data_17302
#######################
# Entry information #
#######################
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 17302
_Entry.Title
;
1H and 15N RESONANCE ASSIGNMENT OF HUMAN APO L-FABP
;
_Entry.Type macromolecule
_Entry.Version_type original
_Entry.Submission_date 2010-11-17
_Entry.Accession_date 2010-11-17
_Entry.Last_release_date 2012-06-05
_Entry.Original_release_date 2012-06-05
_Entry.Origination author
_Entry.NMR_STAR_version 3.1.1.61
_Entry.Original_NMR_STAR_version 3.0.9.13
_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 Jun Cai . . . 17302
2 Christian Luecke . . . 17302
3 Zhongjing Chen . . . 17302
4 Ye Qiao . . . 17302
5 Elena Klimtchuk . S. . 17302
6 James Hamilton . A. . 17302
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' . 17302
stop_
loop_
_Struct_keywords.Keywords
_Struct_keywords.Text
_Struct_keywords.Entry_ID
'apo form' . 17302
'fatty acid carrier' . 17302
'lipid binding protein' . 17302
stop_
loop_
_Data_set.Type
_Data_set.Count
_Data_set.Entry_ID
assigned_chemical_shifts 1 17302
stop_
loop_
_Datum.Type
_Datum.Count
_Datum.Entry_ID
'15N chemical shifts' 140 17302
'1H chemical shifts' 938 17302
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
1 . . 2012-06-05 2010-11-17 original author . 17302
stop_
loop_
_Related_entries.Database_name
_Related_entries.Database_accession_code
_Related_entries.Relationship
_Related_entries.Entry_ID
BMRB 15429 'rat apo L-FABP assignment' 17302
BMRB 15433 'rat holo L-FABP assignment' 17302
BMRB 17303 'human apo L-FABP assignment' 17302
PDB 1LFO 'rat holo L-FABP X-ray structure' 17302
PDB 2F73 'human L-FABP X-ray structure' 17302
PDB 2JU3 'rat apo L-FABP solution structure' 17302
PDB 2JU7 'rat holo L-FABP solution structure' 17302
PDB 2L67 'BMRB Entry Tracking System' 17302
PDB 2PY1 'human L-FABP solution structure' 17302
stop_
save_
###############
# Citations #
###############
save_entry_citation
_Citation.Sf_category citations
_Citation.Sf_framecode entry_citation
_Citation.Entry_ID 17302
_Citation.ID 1
_Citation.Class 'entry citation'
_Citation.CAS_abstract_code .
_Citation.MEDLINE_UI_code .
_Citation.DOI .
_Citation.PubMed_ID .
_Citation.Full_citation .
_Citation.Title 'Solution Structure and Backbone Dynamics of Human Liver Fatty Acid Binding Protein: Fatty Acid Binding Revisited'
_Citation.Status published
_Citation.Type journal
_Citation.Journal_abbrev 'Biophys. J.'
_Citation.Journal_name_full 'Biophysical Journal'
_Citation.Journal_volume 102
_Citation.Journal_issue .
_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 2585
_Citation.Page_last 2594
_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 Jun Cai . . . 17302 1
2 Christian Luecke . . . 17302 1
3 Zhongjing Chen . . . 17302 1
4 Ye Qiao . . . 17302 1
5 Elena Klimtchuk . S. . 17302 1
6 James Hamilton . A. . 17302 1
stop_
loop_
_Citation_keyword.Keyword
_Citation_keyword.Entry_ID
_Citation_keyword.Citation_ID
'apo form' 17302 1
'fatty acid carrier' 17302 1
'lipid binding protein' 17302 1
stop_
save_
#############################################
# Molecular system (assembly) description #
#############################################
save_assembly
_Assembly.Sf_category assembly
_Assembly.Sf_framecode assembly
_Assembly.Entry_ID 17302
_Assembly.ID 1
_Assembly.Name 'human liver fatty acid binding protein'
_Assembly.BMRB_code .
_Assembly.Number_of_components 1
_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 'human liver fatty acid binding protein' 1 $L-FABP A . yes native no no . . . 17302 1
stop_
save_
####################################
# Biological polymers and ligands #
####################################
save_L-FABP
_Entity.Sf_category entity
_Entity.Sf_framecode L-FABP
_Entity.Entry_ID 17302
_Entity.ID 1
_Entity.BMRB_code .
_Entity.Name L-FABP
_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
;
SFSGKYQLQSQENFEAFMKA
IGLPEELIQKGKDIKGVSEI
VQNGKHFKFTITAGSKVIQN
EFTVGEECELETMTGEKVKT
VVQLEGDNKLVTTFKNIKSV
TELNGDIITNTMTLGDIVFK
RISKRI
;
_Entity.Target_identifier .
_Entity.Polymer_author_defined_seq .
_Entity.Polymer_author_seq_details
;
the N-terminal residue Met1 is missing;
the assignments thus start with Ser2
;
_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 126
_Entity.Number_of_nonpolymer_components .
_Entity.Paramagnetic no
_Entity.Thiol_state 'all free'
_Entity.Src_method man
_Entity.Parent_entity_ID .
_Entity.Fragment .
_Entity.Mutation .
_Entity.EC_number .
_Entity.Calc_isoelectric_point .
_Entity.Formula_weight 14095.292
_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 17303 . L-FABP . . . . . 100.00 126 100.00 100.00 6.53e-82 . . . . 17302 1
2 no BMRB 19160 . hL-FABP . . . . . 100.00 135 99.21 99.21 1.80e-81 . . . . 17302 1
3 no BMRB 19188 . hL-FABP . . . . . 100.00 135 99.21 99.21 1.80e-81 . . . . 17302 1
4 no BMRB 19189 . hL-FABP . . . . . 100.00 135 99.21 99.21 1.80e-81 . . . . 17302 1
5 no BMRB 25333 . hL-FABP . . . . . 100.00 135 99.21 99.21 1.80e-81 . . . . 17302 1
6 no PDB 2F73 . "Crystal Structure Of Human Fatty Acid Binding Protein 1 (Fabp1)" . . . . . 100.00 149 100.00 100.00 3.57e-82 . . . . 17302 1
7 no PDB 2L67 . "Solution Structure Of Human Apo L-fabp" . . . . . 100.00 126 100.00 100.00 6.53e-82 . . . . 17302 1
8 no PDB 2L68 . "Solution Structure Of Human Holo L-fabp" . . . . . 100.00 126 100.00 100.00 6.53e-82 . . . . 17302 1
9 no PDB 2LKK . "Human L-fabp In Complex With Oleate" . . . . . 100.00 126 100.00 100.00 6.53e-82 . . . . 17302 1
10 no PDB 2PY1 . "Solution Structure Of Human Liver Fatty Acid Binding Protein" . . . . . 100.00 129 100.00 100.00 5.85e-82 . . . . 17302 1
11 no PDB 3B2H . "Iodide Derivative Of Human Lfabp At High Resolution" . . . . . 100.00 132 100.00 100.00 4.65e-82 . . . . 17302 1
12 no PDB 3B2I . "Iodide Derivative Of Human Lfabp" . . . . . 100.00 132 100.00 100.00 4.65e-82 . . . . 17302 1
13 no PDB 3B2J . "Iodide Derivative Of Human Lfabp" . . . . . 100.00 132 100.00 100.00 4.65e-82 . . . . 17302 1
14 no PDB 3B2K . "Iodide Derivative Of Human Lfabp" . . . . . 100.00 132 100.00 100.00 4.65e-82 . . . . 17302 1
15 no PDB 3B2L . "Iodide Derivative Of Human Lfabp" . . . . . 100.00 132 100.00 100.00 4.65e-82 . . . . 17302 1
16 no PDB 3STK . "Crystal Structure Of Human Lfabp Complex With Two Molecules Of Palmitic Acid (Holo-Lfabp)" . . . . . 100.00 132 100.00 100.00 4.65e-82 . . . . 17302 1
17 no PDB 3STM . "Structure Of Human Lfabp In Complex With One Molecule Of Palmitic Acid" . . . . . 100.00 132 100.00 100.00 4.65e-82 . . . . 17302 1
18 no PDB 3STN . "Structure Of Human Lfabp (Apo-Lfabp)" . . . . . 100.00 132 100.00 100.00 4.65e-82 . . . . 17302 1
19 no PDB 3VG2 . "Iodide Derivative Of Human Lfabp" . . . . . 100.00 132 100.00 100.00 4.65e-82 . . . . 17302 1
20 no PDB 3VG3 . "Cadmium Derivative Of Human Lfabp" . . . . . 100.00 132 100.00 100.00 4.65e-82 . . . . 17302 1
21 no PDB 3VG4 . "Cadmium Derivative Of Human Lfabp" . . . . . 100.00 132 100.00 100.00 4.65e-82 . . . . 17302 1
22 no PDB 3VG5 . "Barium Derivative Of Human Lfabp" . . . . . 100.00 132 100.00 100.00 4.65e-82 . . . . 17302 1
23 no PDB 3VG6 . "Barium Derivative Of Human Lfabp" . . . . . 100.00 132 100.00 100.00 4.65e-82 . . . . 17302 1
24 no PDB 3VG7 . "Structure Of Human Lfabp At High Resolution From S-sad" . . . . . 100.00 132 100.00 100.00 4.65e-82 . . . . 17302 1
25 no DBJ BAI46102 . "fatty acid binding protein 1, liver [synthetic construct]" . . . . . 100.00 127 100.00 100.00 4.08e-82 . . . . 17302 1
26 no EMBL CAG46887 . "FABP1 [Homo sapiens]" . . . . . 100.00 127 100.00 100.00 4.08e-82 . . . . 17302 1
27 no EMBL CAH90116 . "hypothetical protein [Pongo abelii]" . . . . . 100.00 127 97.62 98.41 8.13e-80 . . . . 17302 1
28 no GB AAA52418 . "fatty acid binding protein [Homo sapiens]" . . . . . 100.00 127 99.21 99.21 1.82e-81 . . . . 17302 1
29 no GB AAA52419 . "L-FABP [Homo sapiens]" . . . . . 100.00 127 100.00 100.00 4.08e-82 . . . . 17302 1
30 no GB AAH22287 . "FABP1 protein, partial [Homo sapiens]" . . . . . 99.21 134 99.20 100.00 7.94e-81 . . . . 17302 1
31 no GB AAH32801 . "Fatty acid binding protein 1, liver [Homo sapiens]" . . . . . 100.00 127 100.00 100.00 4.08e-82 . . . . 17302 1
