 1 32 32 GLY C C 13 175.035 . . 1 . . . A 33 GLY C . 17807 1
154 . 1 1 32 32 GLY CA C 13 48.228 . . 1 . . . A 33 GLY CA . 17807 1
155 . 1 1 32 32 GLY N N 15 105.647 . . 1 . . . A 33 GLY N . 17807 1
156 . 1 1 33 33 THR H H 1 8.092 . . 1 . . . A 34 THR H . 17807 1
157 . 1 1 33 33 THR C C 13 177.065 . . 1 . . . A 34 THR C . 17807 1
158 . 1 1 33 33 THR CA C 13 66.921 . . 1 . . . A 34 THR CA . 17807 1
159 . 1 1 33 33 THR CB C 13 68.791 . . 1 . . . A 34 THR CB . 17807 1
160 . 1 1 33 33 THR N N 15 118.366 . . 1 . . . A 34 THR N . 17807 1
161 . 1 1 34 34 VAL H H 1 7.487 . . 1 . . . A 35 VAL H . 17807 1
162 . 1 1 34 34 VAL C C 13 178.848 . . 1 . . . A 35 VAL C . 17807 1
163 . 1 1 34 34 VAL CA C 13 66.386 . . 1 . . . A 35 VAL CA . 17807 1
164 . 1 1 34 34 VAL CB C 13 31.299 . . 1 . . . A 35 VAL CB . 17807 1
165 . 1 1 34 34 VAL N N 15 121.787 . . 1 . . . A 35 VAL N . 17807 1
166 . 1 1 35 35 MET H H 1 8.380 . . 1 . . . A 36 MET H . 17807 1
167 . 1 1 35 35 MET HA H 1 4.070 . . 1 . . . A 36 MET HA . 17807 1
168 . 1 1 35 35 MET HE1 H 1 1.973 . . 1 . . . A 36 MET HE1 . 17807 1
169 . 1 1 35 35 MET HE2 H 1 1.973 . . 1 . . . A 36 MET HE2 . 17807 1
170 . 1 1 35 35 MET HE3 H 1 1.973 . . 1 . . . A 36 MET HE3 . 17807 1
171 . 1 1 35 35 MET C C 13 179.096 . . 1 . . . A 36 MET C . 17807 1
172 . 1 1 35 35 MET CA C 13 59.166 . . 1 . . . A 36 MET CA . 17807 1
173 . 1 1 35 35 MET CB C 13 31.147 . . 1 . . . A 36 MET CB . 17807 1
174 . 1 1 35 35 MET CE C 13 16.994 . . 1 . . . A 36 MET CE . 17807 1
175 . 1 1 35 35 MET N N 15 117.927 . . 1 . . . A 36 MET N . 17807 1
176 . 1 1 36 36 ARG H H 1 8.675 . . 1 . . . A 37 ARG H . 17807 1
177 . 1 1 36 36 ARG C C 13 181.497 . . 1 . . . A 37 ARG C . 17807 1
178 . 1 1 36 36 ARG CA C 13 58.998 . . 1 . . . A 37 ARG CA . 17807 1
179 . 1 1 36 36 ARG CB C 13 29.563 . . 1 . . . A 37 ARG CB . 17807 1
180 . 1 1 36 36 ARG N N 15 118.803 . . 1 . . . A 37 ARG N . 17807 1
181 . 1 1 37 37 SER H H 1 7.925 . . 1 . . . A 38 SER H . 17807 1
182 . 1 1 37 37 SER C C 13 174.688 . . 1 . . . A 38 SER C . 17807 1
183 . 1 1 37 37 SER CA C 13 61.476 . . 1 . . . A 38 SER CA . 17807 1
184 . 1 1 37 37 SER CB C 13 62.581 . . 1 . . . A 38 SER CB . 17807 1
185 . 1 1 37 37 SER N N 15 119.387 . . 1 . . . A 38 SER N . 17807 1
186 . 1 1 38 38 LEU H H 1 7.277 . . 1 . . . A 39 LEU H . 17807 1
187 . 1 1 38 38 LEU C C 13 176.793 . . 1 . . . A 39 LEU C . 17807 1
188 . 1 1 38 38 LEU CA C 13 54.305 . . 1 . . . A 39 LEU CA . 17807 1
189 . 1 1 38 38 LEU CB C 13 41.655 . . 1 . . . A 39 LEU CB . 17807 1
190 . 1 1 38 38 LEU N N 15 119.585 . . 1 . . . A 39 LEU N . 17807 1
191 . 1 1 39 39 GLY H H 1 7.799 . . 1 . . . A 40 GLY H . 17807 1
192 . 1 1 39 39 GLY C C 13 174.391 . . 1 . . . A 40 GLY C . 17807 1
193 . 1 1 39 39 GLY CA C 13 45.594 . . 1 . . . A 40 GLY CA . 17807 1
194 . 1 1 39 39 GLY N N 15 106.055 . . 1 . . . A 40 GLY N . 17807 1
195 . 1 1 40 40 GLN H H 1 7.766 . . 1 . . . A 41 GLN H . 17807 1
196 . 1 1 40 40 GLN C C 13 174.168 . . 1 . . . A 41 GLN C . 17807 1
197 . 1 1 40 40 GLN CA C 13 54.213 . . 1 . . . A 41 GLN CA . 17807 1
198 . 1 1 40 40 GLN CB C 13 30.168 . . 1 . . . A 41 GLN CB . 17807 1
199 . 1 1 40 40 GLN N N 15 118.145 . . 1 . . . A 41 GLN N . 17807 1
200 . 1 1 41 41 ASN H H 1 8.706 . . 1 . . . A 42 ASN H . 17807 1
201 . 1 1 41 41 ASN CA C 13 51.291 . . 1 . . . A 42 ASN CA . 17807 1
202 . 1 1 41 41 ASN CB C 13 39.272 . . 1 . . . A 42 ASN CB . 17807 1
203 . 1 1 41 41 ASN N N 15 116.486 . . 1 . . . A 42 ASN N . 17807 1
204 . 1 1 42 42 PRO C C 13 177.783 . . 1 . . . A 43 PRO C . 17807 1
205 . 1 1 42 42 PRO CA C 13 62.208 . . 1 . . . A 43 PRO CA . 17807 1
206 . 1 1 42 42 PRO CB C 13 31.781 . . 1 . . . A 43 PRO CB . 17807 1
207 . 1 1 43 43 THR H H 1 8.765 . . 1 . . . A 44 THR H . 17807 1
208 . 1 1 43 43 THR C C 13 175.159 . . 1 . . . A 44 THR C . 17807 1
209 . 1 1 43 43 THR CA C 13 60.315 . . 1 . . . A 44 THR CA . 17807 1
210 . 1 1 43 43 THR CB C 13 71.002 . . 1 . . . A 44 THR CB . 17807 1
211 . 1 1 43 43 THR N N 15 113.194 . . 1 . . . A 44 THR N . 17807 1
212 . 1 1 44 44 GLU H H 1 8.773 . . 1 . . . A 45 GLU H . 17807 1
213 . 1 1 44 44 GLU C C 13 178.897 . . 1 . . . A 45 GLU C . 17807 1
214 . 1 1 44 44 GLU CA C 13 59.822 . . 1 . . . A 45 GLU CA . 17807 1
215 . 1 1 44 44 GLU CB C 13 28.806 . . 1 . . . A 45 GLU CB . 17807 1
216 . 1 1 44 44 GLU N N 15 120.690 . . 1 . . . A 45 GLU N . 17807 1
217 . 1 1 45 45 ALA H H 1 8.232 . . 1 . . . A 46 ALA H . 17807 1
218 . 1 1 45 45 ALA C C 13 180.234 . . 1 . . . A 46 ALA C . 17807 1
219 . 1 1 45 45 ALA CA C 13 55.049 . . 1 . . . A 46 ALA CA . 17807 1
220 . 1 1 45 45 ALA CB C 13 18.089 . . 1 . . . A 46 ALA CB . 17807 1
221 . 1 1 45 45 ALA N N 15 120.784 . . 1 . . . A 46 ALA N . 17807 1
222 . 1 1 46 46 GLU H H 1 7.684 . . 1 . . . A 47 GLU H . 17807 1
223 . 1 1 46 46 GLU C C 13 180.259 . . 1 . . . A 47 GLU C . 17807 1
224 . 1 1 46 46 GLU CA C 13 58.998 . . 1 . . . A 47 GLU CA . 17807 1
225 . 1 1 46 46 GLU CB C 13 29.479 . . 1 . . . A 47 GLU CB . 17807 1
226 . 1 1 46 46 GLU N N 15 118.728 . . 1 . . . A 47 GLU N . 17807 1
227 . 1 1 47 47 LEU H H 1 8.129 . . 1 . . . A 48 LEU H . 17807 1
228 . 1 1 47 47 LEU C C 13 178.625 . . 1 . . . A 48 LEU C . 17807 1
229 . 1 1 47 47 LEU CA C 13 57.683 . . 1 . . . A 48 LEU CA . 17807 1
230 . 1 1 47 47 LEU CB C 13 42.385 . . 1 . . . A 48 LEU CB . 17807 1
231 . 1 1 47 47 LEU N N 15 120.336 . . 1 . . . A 48 LEU N . 17807 1
232 . 1 1 48 48 GLN H H 1 8.263 . . 1 . . . A 49 GLN H . 17807 1
233 . 1 1 48 48 GLN C C 13 178.551 . . 1 . . . A 49 GLN C . 17807 1
234 . 1 1 48 48 GLN CA C 13 58.494 . . 1 . . . A 49 GLN CA . 17807 1
235 . 1 1 48 48 GLN CB C 13 28.031 . . 1 . . . A 49 GLN CB . 17807 1
236 . 1 1 48 48 GLN N N 15 118.660 . . 1 . . . A 49 GLN N . 17807 1
237 . 1 1 49 49 ASP H H 1 8.120 . . 1 . . . A 50 ASP H . 17807 1
238 . 1 1 49 49 ASP C C 13 178.675 . . 1 . . . A 50 ASP C . 17807 1
239 . 1 1 49 49 ASP CA C 13 57.505 . . 1 . . . A 50 ASP CA . 17807 1
240 . 1 1 49 49 ASP CB C 13 40.071 . . 1 . . . A 50 ASP CB . 17807 1
241 . 1 1 49 49 ASP N N 15 120.191 . . 1 . . . A 50 ASP N . 17807 1
242 . 1 1 50 50 MET H H 1 7.791 . . 1 . . . A 51 MET H . 17807 1
243 . 1 1 50 50 MET HA H 1 4.028 . . 1 . . . A 51 MET HA . 17807 1
244 . 1 1 50 50 MET HE1 H 1 2.043 . . 1 . . . A 51 MET HE1 . 17807 1
245 . 1 1 50 50 MET HE2 H 1 2.043 . . 1 . . . A 51 MET HE2 . 17807 1
246 . 1 1 50 50 MET HE3 H 1 2.043 . . 1 . . . A 51 MET HE3 . 17807 1
247 . 1 1 50 50 MET C C 13 178.897 . . 1 . . . A 51 MET C . 17807 1
248 . 1 1 50 50 MET CA C 13 59.393 . . 1 . . . A 51 MET CA . 17807 1
249 . 1 1 50 50 MET CB C 13 33.273 . . 1 . . . A 51 MET CB . 17807 1
250 . 1 1 50 50 MET CE C 13 17.267 . . 1 . . . A 51 MET CE . 17807 1
251 . 1 1 50 50 MET N N 15 119.328 . . 1 . . . A 51 MET N . 17807 1
252 . 1 1 51 51 ILE H H 1 7.665 . . 1 . . . A 52 ILE H . 17807 1
253 . 1 1 51 51 ILE C C 13 178.080 . . 1 . . . A 52 ILE C . 17807 1
254 . 1 1 51 51 ILE CA C 13 64.192 . . 1 . . . A 52 ILE CA . 17807 1
255 . 1 1 51 51 ILE CB C 13 36.816 . . 1 . . . A 52 ILE CB . 17807 1
256 . 1 1 51 51 ILE N N 15 118.115 . . 1 . . . A 52 ILE N . 17807 1
257 . 1 1 52 52 ASN H H 1 8.653 . . 1 . . . A 53 ASN H . 17807 1
258 . 1 1 52 52 ASN C C 13 177.115 . . 1 . . . A 53 ASN C . 17807 1
259 . 1 1 52 52 ASN CA C 13 55.680 . . 1 . . . A 53 ASN CA . 17807 1
260 . 1 1 52 52 ASN CB C 13 37.954 . . 1 . . . A 53 ASN CB . 17807 1
261 . 1 1 52 52 ASN N N 15 118.232 . . 1 . . . A 53 ASN N . 17807 1
262 . 1 1 53 53 GLU H H 1 7.471 . . 1 . . . A 54 GLU H . 17807 1
263 . 1 1 53 53 GLU C C 13 177.239 . . 1 . . . A 54 GLU C . 17807 1
264 . 1 1 53 53 GLU CA C 13 58.801 . . 1 . . . A 54 GLU CA . 17807 1
265 . 1 1 53 53 GLU CB C 13 30.100 . . 1 . . . A 54 GLU CB . 17807 1
266 . 1 1 53 53 GLU N N 15 116.273 . . 1 . . . A 54 GLU N . 17807 1
267 . 1 1 54 54 VAL H H 1 7.167 . . 1 . . . A 55 VAL H . 17807 1
268 . 1 1 54 54 VAL C C 13 175.629 . . 1 . . . A 55 VAL C . 17807 1
269 . 1 1 54 54 VAL CA C 13 60.680 . . 1 . . . A 55 VAL CA . 17807 1
270 . 1 1 54 54 VAL CB C 13 32.808 . . 1 . . . A 55 VAL CB . 17807 1
271 . 1 1 54 54 VAL N N 15 110.342 . . 1 . . . A 55 VAL N . 17807 1
272 . 1 1 55 55 ASP H H 1 7.683 . . 1 . . . A 56 ASP H . 17807 1
273 . 1 1 55 55 ASP C C 13 175.951 . . 1 . . . A 56 ASP C . 17807 1
274 . 1 1 55 55 ASP CA C 13 53.797 . . 1 . . . A 56 ASP CA . 17807 1
275 . 1 1 55 55 ASP CB C 13 40.495 . . 1 . . . A 56 ASP CB . 17807 1
276 . 1 1 55 55 ASP N N 15 121.236 . . 1 . . . A 56 ASP N . 17807 1
277 . 1 1 56 56 ALA H H 1 8.300 . . 1 . . . A 57 ALA H . 17807 1
278 . 1 1 56 56 ALA C C 13 178.675 . . 1 . . . A 57 ALA C . 17807 1
279 . 1 1 56 56 ALA CA C 13 54.166 . . 1 . . . A 57 ALA CA . 17807 1
280 . 1 1 56 56 ALA CB C 13 19.495 . . 1 . . . A 57 ALA CB . 17807 1
281 . 1 1 56 56 ALA N N 15 131.653 . . 1 . . . A 57 ALA N . 17807 1
282 . 1 1 57 57 ASP H H 1 8.180 . . 1 . . . A 58 ASP H . 17807 1
283 . 1 1 57 57 ASP C C 13 177.833 . . 1 . . . A 58 ASP C . 17807 1
284 . 1 1 57 57 ASP CA C 13 52.696 . . 1 . . . A 58 ASP CA . 17807 1
285 . 1 1 57 57 ASP CB C 13 39.908 . . 1 . . . A 58 ASP CB . 17807 1
286 . 1 1 57 57 ASP N N 15 114.029 . . 1 . . . A 58 ASP N . 17807 1
287 . 1 1 58 58 GLY H H 1 7.571 . . 1 . . . A 59 GLY H . 17807 1
288 . 1 1 58 58 GLY C C 13 174.936 . . 1 . . . A 59 GLY C . 17807 1
289 . 1 1 58 58 GLY CA C 13 47.164 . . 1 . . . A 59 GLY CA . 17807 1
290 . 1 1 58 58 GLY N N 15 108.625 . . 1 . . . A 59 GLY N . 17807 1
291 . 1 1 59 59 ASN H H 1 8.116 . . 1 . . . A 60 ASN H . 17807 1
292 . 1 1 59 59 ASN C C 13 176.867 . . 1 . . . A 60 ASN C . 17807 1
293 . 1 1 59 59 ASN CA C 13 52.669 . . 1 . . . A 60 ASN CA . 17807 1
294 . 1 1 59 59 ASN CB C 13 37.481 . . 1 . . . A 60 ASN CB . 17807 1
295 . 1 1 59 59 ASN N N 15 118.681 . . 1 . . . A 60 ASN N . 17807 1
296 . 1 1 60 60 GLY H H 1 10.504 . . 1 . . . A 61 GLY H . 17807 1
297 . 1 1 60 60 GLY C C 13 173.277 . . 1 . . . A 61 GLY C . 17807 1
298 . 1 1 60 60 GLY CA C 13 45.704 . . 1 . . . A 61 GLY CA . 17807 1
299 . 1 1 60 60 GLY N N 15 113.261 . . 1 . . . A 61 GLY N . 17807 1
300 . 1 1 61 61 THR H H 1 7.626 . . 1 . . . A 62 THR H . 17807 1
301 . 1 1 61 61 THR C C 13 173.327 . . 1 . . . A 62 THR C . 17807 1
302 . 1 1 61 61 THR CA C 13 59.223 . . 1 . . . A 62 THR CA . 17807 1
303 . 1 1 61 61 THR CB C 13 72.207 . . 1 . . . A 62 THR CB . 17807 1
304 . 1 1 61 61 THR N N 15 108.641 . . 1 . . . A 62 THR N . 17807 1
305 . 1 1 62 62 ILE H H 1 8.724 . . 1 . . . A 63 ILE H . 17807 1
306 . 1 1 62 62 ILE C C 13 175.604 . . 1 . . . A 63 ILE C . 17807 1
307 . 1 1 62 62 ILE CA C 13 59.923 . . 1 . . . A 63 ILE CA . 17807 1
308 . 1 1 62 62 ILE CB C 13 39.823 . . 1 . . . A 63 ILE CB . 17807 1
309 . 1 1 62 62 ILE N N 15 123.287 . . 1 . . . A 63 ILE N . 17807 1
310 . 1 1 63 63 ASP H H 1 8.910 . . 1 . . . A 64 ASP H . 17807 1
311 . 1 1 63 63 ASP C C 13 176.273 . . 1 . . . A 64 ASP C . 17807 1
312 . 1 1 63 63 ASP CA C 13 52.094 . . 1 . . . A 64 ASP CA . 17807 1
313 . 1 1 63 63 ASP CB C 13 42.236 . . 1 . . . A 64 ASP CB . 17807 1
314 . 1 1 63 63 ASP N N 15 128.408 . . 1 . . . A 64 ASP N . 17807 1
315 . 1 1 64 64 PHE H H 1 8.953 . . 1 . . . A 65 PHE H . 17807 1
316 . 1 1 64 64 PHE C C 13 173.648 . . 1 . . . A 65 PHE C . 17807 1
317 . 1 1 64 64 PHE CA C 13 63.360 . . 1 . . . A 65 PHE CA . 17807 1
318 . 1 1 64 64 PHE CB C 13 35.871 . . 1 . . . A 65 PHE CB . 17807 1
319 . 1 1 64 64 PHE N N 15 118.838 . . 1 . . . A 65 PHE N . 17807 1
320 . 1 1 65 65 PRO C C 13 180.061 . . 1 . . . A 66 PRO C . 17807 1
321 . 1 1 65 65 PRO CA C 13 66.698 . . 1 . . . A 66 PRO CA . 17807 1
322 . 1 1 65 65 PRO CB C 13 30.614 . . 1 . . . A 66 PRO CB . 17807 1
323 . 1 1 66 66 GLU H H 1 8.110 . . 1 . . . A 67 GLU H . 17807 1
324 . 1 1 66 66 GLU C C 13 179.195 . . 1 . . . A 67 GLU C . 17807 1
325 . 1 1 66 66 GLU CA C 13 58.964 . . 1 . . . A 67 GLU CA . 17807 1
326 . 1 1 66 66 GLU CB C 13 29.377 . . 1 . . . A 67 GLU CB . 17807 1
327 . 1 1 66 66 GLU N N 15 117.861 . . 1 . . . A 67 GLU N . 17807 1
328 . 1 1 67 67 PHE H H 1 8.731 . . 1 . . . A 68 PHE H . 17807 1
329 . 1 1 67 67 PHE C C 13 176.715 . . 1 . . . A 68 PHE C . 17807 1
330 . 1 1 67 67 PHE CA C 13 61.605 . . 1 . . . A 68 PHE CA . 17807 1
331 . 1 1 67 67 PHE CB C 13 40.121 . . 1 . . . A 68 PHE CB . 17807 1
332 . 1 1 67 67 PHE N N 15 123.673 . . 1 . . . A 68 PHE N . 17807 1
333 . 1 1 68 68 LEU H H 1 8.596 . . 1 . . . A 69 LEU H . 17807 1
334 . 1 1 68 68 LEU C C 13 178.972 . . 1 . . . A 69 LEU C . 17807 1
335 . 1 1 68 68 LEU CA C 13 57.769 . . 1 . . . A 69 LEU CA . 17807 1