32 no GB AAX37108 . "fatty acid binding protein 1 [synthetic construct]" . . . . . 100.00 128 100.00 100.00 5.31e-82 . . . . 17302 1
33 no REF NP_001125017 . "fatty acid-binding protein, liver [Pongo abelii]" . . . . . 100.00 127 97.62 98.41 8.13e-80 . . . . 17302 1
34 no REF NP_001434 . "fatty acid-binding protein, liver [Homo sapiens]" . . . . . 100.00 127 100.00 100.00 4.08e-82 . . . . 17302 1
35 no REF XP_001140263 . "PREDICTED: fatty acid-binding protein, liver [Pan troglodytes]" . . . . . 100.00 127 100.00 100.00 4.08e-82 . . . . 17302 1
36 no REF XP_003268834 . "PREDICTED: fatty acid-binding protein, liver [Nomascus leucogenys]" . . . . . 100.00 127 98.41 99.21 1.03e-80 . . . . 17302 1
37 no REF XP_003805902 . "PREDICTED: fatty acid-binding protein, liver [Pan paniscus]" . . . . . 100.00 127 100.00 100.00 4.08e-82 . . . . 17302 1
38 no SP P07148 . "RecName: Full=Fatty acid-binding protein, liver; AltName: Full=Fatty acid-binding protein 1; AltName: Full=Liver-type fatty aci" . . . . . 100.00 127 100.00 100.00 4.08e-82 . . . . 17302 1
stop_
loop_
_Entity_biological_function.Biological_function
_Entity_biological_function.Entry_ID
_Entity_biological_function.Entity_ID
'fatty acid carrier' 17302 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 SER . 17302 1
2 3 PHE . 17302 1
3 4 SER . 17302 1
4 5 GLY . 17302 1
5 6 LYS . 17302 1
6 7 TYR . 17302 1
7 8 GLN . 17302 1
8 9 LEU . 17302 1
9 10 GLN . 17302 1
10 11 SER . 17302 1
11 12 GLN . 17302 1
12 13 GLU . 17302 1
13 14 ASN . 17302 1
14 15 PHE . 17302 1
15 16 GLU . 17302 1
16 17 ALA . 17302 1
17 18 PHE . 17302 1
18 19 MET . 17302 1
19 20 LYS . 17302 1
20 21 ALA . 17302 1
21 22 ILE . 17302 1
22 23 GLY . 17302 1
23 24 LEU . 17302 1
24 25 PRO . 17302 1
25 26 GLU . 17302 1
26 27 GLU . 17302 1
27 28 LEU . 17302 1
28 29 ILE . 17302 1
29 30 GLN . 17302 1
30 31 LYS . 17302 1
31 32 GLY . 17302 1
32 33 LYS . 17302 1
33 34 ASP . 17302 1
34 35 ILE . 17302 1
35 36 LYS . 17302 1
36 37 GLY . 17302 1
37 38 VAL . 17302 1
38 39 SER . 17302 1
39 40 GLU . 17302 1
40 41 ILE . 17302 1
41 42 VAL . 17302 1
42 43 GLN . 17302 1
43 44 ASN . 17302 1
44 45 GLY . 17302 1
45 46 LYS . 17302 1
46 47 HIS . 17302 1
47 48 PHE . 17302 1
48 49 LYS . 17302 1
49 50 PHE . 17302 1
50 51 THR . 17302 1
51 52 ILE . 17302 1
52 53 THR . 17302 1
53 54 ALA . 17302 1
54 55 GLY . 17302 1
55 56 SER . 17302 1
56 57 LYS . 17302 1
57 58 VAL . 17302 1
58 59 ILE . 17302 1
59 60 GLN . 17302 1
60 61 ASN . 17302 1
61 62 GLU . 17302 1
62 63 PHE . 17302 1
63 64 THR . 17302 1
64 65 VAL . 17302 1
65 66 GLY . 17302 1
66 67 GLU . 17302 1
67 68 GLU . 17302 1
68 69 CYS . 17302 1
69 70 GLU . 17302 1
70 71 LEU . 17302 1
71 72 GLU . 17302 1
72 73 THR . 17302 1
73 74 MET . 17302 1
74 75 THR . 17302 1
75 76 GLY . 17302 1
76 77 GLU . 17302 1
77 78 LYS . 17302 1
78 79 VAL . 17302 1
79 80 LYS . 17302 1
80 81 THR . 17302 1
81 82 VAL . 17302 1
82 83 VAL . 17302 1
83 84 GLN . 17302 1
84 85 LEU . 17302 1
85 86 GLU . 17302 1
86 87 GLY . 17302 1
87 88 ASP . 17302 1
88 89 ASN . 17302 1
89 90 LYS . 17302 1
90 91 LEU . 17302 1
91 92 VAL . 17302 1
92 93 THR . 17302 1
93 94 THR . 17302 1
94 95 PHE . 17302 1
95 96 LYS . 17302 1
96 97 ASN . 17302 1
97 98 ILE . 17302 1
98 99 LYS . 17302 1
99 100 SER . 17302 1
100 101 VAL . 17302 1
101 102 THR . 17302 1
102 103 GLU . 17302 1
103 104 LEU . 17302 1
104 105 ASN . 17302 1
105 106 GLY . 17302 1
106 107 ASP . 17302 1
107 108 ILE . 17302 1
108 109 ILE . 17302 1
109 110 THR . 17302 1
110 111 ASN . 17302 1
111 112 THR . 17302 1
112 113 MET . 17302 1
113 114 THR . 17302 1
114 115 LEU . 17302 1
115 116 GLY . 17302 1
116 117 ASP . 17302 1
117 118 ILE . 17302 1
118 119 VAL . 17302 1
119 120 PHE . 17302 1
120 121 LYS . 17302 1
121 122 ARG . 17302 1
122 123 ILE . 17302 1
123 124 SER . 17302 1
124 125 LYS . 17302 1
125 126 ARG . 17302 1
126 127 ILE . 17302 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
. SER 1 1 17302 1
. PHE 2 2 17302 1
. SER 3 3 17302 1
. GLY 4 4 17302 1
. LYS 5 5 17302 1
. TYR 6 6 17302 1
. GLN 7 7 17302 1
. LEU 8 8 17302 1
. GLN 9 9 17302 1
. SER 10 10 17302 1
. GLN 11 11 17302 1
. GLU 12 12 17302 1
. ASN 13 13 17302 1
. PHE 14 14 17302 1
. GLU 15 15 17302 1
. ALA 16 16 17302 1
. PHE 17 17 17302 1
. MET 18 18 17302 1
. LYS 19 19 17302 1
. ALA 20 20 17302 1
. ILE 21 21 17302 1
. GLY 22 22 17302 1
. LEU 23 23 17302 1
. PRO 24 24 17302 1
. GLU 25 25 17302 1
. GLU 26 26 17302 1
. LEU 27 27 17302 1
. ILE 28 28 17302 1
. GLN 29 29 17302 1
. LYS 30 30 17302 1
. GLY 31 31 17302 1
. LYS 32 32 17302 1
. ASP 33 33 17302 1
. ILE 34 34 17302 1
. LYS 35 35 17302 1
. GLY 36 36 17302 1
. VAL 37 37 17302 1
. SER 38 38 17302 1
. GLU 39 39 17302 1
. ILE 40 40 17302 1
. VAL 41 41 17302 1
. GLN 42 42 17302 1
. ASN 43 43 17302 1
. GLY 44 44 17302 1
. LYS 45 45 17302 1
. HIS 46 46 17302 1
. PHE 47 47 17302 1
. LYS 48 48 17302 1
. PHE 49 49 17302 1
. THR 50 50 17302 1
. ILE 51 51 17302 1
. THR 52 52 17302 1
. ALA 53 53 17302 1
. GLY 54 54 17302 1
. SER 55 55 17302 1
. LYS 56 56 17302 1
. VAL 57 57 17302 1
. ILE 58 58 17302 1
. GLN 59 59 17302 1
. ASN 60 60 17302 1
. GLU 61 61 17302 1
. PHE 62 62 17302 1
. THR 63 63 17302 1
. VAL 64 64 17302 1
. GLY 65 65 17302 1
. GLU 66 66 17302 1
. GLU 67 67 17302 1
. CYS 68 68 17302 1
. GLU 69 69 17302 1
. LEU 70 70 17302 1
. GLU 71 71 17302 1
. THR 72 72 17302 1
. MET 73 73 17302 1
. THR 74 74 17302 1
. GLY 75 75 17302 1
. GLU 76 76 17302 1
. LYS 77 77 17302 1
. VAL 78 78 17302 1
. LYS 79 79 17302 1
. THR 80 80 17302 1
. VAL 81 81 17302 1
. VAL 82 82 17302 1
. GLN 83 83 17302 1
. LEU 84 84 17302 1
. GLU 85 85 17302 1
. GLY 86 86 17302 1
. ASP 87 87 17302 1
. ASN 88 88 17302 1
. LYS 89 89 17302 1
. LEU 90 90 17302 1
. VAL 91 91 17302 1
. THR 92 92 17302 1
. THR 93 93 17302 1
. PHE 94 94 17302 1
. LYS 95 95 17302 1
. ASN 96 96 17302 1
. ILE 97 97 17302 1
. LYS 98 98 17302 1
. SER 99 99 17302 1
. VAL 100 100 17302 1
. THR 101 101 17302 1
. GLU 102 102 17302 1
. LEU 103 103 17302 1
. ASN 104 104 17302 1
. GLY 105 105 17302 1
. ASP 106 106 17302 1
. ILE 107 107 17302 1
. ILE 108 108 17302 1
. THR 109 109 17302 1
. ASN 110 110 17302 1
. THR 111 111 17302 1
. MET 112 112 17302 1
. THR 113 113 17302 1
. LEU 114 114 17302 1
. GLY 115 115 17302 1
. ASP 116 116 17302 1
. ILE 117 117 17302 1
. VAL 118 118 17302 1
. PHE 119 119 17302 1
. LYS 120 120 17302 1
. ARG 121 121 17302 1
. ILE 122 122 17302 1
. SER 123 123 17302 1
. LYS 124 124 17302 1
. ARG 125 125 17302 1
. ILE 126 126 17302 1
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 17302
_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 $L-FABP . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 17302 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 17302
_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 $L-FABP . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli MG1655 . . . . . . . . . . . . . . . pMON . . . . . . 17302 1
stop_
save_
#####################################
# Sample contents and methodology #
#####################################
########################
# Sample description #
########################
save_sample_1
_Sample.Sf_category sample
_Sample.Sf_framecode sample_1
_Sample.Entry_ID 17302
_Sample.ID 1
_Sample.Type solution
_Sample.Sub_type .
_Sample.Details 'non-labeled L-FABP'
_Sample.Aggregate_sample_number .
_Sample.Solvent_system '95% H2O/5% 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 'potassium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 17302 1
2 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 17302 1
3 'sodium azide' 'natural abundance' . . . . . . 0.05 . . % . . . . 17302 1
4 'human liver fatty acid binding protein' 'natural abundance' . . 1 $L-FABP . . . 2 3 mM . . . . 17302 1
5 H2O 'natural abundance' . . . . . . 95 . . % . . . . 17302 1
6 D2O 'natural abundance' . . . . . . 5 . . % . . . . 17302 1
stop_
save_
save_sample_2
_Sample.Sf_category sample
_Sample.Sf_framecode sample_2
_Sample.Entry_ID 17302
_Sample.ID 2
_Sample.Type solution
_Sample.Sub_type .
_Sample.Details '15N-labeled L-FABP'
_Sample.Aggregate_sample_number .