336 . 1 1 68 68 LEU CB C 13 41.070 . . 1 . . . A 69 LEU CB . 17807 1
337 . 1 1 68 68 LEU N N 15 119.621 . . 1 . . . A 69 LEU N . 17807 1
338 . 1 1 69 69 THR H H 1 7.669 . . 1 . . . A 70 THR H . 17807 1
339 . 1 1 69 69 THR C C 13 176.280 . . 1 . . . A 70 THR C . 17807 1
340 . 1 1 69 69 THR CA C 13 66.391 . . 1 . . . A 70 THR CA . 17807 1
341 . 1 1 69 69 THR CB C 13 68.042 . . 1 . . . A 70 THR CB . 17807 1
342 . 1 1 69 69 THR N N 15 115.862 . . 1 . . . A 70 THR N . 17807 1
343 . 1 1 70 70 MET H H 1 7.606 . . 1 . . . A 71 MET H . 17807 1
344 . 1 1 70 70 MET HA H 1 3.848 . . 1 . . . A 71 MET HA . 17807 1
345 . 1 1 70 70 MET HE1 H 1 1.683 . . 1 . . . A 71 MET HE1 . 17807 1
346 . 1 1 70 70 MET HE2 H 1 1.683 . . 1 . . . A 71 MET HE2 . 17807 1
347 . 1 1 70 70 MET HE3 H 1 1.683 . . 1 . . . A 71 MET HE3 . 17807 1
348 . 1 1 70 70 MET C C 13 177.808 . . 1 . . . A 71 MET C . 17807 1
349 . 1 1 70 70 MET CA C 13 58.669 . . 1 . . . A 71 MET CA . 17807 1
350 . 1 1 70 70 MET CB C 13 32.086 . . 1 . . . A 71 MET CB . 17807 1
351 . 1 1 70 70 MET CE C 13 17.153 . . 1 . . . A 71 MET CE . 17807 1
352 . 1 1 70 70 MET N N 15 121.347 . . 1 . . . A 71 MET N . 17807 1
353 . 1 1 71 71 MET H H 1 8.103 . . 1 . . . A 72 MET H . 17807 1
354 . 1 1 71 71 MET HA H 1 3.866 . . 1 . . . A 72 MET HA . 17807 1
355 . 1 1 71 71 MET HE1 H 1 1.556 . . 1 . . . A 72 MET HE1 . 17807 1
356 . 1 1 71 71 MET HE2 H 1 1.556 . . 1 . . . A 72 MET HE2 . 17807 1
357 . 1 1 71 71 MET HE3 H 1 1.556 . . 1 . . . A 72 MET HE3 . 17807 1
358 . 1 1 71 71 MET C C 13 178.130 . . 1 . . . A 72 MET C . 17807 1
359 . 1 1 71 71 MET CA C 13 56.013 . . 1 . . . A 72 MET CA . 17807 1
360 . 1 1 71 71 MET CB C 13 30.561 . . 1 . . . A 72 MET CB . 17807 1
361 . 1 1 71 71 MET CE C 13 17.073 . . 1 . . . A 72 MET CE . 17807 1
362 . 1 1 71 71 MET N N 15 117.640 . . 1 . . . A 72 MET N . 17807 1
363 . 1 1 72 72 ALA H H 1 8.203 . . 1 . . . A 73 ALA H . 17807 1
364 . 1 1 72 72 ALA C C 13 180.185 . . 1 . . . A 73 ALA C . 17807 1
365 . 1 1 72 72 ALA CA C 13 54.816 . . 1 . . . A 73 ALA CA . 17807 1
366 . 1 1 72 72 ALA CB C 13 17.892 . . 1 . . . A 73 ALA CB . 17807 1
367 . 1 1 72 72 ALA N N 15 121.142 . . 1 . . . A 73 ALA N . 17807 1
368 . 1 1 73 73 ARG H H 1 7.439 . . 1 . . . A 74 ARG H . 17807 1
369 . 1 1 73 73 ARG C C 13 178.650 . . 1 . . . A 74 ARG C . 17807 1
370 . 1 1 73 73 ARG CA C 13 58.724 . . 1 . . . A 74 ARG CA . 17807 1
371 . 1 1 73 73 ARG CB C 13 30.030 . . 1 . . . A 74 ARG CB . 17807 1
372 . 1 1 73 73 ARG N N 15 116.735 . . 1 . . . A 74 ARG N . 17807 1
373 . 1 1 74 74 LYS H H 1 7.796 . . 1 . . . A 75 LYS H . 17807 1
374 . 1 1 74 74 LYS C C 13 178.155 . . 1 . . . A 75 LYS C . 17807 1
375 . 1 1 74 74 LYS CA C 13 57.156 . . 1 . . . A 75 LYS CA . 17807 1
376 . 1 1 74 74 LYS CB C 13 31.640 . . 1 . . . A 75 LYS CB . 17807 1
377 . 1 1 74 74 LYS N N 15 118.495 . . 1 . . . A 75 LYS N . 17807 1
378 . 1 1 75 75 MET H H 1 7.866 . . 1 . . . A 76 MET H . 17807 1
379 . 1 1 75 75 MET HA H 1 4.189 . . 1 . . . A 76 MET HA . 17807 1
380 . 1 1 75 75 MET HE1 H 1 1.974 . . 1 . . . A 76 MET HE1 . 17807 1
381 . 1 1 75 75 MET HE2 H 1 1.974 . . 1 . . . A 76 MET HE2 . 17807 1
382 . 1 1 75 75 MET HE3 H 1 1.974 . . 1 . . . A 76 MET HE3 . 17807 1
383 . 1 1 75 75 MET C C 13 176.941 . . 1 . . . A 76 MET C . 17807 1
384 . 1 1 75 75 MET CA C 13 57.038 . . 1 . . . A 76 MET CA . 17807 1
385 . 1 1 75 75 MET CB C 13 32.629 . . 1 . . . A 76 MET CB . 17807 1
386 . 1 1 75 75 MET CE C 13 16.922 . . 1 . . . A 76 MET CE . 17807 1
387 . 1 1 75 75 MET N N 15 116.958 . . 1 . . . A 76 MET N . 17807 1
388 . 1 1 76 76 LYS H H 1 7.490 . . 1 . . . A 77 LYS H . 17807 1
389 . 1 1 76 76 LYS C C 13 176.496 . . 1 . . . A 77 LYS C . 17807 1
390 . 1 1 76 76 LYS CA C 13 56.554 . . 1 . . . A 77 LYS CA . 17807 1
391 . 1 1 76 76 LYS CB C 13 32.885 . . 1 . . . A 77 LYS CB . 17807 1
392 . 1 1 76 76 LYS N N 15 118.347 . . 1 . . . A 77 LYS N . 17807 1
393 . 1 1 77 77 ASP H H 1 7.874 . . 1 . . . A 78 ASP H . 17807 1
394 . 1 1 77 77 ASP C C 13 176.521 . . 1 . . . A 78 ASP C . 17807 1
395 . 1 1 77 77 ASP CA C 13 54.583 . . 1 . . . A 78 ASP CA . 17807 1
396 . 1 1 77 77 ASP CB C 13 41.279 . . 1 . . . A 78 ASP CB . 17807 1
397 . 1 1 77 77 ASP N N 15 120.547 . . 1 . . . A 78 ASP N . 17807 1
398 . 1 1 78 78 THR H H 1 7.974 . . 1 . . . A 79 THR H . 17807 1
399 . 1 1 78 78 THR C C 13 174.416 . . 1 . . . A 79 THR C . 17807 1
400 . 1 1 78 78 THR CA C 13 62.145 . . 1 . . . A 79 THR CA . 17807 1
401 . 1 1 78 78 THR CB C 13 69.700 . . 1 . . . A 79 THR CB . 17807 1
402 . 1 1 78 78 THR N N 15 113.584 . . 1 . . . A 79 THR N . 17807 1
403 . 1 1 79 79 ASP H H 1 8.347 . . 1 . . . A 80 ASP H . 17807 1
404 . 1 1 79 79 ASP C C 13 176.174 . . 1 . . . A 80 ASP C . 17807 1
405 . 1 1 79 79 ASP CA C 13 54.357 . . 1 . . . A 80 ASP CA . 17807 1
406 . 1 1 79 79 ASP CB C 13 41.310 . . 1 . . . A 80 ASP CB . 17807 1
407 . 1 1 79 79 ASP N N 15 122.500 . . 1 . . . A 80 ASP N . 17807 1
408 . 1 1 80 80 SER H H 1 8.347 . . 1 . . . A 81 SER H . 17807 1
409 . 1 1 80 80 SER C C 13 175.283 . . 1 . . . A 81 SER C . 17807 1
410 . 1 1 80 80 SER CA C 13 58.198 . . 1 . . . A 81 SER CA . 17807 1
411 . 1 1 80 80 SER CB C 13 64.050 . . 1 . . . A 81 SER CB . 17807 1
412 . 1 1 80 80 SER N N 15 117.077 . . 1 . . . A 81 SER N . 17807 1
413 . 1 1 81 81 GLU H H 1 8.635 . . 1 . . . A 82 GLU H . 17807 1
414 . 1 1 81 81 GLU C C 13 178.105 . . 1 . . . A 82 GLU C . 17807 1
415 . 1 1 81 81 GLU CA C 13 59.414 . . 1 . . . A 82 GLU CA . 17807 1
416 . 1 1 81 81 GLU CB C 13 29.322 . . 1 . . . A 82 GLU CB . 17807 1
417 . 1 1 81 81 GLU N N 15 123.729 . . 1 . . . A 82 GLU N . 17807 1
418 . 1 1 82 82 GLU H H 1 8.367 . . 1 . . . A 83 GLU H . 17807 1
419 . 1 1 82 82 GLU C C 13 179.096 . . 1 . . . A 83 GLU C . 17807 1
420 . 1 1 82 82 GLU CA C 13 59.503 . . 1 . . . A 83 GLU CA . 17807 1
421 . 1 1 82 82 GLU CB C 13 29.060 . . 1 . . . A 83 GLU CB . 17807 1
422 . 1 1 82 82 GLU N N 15 118.268 . . 1 . . . A 83 GLU N . 17807 1
423 . 1 1 83 83 GLU H H 1 7.884 . . 1 . . . A 84 GLU H . 17807 1
424 . 1 1 83 83 GLU C C 13 178.996 . . 1 . . . A 84 GLU C . 17807 1
425 . 1 1 83 83 GLU CA C 13 59.250 . . 1 . . . A 84 GLU CA . 17807 1
426 . 1 1 83 83 GLU CB C 13 29.144 . . 1 . . . A 84 GLU CB . 17807 1
427 . 1 1 83 83 GLU N N 15 118.909 . . 1 . . . A 84 GLU N . 17807 1
428 . 1 1 84 84 ILE H H 1 8.001 . . 1 . . . A 85 ILE H . 17807 1
429 . 1 1 84 84 ILE C C 13 178.204 . . 1 . . . A 85 ILE C . 17807 1
430 . 1 1 84 84 ILE CA C 13 65.345 . . 1 . . . A 85 ILE CA . 17807 1
431 . 1 1 84 84 ILE CB C 13 37.006 . . 1 . . . A 85 ILE CB . 17807 1
432 . 1 1 84 84 ILE N N 15 120.951 . . 1 . . . A 85 ILE N . 17807 1
433 . 1 1 85 85 ARG H H 1 8.488 . . 1 . . . A 86 ARG H . 17807 1
434 . 1 1 85 85 ARG C C 13 179.343 . . 1 . . . A 86 ARG C . 17807 1
435 . 1 1 85 85 ARG CA C 13 59.777 . . 1 . . . A 86 ARG CA . 17807 1
436 . 1 1 85 85 ARG CB C 13 29.628 . . 1 . . . A 86 ARG CB . 17807 1
437 . 1 1 85 85 ARG N N 15 121.281 . . 1 . . . A 86 ARG N . 17807 1
438 . 1 1 86 86 GLU H H 1 7.958 . . 1 . . . A 87 GLU H . 17807 1
439 . 1 1 86 86 GLU C C 13 178.848 . . 1 . . . A 87 GLU C . 17807 1
440 . 1 1 86 86 GLU CA C 13 58.865 . . 1 . . . A 87 GLU CA . 17807 1
441 . 1 1 86 86 GLU CB C 13 29.059 . . 1 . . . A 87 GLU CB . 17807 1
442 . 1 1 86 86 GLU N N 15 119.274 . . 1 . . . A 87 GLU N . 17807 1
443 . 1 1 87 87 ALA H H 1 8.232 . . 1 . . . A 88 ALA H . 17807 1
444 . 1 1 87 87 ALA C C 13 178.551 . . 1 . . . A 88 ALA C . 17807 1
445 . 1 1 87 87 ALA CA C 13 55.157 . . 1 . . . A 88 ALA CA . 17807 1
446 . 1 1 87 87 ALA CB C 13 17.799 . . 1 . . . A 88 ALA CB . 17807 1
447 . 1 1 87 87 ALA N N 15 121.630 . . 1 . . . A 88 ALA N . 17807 1
448 . 1 1 88 88 PHE H H 1 8.602 . . 1 . . . A 89 PHE H . 17807 1
449 . 1 1 88 88 PHE C C 13 176.446 . . 1 . . . A 89 PHE C . 17807 1
450 . 1 1 88 88 PHE CA C 13 62.208 . . 1 . . . A 89 PHE CA . 17807 1
451 . 1 1 88 88 PHE CB C 13 38.902 . . 1 . . . A 89 PHE CB . 17807 1
452 . 1 1 88 88 PHE N N 15 118.931 . . 1 . . . A 89 PHE N . 17807 1
453 . 1 1 89 89 ARG H H 1 7.653 . . 1 . . . A 90 ARG H . 17807 1
454 . 1 1 89 89 ARG C C 13 178.031 . . 1 . . . A 90 ARG C . 17807 1
455 . 1 1 89 89 ARG CA C 13 58.919 . . 1 . . . A 90 ARG CA . 17807 1
456 . 1 1 89 89 ARG CB C 13 30.044 . . 1 . . . A 90 ARG CB . 17807 1
457 . 1 1 89 89 ARG N N 15 115.957 . . 1 . . . A 90 ARG N . 17807 1
458 . 1 1 90 90 VAL H H 1 7.512 . . 1 . . . A 91 VAL H . 17807 1
459 . 1 1 90 90 VAL C C 13 177.140 . . 1 . . . A 91 VAL C . 17807 1
460 . 1 1 90 90 VAL CA C 13 65.474 . . 1 . . . A 91 VAL CA . 17807 1
461 . 1 1 90 90 VAL CB C 13 31.076 . . 1 . . . A 91 VAL CB . 17807 1
462 . 1 1 90 90 VAL N N 15 117.880 . . 1 . . . A 91 VAL N . 17807 1
463 . 1 1 91 91 PHE H H 1 7.442 . . 1 . . . A 92 PHE H . 17807 1
464 . 1 1 91 91 PHE C C 13 177.189 . . 1 . . . A 92 PHE C . 17807 1
465 . 1 1 91 91 PHE CA C 13 59.954 . . 1 . . . A 92 PHE CA . 17807 1
466 . 1 1 91 91 PHE CB C 13 40.515 . . 1 . . . A 92 PHE CB . 17807 1
467 . 1 1 91 91 PHE N N 15 116.271 . . 1 . . . A 92 PHE N . 17807 1
468 . 1 1 92 92 ASP H H 1 7.913 . . 1 . . . A 93 ASP H . 17807 1
469 . 1 1 92 92 ASP C C 13 177.387 . . 1 . . . A 93 ASP C . 17807 1
470 . 1 1 92 92 ASP CA C 13 52.274 . . 1 . . . A 93 ASP CA . 17807 1
471 . 1 1 92 92 ASP CB C 13 38.220 . . 1 . . . A 93 ASP CB . 17807 1
472 . 1 1 92 92 ASP N N 15 116.761 . . 1 . . . A 93 ASP N . 17807 1
473 . 1 1 93 93 LYS H H 1 7.753 . . 1 . . . A 94 LYS H . 17807 1
474 . 1 1 93 93 LYS C C 13 178.303 . . 1 . . . A 94 LYS C . 17807 1
475 . 1 1 93 93 LYS CA C 13 59.039 . . 1 . . . A 94 LYS CA . 17807 1
476 . 1 1 93 93 LYS CB C 13 32.656 . . 1 . . . A 94 LYS CB . 17807 1
477 . 1 1 93 93 LYS N N 15 126.274 . . 1 . . . A 94 LYS N . 17807 1
478 . 1 1 94 94 ASP H H 1 8.126 . . 1 . . . A 95 ASP H . 17807 1
479 . 1 1 94 94 ASP C C 13 177.684 . . 1 . . . A 95 ASP C . 17807 1
480 . 1 1 94 94 ASP CA C 13 52.828 . . 1 . . . A 95 ASP CA . 17807 1
481 . 1 1 94 94 ASP CB C 13 39.483 . . 1 . . . A 95 ASP CB . 17807 1
482 . 1 1 94 94 ASP N N 15 113.949 . . 1 . . . A 95 ASP N . 17807 1
483 . 1 1 95 95 GLY H H 1 7.769 . . 1 . . . A 96 GLY H . 17807 1
484 . 1 1 95 95 GLY C C 13 175.134 . . 1 . . . A 96 GLY C . 17807 1
485 . 1 1 95 95 GLY CA C 13 47.101 . . 1 . . . A 96 GLY CA . 17807 1
486 . 1 1 95 95 GLY N N 15 109.369 . . 1 . . . A 96 GLY N . 17807 1
487 . 1 1 96 96 ASN H H 1 8.304 . . 1 . . . A 97 ASN H . 17807 1
488 . 1 1 96 96 ASN C C 13 176.025 . . 1 . . . A 97 ASN C . 17807 1
489 . 1 1 96 96 ASN CA C 13 52.633 . . 1 . . . A 97 ASN CA . 17807 1
490 . 1 1 96 96 ASN CB C 13 38.089 . . 1 . . . A 97 ASN CB . 17807 1
491 . 1 1 96 96 ASN N N 15 119.586 . . 1 . . . A 97 ASN N . 17807 1
492 . 1 1 97 97 GLY H H 1 10.604 . . 1 . . . A 98 GLY H . 17807 1
493 . 1 1 97 97 GLY C C 13 172.386 . . 1 . . . A 98 GLY C . 17807 1
494 . 1 1 97 97 GLY CA C 13 45.083 . . 1 . . . A 98 GLY CA . 17807 1
495 . 1 1 97 97 GLY N N 15 112.946 . . 1 . . . A 98 GLY N . 17807 1
496 . 1 1 98 98 TYR H H 1 7.573 . . 1 . . . A 99 TYR H . 17807 1
497 . 1 1 98 98 TYR C C 13 174.540 . . 1 . . . A 99 TYR C . 17807 1
498 . 1 1 98 98 TYR CA C 13 55.854 . . 1 . . . A 99 TYR CA . 17807 1
499 . 1 1 98 98 TYR CB C 13 43.090 . . 1 . . . A 99 TYR CB . 17807 1
500 . 1 1 98 98 TYR N N 15 115.864 . . 1 . . . A 99 TYR N . 17807 1
501 . 1 1 99 99 ILE H H 1 10.129 . . 1 . . . A 100 ILE H . 17807 1
502 . 1 1 99 99 ILE C C 13 175.456 . . 1 . . . A 100 ILE C . 17807 1
503 . 1 1 99 99 ILE CA C 13 60.513 . . 1 . . . A 100 ILE CA . 17807 1
504 . 1 1 99 99 ILE CB C 13 38.814 . . 1 . . . A 100 ILE CB . 17807 1
505 . 1 1 99 99 ILE N N 15 127.210 . . 1 . . . A 100 ILE N . 17807 1
506 . 1 1 100 100 SER H H 1 8.929 . . 1 . . . A 101 SER H . 17807 1
507 . 1 1 100 100 SER C C 13 175.283 . . 1 . . . A 101 SER C . 17807 1
508 . 1 1 100 100 SER CA C 13 55.573 . . 1 . . . A 101 SER CA . 17807 1
509 . 1 1 100 100 SER CB C 13 66.766 . . 1 . . . A 101 SER CB . 17807 1
510 . 1 1 100 100 SER N N 15 123.770 . . 1 . . . A 101 SER N . 17807 1
511 . 1 1 101 101 ALA H H 1 9.163 . . 1 . . . A 102 ALA H . 17807 1
512 . 1 1 101 101 ALA C C 13 179.269 . . 1 . . . A 102 ALA C . 17807 1
513 . 1 1 101 101 ALA CA C 13 55.821 . . 1 . . . A 102 ALA CA . 17807 1
514 . 1 1 101 101 ALA CB C 13 17.902 . . 1 . . . A 102 ALA CB . 17807 1
515 . 1 1 101 101 ALA N N 15 122.922 . . 1 . . . A 102 ALA N . 17807 1
516 . 1 1 102 102 ALA H H 1 8.245 . . 1 . . . A 103 ALA H . 17807 1