_Sample.Solvent_system '95% H2O/5% 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 'potassium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 17302 2
2 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 17302 2
3 'sodium azide' 'natural abundance' . . . . . . 0.05 . . % . . . . 17302 2
4 'human liver fatty acid binding protein' [U-15N] . . 1 $L-FABP . . . 2 3 mM . . . . 17302 2
5 H2O 'natural abundance' . . . . . . 95 . . % . . . . 17302 2
6 D2O 'natural abundance' . . . . . . 5 . . % . . . . 17302 2
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 17302
_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' 150 . mM 17302 1
pH 6.0 . pH 17302 1
pressure 1 . atm 17302 1
temperature 298 . K 17302 1
stop_
save_
############################
# Computer software used #
############################
save_CYANA
_Software.Sf_category software
_Software.Sf_framecode CYANA
_Software.Entry_ID 17302
_Software.ID 1
_Software.Name CYANA
_Software.Version 2.1
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Guntert, Mumenthaler and Wuthrich' . . 17302 1
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
'structure solution' 17302 1
stop_
save_
save_DISCOVER
_Software.Sf_category software
_Software.Sf_framecode DISCOVER
_Software.Entry_ID 17302
_Software.ID 2
_Software.Name DISCOVER
_Software.Version 2000
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Accelrys Software Inc.' . . 17302 2
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
refinement 17302 2
stop_
save_
save_NMRView
_Software.Sf_category software
_Software.Sf_framecode NMRView
_Software.Entry_ID 17302
_Software.ID 3
_Software.Name NMRView
_Software.Version 8.0
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Johnson, One Moon Scientific' . . 17302 3
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
'data analysis' 17302 3
'peak picking' 17302 3
stop_
save_
save_xwinnmr
_Software.Sf_category software
_Software.Sf_framecode xwinnmr
_Software.Entry_ID 17302
_Software.ID 4
_Software.Name xwinnmr
_Software.Version 3.5
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Bruker Biospin' . . 17302 4
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
collection 17302 4
processing 17302 4
stop_
save_
save_TOPSPIN
_Software.Sf_category software
_Software.Sf_framecode TOPSPIN
_Software.Entry_ID 17302
_Software.ID 5
_Software.Name TOPSPIN
_Software.Version 1.3
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Bruker Biospin' . . 17302 5
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
collection 17302 5
processing 17302 5
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 17302
_NMR_spectrometer.ID 1
_NMR_spectrometer.Details .
_NMR_spectrometer.Manufacturer Bruker
_NMR_spectrometer.Model DMX
_NMR_spectrometer.Serial_number .
_NMR_spectrometer.Field_strength 500
save_
save_spectrometer_2
_NMR_spectrometer.Sf_category NMR_spectrometer
_NMR_spectrometer.Sf_framecode spectrometer_2
_NMR_spectrometer.Entry_ID 17302
_NMR_spectrometer.ID 2
_NMR_spectrometer.Details .
_NMR_spectrometer.Manufacturer Bruker
_NMR_spectrometer.Model Avance
_NMR_spectrometer.Serial_number .
_NMR_spectrometer.Field_strength 800
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 17302
_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 DMX . 500 . . . 17302 1
2 spectrometer_2 Bruker Avance . 800 . . . 17302 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 17302
_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 . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17302 1
2 '2D 1H-1H TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17302 1
3 '2D 1H-1H NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17302 1
4 '3D 1H-15N NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17302 1
5 '3D 1H-15N TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17302 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 17302
_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
H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 17302 1
N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 17302 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 17302
_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' . . . 17302 1
2 '2D 1H-1H TOCSY' . . . 17302 1
3 '2D 1H-1H NOESY' . . . 17302 1
4 '3D 1H-15N NOESY' . . . 17302 1
5 '3D 1H-15N TOCSY' . . . 17302 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 SER HA H 1 4.30 0.01 . 1 . . . . 2 SER HA . 17302 1
2 . 1 1 1 1 SER HB2 H 1 4.24 0.01 . 2 . . . . 2 SER HB2 . 17302 1
3 . 1 1 1 1 SER HB3 H 1 4.02 0.01 . 2 . . . . 2 SER HB3 . 17302 1
4 . 1 1 2 2 PHE H H 1 9.47 0.01 . 1 . . . . 3 PHE H . 17302 1
5 . 1 1 2 2 PHE HA H 1 4.34 0.01 . 1 . . . . 3 PHE HA . 17302 1
6 . 1 1 2 2 PHE HB2 H 1 3.20 0.01 . 1 . . . . 3 PHE HB2 . 17302 1
7 . 1 1 2 2 PHE HB3 H 1 3.20 0.01 . 1 . . . . 3 PHE HB3 . 17302 1
8 . 1 1 2 2 PHE HD1 H 1 7.41 0.01 . 1 . . . . 3 PHE HD1 . 17302 1
9 . 1 1 2 2 PHE HD2 H 1 7.41 0.01 . 1 . . . . 3 PHE HD2 . 17302 1
10 . 1 1 2 2 PHE HE1 H 1 7.12 0.01 . 1 . . . . 3 PHE HE1 . 17302 1
11 . 1 1 2 2 PHE HE2 H 1 7.12 0.01 . 1 . . . . 3 PHE HE2 . 17302 1
12 . 1 1 2 2 PHE HZ H 1 6.99 0.01 . 1 . . . . 3 PHE HZ . 17302 1
13 . 1 1 2 2 PHE N N 15 119.6 0.1 . 1 . . . . 3 PHE N . 17302 1
14 . 1 1 3 3 SER H H 1 8.38 0.01 . 1 . . . . 4 SER H . 17302 1
15 . 1 1 3 3 SER HA H 1 4.45 0.01 . 1 . . . . 4 SER HA . 17302 1
16 . 1 1 3 3 SER HB2 H 1 3.85 0.01 . 1 . . . . 4 SER HB2 . 17302 1
17 . 1 1 3 3 SER HB3 H 1 4.02 0.01 . 1 . . . . 4 SER HB3 . 17302 1
18 . 1 1 3 3 SER N N 15 116.0 0.1 . 1 . . . . 4 SER N . 17302 1
19 . 1 1 4 4 GLY H H 1 9.05 0.01 . 1 . . . . 5 GLY H . 17302 1
20 . 1 1 4 4 GLY HA2 H 1 3.81 0.01 . 1 . . . . 5 GLY HA2 . 17302 1
21 . 1 1 4 4 GLY HA3 H 1 3.93 0.01 . 1 . . . . 5 GLY HA3 . 17302 1
22 . 1 1 4 4 GLY N N 15 111.5 0.1 . 1 . . . . 5 GLY N . 17302 1
23 . 1 1 5 5 LYS H H 1 8.26 0.01 . 1 . . . . 6 LYS H . 17302 1
24 . 1 1 5 5 LYS HA H 1 5.19 0.01 . 1 . . . . 6 LYS HA . 17302 1
25 . 1 1 5 5 LYS HB2 H 1 1.61 0.01 . 1 . . . . 6 LYS HB2 . 17302 1
26 . 1 1 5 5 LYS HB3 H 1 1.61 0.01 . 1 . . . . 6 LYS HB3 . 17302 1
27 . 1 1 5 5 LYS HG2 H 1 1.19 0.01 . 1 . . . . 6 LYS HG2 . 17302 1
28 . 1 1 5 5 LYS HG3 H 1 1.41 0.01 . 1 . . . . 6 LYS HG3 . 17302 1
29 . 1 1 5 5 LYS HD2 H 1 1.62 0.01 . 1 . . . . 6 LYS HD2 . 17302 1
30 . 1 1 5 5 LYS HD3 H 1 1.62 0.01 . 1 . . . . 6 LYS HD3 . 17302 1
31 . 1 1 5 5 LYS HE2 H 1 2.87 0.01 . 1 . . . . 6 LYS HE2 . 17302 1
32 . 1 1 5 5 LYS HE3 H 1 2.87 0.01 . 1 . . . . 6 LYS HE3 . 17302 1
33 . 1 1 5 5 LYS N N 15 120.2 0.1 . 1 . . . . 6 LYS N . 17302 1
34 . 1 1 6 6 TYR H H 1 9.24 0.01 . 1 . . . . 7 TYR H . 17302 1
35 . 1 1 6 6 TYR HA H 1 5.08 0.01 . 1 . . . . 7 TYR HA . 17302 1
36 . 1 1 6 6 TYR HB2 H 1 2.71 0.01 . 1 . . . . 7 TYR HB2 . 17302 1
37 . 1 1 6 6 TYR HB3 H 1 2.42 0.01 . 1 . . . . 7 TYR HB3 . 17302 1
38 . 1 1 6 6 TYR HD1 H 1 6.79 0.01 . 1 . . . . 7 TYR HD1 . 17302 1
39 . 1 1 6 6 TYR HD2 H 1 6.79 0.01 . 1 . . . . 7 TYR HD2 . 17302 1
40 . 1 1 6 6 TYR HE1 H 1 6.50 0.01 . 1 . . . . 7 TYR HE1 . 17302 1
41 . 1 1 6 6 TYR HE2 H 1 6.50 0.01 . 1 . . . . 7 TYR HE2 . 17302 1
42 . 1 1 6 6 TYR N N 15 119.7 0.1 . 1 . . . . 7 TYR N . 17302 1
43 . 1 1 7 7 GLN H H 1 9.25 0.01 . 1 . . . . 8 GLN H . 17302 1
44 . 1 1 7 7 GLN HA H 1 5.01 0.01 . 1 . . . . 8 GLN HA . 17302 1
45 . 1 1 7 7 GLN HB2 H 1 2.09 0.01 . 1 . . . . 8 GLN HB2 . 17302 1
46 . 1 1 7 7 GLN HB3 H 1 2.09 0.01 . 1 . . . . 8 GLN HB3 . 17302 1
47 . 1 1 7 7 GLN HG2 H 1 2.45 0.01 . 1 . . . . 8 GLN HG2 . 17302 1
48 . 1 1 7 7 GLN HG3 H 1 2.24 0.01 . 1 . . . . 8 GLN HG3 . 17302 1
49 . 1 1 7 7 GLN HE21 H 1 7.54 0.01 . 1 . . . . 8 GLN HE21 . 17302 1
50 . 1 1 7 7 GLN HE22 H 1 6.84 0.01 . 1 . . . . 8 GLN HE22 . 17302 1
51 . 1 1 7 7 GLN N N 15 124.4 0.1 . 1 . . . . 8 GLN N . 17302 1
52 . 1 1 7 7 GLN NE2 N 15 112.2 0.1 . 1 . . . . 8 GLN NE2 . 17302 1
53 . 1 1 8 8 LEU H H 1 8.66 0.01 . 1 . . . . 9 LEU H . 17302 1
54 . 1 1 8 8 LEU HA H 1 4.57 0.01 . 1 . . . . 9 LEU HA . 17302 1
55 . 1 1 8 8 LEU HB2 H 1 1.61 0.01 . 1 . . . . 9 LEU HB2 . 17302 1
56 . 1 1 8 8 LEU HB3 H 1 1.73 0.01 . 1 . . . . 9 LEU HB3 . 17302 1
57 . 1 1 8 8 LEU HG H 1 1.46 0.01 . 1 . . . . 9 LEU HG . 17302 1
58 . 1 1 8 8 LEU HD11 H 1 0.94 0.01 . 1 . . . . 9 LEU MD1 . 17302 1
59 . 1 1 8 8 LEU HD12 H 1 0.94 0.01 . 1 . . . . 9 LEU MD1 . 17302 1
60 . 1 1 8 8 LEU HD13 H 1 0.94 0.01 . 1 . . . . 9 LEU MD1 . 17302 1
61 . 1 1 8 8 LEU HD21 H 1 0.90 0.01 . 1 . . . . 9 LEU MD2 . 17302 1
62 . 1 1 8 8 LEU HD22 H 1 0.90 0.01 . 1 . . . . 9 LEU MD2 . 17302 1
63 . 1 1 8 8 LEU HD23 H 1 0.90 0.01 . 1 . . . . 9 LEU MD2 . 17302 1
64 . 1 1 8 8 LEU N N 15 132.5 0.1 . 1 . . . . 9 LEU N . 17302 1
65 . 1 1 9 9 GLN H H 1 10.19 0.01 . 1 . . . . 10 GLN H . 17302 1
66 . 1 1 9 9 GLN HA H 1 4.56 0.01 . 1 . . . . 10 GLN HA . 17302 1
67 . 1 1 9 9 GLN HB2 H 1 2.22 0.01 . 2 . . . . 10 GLN HB2 . 17302 1
68 . 1 1 9 9 GLN HB3 H 1 2.00 0.01 . 2 . . . . 10 GLN HB3 . 17302 1
69 . 1 1 9 9 GLN HG2 H 1 2.44 0.01 . 2 . . . . 10 GLN HG2 . 17302 1
70 . 1 1 9 9 GLN HG3 H 1 2.41 0.01 . 2 . . . . 10 GLN HG3 . 17302 1
71 . 1 1 9 9 GLN HE21 H 1 7.24 0.01 . 1 . . . . 10 GLN HE21 . 17302 1
72 . 1 1 9 9 GLN HE22 H 1 7.11 0.01 . 1 . . . . 10 GLN HE22 . 17302 1
73 . 1 1 9 9 GLN N N 15 126.1 0.1 . 1 . . . . 10 GLN N . 17302 1
74 . 1 1 9 9 GLN NE2 N 15 113.3 0.1 . 1 . . . . 10 GLN NE2 . 17302 1
75 . 1 1 10 10 SER H H 1 8.04 0.01 . 1 . . . . 11 SER H . 17302 1
76 . 1 1 10 10 SER HA H 1 4.73 0.01 . 1 . . . . 11 SER HA . 17302 1
77 . 1 1 10 10 SER HB2 H 1 3.91 0.01 . 1 . . . . 11 SER HB2 . 17302 1
78 . 1 1 10 10 SER HB3 H 1 3.88 0.01 . 1 . . . . 11 SER HB3 . 17302 1
79 . 1 1 10 10 SER N N 15 111.1 0.1 . 1 . . . . 11 SER N . 17302 1
80 . 1 1 11 11 GLN H H 1 8.65 0.01 . 1 . . . . 12 GLN H . 17302 1
81 . 1 1 11 11 GLN HA H 1 5.55 0.01 . 1 . . . . 12 GLN HA . 17302 1
82 . 1 1 11 11 GLN HB2 H 1 2.34 0.01 . 1 . . . . 12 GLN HB2 . 17302 1
83 . 1 1 11 11 GLN HB3 H 1 2.30 0.01 . 1 . . . . 12 GLN HB3 . 17302 1
84 . 1 1 11 11 GLN HG2 H 1 2.46 0.01 . 1 . . . . 12 GLN HG2 . 17302 1
85 . 1 1 11 11 GLN HG3 H 1 2.52 0.01 . 1 . . . . 12 GLN HG3 . 17302 1
86 . 1 1 11 11 GLN HE21 H 1 6.07 0.01 . 1 . . . . 12 GLN HE21 . 17302 1
87 . 1 1 11 11 GLN HE22 H 1 7.11 0.01 . 1 . . . . 12 GLN HE22 . 17302 1
88 . 1 1 11 11 GLN N N 15 116.6 0.1 . 1 . . . . 12 GLN N . 17302 1
89 . 1 1 11 11 GLN NE2 N 15 109.1 0.1 . 1 . . . . 12 GLN NE2 . 17302 1
90 . 1 1 12 12 GLU H H 1 9.16 0.01 . 1 . . . . 13 GLU H . 17302 1
91 . 1 1 12 12 GLU HA H 1 4.87 0.01 . 1 . . . . 13 GLU HA . 17302 1
92 . 1 1 12 12 GLU HB2 H 1 2.17 0.01 . 1 . . . . 13 GLU HB2 . 17302 1
93 . 1 1 12 12 GLU HB3 H 1 1.95 0.01 . 1 . . . . 13 GLU HB3 . 17302 1
94 . 1 1 12 12 GLU HG2 H 1 2.29 0.01 . 1 . . . . 13 GLU HG2 . 17302 1
95 . 1 1 12 12 GLU HG3 H 1 2.33 0.01 . 1 . . . . 13 GLU HG3 . 17302 1
96 . 1 1 12 12 GLU N N 15 121.1 0.1 . 1 . . . . 13 GLU N . 17302 1
97 . 1 1 13 13 ASN H H 1 9.32 0.01 . 1 . . . . 14 ASN H . 17302 1
98 . 1 1 13 13 ASN HA H 1 4.86 0.01 . 1 . . . . 14 ASN HA . 17302 1
99 . 1 1 13 13 ASN HB2 H 1 3.58 0.01 . 1 . . . . 14 ASN HB2 . 17302 1
100 . 1 1 13 13 ASN HB3 H 1 3.23 0.01 . 1 . . . . 14 ASN HB3 . 17302 1
101 . 1 1 13 13 ASN HD21 H 1 7.18 0.01 . 1 . . . . 14 ASN HD21 . 17302 1
102 . 1 1 13 13 ASN HD22 H 1 7.96 0.01 . 1 . . . . 14 ASN HD22 . 17302 1
103 . 1 1 13 13 ASN N N 15 117.1 0.1 . 1 . . . . 14 ASN N . 17302 1
104 . 1 1 13 13 ASN ND2 N 15 114.7 0.1 . 1 . . . . 14 ASN ND2 . 17302 1
105 . 1 1 14 14 PHE H H 1 8.49 0.01 . 1 . . . . 15 PHE H . 17302 1
106 . 1 1 14 14 PHE HA H 1 3.58 0.01 . 1 . . . . 15 PHE HA . 17302 1
107 . 1 1 14 14 PHE HB2 H 1 3.02 0.01 . 1 . . . . 15 PHE HB2 . 17302 1
108 . 1 1 14 14 PHE HB3 H 1 3.08 0.01 . 1 . . . . 15 PHE HB3 . 17302 1
109 . 1 1 14 14 PHE HD1 H 1 7.10 0.01 . 1 . . . . 15 PHE HD1 . 17302 1
110 . 1 1 14 14 PHE HD2 H 1 7.10 0.01 . 1 . . . . 15 PHE HD2 . 17302 1
111 . 1 1 14 14 PHE HE1 H 1 7.44 0.01 . 1 . . . . 15 PHE HE1 . 17302 1
112 . 1 1 14 14 PHE HE2 H 1 7.44 0.01 . 1 . . . . 15 PHE HE2 . 17302 1
113 . 1 1 14 14 PHE HZ H 1 7.17 0.01 . 1 . . . . 15 PHE HZ . 17302 1
114 . 1 1 14 14 PHE N N 15 118.2 0.1 . 1 . . . . 15 PHE N . 17302 1
115 . 1 1 15 15 GLU H H 1 9.49 0.01 . 1 . . . . 16 GLU H . 17302 1
116 . 1 1 15 15 GLU HA H 1 3.51 0.01 . 1 . . . . 16 GLU HA . 17302 1
117 . 1 1 15 15 GLU HB2 H 1 2.12 0.01 . 1 . . . . 16 GLU HB2 . 17302 1
118 . 1 1 15 15 GLU HB3 H 1 2.08 0.01 . 1 . . . . 16 GLU HB3 . 17302 1
119 . 1 1 15 15 GLU HG2 H 1 2.32 0.01 . 1 . . . . 16 GLU HG2 . 17302 1