517 . 1 1 102 102 ALA C C 13 181.497 . . 1 . . . A 103 ALA C . 17807 1
518 . 1 1 102 102 ALA CA C 13 55.208 . . 1 . . . A 103 ALA CA . 17807 1
519 . 1 1 102 102 ALA CB C 13 18.241 . . 1 . . . A 103 ALA CB . 17807 1
520 . 1 1 102 102 ALA N N 15 118.478 . . 1 . . . A 103 ALA N . 17807 1
521 . 1 1 103 103 GLU H H 1 7.876 . . 1 . . . A 104 GLU H . 17807 1
522 . 1 1 103 103 GLU C C 13 179.417 . . 1 . . . A 104 GLU C . 17807 1
523 . 1 1 103 103 GLU CA C 13 59.382 . . 1 . . . A 104 GLU CA . 17807 1
524 . 1 1 103 103 GLU CB C 13 28.858 . . 1 . . . A 104 GLU CB . 17807 1
525 . 1 1 103 103 GLU N N 15 120.353 . . 1 . . . A 104 GLU N . 17807 1
526 . 1 1 104 104 LEU H H 1 8.509 . . 1 . . . A 105 LEU H . 17807 1
527 . 1 1 104 104 LEU C C 13 178.526 . . 1 . . . A 105 LEU C . 17807 1
528 . 1 1 104 104 LEU CA C 13 58.615 . . 1 . . . A 105 LEU CA . 17807 1
529 . 1 1 104 104 LEU CB C 13 42.170 . . 1 . . . A 105 LEU CB . 17807 1
530 . 1 1 104 104 LEU N N 15 121.184 . . 1 . . . A 105 LEU N . 17807 1
531 . 1 1 105 105 ARG H H 1 8.732 . . 1 . . . A 106 ARG H . 17807 1
532 . 1 1 105 105 ARG C C 13 178.699 . . 1 . . . A 106 ARG C . 17807 1
533 . 1 1 105 105 ARG CA C 13 59.863 . . 1 . . . A 106 ARG CA . 17807 1
534 . 1 1 105 105 ARG CB C 13 30.563 . . 1 . . . A 106 ARG CB . 17807 1
535 . 1 1 105 105 ARG N N 15 117.878 . . 1 . . . A 106 ARG N . 17807 1
536 . 1 1 106 106 HIS H H 1 8.064 . . 1 . . . A 107 HIS H . 17807 1
537 . 1 1 106 106 HIS C C 13 177.684 . . 1 . . . A 107 HIS C . 17807 1
538 . 1 1 106 106 HIS CA C 13 59.871 . . 1 . . . A 107 HIS CA . 17807 1
539 . 1 1 106 106 HIS CB C 13 30.522 . . 1 . . . A 107 HIS CB . 17807 1
540 . 1 1 106 106 HIS N N 15 119.578 . . 1 . . . A 107 HIS N . 17807 1
541 . 1 1 107 107 VAL H H 1 7.758 . . 1 . . . A 108 VAL H . 17807 1
542 . 1 1 107 107 VAL C C 13 177.783 . . 1 . . . A 108 VAL C . 17807 1
543 . 1 1 107 107 VAL CA C 13 66.619 . . 1 . . . A 108 VAL CA . 17807 1
544 . 1 1 107 107 VAL CB C 13 31.414 . . 1 . . . A 108 VAL CB . 17807 1
545 . 1 1 107 107 VAL N N 15 118.640 . . 1 . . . A 108 VAL N . 17807 1
546 . 1 1 108 108 MET H H 1 8.074 . . 1 . . . A 109 MET H . 17807 1
547 . 1 1 108 108 MET HA H 1 4.225 . . 1 . . . A 109 MET HA . 17807 1
548 . 1 1 108 108 MET HE1 H 1 2.019 . . 1 . . . A 109 MET HE1 . 17807 1
549 . 1 1 108 108 MET HE2 H 1 2.019 . . 1 . . . A 109 MET HE2 . 17807 1
550 . 1 1 108 108 MET HE3 H 1 2.019 . . 1 . . . A 109 MET HE3 . 17807 1
551 . 1 1 108 108 MET C C 13 179.071 . . 1 . . . A 109 MET C . 17807 1
552 . 1 1 108 108 MET CA C 13 57.669 . . 1 . . . A 109 MET CA . 17807 1
553 . 1 1 108 108 MET CB C 13 30.411 . . 1 . . . A 109 MET CB . 17807 1
554 . 1 1 108 108 MET CE C 13 17.263 . . 1 . . . A 109 MET CE . 17807 1
555 . 1 1 108 108 MET N N 15 115.142 . . 1 . . . A 109 MET N . 17807 1
556 . 1 1 109 109 THR H H 1 8.335 . . 1 . . . A 110 THR H . 17807 1
557 . 1 1 109 109 THR C C 13 178.130 . . 1 . . . A 110 THR C . 17807 1
558 . 1 1 109 109 THR CA C 13 66.421 . . 1 . . . A 110 THR CA . 17807 1
559 . 1 1 109 109 THR CB C 13 68.726 . . 1 . . . A 110 THR CB . 17807 1
560 . 1 1 109 109 THR N N 15 115.321 . . 1 . . . A 110 THR N . 17807 1
561 . 1 1 110 110 ASN H H 1 7.659 . . 1 . . . A 111 ASN H . 17807 1
562 . 1 1 110 110 ASN C C 13 176.050 . . 1 . . . A 111 ASN C . 17807 1
563 . 1 1 110 110 ASN CA C 13 55.759 . . 1 . . . A 111 ASN CA . 17807 1
564 . 1 1 110 110 ASN CB C 13 38.161 . . 1 . . . A 111 ASN CB . 17807 1
565 . 1 1 110 110 ASN N N 15 122.427 . . 1 . . . A 111 ASN N . 17807 1
566 . 1 1 111 111 LEU H H 1 7.621 . . 1 . . . A 112 LEU H . 17807 1
567 . 1 1 111 111 LEU C C 13 176.347 . . 1 . . . A 112 LEU C . 17807 1
568 . 1 1 111 111 LEU CA C 13 54.887 . . 1 . . . A 112 LEU CA . 17807 1
569 . 1 1 111 111 LEU CB C 13 41.890 . . 1 . . . A 112 LEU CB . 17807 1
570 . 1 1 111 111 LEU N N 15 118.294 . . 1 . . . A 112 LEU N . 17807 1
571 . 1 1 112 112 GLY H H 1 7.645 . . 1 . . . A 113 GLY H . 17807 1
572 . 1 1 112 112 GLY C C 13 174.193 . . 1 . . . A 113 GLY C . 17807 1
573 . 1 1 112 112 GLY CA C 13 45.432 . . 1 . . . A 113 GLY CA . 17807 1
574 . 1 1 112 112 GLY N N 15 105.816 . . 1 . . . A 113 GLY N . 17807 1
575 . 1 1 113 113 GLU H H 1 7.927 . . 1 . . . A 114 GLU H . 17807 1
576 . 1 1 113 113 GLU C C 13 175.085 . . 1 . . . A 114 GLU C . 17807 1
577 . 1 1 113 113 GLU CA C 13 54.644 . . 1 . . . A 114 GLU CA . 17807 1
578 . 1 1 113 113 GLU CB C 13 30.257 . . 1 . . . A 114 GLU CB . 17807 1
579 . 1 1 113 113 GLU N N 15 120.489 . . 1 . . . A 114 GLU N . 17807 1
580 . 1 1 114 114 LYS H H 1 8.481 . . 1 . . . A 115 LYS H . 17807 1
581 . 1 1 114 114 LYS C C 13 175.555 . . 1 . . . A 115 LYS C . 17807 1
582 . 1 1 114 114 LYS CA C 13 55.579 . . 1 . . . A 115 LYS CA . 17807 1
583 . 1 1 114 114 LYS CB C 13 31.774 . . 1 . . . A 115 LYS CB . 17807 1
584 . 1 1 114 114 LYS N N 15 124.456 . . 1 . . . A 115 LYS N . 17807 1
585 . 1 1 115 115 LEU H H 1 8.026 . . 1 . . . A 116 LEU H . 17807 1
586 . 1 1 115 115 LEU C C 13 177.932 . . 1 . . . A 116 LEU C . 17807 1
587 . 1 1 115 115 LEU CA C 13 53.762 . . 1 . . . A 116 LEU CA . 17807 1
588 . 1 1 115 115 LEU CB C 13 44.936 . . 1 . . . A 116 LEU CB . 17807 1
589 . 1 1 115 115 LEU N N 15 124.923 . . 1 . . . A 116 LEU N . 17807 1
590 . 1 1 116 116 THR H H 1 9.192 . . 1 . . . A 117 THR H . 17807 1
591 . 1 1 116 116 THR C C 13 175.481 . . 1 . . . A 117 THR C . 17807 1
592 . 1 1 116 116 THR CA C 13 60.465 . . 1 . . . A 117 THR CA . 17807 1
593 . 1 1 116 116 THR CB C 13 71.008 . . 1 . . . A 117 THR CB . 17807 1
594 . 1 1 116 116 THR N N 15 114.707 . . 1 . . . A 117 THR N . 17807 1
595 . 1 1 117 117 ASP H H 1 8.871 . . 1 . . . A 118 ASP H . 17807 1
596 . 1 1 117 117 ASP C C 13 178.576 . . 1 . . . A 118 ASP C . 17807 1
597 . 1 1 117 117 ASP CA C 13 57.841 . . 1 . . . A 118 ASP CA . 17807 1
598 . 1 1 117 117 ASP CB C 13 39.546 . . 1 . . . A 118 ASP CB . 17807 1
599 . 1 1 117 117 ASP N N 15 121.104 . . 1 . . . A 118 ASP N . 17807 1
600 . 1 1 118 118 GLU H H 1 8.641 . . 1 . . . A 119 GLU H . 17807 1
601 . 1 1 118 118 GLU C C 13 179.170 . . 1 . . . A 119 GLU C . 17807 1
602 . 1 1 118 118 GLU CA C 13 59.873 . . 1 . . . A 119 GLU CA . 17807 1
603 . 1 1 118 118 GLU CB C 13 28.893 . . 1 . . . A 119 GLU CB . 17807 1
604 . 1 1 118 118 GLU N N 15 119.139 . . 1 . . . A 119 GLU N . 17807 1
605 . 1 1 119 119 GLU H H 1 7.724 . . 1 . . . A 120 GLU H . 17807 1
606 . 1 1 119 119 GLU C C 13 180.012 . . 1 . . . A 120 GLU C . 17807 1
607 . 1 1 119 119 GLU CA C 13 59.294 . . 1 . . . A 120 GLU CA . 17807 1
608 . 1 1 119 119 GLU CB C 13 30.451 . . 1 . . . A 120 GLU CB . 17807 1
609 . 1 1 119 119 GLU N N 15 120.412 . . 1 . . . A 120 GLU N . 17807 1
610 . 1 1 120 120 VAL H H 1 8.034 . . 1 . . . A 121 VAL H . 17807 1
611 . 1 1 120 120 VAL C C 13 177.263 . . 1 . . . A 121 VAL C . 17807 1
612 . 1 1 120 120 VAL CA C 13 66.762 . . 1 . . . A 121 VAL CA . 17807 1
613 . 1 1 120 120 VAL CB C 13 30.993 . . 1 . . . A 121 VAL CB . 17807 1
614 . 1 1 120 120 VAL N N 15 120.791 . . 1 . . . A 121 VAL N . 17807 1
615 . 1 1 121 121 ASP H H 1 8.044 . . 1 . . . A 122 ASP H . 17807 1
616 . 1 1 121 121 ASP C C 13 179.170 . . 1 . . . A 122 ASP C . 17807 1
617 . 1 1 121 121 ASP CA C 13 57.517 . . 1 . . . A 122 ASP CA . 17807 1
618 . 1 1 121 121 ASP CB C 13 40.476 . . 1 . . . A 122 ASP CB . 17807 1
619 . 1 1 121 121 ASP N N 15 119.751 . . 1 . . . A 122 ASP N . 17807 1
620 . 1 1 122 122 GLU H H 1 7.998 . . 1 . . . A 123 GLU H . 17807 1
621 . 1 1 122 122 GLU C C 13 178.031 . . 1 . . . A 123 GLU C . 17807 1
622 . 1 1 122 122 GLU CA C 13 59.257 . . 1 . . . A 123 GLU CA . 17807 1
623 . 1 1 122 122 GLU CB C 13 29.381 . . 1 . . . A 123 GLU CB . 17807 1
624 . 1 1 122 122 GLU N N 15 119.393 . . 1 . . . A 123 GLU N . 17807 1
625 . 1 1 123 123 MET H H 1 7.735 . . 1 . . . A 124 MET H . 17807 1
626 . 1 1 123 123 MET HA H 1 3.991 . . 1 . . . A 124 MET HA . 17807 1
627 . 1 1 123 123 MET HE1 H 1 1.996 . . 1 . . . A 124 MET HE1 . 17807 1
628 . 1 1 123 123 MET HE2 H 1 1.996 . . 1 . . . A 124 MET HE2 . 17807 1
629 . 1 1 123 123 MET HE3 H 1 1.996 . . 1 . . . A 124 MET HE3 . 17807 1
630 . 1 1 123 123 MET C C 13 179.170 . . 1 . . . A 124 MET C . 17807 1
631 . 1 1 123 123 MET CA C 13 59.477 . . 1 . . . A 124 MET CA . 17807 1
632 . 1 1 123 123 MET CB C 13 33.230 . . 1 . . . A 124 MET CB . 17807 1
633 . 1 1 123 123 MET CE C 13 17.135 . . 1 . . . A 124 MET CE . 17807 1
634 . 1 1 123 123 MET N N 15 119.324 . . 1 . . . A 124 MET N . 17807 1
635 . 1 1 124 124 ILE H H 1 7.896 . . 1 . . . A 125 ILE H . 17807 1
636 . 1 1 124 124 ILE C C 13 177.214 . . 1 . . . A 125 ILE C . 17807 1
637 . 1 1 124 124 ILE CA C 13 63.536 . . 1 . . . A 125 ILE CA . 17807 1
638 . 1 1 124 124 ILE CB C 13 36.046 . . 1 . . . A 125 ILE CB . 17807 1
639 . 1 1 124 124 ILE N N 15 118.124 . . 1 . . . A 125 ILE N . 17807 1
640 . 1 1 125 125 ARG H H 1 8.298 . . 1 . . . A 126 ARG H . 17807 1
641 . 1 1 125 125 ARG C C 13 179.318 . . 1 . . . A 126 ARG C . 17807 1
642 . 1 1 125 125 ARG CA C 13 59.721 . . 1 . . . A 126 ARG CA . 17807 1
643 . 1 1 125 125 ARG CB C 13 29.988 . . 1 . . . A 126 ARG CB . 17807 1
644 . 1 1 125 125 ARG N N 15 118.399 . . 1 . . . A 126 ARG N . 17807 1
645 . 1 1 126 126 GLU H H 1 7.862 . . 1 . . . A 127 GLU H . 17807 1
646 . 1 1 126 126 GLU C C 13 177.189 . . 1 . . . A 127 GLU C . 17807 1
647 . 1 1 126 126 GLU CA C 13 58.550 . . 1 . . . A 127 GLU CA . 17807 1
648 . 1 1 126 126 GLU CB C 13 29.531 . . 1 . . . A 127 GLU CB . 17807 1
649 . 1 1 126 126 GLU N N 15 115.951 . . 1 . . . A 127 GLU N . 17807 1
650 . 1 1 127 127 ALA H H 1 7.215 . . 1 . . . A 128 ALA H . 17807 1
651 . 1 1 127 127 ALA C C 13 177.759 . . 1 . . . A 128 ALA C . 17807 1
652 . 1 1 127 127 ALA CA C 13 51.954 . . 1 . . . A 128 ALA CA . 17807 1
653 . 1 1 127 127 ALA CB C 13 21.131 . . 1 . . . A 128 ALA CB . 17807 1
654 . 1 1 127 127 ALA N N 15 118.820 . . 1 . . . A 128 ALA N . 17807 1
655 . 1 1 128 128 ASP H H 1 7.851 . . 1 . . . A 129 ASP H . 17807 1
656 . 1 1 128 128 ASP C C 13 176.025 . . 1 . . . A 129 ASP C . 17807 1
657 . 1 1 128 128 ASP CA C 13 54.028 . . 1 . . . A 129 ASP CA . 17807 1
658 . 1 1 128 128 ASP CB C 13 40.400 . . 1 . . . A 129 ASP CB . 17807 1
659 . 1 1 128 128 ASP N N 15 117.921 . . 1 . . . A 129 ASP N . 17807 1
660 . 1 1 129 129 ILE H H 1 8.307 . . 1 . . . A 130 ILE H . 17807 1
661 . 1 1 129 129 ILE C C 13 177.907 . . 1 . . . A 130 ILE C . 17807 1
662 . 1 1 129 129 ILE CA C 13 63.423 . . 1 . . . A 130 ILE CA . 17807 1
663 . 1 1 129 129 ILE CB C 13 38.423 . . 1 . . . A 130 ILE CB . 17807 1
664 . 1 1 129 129 ILE N N 15 127.773 . . 1 . . . A 130 ILE N . 17807 1
665 . 1 1 130 130 ASP H H 1 8.277 . . 1 . . . A 131 ASP H . 17807 1
666 . 1 1 130 130 ASP C C 13 178.229 . . 1 . . . A 131 ASP C . 17807 1
667 . 1 1 130 130 ASP CA C 13 53.532 . . 1 . . . A 131 ASP CA . 17807 1
668 . 1 1 130 130 ASP CB C 13 39.829 . . 1 . . . A 131 ASP CB . 17807 1
669 . 1 1 130 130 ASP N N 15 116.587 . . 1 . . . A 131 ASP N . 17807 1
670 . 1 1 131 131 GLY H H 1 7.542 . . 1 . . . A 132 GLY H . 17807 1
671 . 1 1 131 131 GLY C C 13 175.283 . . 1 . . . A 132 GLY C . 17807 1
672 . 1 1 131 131 GLY CA C 13 47.505 . . 1 . . . A 132 GLY CA . 17807 1
673 . 1 1 131 131 GLY N N 15 108.541 . . 1 . . . A 132 GLY N . 17807 1
674 . 1 1 132 132 ASP H H 1 8.292 . . 1 . . . A 133 ASP H . 17807 1
675 . 1 1 132 132 ASP C C 13 177.659 . . 1 . . . A 133 ASP C . 17807 1
676 . 1 1 132 132 ASP CA C 13 53.480 . . 1 . . . A 133 ASP CA . 17807 1
677 . 1 1 132 132 ASP CB C 13 40.099 . . 1 . . . A 133 ASP CB . 17807 1
678 . 1 1 132 132 ASP N N 15 120.864 . . 1 . . . A 133 ASP N . 17807 1
679 . 1 1 133 133 GLY H H 1 10.351 . . 1 . . . A 134 GLY H . 17807 1
680 . 1 1 133 133 GLY C C 13 172.732 . . 1 . . . A 134 GLY C . 17807 1
681 . 1 1 133 133 GLY CA C 13 45.787 . . 1 . . . A 134 GLY CA . 17807 1
682 . 1 1 133 133 GLY N N 15 112.942 . . 1 . . . A 134 GLY N . 17807 1
683 . 1 1 134 134 GLN H H 1 7.905 . . 1 . . . A 135 GLN H . 17807 1
684 . 1 1 134 134 GLN C C 13 174.688 . . 1 . . . A 135 GLN C . 17807 1
685 . 1 1 134 134 GLN CA C 13 53.081 . . 1 . . . A 135 GLN CA . 17807 1
686 . 1 1 134 134 GLN CB C 13 32.222 . . 1 . . . A 135 GLN CB . 17807 1
687 . 1 1 134 134 GLN N N 15 115.249 . . 1 . . . A 135 GLN N . 17807 1
688 . 1 1 135 135 VAL H H 1 9.078 . . 1 . . . A 136 VAL H . 17807 1
689 . 1 1 135 135 VAL C C 13 175.902 . . 1 . . . A 136 VAL C . 17807 1
690 . 1 1 135 135 VAL CA C 13 61.723 . . 1 . . . A 136 VAL CA . 17807 1
691 . 1 1 135 135 VAL CB C 13 33.606 . . 1 . . . A 136 VAL CB . 17807 1