120 . 1 1 15 15 GLU HG3 H 1 2.36 0.01 . 1 . . . . 16 GLU HG3 . 17302 1
121 . 1 1 15 15 GLU N N 15 118.6 0.1 . 1 . . . . 16 GLU N . 17302 1
122 . 1 1 16 16 ALA H H 1 8.35 0.01 . 1 . . . . 17 ALA H . 17302 1
123 . 1 1 16 16 ALA HA H 1 3.98 0.01 . 1 . . . . 17 ALA HA . 17302 1
124 . 1 1 16 16 ALA HB1 H 1 1.39 0.01 . 1 . . . . 17 ALA MB . 17302 1
125 . 1 1 16 16 ALA HB2 H 1 1.39 0.01 . 1 . . . . 17 ALA MB . 17302 1
126 . 1 1 16 16 ALA HB3 H 1 1.39 0.01 . 1 . . . . 17 ALA MB . 17302 1
127 . 1 1 16 16 ALA N N 15 119.7 0.1 . 1 . . . . 17 ALA N . 17302 1
128 . 1 1 17 17 PHE H H 1 7.90 0.01 . 1 . . . . 18 PHE H . 17302 1
129 . 1 1 17 17 PHE HA H 1 3.86 0.01 . 1 . . . . 18 PHE HA . 17302 1
130 . 1 1 17 17 PHE HB2 H 1 2.87 0.01 . 1 . . . . 18 PHE HB2 . 17302 1
131 . 1 1 17 17 PHE HB3 H 1 2.49 0.01 . 1 . . . . 18 PHE HB3 . 17302 1
132 . 1 1 17 17 PHE HD1 H 1 6.77 0.01 . 1 . . . . 18 PHE HD1 . 17302 1
133 . 1 1 17 17 PHE HD2 H 1 6.77 0.01 . 1 . . . . 18 PHE HD2 . 17302 1
134 . 1 1 17 17 PHE HE1 H 1 7.08 0.01 . 1 . . . . 18 PHE HE1 . 17302 1
135 . 1 1 17 17 PHE HE2 H 1 7.08 0.01 . 1 . . . . 18 PHE HE2 . 17302 1
136 . 1 1 17 17 PHE HZ H 1 7.17 0.01 . 1 . . . . 18 PHE HZ . 17302 1
137 . 1 1 17 17 PHE N N 15 118.7 0.1 . 1 . . . . 18 PHE N . 17302 1
138 . 1 1 18 18 MET H H 1 8.21 0.01 . 1 . . . . 19 MET H . 17302 1
139 . 1 1 18 18 MET HA H 1 4.11 0.01 . 1 . . . . 19 MET HA . 17302 1
140 . 1 1 18 18 MET HB2 H 1 1.60 0.01 . 1 . . . . 19 MET HB2 . 17302 1
141 . 1 1 18 18 MET HB3 H 1 1.19 0.01 . 1 . . . . 19 MET HB3 . 17302 1
142 . 1 1 18 18 MET HG2 H 1 1.40 0.01 . 1 . . . . 19 MET HG2 . 17302 1
143 . 1 1 18 18 MET HG3 H 1 1.40 0.01 . 1 . . . . 19 MET HG3 . 17302 1
144 . 1 1 18 18 MET HE1 H 1 2.21 0.01 . 9 . . . . 19 MET ME . 17302 1
145 . 1 1 18 18 MET HE2 H 1 2.21 0.01 . 9 . . . . 19 MET ME . 17302 1
146 . 1 1 18 18 MET HE3 H 1 2.21 0.01 . 9 . . . . 19 MET ME . 17302 1
147 . 1 1 18 18 MET N N 15 114.7 0.1 . 1 . . . . 19 MET N . 17302 1
148 . 1 1 19 19 LYS H H 1 8.14 0.01 . 1 . . . . 20 LYS H . 17302 1
149 . 1 1 19 19 LYS HA H 1 3.96 0.01 . 1 . . . . 20 LYS HA . 17302 1
150 . 1 1 19 19 LYS HB2 H 1 1.78 0.01 . 1 . . . . 20 LYS HB2 . 17302 1
151 . 1 1 19 19 LYS HB3 H 1 1.78 0.01 . 1 . . . . 20 LYS HB3 . 17302 1
152 . 1 1 19 19 LYS HG2 H 1 1.33 0.01 . 1 . . . . 20 LYS HG2 . 17302 1
153 . 1 1 19 19 LYS HG3 H 1 1.50 0.01 . 1 . . . . 20 LYS HG3 . 17302 1
154 . 1 1 19 19 LYS HD2 H 1 1.64 0.01 . 1 . . . . 20 LYS HD2 . 17302 1
155 . 1 1 19 19 LYS HD3 H 1 1.64 0.01 . 1 . . . . 20 LYS HD3 . 17302 1
156 . 1 1 19 19 LYS HE2 H 1 2.93 0.01 . 1 . . . . 20 LYS HE2 . 17302 1
157 . 1 1 19 19 LYS HE3 H 1 2.93 0.01 . 1 . . . . 20 LYS HE3 . 17302 1
158 . 1 1 19 19 LYS N N 15 119.0 0.1 . 1 . . . . 20 LYS N . 17302 1
159 . 1 1 20 20 ALA H H 1 7.52 0.01 . 1 . . . . 21 ALA H . 17302 1
160 . 1 1 20 20 ALA HA H 1 4.01 0.01 . 1 . . . . 21 ALA HA . 17302 1
161 . 1 1 20 20 ALA HB1 H 1 1.33 0.01 . 1 . . . . 21 ALA MB . 17302 1
162 . 1 1 20 20 ALA HB2 H 1 1.33 0.01 . 1 . . . . 21 ALA MB . 17302 1
163 . 1 1 20 20 ALA HB3 H 1 1.33 0.01 . 1 . . . . 21 ALA MB . 17302 1
164 . 1 1 20 20 ALA N N 15 123.2 0.1 . 1 . . . . 21 ALA N . 17302 1
165 . 1 1 21 21 ILE H H 1 7.42 0.01 . 1 . . . . 22 ILE H . 17302 1
166 . 1 1 21 21 ILE HA H 1 4.17 0.01 . 1 . . . . 22 ILE HA . 17302 1
167 . 1 1 21 21 ILE HB H 1 1.95 0.01 . 1 . . . . 22 ILE HB . 17302 1
168 . 1 1 21 21 ILE HG12 H 1 1.25 0.01 . 1 . . . . 22 ILE HG12 . 17302 1
169 . 1 1 21 21 ILE HG13 H 1 1.10 0.01 . 1 . . . . 22 ILE HG13 . 17302 1
170 . 1 1 21 21 ILE HG21 H 1 0.42 0.01 . 1 . . . . 22 ILE MG . 17302 1
171 . 1 1 21 21 ILE HG22 H 1 0.42 0.01 . 1 . . . . 22 ILE MG . 17302 1
172 . 1 1 21 21 ILE HG23 H 1 0.42 0.01 . 1 . . . . 22 ILE MG . 17302 1
173 . 1 1 21 21 ILE HD11 H 1 0.78 0.01 . 1 . . . . 22 ILE MD . 17302 1
174 . 1 1 21 21 ILE HD12 H 1 0.78 0.01 . 1 . . . . 22 ILE MD . 17302 1
175 . 1 1 21 21 ILE HD13 H 1 0.78 0.01 . 1 . . . . 22 ILE MD . 17302 1
176 . 1 1 21 21 ILE N N 15 110.0 0.1 . 1 . . . . 22 ILE N . 17302 1
177 . 1 1 22 22 GLY H H 1 7.45 0.01 . 1 . . . . 23 GLY H . 17302 1
178 . 1 1 22 22 GLY HA2 H 1 4.12 0.01 . 1 . . . . 23 GLY HA2 . 17302 1
179 . 1 1 22 22 GLY HA3 H 1 3.67 0.01 . 1 . . . . 23 GLY HA3 . 17302 1
180 . 1 1 22 22 GLY N N 15 108.5 0.1 . 1 . . . . 23 GLY N . 17302 1
181 . 1 1 23 23 LEU H H 1 7.90 0.01 . 1 . . . . 24 LEU H . 17302 1
182 . 1 1 23 23 LEU HA H 1 4.39 0.01 . 1 . . . . 24 LEU HA . 17302 1
183 . 1 1 23 23 LEU HB2 H 1 1.17 0.01 . 1 . . . . 24 LEU HB2 . 17302 1
184 . 1 1 23 23 LEU HB3 H 1 1.40 0.01 . 1 . . . . 24 LEU HB3 . 17302 1
185 . 1 1 23 23 LEU HG H 1 1.66 0.01 . 1 . . . . 24 LEU HG . 17302 1
186 . 1 1 23 23 LEU HD11 H 1 0.77 0.01 . 1 . . . . 24 LEU MD1 . 17302 1
187 . 1 1 23 23 LEU HD12 H 1 0.77 0.01 . 1 . . . . 24 LEU MD1 . 17302 1
188 . 1 1 23 23 LEU HD13 H 1 0.77 0.01 . 1 . . . . 24 LEU MD1 . 17302 1
189 . 1 1 23 23 LEU HD21 H 1 0.88 0.01 . 1 . . . . 24 LEU MD2 . 17302 1
190 . 1 1 23 23 LEU HD22 H 1 0.88 0.01 . 1 . . . . 24 LEU MD2 . 17302 1
191 . 1 1 23 23 LEU HD23 H 1 0.88 0.01 . 1 . . . . 24 LEU MD2 . 17302 1
192 . 1 1 23 23 LEU N N 15 124.6 0.1 . 1 . . . . 24 LEU N . 17302 1
193 . 1 1 24 24 PRO HA H 1 4.42 0.01 . 1 . . . . 25 PRO HA . 17302 1
194 . 1 1 24 24 PRO HB2 H 1 1.92 0.01 . 1 . . . . 25 PRO HB2 . 17302 1
195 . 1 1 24 24 PRO HB3 H 1 2.49 0.01 . 1 . . . . 25 PRO HB3 . 17302 1
196 . 1 1 24 24 PRO HG2 H 1 2.11 0.01 . 1 . . . . 25 PRO HG2 . 17302 1
197 . 1 1 24 24 PRO HG3 H 1 2.11 0.01 . 1 . . . . 25 PRO HG3 . 17302 1
198 . 1 1 24 24 PRO HD2 H 1 3.53 0.01 . 1 . . . . 25 PRO HD2 . 17302 1
199 . 1 1 24 24 PRO HD3 H 1 4.04 0.01 . 1 . . . . 25 PRO HD3 . 17302 1
200 . 1 1 25 25 GLU H H 1 8.82 0.01 . 1 . . . . 26 GLU H . 17302 1
201 . 1 1 25 25 GLU HA H 1 3.87 0.01 . 1 . . . . 26 GLU HA . 17302 1
202 . 1 1 25 25 GLU HB2 H 1 2.12 0.01 . 1 . . . . 26 GLU HB2 . 17302 1
203 . 1 1 25 25 GLU HB3 H 1 2.01 0.01 . 1 . . . . 26 GLU HB3 . 17302 1
204 . 1 1 25 25 GLU HG2 H 1 2.33 0.01 . 1 . . . . 26 GLU HG2 . 17302 1
205 . 1 1 25 25 GLU HG3 H 1 2.33 0.01 . 1 . . . . 26 GLU HG3 . 17302 1
206 . 1 1 25 25 GLU N N 15 124.2 0.1 . 1 . . . . 26 GLU N . 17302 1
207 . 1 1 26 26 GLU H H 1 9.38 0.01 . 1 . . . . 27 GLU H . 17302 1
208 . 1 1 26 26 GLU HA H 1 4.12 0.01 . 1 . . . . 27 GLU HA . 17302 1