692 . 1 1 135 135 VAL N N 15 125.492 . . 1 . . . A 136 VAL N . 17807 1
693 . 1 1 136 136 ASN H H 1 9.503 . . 1 . . . A 137 ASN H . 17807 1
694 . 1 1 136 136 ASN C C 13 174.936 . . 1 . . . A 137 ASN C . 17807 1
695 . 1 1 136 136 ASN CA C 13 51.009 . . 1 . . . A 137 ASN CA . 17807 1
696 . 1 1 136 136 ASN CB C 13 38.163 . . 1 . . . A 137 ASN CB . 17807 1
697 . 1 1 136 136 ASN N N 15 129.146 . . 1 . . . A 137 ASN N . 17807 1
698 . 1 1 137 137 TYR H H 1 8.451 . . 1 . . . A 138 TYR H . 17807 1
699 . 1 1 137 137 TYR C C 13 176.100 . . 1 . . . A 138 TYR C . 17807 1
700 . 1 1 137 137 TYR CA C 13 62.708 . . 1 . . . A 138 TYR CA . 17807 1
701 . 1 1 137 137 TYR CB C 13 37.566 . . 1 . . . A 138 TYR CB . 17807 1
702 . 1 1 137 137 TYR N N 15 118.634 . . 1 . . . A 138 TYR N . 17807 1
703 . 1 1 138 138 GLU H H 1 8.080 . . 1 . . . A 139 GLU H . 17807 1
704 . 1 1 138 138 GLU C C 13 180.581 . . 1 . . . A 139 GLU C . 17807 1
705 . 1 1 138 138 GLU CA C 13 60.268 . . 1 . . . A 139 GLU CA . 17807 1
706 . 1 1 138 138 GLU CB C 13 28.767 . . 1 . . . A 139 GLU CB . 17807 1
707 . 1 1 138 138 GLU N N 15 118.474 . . 1 . . . A 139 GLU N . 17807 1
708 . 1 1 139 139 GLU H H 1 8.736 . . 1 . . . A 140 GLU H . 17807 1
709 . 1 1 139 139 GLU C C 13 179.417 . . 1 . . . A 140 GLU C . 17807 1
710 . 1 1 139 139 GLU CA C 13 58.379 . . 1 . . . A 140 GLU CA . 17807 1
711 . 1 1 139 139 GLU CB C 13 29.586 . . 1 . . . A 140 GLU CB . 17807 1
712 . 1 1 139 139 GLU N N 15 119.819 . . 1 . . . A 140 GLU N . 17807 1
713 . 1 1 140 140 PHE H H 1 8.875 . . 1 . . . A 141 PHE H . 17807 1
714 . 1 1 140 140 PHE C C 13 176.818 . . 1 . . . A 141 PHE C . 17807 1
715 . 1 1 140 140 PHE CA C 13 61.563 . . 1 . . . A 141 PHE CA . 17807 1
716 . 1 1 140 140 PHE CB C 13 39.829 . . 1 . . . A 141 PHE CB . 17807 1
717 . 1 1 140 140 PHE N N 15 124.906 . . 1 . . . A 141 PHE N . 17807 1
718 . 1 1 141 141 VAL H H 1 8.524 . . 1 . . . A 142 VAL H . 17807 1
719 . 1 1 141 141 VAL C C 13 179.690 . . 1 . . . A 142 VAL C . 17807 1
720 . 1 1 141 141 VAL CA C 13 67.050 . . 1 . . . A 142 VAL CA . 17807 1
721 . 1 1 141 141 VAL CB C 13 31.218 . . 1 . . . A 142 VAL CB . 17807 1
722 . 1 1 141 141 VAL N N 15 119.425 . . 1 . . . A 142 VAL N . 17807 1
723 . 1 1 142 142 GLN H H 1 7.387 . . 1 . . . A 143 GLN H . 17807 1
724 . 1 1 142 142 GLN C C 13 177.932 . . 1 . . . A 143 GLN C . 17807 1
725 . 1 1 142 142 GLN CA C 13 58.789 . . 1 . . . A 143 GLN CA . 17807 1
726 . 1 1 142 142 GLN CB C 13 27.863 . . 1 . . . A 143 GLN CB . 17807 1
727 . 1 1 142 142 GLN N N 15 118.155 . . 1 . . . A 143 GLN N . 17807 1
728 . 1 1 143 143 MET H H 1 7.840 . . 1 . . . A 144 MET H . 17807 1
729 . 1 1 143 143 MET HA H 1 4.069 . . 1 . . . A 144 MET HA . 17807 1
730 . 1 1 143 143 MET HE1 H 1 1.741 . . 1 . . . A 144 MET HE1 . 17807 1
731 . 1 1 143 143 MET HE2 H 1 1.741 . . 1 . . . A 144 MET HE2 . 17807 1
732 . 1 1 143 143 MET HE3 H 1 1.741 . . 1 . . . A 144 MET HE3 . 17807 1
733 . 1 1 143 143 MET C C 13 177.808 . . 1 . . . A 144 MET C . 17807 1
734 . 1 1 143 143 MET CA C 13 58.156 . . 1 . . . A 144 MET CA . 17807 1
735 . 1 1 143 143 MET CB C 13 32.591 . . 1 . . . A 144 MET CB . 17807 1
736 . 1 1 143 143 MET CE C 13 16.792 . . 1 . . . A 144 MET CE . 17807 1
737 . 1 1 143 143 MET N N 15 119.328 . . 1 . . . A 144 MET N . 17807 1
738 . 1 1 144 144 MET H H 1 7.693 . . 1 . . . A 145 MET H . 17807 1
739 . 1 1 144 144 MET HA H 1 4.116 . . 1 . . . A 145 MET HA . 17807 1
740 . 1 1 144 144 MET HE1 H 1 1.469 . . 1 . . . A 145 MET HE1 . 17807 1
741 . 1 1 144 144 MET HE2 H 1 1.469 . . 1 . . . A 145 MET HE2 . 17807 1
742 . 1 1 144 144 MET HE3 H 1 1.469 . . 1 . . . A 145 MET HE3 . 17807 1
743 . 1 1 144 144 MET C C 13 177.189 . . 1 . . . A 145 MET C . 17807 1
744 . 1 1 144 144 MET CA C 13 55.530 . . 1 . . . A 145 MET CA . 17807 1
745 . 1 1 144 144 MET CB C 13 32.393 . . 1 . . . A 145 MET CB . 17807 1
746 . 1 1 144 144 MET CE C 13 17.747 . . 1 . . . A 145 MET CE . 17807 1
747 . 1 1 144 144 MET N N 15 114.584 . . 1 . . . A 145 MET N . 17807 1
748 . 1 1 145 145 THR H H 1 7.487 . . 1 . . . A 146 THR H . 17807 1
749 . 1 1 145 145 THR C C 13 174.218 . . 1 . . . A 146 THR C . 17807 1
750 . 1 1 145 145 THR CA C 13 62.000 . . 1 . . . A 146 THR CA . 17807 1
751 . 1 1 145 145 THR CB C 13 70.340 . . 1 . . . A 146 THR CB . 17807 1
752 . 1 1 145 145 THR N N 15 109.795 . . 1 . . . A 146 THR N . 17807 1
753 . 1 1 146 146 ALA H H 1 7.674 . . 1 . . . A 147 ALA H . 17807 1
754 . 1 1 146 146 ALA C C 13 176.761 . . 1 . . . A 147 ALA C . 17807 1
755 . 1 1 146 146 ALA CA C 13 52.868 . . 1 . . . A 147 ALA CA . 17807 1
756 . 1 1 146 146 ALA CB C 13 18.899 . . 1 . . . A 147 ALA CB . 17807 1
757 . 1 1 146 146 ALA N N 15 126.858 . . 1 . . . A 147 ALA N . 17807 1
758 . 1 1 147 147 LYS H H 1 7.911 . . 1 . . . A 148 LYS H . 17807 1
759 . 1 1 147 147 LYS C C 13 181.472 . . 1 . . . A 148 LYS C . 17807 1
760 . 1 1 147 147 LYS CA C 13 57.530 . . 1 . . . A 148 LYS CA . 17807 1
761 . 1 1 147 147 LYS CB C 13 33.674 . . 1 . . . A 148 LYS CB . 17807 1
762 . 1 1 147 147 LYS N N 15 126.271 . . 1 . . . A 148 LYS N . 17807 1
763 . 2 2 1 1 ALA H H 1 8.634 . . 1 . . . . 349 ALA HN . 17807 1
764 . 2 2 1 1 ALA HA H 1 3.985 . . 1 . . . . 349 ALA HA . 17807 1
765 . 2 2 1 1 ALA HB1 H 1 1.334 . . 1 . . . . 349 ALA HB1 . 17807 1
766 . 2 2 1 1 ALA HB2 H 1 1.334 . . 1 . . . . 349 ALA HB1 . 17807 1
767 . 2 2 1 1 ALA HB3 H 1 1.334 . . 1 . . . . 349 ALA HB1 . 17807 1
768 . 2 2 2 2 PHE H H 1 8.732 . . 1 . . . . 350 PHE HN . 17807 1
769 . 2 2 2 2 PHE HA H 1 4.297 . . 1 . . . . 350 PHE HA . 17807 1
770 . 2 2 2 2 PHE HB2 H 1 3.096 . . 2 . . . . 350 PHE HB2 . 17807 1
771 . 2 2 2 2 PHE HB3 H 1 3.171 . . 2 . . . . 350 PHE HB3 . 17807 1
772 . 2 2 2 2 PHE HD1 H 1 7.213 . . 3 . . . . 350 PHE HD1 . 17807 1
773 . 2 2 2 2 PHE HE1 H 1 7.157 . . 3 . . . . 350 PHE HE1 . 17807 1
774 . 2 2 2 2 PHE HZ H 1 6.847 . . 1 . . . . 350 PHE HZ . 17807 1
775 . 2 2 3 3 ILE H H 1 7.449 . . 1 . . . . 351 ILE HN . 17807 1
776 . 2 2 3 3 ILE HA H 1 3.645 . . 1 . . . . 351 ILE HA . 17807 1
777 . 2 2 3 3 ILE HB H 1 2.014 . . 1 . . . . 351 ILE HB . 17807 1
778 . 2 2 3 3 ILE HG12 H 1 1.536 . . 1 . . . . 351 ILE HG12 . 17807 1
779 . 2 2 3 3 ILE HG13 H 1 1.203 . . 1 . . . . 351 ILE HG13 . 17807 1
780 . 2 2 3 3 ILE HG21 H 1 0.917 . . 1 . . . . 351 ILE HG21 . 17807 1
781 . 2 2 3 3 ILE HG22 H 1 0.917 . . 1 . . . . 351 ILE HG21 . 17807 1
782 . 2 2 3 3 ILE HG23 H 1 0.917 . . 1 . . . . 351 ILE HG21 . 17807 1
783 . 2 2 3 3 ILE HD11 H 1 0.881 . . 1 . . . . 351 ILE HD11 . 17807 1
784 . 2 2 3 3 ILE HD12 H 1 0.881 . . 1 . . . . 351 ILE HD11 . 17807 1
785 . 2 2 3 3 ILE HD13 H 1 0.881 . . 1 . . . . 351 ILE HD11 . 17807 1
786 . 2 2 4 4 ILE H H 1 7.787 . . 1 . . . . 352 ILE HN . 17807 1
787 . 2 2 4 4 ILE HA H 1 3.671 . . 1 . . . . 352 ILE HA . 17807 1
788 . 2 2 4 4 ILE HB H 1 2.017 . . 1 . . . . 352 ILE HB . 17807 1
789 . 2 2 4 4 ILE HG12 H 1 1.467 . . 1 . . . . 352 ILE HG12 . 17807 1
790 . 2 2 4 4 ILE HG13 H 1 1.182 . . 1 . . . . 352 ILE HG13 . 17807 1
791 . 2 2 4 4 ILE HG21 H 1 0.876 . . 1 . . . . 352 ILE HG21 . 17807 1
792 . 2 2 4 4 ILE HG22 H 1 0.876 . . 1 . . . . 352 ILE HG21 . 17807 1
793 . 2 2 4 4 ILE HG23 H 1 0.876 . . 1 . . . . 352 ILE HG21 . 17807 1
794 . 2 2 4 4 ILE HD11 H 1 0.698 . . 1 . . . . 352 ILE HD11 . 17807 1
795 . 2 2 4 4 ILE HD12 H 1 0.698 . . 1 . . . . 352 ILE HD11 . 17807 1
796 . 2 2 4 4 ILE HD13 H 1 0.698 . . 1 . . . . 352 ILE HD11 . 17807 1
797 . 2 2 5 5 TRP H H 1 7.814 . . 1 . . . . 353 TRP HN . 17807 1
798 . 2 2 5 5 TRP HA H 1 4.211 . . 1 . . . . 353 TRP HA . 17807 1
799 . 2 2 5 5 TRP HB2 H 1 3.268 . . 2 . . . . 353 TRP HB2 . 17807 1
800 . 2 2 5 5 TRP HB3 H 1 3.453 . . 2 . . . . 353 TRP HB3 . 17807 1
801 . 2 2 5 5 TRP HD1 H 1 7.157 . . 1 . . . . 353 TRP HD1 . 17807 1
802 . 2 2 5 5 TRP HE1 H 1 10.173 . . 1 . . . . 353 TRP HE1 . 17807 1
803 . 2 2 5 5 TRP HE3 H 1 7.229 . . 1 . . . . 353 TRP HE3 . 17807 1
804 . 2 2 5 5 TRP HZ2 H 1 7.323 . . 1 . . . . 353 TRP HZ2 . 17807 1
805 . 2 2 5 5 TRP HZ3 H 1 6.883 . . 1 . . . . 353 TRP HZ3 . 17807 1
806 . 2 2 5 5 TRP HH2 H 1 7.004 . . 1 . . . . 353 TRP HH2 . 17807 1
807 . 2 2 6 6 LEU H H 1 8.177 . . 1 . . . . 354 LEU HN . 17807 1
808 . 2 2 6 6 LEU HA H 1 3.469 . . 1 . . . . 354 LEU HA . 17807 1
809 . 2 2 6 6 LEU HB2 H 1 1.527 . . 2 . . . . 354 LEU HB1 . 17807 1
810 . 2 2 6 6 LEU HG H 1 1.610 . . 1 . . . . 354 LEU HG . 17807 1
811 . 2 2 6 6 LEU HD11 H 1 0.812 . . 2 . . . . 354 LEU HD11 . 17807 1
812 . 2 2 6 6 LEU HD12 H 1 0.812 . . 2 . . . . 354 LEU HD11 . 17807 1
813 . 2 2 6 6 LEU HD13 H 1 0.812 . . 2 . . . . 354 LEU HD11 . 17807 1
814 . 2 2 7 7 ALA H H 1 8.470 . . 1 . . . . 355 ALA HN . 17807 1
815 . 2 2 7 7 ALA HA H 1 3.878 . . 1 . . . . 355 ALA HA . 17807 1
816 . 2 2 7 7 ALA HB1 H 1 1.467 . . 1 . . . . 355 ALA HB1 . 17807 1
817 . 2 2 7 7 ALA HB2 H 1 1.467 . . 1 . . . . 355 ALA HB1 . 17807 1
818 . 2 2 7 7 ALA HB3 H 1 1.467 . . 1 . . . . 355 ALA HB1 . 17807 1
819 . 2 2 8 8 ARG H H 1 7.799 . . 1 . . . . 356 ARG HN . 17807 1
820 . 2 2 8 8 ARG HA H 1 3.881 . . 1 . . . . 356 ARG HA . 17807 1
821 . 2 2 8 8 ARG HB2 H 1 1.471 . . 2 . . . . 356 ARG HB2 . 17807 1
822 . 2 2 8 8 ARG HB3 H 1 1.824 . . 2 . . . . 356 ARG HB3 . 17807 1
823 . 2 2 8 8 ARG HG2 H 1 1.733 . . 2 . . . . 356 ARG HG2 . 17807 1
824 . 2 2 8 8 ARG HG3 H 1 1.601 . . 2 . . . . 356 ARG HG3 . 17807 1
825 . 2 2 9 9 ARG H H 1 7.696 . . 1 . . . . 357 ARG HN . 17807 1
826 . 2 2 9 9 ARG HA H 1 3.879 . . 1 . . . . 357 ARG HA . 17807 1
827 . 2 2 9 9 ARG HB2 H 1 1.580 . . 2 . . . . 357 ARG HB2 . 17807 1
828 . 2 2 9 9 ARG HB3 H 1 1.461 . . 2 . . . . 357 ARG HB3 . 17807 1
829 . 2 2 9 9 ARG HG2 H 1 1.263 . . 2 . . . . 357 ARG HG2 . 17807 1
830 . 2 2 9 9 ARG HG3 H 1 1.130 . . 2 . . . . 357 ARG HG3 . 17807 1
831 . 2 2 9 9 ARG HD2 H 1 2.683 . . 2 . . . . 357 ARG HD1 . 17807 1
832 . 2 2 9 9 ARG HE H 1 7.388 . . 1 . . . . 357 ARG HE . 17807 1
833 . 2 2 10 10 LEU H H 1 7.771 . . 1 . . . . 358 LEU HN . 17807 1
834 . 2 2 10 10 LEU HA H 1 4.018 . . 1 . . . . 358 LEU HA . 17807 1
835 . 2 2 10 10 LEU HB2 H 1 1.684 . . 2 . . . . 358 LEU HB1 . 17807 1
836 . 2 2 10 10 LEU HG H 1 1.670 . . 1 . . . . 358 LEU HG . 17807 1
837 . 2 2 10 10 LEU HD11 H 1 0.762 . . 2 . . . . 358 LEU HD11 . 17807 1
838 . 2 2 10 10 LEU HD12 H 1 0.762 . . 2 . . . . 358 LEU HD11 . 17807 1
839 . 2 2 10 10 LEU HD13 H 1 0.762 . . 2 . . . . 358 LEU HD11 . 17807 1
840 . 2 2 10 10 LEU HD21 H 1 0.700 . . 2 . . . . 358 LEU HD21 . 17807 1
841 . 2 2 10 10 LEU HD22 H 1 0.700 . . 2 . . . . 358 LEU HD21 . 17807 1
842 . 2 2 10 10 LEU HD23 H 1 0.700 . . 2 . . . . 358 LEU HD21 . 17807 1
843 . 2 2 11 11 LYS H H 1 7.624 . . 1 . . . . 359 LYS HN . 17807 1
844 . 2 2 11 11 LYS HA H 1 4.076 . . 1 . . . . 359 LYS HA . 17807 1
845 . 2 2 11 11 LYS HB2 H 1 1.839 . . 2 . . . . 359 LYS HB2 . 17807 1
846 . 2 2 11 11 LYS HB3 H 1 1.704 . . 2 . . . . 359 LYS HB3 . 17807 1
847 . 2 2 11 11 LYS HG2 H 1 1.445 . . 2 . . . . 359 LYS HG2 . 17807 1
848 . 2 2 11 11 LYS HG3 H 1 1.402 . . 2 . . . . 359 LYS HG3 . 17807 1
849 . 2 2 11 11 LYS HD2 H 1 1.575 . . 2 . . . . 359 LYS HD1 . 17807 1
850 . 2 2 12 12 LYS H H 1 7.895 . . 1 . . . . 360 LYS HN . 17807 1
851 . 2 2 12 12 LYS HA H 1 4.137 . . 1 . . . . 360 LYS HA . 17807 1
852 . 2 2 12 12 LYS HB2 H 1 1.770 . . 2 . . . . 360 LYS HB1 . 17807 1
853 . 2 2 12 12 LYS HG2 H 1 1.417 . . 2 . . . . 360 LYS HG2 . 17807 1
854 . 2 2 12 12 LYS HG3 H 1 1.378 . . 2 . . . . 360 LYS HG3 . 17807 1
855 . 2 2 12 12 LYS HD2 H 1 1.593 . . 2 . . . . 360 LYS HD1 . 17807 1
856 . 2 2 13 13 GLY H H 1 8.182 . . 1 . . . . 361 GLY HN . 17807 1
857 . 2 2 13 13 GLY HA2 H 1 3.885 . . 2 . . . . 361 GLY HA1 . 17807 1
858 . 2 2 14 14 LYS H H 1 8.115 . . 1 . . . . 362 LYS HN . 17807 1
859 . 2 2 14 14 LYS HA H 1 4.250 . . 1 . . . . 362 LYS HA . 17807 1
860 . 2 2 14 14 LYS HB2 H 1 1.796 . . 2 . . . . 362 LYS HB2 . 17807 1
861 . 2 2 14 14 LYS HB3 H 1 1.711 . . 2 . . . . 362 LYS HB3 . 17807 1
862 . 2 2 14 14 LYS HG2 H 1 1.373 . . 2 . . . . 362 LYS HG1 . 17807 1
863 . 2 2 14 14 LYS HD2 H 1 1.597 . . 2 . . . . 362 LYS HD1 . 17807 1
864 . 2 2 15 15 LYS H H 1 8.313 . . 1 . . . . 363 LYS HN . 17807 1
865 . 2 2 15 15 LYS HA H 1 4.222 . . 1 . . . . 363 LYS HA . 17807 1
866 . 2 2 15 15 LYS HB2 H 1 1.796 . . 2 . . . . 363 LYS HB2 . 17807 1
867 . 2 2 15 15 LYS HB3 H 1 1.735 . . 2 . . . . 363 LYS HB3 . 17807 1
868 . 2 2 15 15 LYS HG2 H 1 1.389 . . 2 . . . . 363 LYS HG1 . 17807 1
869 . 2 2 15 15 LYS HD2 H 1 1.613 . . 2 . . . . 363 LYS HD1 . 17807 1
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