209 . 1 1 26 26 GLU HB2 H 1 2.07 0.01 . 1 . . . . 27 GLU HB2 . 17302 1
210 . 1 1 26 26 GLU HB3 H 1 1.97 0.01 . 1 . . . . 27 GLU HB3 . 17302 1
211 . 1 1 26 26 GLU HG2 H 1 2.27 0.01 . 1 . . . . 27 GLU HG2 . 17302 1
212 . 1 1 26 26 GLU HG3 H 1 2.34 0.01 . 1 . . . . 27 GLU HG3 . 17302 1
213 . 1 1 26 26 GLU N N 15 117.6 0.1 . 1 . . . . 27 GLU N . 17302 1
214 . 1 1 27 27 LEU H H 1 7.23 0.01 . 1 . . . . 28 LEU H . 17302 1
215 . 1 1 27 27 LEU HA H 1 4.27 0.01 . 1 . . . . 28 LEU HA . 17302 1
216 . 1 1 27 27 LEU HB2 H 1 1.84 0.01 . 1 . . . . 28 LEU HB2 . 17302 1
217 . 1 1 27 27 LEU HB3 H 1 1.62 0.01 . 1 . . . . 28 LEU HB3 . 17302 1
218 . 1 1 27 27 LEU HG H 1 1.72 0.01 . 1 . . . . 28 LEU HG . 17302 1
219 . 1 1 27 27 LEU HD11 H 1 0.98 0.01 . 1 . . . . 28 LEU MD1 . 17302 1
220 . 1 1 27 27 LEU HD12 H 1 0.98 0.01 . 1 . . . . 28 LEU MD1 . 17302 1
221 . 1 1 27 27 LEU HD13 H 1 0.98 0.01 . 1 . . . . 28 LEU MD1 . 17302 1
222 . 1 1 27 27 LEU HD21 H 1 0.90 0.01 . 1 . . . . 28 LEU MD2 . 17302 1
223 . 1 1 27 27 LEU HD22 H 1 0.90 0.01 . 1 . . . . 28 LEU MD2 . 17302 1
224 . 1 1 27 27 LEU HD23 H 1 0.90 0.01 . 1 . . . . 28 LEU MD2 . 17302 1
225 . 1 1 27 27 LEU N N 15 117.8 0.1 . 1 . . . . 28 LEU N . 17302 1
226 . 1 1 28 28 ILE H H 1 7.86 0.01 . 1 . . . . 29 ILE H . 17302 1
227 . 1 1 28 28 ILE HA H 1 3.61 0.01 . 1 . . . . 29 ILE HA . 17302 1
228 . 1 1 28 28 ILE HB H 1 2.10 0.01 . 1 . . . . 29 ILE HB . 17302 1
229 . 1 1 28 28 ILE HG12 H 1 0.44 0.01 . 1 . . . . 29 ILE HG12 . 17302 1
230 . 1 1 28 28 ILE HG13 H 1 1.70 0.01 . 1 . . . . 29 ILE HG13 . 17302 1
231 . 1 1 28 28 ILE HG21 H 1 0.94 0.01 . 1 . . . . 29 ILE MG . 17302 1
232 . 1 1 28 28 ILE HG22 H 1 0.94 0.01 . 1 . . . . 29 ILE MG . 17302 1
233 . 1 1 28 28 ILE HG23 H 1 0.94 0.01 . 1 . . . . 29 ILE MG . 17302 1
234 . 1 1 28 28 ILE HD11 H 1 0.71 0.01 . 1 . . . . 29 ILE MD . 17302 1
235 . 1 1 28 28 ILE HD12 H 1 0.71 0.01 . 1 . . . . 29 ILE MD . 17302 1
236 . 1 1 28 28 ILE HD13 H 1 0.71 0.01 . 1 . . . . 29 ILE MD . 17302 1
237 . 1 1 28 28 ILE N N 15 123.4 0.1 . 1 . . . . 29 ILE N . 17302 1
238 . 1 1 29 29 GLN H H 1 8.24 0.01 . 1 . . . . 30 GLN H . 17302 1
239 . 1 1 29 29 GLN HA H 1 3.97 0.01 . 1 . . . . 30 GLN HA . 17302 1
240 . 1 1 29 29 GLN HB2 H 1 2.17 0.01 . 1 . . . . 30 GLN HB2 . 17302 1
241 . 1 1 29 29 GLN HB3 H 1 2.11 0.01 . 1 . . . . 30 GLN HB3 . 17302 1
242 . 1 1 29 29 GLN HG2 H 1 2.51 0.01 . 1 . . . . 30 GLN HG2 . 17302 1
243 . 1 1 29 29 GLN HG3 H 1 2.51 0.01 . 1 . . . . 30 GLN HG3 . 17302 1
244 . 1 1 29 29 GLN HE21 H 1 7.00 0.01 . 1 . . . . 30 GLN HE21 . 17302 1
245 . 1 1 29 29 GLN HE22 H 1 7.67 0.01 . 1 . . . . 30 GLN HE22 . 17302 1
246 . 1 1 29 29 GLN N N 15 116.8 0.1 . 1 . . . . 30 GLN N . 17302 1
247 . 1 1 29 29 GLN NE2 N 15 113.4 0.1 . 1 . . . . 30 GLN NE2 . 17302 1
248 . 1 1 30 30 LYS H H 1 7.57 0.01 . 1 . . . . 31 LYS H . 17302 1
249 . 1 1 30 30 LYS HA H 1 4.22 0.01 . 1 . . . . 31 LYS HA . 17302 1
250 . 1 1 30 30 LYS HB2 H 1 1.90 0.01 . 1 . . . . 31 LYS HB2 . 17302 1
251 . 1 1 30 30 LYS HB3 H 1 1.90 0.01 . 1 . . . . 31 LYS HB3 . 17302 1
252 . 1 1 30 30 LYS HG2 H 1 1.53 0.01 . 1 . . . . 31 LYS HG2 . 17302 1
253 . 1 1 30 30 LYS HG3 H 1 1.53 0.01 . 1 . . . . 31 LYS HG3 . 17302 1
254 . 1 1 30 30 LYS HD2 H 1 1.72 0.01 . 1 . . . . 31 LYS HD2 . 17302 1
255 . 1 1 30 30 LYS HD3 H 1 1.72 0.01 . 1 . . . . 31 LYS HD3 . 17302 1
256 . 1 1 30 30 LYS HE2 H 1 3.00 0.01 . 1 . . . . 31 LYS HE2 . 17302 1
257 . 1 1 30 30 LYS HE3 H 1 3.00 0.01 . 1 . . . . 31 LYS HE3 . 17302 1
258 . 1 1 30 30 LYS N N 15 116.1 0.1 . 1 . . . . 31 LYS N . 17302 1
259 . 1 1 31 31 GLY H H 1 7.90 0.01 . 1 . . . . 32 GLY H . 17302 1
260 . 1 1 31 31 GLY HA2 H 1 3.86 0.01 . 1 . . . . 32 GLY HA2 . 17302 1
261 . 1 1 31 31 GLY HA3 H 1 4.17 0.01 . 1 . . . . 32 GLY HA3 . 17302 1
262 . 1 1 31 31 GLY N N 15 105.5 0.1 . 1 . . . . 32 GLY N . 17302 1
263 . 1 1 32 32 LYS H H 1 7.50 0.01 . 1 . . . . 33 LYS H . 17302 1
264 . 1 1 32 32 LYS HA H 1 3.05 0.01 . 1 . . . . 33 LYS HA . 17302 1
265 . 1 1 32 32 LYS HB2 H 1 1.77 0.01 . 1 . . . . 33 LYS HB2 . 17302 1
266 . 1 1 32 32 LYS HB3 H 1 1.77 0.01 . 1 . . . . 33 LYS HB3 . 17302 1
267 . 1 1 32 32 LYS HG2 H 1 1.33 0.01 . 1 . . . . 33 LYS HG2 . 17302 1
268 . 1 1 32 32 LYS HG3 H 1 1.48 0.01 . 1 . . . . 33 LYS HG3 . 17302 1
269 . 1 1 32 32 LYS HD2 H 1 1.66 0.01 . 1 . . . . 33 LYS HD2 . 17302 1
270 . 1 1 32 32 LYS HD3 H 1 1.66 0.01 . 1 . . . . 33 LYS HD3 . 17302 1
271 . 1 1 32 32 LYS HE2 H 1 3.09 0.01 . 1 . . . . 33 LYS HE2 . 17302 1
272 . 1 1 32 32 LYS HE3 H 1 3.09 0.01 . 1 . . . . 33 LYS HE3 . 17302 1
273 . 1 1 32 32 LYS N N 15 119.8 0.1 . 1 . . . . 33 LYS N . 17302 1
274 . 1 1 33 33 ASP H H 1 7.83 0.01 . 1 . . . . 34 ASP H . 17302 1
275 . 1 1 33 33 ASP HA H 1 4.73 0.01 . 1 . . . . 34 ASP HA . 17302 1
276 . 1 1 33 33 ASP HB2 H 1 2.46 0.01 . 1 . . . . 34 ASP HB2 . 17302 1
277 . 1 1 33 33 ASP HB3 H 1 2.81 0.01 . 1 . . . . 34 ASP HB3 . 17302 1
278 . 1 1 33 33 ASP N N 15 117.2 0.1 . 1 . . . . 34 ASP N . 17302 1
279 . 1 1 34 34 ILE H H 1 7.15 0.01 . 1 . . . . 35 ILE H . 17302 1
280 . 1 1 34 34 ILE HA H 1 3.92 0.01 . 1 . . . . 35 ILE HA . 17302 1
281 . 1 1 34 34 ILE HB H 1 1.82 0.01 . 1 . . . . 35 ILE HB . 17302 1
282 . 1 1 34 34 ILE HG12 H 1 1.19 0.01 . 1 . . . . 35 ILE HG12 . 17302 1
283 . 1 1 34 34 ILE HG13 H 1 1.55 0.01 . 1 . . . . 35 ILE HG13 . 17302 1
284 . 1 1 34 34 ILE HG21 H 1 0.79 0.01 . 1 . . . . 35 ILE MG . 17302 1
285 . 1 1 34 34 ILE HG22 H 1 0.79 0.01 . 1 . . . . 35 ILE MG . 17302 1
286 . 1 1 34 34 ILE HG23 H 1 0.79 0.01 . 1 . . . . 35 ILE MG . 17302 1
287 . 1 1 34 34 ILE HD11 H 1 0.81 0.01 . 1 . . . . 35 ILE MD . 17302 1
288 . 1 1 34 34 ILE HD12 H 1 0.81 0.01 . 1 . . . . 35 ILE MD . 17302 1
289 . 1 1 34 34 ILE HD13 H 1 0.81 0.01 . 1 . . . . 35 ILE MD . 17302 1
290 . 1 1 34 34 ILE N N 15 120.4 0.1 . 1 . . . . 35 ILE N . 17302 1
291 . 1 1 35 35 LYS H H 1 8.72 0.01 . 1 . . . . 36 LYS H . 17302 1
292 . 1 1 35 35 LYS HA H 1 4.57 0.01 . 1 . . . . 36 LYS HA . 17302 1
293 . 1 1 35 35 LYS HB2 H 1 1.90 0.01 . 1 . . . . 36 LYS HB2 . 17302 1
294 . 1 1 35 35 LYS HB3 H 1 1.86 0.01 . 1 . . . . 36 LYS HB3 . 17302 1
295 . 1 1 35 35 LYS HG2 H 1 1.48 0.01 . 2 . . . . 36 LYS HG2 . 17302 1
296 . 1 1 35 35 LYS HG3 H 1 1.28 0.01 . 2 . . . . 36 LYS HG3 . 17302 1
297 . 1 1 35 35 LYS HD2 H 1 1.64 0.01 . 1 . . . . 36 LYS HD2 . 17302 1
298 . 1 1 35 35 LYS HD3 H 1 1.64 0.01 . 1 . . . . 36 LYS HD3 . 17302 1
299 . 1 1 35 35 LYS HE2 H 1 2.99 0.01 . 1 . . . . 36 LYS HE2 . 17302 1
300 . 1 1 35 35 LYS HE3 H 1 2.99 0.01 . 1 . . . . 36 LYS HE3 . 17302 1
301 . 1 1 35 35 LYS N N 15 128.9 0.1 . 1 . . . . 36 LYS N . 17302 1
302 . 1 1 36 36 GLY H H 1 7.94 0.01 . 1 . . . . 37 GLY H . 17302 1
303 . 1 1 36 36 GLY HA2 H 1 4.40 0.01 . 2 . . . . 37 GLY HA2 . 17302 1
304 . 1 1 36 36 GLY HA3 H 1 3.98 0.01 . 2 . . . . 37 GLY HA3 . 17302 1
305 . 1 1 36 36 GLY N N 15 111.6 0.1 . 1 . . . . 37 GLY N . 17302 1
306 . 1 1 37 37 VAL H H 1 8.41 0.01 . 1 . . . . 38 VAL H . 17302 1
307 . 1 1 37 37 VAL HA H 1 5.06 0.01 . 1 . . . . 38 VAL HA . 17302 1
308 . 1 1 37 37 VAL HB H 1 2.05 0.01 . 1 . . . . 38 VAL HB . 17302 1
309 . 1 1 37 37 VAL HG11 H 1 0.95 0.01 . 1 . . . . 38 VAL MG1 . 17302 1
310 . 1 1 37 37 VAL HG12 H 1 0.95 0.01 . 1 . . . . 38 VAL MG1 . 17302 1
311 . 1 1 37 37 VAL HG13 H 1 0.95 0.01 . 1 . . . . 38 VAL MG1 . 17302 1
312 . 1 1 37 37 VAL HG21 H 1 1.00 0.01 . 1 . . . . 38 VAL MG2 . 17302 1
313 . 1 1 37 37 VAL HG22 H 1 1.00 0.01 . 1 . . . . 38 VAL MG2 . 17302 1
314 . 1 1 37 37 VAL HG23 H 1 1.00 0.01 . 1 . . . . 38 VAL MG2 . 17302 1
315 . 1 1 37 37 VAL N N 15 120.7 0.1 . 1 . . . . 38 VAL N . 17302 1
316 . 1 1 38 38 SER H H 1 9.31 0.01 . 1 . . . . 39 SER H . 17302 1
317 . 1 1 38 38 SER HA H 1 5.39 0.01 . 1 . . . . 39 SER HA . 17302 1
318 . 1 1 38 38 SER HB2 H 1 3.85 0.01 . 1 . . . . 39 SER HB2 . 17302 1
319 . 1 1 38 38 SER HB3 H 1 3.77 0.01 . 1 . . . . 39 SER HB3 . 17302 1
320 . 1 1 38 38 SER N N 15 122.0 0.1 . 1 . . . . 39 SER N . 17302 1
321 . 1 1 39 39 GLU H H 1 9.50 0.01 . 1 . . . . 40 GLU H . 17302 1
322 . 1 1 39 39 GLU HA H 1 5.33 0.01 . 1 . . . . 40 GLU HA . 17302 1
323 . 1 1 39 39 GLU HB2 H 1 2.12 0.01 . 1 . . . . 40 GLU HB2 . 17302 1
324 . 1 1 39 39 GLU HB3 H 1 1.90 0.01 . 1 . . . . 40 GLU HB3 . 17302 1
325 . 1 1 39 39 GLU HG2 H 1 2.19 0.01 . 1 . . . . 40 GLU HG2 . 17302 1
326 . 1 1 39 39 GLU HG3 H 1 2.02 0.01 . 1 . . . . 40 GLU HG3 . 17302 1
327 . 1 1 39 39 GLU N N 15 125.8 0.1 . 1 . . . . 40 GLU N . 17302 1
328 . 1 1 40 40 ILE H H 1 9.46 0.01 . 1 . . . . 41 ILE H . 17302 1
329 . 1 1 40 40 ILE HA H 1 4.89 0.01 . 1 . . . . 41 ILE HA . 17302 1
330 . 1 1 40 40 ILE HB H 1 2.01 0.01 . 1 . . . . 41 ILE HB . 17302 1
331 . 1 1 40 40 ILE HG12 H 1 1.31 0.01 . 1 . . . . 41 ILE HG12 . 17302 1
332 . 1 1 40 40 ILE HG13 H 1 -0.01 0.01 . 1 . . . . 41 ILE HG13 . 17302 1
333 . 1 1 40 40 ILE HG21 H 1 0.42 0.01 . 1 . . . . 41 ILE MG . 17302 1
334 . 1 1 40 40 ILE HG22 H 1 0.42 0.01 . 1 . . . . 41 ILE MG . 17302 1
335 . 1 1 40 40 ILE HG23 H 1 0.42 0.01 . 1 . . . . 41 ILE MG . 17302 1
336 . 1 1 40 40 ILE HD11 H 1 0.58 0.01 . 1 . . . . 41 ILE MD . 17302 1
337 . 1 1 40 40 ILE HD12 H 1 0.58 0.01 . 1 . . . . 41 ILE MD . 17302 1
338 . 1 1 40 40 ILE HD13 H 1 0.58 0.01 . 1 . . . . 41 ILE MD . 17302 1
339 . 1 1 40 40 ILE N N 15 126.5 0.1 . 1 . . . . 41 ILE N . 17302 1
340 . 1 1 41 41 VAL H H 1 9.10 0.01 . 1 . . . . 42 VAL H . 17302 1
341 . 1 1 41 41 VAL HA H 1 4.17 0.01 . 1 . . . . 42 VAL HA . 17302 1
342 . 1 1 41 41 VAL HB H 1 1.93 0.01 . 1 . . . . 42 VAL HB . 17302 1
343 . 1 1 41 41 VAL HG11 H 1 0.82 0.01 . 1 . . . . 42 VAL MG1 . 17302 1
344 . 1 1 41 41 VAL HG12 H 1 0.82 0.01 . 1 . . . . 42 VAL MG1 . 17302 1
345 . 1 1 41 41 VAL HG13 H 1 0.82 0.01 . 1 . . . . 42 VAL MG1 . 17302 1
346 . 1 1 41 41 VAL HG21 H 1 0.91 0.01 . 1 . . . . 42 VAL MG2 . 17302 1
347 . 1 1 41 41 VAL HG22 H 1 0.91 0.01 . 1 . . . . 42 VAL MG2 . 17302 1
348 . 1 1 41 41 VAL HG23 H 1 0.91 0.01 . 1 . . . . 42 VAL MG2 . 17302 1
349 . 1 1 41 41 VAL N N 15 128.5 0.1 . 1 . . . . 42 VAL N . 17302 1
350 . 1 1 42 42 GLN H H 1 8.64 0.01 . 1 . . . . 43 GLN H . 17302 1
351 . 1 1 42 42 GLN HA H 1 4.41 0.01 . 1 . . . . 43 GLN HA . 17302 1
352 . 1 1 42 42 GLN HB2 H 1 1.92 0.01 . 1 . . . . 43 GLN HB2 . 17302 1
353 . 1 1 42 42 GLN HB3 H 1 1.92 0.01 . 1 . . . . 43 GLN HB3 . 17302 1
354 . 1 1 42 42 GLN HG2 H 1 1.85 0.01 . 1 . . . . 43 GLN HG2 . 17302 1
355 . 1 1 42 42 GLN HG3 H 1 1.85 0.01 . 1 . . . . 43 GLN HG3 . 17302 1
356 . 1 1 42 42 GLN HE21 H 1 7.16 0.01 . 1 . . . . 43 GLN HE21 . 17302 1
357 . 1 1 42 42 GLN HE22 H 1 7.51 0.01 . 1 . . . . 43 GLN HE22 . 17302 1
358 . 1 1 42 42 GLN N N 15 130.8 0.1 . 1 . . . . 43 GLN N . 17302 1
359 . 1 1 42 42 GLN NE2 N 15 108.3 0.1 . 1 . . . . 43 GLN NE2 . 17302 1
360 . 1 1 43 43 ASN H H 1 8.98 0.01 . 1 . . . . 44 ASN H . 17302 1
361 . 1 1 43 43 ASN HA H 1 4.82 0.01 . 1 . . . . 44 ASN HA . 17302 1
362 . 1 1 43 43 ASN HB2 H 1 2.77 0.01 . 1 . . . . 44 ASN HB2 . 17302 1
363 . 1 1 43 43 ASN HB3 H 1 2.54 0.01 . 1 . . . . 44 ASN HB3 . 17302 1
364 . 1 1 43 43 ASN HD21 H 1 7.63 0.01 . 1 . . . . 44 ASN HD21 . 17302 1
365 . 1 1 43 43 ASN HD22 H 1 6.81 0.01 . 1 . . . . 44 ASN HD22 . 17302 1
366 . 1 1 43 43 ASN N N 15 127.3 0.1 . 1 . . . . 44 ASN N . 17302 1
367 . 1 1 43 43 ASN ND2 N 15 112.8 0.1 . 1 . . . . 44 ASN ND2 . 17302 1
368 . 1 1 44 44 GLY H H 1 9.15 0.01 . 1 . . . . 45 GLY H . 17302 1
369 . 1 1 44 44 GLY HA2 H 1 3.63 0.01 . 1 . . . . 45 GLY HA2 . 17302 1
370 . 1 1 44 44 GLY HA3 H 1 4.04 0.01 . 1 . . . . 45 GLY HA3 . 17302 1
371 . 1 1 44 44 GLY N N 15 116.3 0.1 . 1 . . . . 45 GLY N . 17302 1
372 . 1 1 45 45 LYS H H 1 8.85 0.01 . 1 . . . . 46 LYS H . 17302 1
373 . 1 1 45 45 LYS HA H 1 4.38 0.01 . 1 . . . . 46 LYS HA . 17302 1
374 . 1 1 45 45 LYS HB2 H 1 2.31 0.01 . 1 . . . . 46 LYS HB2 . 17302 1
375 . 1 1 45 45 LYS HB3 H 1 1.82 0.01 . 1 . . . . 46 LYS HB3 . 17302 1
376 . 1 1 45 45 LYS HG2 H 1 1.67 0.01 . 2 . . . . 46 LYS HG2 . 17302 1
377 . 1 1 45 45 LYS HG3 H 1 1.42 0.01 . 2 . . . . 46 LYS HG3 . 17302 1
378 . 1 1 45 45 LYS HD2 H 1 1.76 0.01 . 1 . . . . 46 LYS HD2 . 17302 1
379 . 1 1 45 45 LYS HD3 H 1 1.76 0.01 . 1 . . . . 46 LYS HD3 . 17302 1
380 . 1 1 45 45 LYS HE2 H 1 3.04 0.01 . 1 . . . . 46 LYS HE2 . 17302 1
381 . 1 1 45 45 LYS HE3 H 1 3.04 0.01 . 1 . . . . 46 LYS HE3 . 17302 1
382 . 1 1 45 45 LYS N N 15 126.3 0.1 . 1 . . . . 46 LYS N . 17302 1
383 . 1 1 46 46 HIS H H 1 8.19 0.01 . 1 . . . . 47 HIS H . 17302 1
384 . 1 1 46 46 HIS HA H 1 5.19 0.01 . 1 . . . . 47 HIS HA . 17302 1
385 . 1 1 46 46 HIS HB2 H 1 3.34 0.01 . 1 . . . . 47 HIS HB2 . 17302 1
386 . 1 1 46 46 HIS HB3 H 1 3.15 0.01 . 1 . . . . 47 HIS HB3 . 17302 1
387 . 1 1 46 46 HIS HD2 H 1 7.23 0.01 . 1 . . . . 47 HIS HD2 . 17302 1
388 . 1 1 46 46 HIS HE1 H 1 8.44 0.01 . 1 . . . . 47 HIS HE1 . 17302 1
389 . 1 1 46 46 HIS N N 15 120.0 0.1 . 1 . . . . 47 HIS N . 17302 1
390 . 1 1 47 47 PHE H H 1 8.87 0.01 . 1 . . . . 48 PHE H . 17302 1
391 . 1 1 47 47 PHE HA H 1 4.85 0.01 . 1 . . . . 48 PHE HA . 17302 1
392 . 1 1 47 47 PHE HB2 H 1 1.48 0.01 . 1 . . . . 48 PHE HB2 . 17302 1
393 . 1 1 47 47 PHE HB3 H 1 2.01 0.01 . 1 . . . . 48 PHE HB3 . 17302 1
394 . 1 1 47 47 PHE HD1 H 1 6.74 0.01 . 1 . . . . 48 PHE HD1 . 17302 1
395 . 1 1 47 47 PHE HD2 H 1 6.74 0.01 . 1 . . . . 48 PHE HD2 . 17302 1
396 . 1 1 47 47 PHE HE1 H 1 6.82 0.01 . 1 . . . . 48 PHE HE1 . 17302 1
397 . 1 1 47 47 PHE HE2 H 1 6.82 0.01 . 1 . . . . 48 PHE HE2 . 17302 1
398 . 1 1 47 47 PHE HZ H 1 7.02 0.01 . 1 . . . . 48 PHE HZ . 17302 1
399 . 1 1 47 47 PHE N N 15 124.9 0.1 . 1 . . . . 48 PHE N . 17302 1
400 . 1 1 48 48 LYS H H 1 8.38 0.01 . 1 . . . . 49 LYS H . 17302 1
401 . 1 1 48 48 LYS HA H 1 4.85 0.01 . 1 . . . . 49 LYS HA . 17302 1
402 . 1 1 48 48 LYS HB2 H 1 1.82 0.01 . 1 . . . . 49 LYS HB2 . 17302 1
403 . 1 1 48 48 LYS HB3 H 1 1.82 0.01 . 1 . . . . 49 LYS HB3 . 17302 1
404 . 1 1 48 48 LYS HG2 H 1 1.33 0.01 . 1 . . . . 49 LYS HG2 . 17302 1
405 . 1 1 48 48 LYS HG3 H 1 1.33 0.01 . 1 . . . . 49 LYS HG3 . 17302 1
406 . 1 1 48 48 LYS HD2 H 1 1.57 0.01 . 1 . . . . 49 LYS HD2 . 17302 1
407 . 1 1 48 48 LYS HD3 H 1 1.57 0.01 . 1 . . . . 49 LYS HD3 . 17302 1
408 . 1 1 48 48 LYS HE2 H 1 2.85 0.01 . 2 . . . . 49 LYS HE2 . 17302 1
409 . 1 1 48 48 LYS HE3 H 1 2.77 0.01 . 2 . . . . 49 LYS HE3 . 17302 1
410 . 1 1 48 48 LYS N N 15 119.3 0.1 . 1 . . . . 49 LYS N . 17302 1
411 . 1 1 49 49 PHE H H 1 9.56 0.01 . 1 . . . . 50 PHE H . 17302 1
412 . 1 1 49 49 PHE HA H 1 5.27 0.01 . 1 . . . . 50 PHE HA . 17302 1
413 . 1 1 49 49 PHE HB2 H 1 2.99 0.01 . 1 . . . . 50 PHE HB2 . 17302 1
414 . 1 1 49 49 PHE HB3 H 1 3.10 0.01 . 1 . . . . 50 PHE HB3 . 17302 1
415 . 1 1 49 49 PHE HD1 H 1 7.06 0.01 . 1 . . . . 50 PHE HD1 . 17302 1
416 . 1 1 49 49 PHE HD2 H 1 7.06 0.01 . 1 . . . . 50 PHE HD2 . 17302 1
417 . 1 1 49 49 PHE HE1 H 1 7.06 0.01 . 9 . . . . 50 PHE HE1 . 17302 1
418 . 1 1 49 49 PHE HE2 H 1 7.06 0.01 . 9 . . . . 50 PHE HE2 . 17302 1
419 . 1 1 49 49 PHE HZ H 1 6.76 0.01 . 9 . . . . 50 PHE HZ . 17302 1
420 . 1 1 49 49 PHE N N 15 127.7 0.1 . 1 . . . . 50 PHE N . 17302 1
421 . 1 1 50 50 THR H H 1 9.35 0.01 . 1 . . . . 51 THR H . 17302 1
422 . 1 1 50 50 THR HA H 1 5.18 0.01 . 1 . . . . 51 THR HA . 17302 1
423 . 1 1 50 50 THR HB H 1 4.13 0.01 . 1 . . . . 51 THR HB . 17302 1
424 . 1 1 50 50 THR HG21 H 1 1.17 0.01 . 1 . . . . 51 THR MG . 17302 1
425 . 1 1 50 50 THR HG22 H 1 1.17 0.01 . 1 . . . . 51 THR MG . 17302 1
426 . 1 1 50 50 THR HG23 H 1 1.17 0.01 . 1 . . . . 51 THR MG . 17302 1
427 . 1 1 50 50 THR N N 15 121.2 0.1 . 1 . . . . 51 THR N . 17302 1
428 . 1 1 51 51 ILE H H 1 9.48 0.01 . 1 . . . . 52 ILE H . 17302 1
429 . 1 1 51 51 ILE HA H 1 4.92 0.01 . 1 . . . . 52 ILE HA . 17302 1
430 . 1 1 51 51 ILE HB H 1 1.90 0.01 . 1 . . . . 52 ILE HB . 17302 1
431 . 1 1 51 51 ILE HG12 H 1 1.57 0.01 . 2 . . . . 52 ILE HG12 . 17302 1
432 . 1 1 51 51 ILE HG13 H 1 1.32 0.01 . 2 . . . . 52 ILE HG13 . 17302 1
433 . 1 1 51 51 ILE HG21 H 1 0.90 0.01 . 1 . . . . 52 ILE MG . 17302 1
434 . 1 1 51 51 ILE HG22 H 1 0.90 0.01 . 1 . . . . 52 ILE MG . 17302 1
435 . 1 1 51 51 ILE HG23 H 1 0.90 0.01 . 1 . . . . 52 ILE MG . 17302 1
436 . 1 1 51 51 ILE HD11 H 1 0.87 0.01 . 1 . . . . 52 ILE MD . 17302 1
437 . 1 1 51 51 ILE HD12 H 1 0.87 0.01 . 1 . . . . 52 ILE MD . 17302 1
438 . 1 1 51 51 ILE HD13 H 1 0.87 0.01 . 1 . . . . 52 ILE MD . 17302 1
439 . 1 1 51 51 ILE N N 15 128.9 0.1 . 9 . . . . 52 ILE N . 17302 1
440 . 1 1 52 52 THR H H 1 8.78 0.01 . 1 . . . . 53 THR H . 17302 1
441 . 1 1 52 52 THR HA H 1 4.91 0.01 . 1 . . . . 53 THR HA . 17302 1
442 . 1 1 52 52 THR HB H 1 4.11 0.01 . 1 . . . . 53 THR HB . 17302 1
443 . 1 1 52 52 THR HG21 H 1 1.20 0.01 . 1 . . . . 53 THR MG . 17302 1
444 . 1 1 52 52 THR HG22 H 1 1.20 0.01 . 1 . . . . 53 THR MG . 17302 1
445 . 1 1 52 52 THR HG23 H 1 1.20 0.01 . 1 . . . . 53 THR MG . 17302 1
446 . 1 1 52 52 THR N N 15 123.1 0.1 . 1 . . . . 53 THR N . 17302 1
447 . 1 1 53 53 ALA H H 1 8.90 0.01 . 1 . . . . 54 ALA H . 17302 1
448 . 1 1 53 53 ALA HA H 1 4.71 0.01 . 1 . . . . 54 ALA HA . 17302 1
449 . 1 1 53 53 ALA HB1 H 1 1.31 0.01 . 1 . . . . 54 ALA MB . 17302 1
450 . 1 1 53 53 ALA HB2 H 1 1.31 0.01 . 1 . . . . 54 ALA MB . 17302 1
451 . 1 1 53 53 ALA HB3 H 1 1.31 0.01 . 1 . . . . 54 ALA MB . 17302 1
452 . 1 1 53 53 ALA N N 15 131.7 0.1 . 1 . . . . 54 ALA N . 17302 1
453 . 1 1 54 54 GLY H H 1 9.00 0.01 . 1 . . . . 55 GLY H . 17302 1
454 . 1 1 54 54 GLY HA2 H 1 3.72 0.01 . 1 . . . . 55 GLY HA2 . 17302 1
455 . 1 1 54 54 GLY HA3 H 1 4.11 0.01 . 1 . . . . 55 GLY HA3 . 17302 1
456 . 1 1 54 54 GLY N N 15 115.2 0.1 . 1 . . . . 55 GLY N . 17302 1
457 . 1 1 55 55 SER H H 1 8.85 0.01 . 1 . . . . 56 SER H . 17302 1
458 . 1 1 55 55 SER HA H 1 4.38 0.01 . 1 . . . . 56 SER HA . 17302 1
459 . 1 1 55 55 SER HB2 H 1 3.87 0.01 . 1 . . . . 56 SER HB2 . 17302 1
460 . 1 1 55 55 SER HB3 H 1 4.05 0.01 . 1 . . . . 56 SER HB3 . 17302 1
461 . 1 1 55 55 SER N N 15 121.2 0.1 . 1 . . . . 56 SER N . 17302 1
462 . 1 1 56 56 LYS H H 1 7.80 0.01 . 1 . . . . 57 LYS H . 17302 1
463 . 1 1 56 56 LYS HA H 1 4.56 0.01 . 1 . . . . 57 LYS HA . 17302 1
464 . 1 1 56 56 LYS HB2 H 1 1.86 0.01 . 1 . . . . 57 LYS HB2 . 17302 1
465 . 1 1 56 56 LYS HB3 H 1 1.98 0.01 . 1 . . . . 57 LYS HB3 . 17302 1
466 . 1 1 56 56 LYS HG2 H 1 1.42 0.01 . 1 . . . . 57 LYS HG2 . 17302 1
467 . 1 1 56 56 LYS HG3 H 1 1.42 0.01 . 1 . . . . 57 LYS HG3 . 17302 1
468 . 1 1 56 56 LYS HD2 H 1 1.73 0.01 . 1 . . . . 57 LYS HD2 . 17302 1
469 . 1 1 56 56 LYS HD3 H 1 1.73 0.01 . 1 . . . . 57 LYS HD3 . 17302 1
470 . 1 1 56 56 LYS HE2 H 1 2.93 0.01 . 1 . . . . 57 LYS HE2 . 17302 1
471 . 1 1 56 56 LYS HE3 H 1 2.93 0.01 . 1 . . . . 57 LYS HE3 . 17302 1
472 . 1 1 56 56 LYS N N 15 123.4 0.1 . 1 . . . . 57 LYS N . 17302 1
473 . 1 1 57 57 VAL H H 1 8.50 0.01 . 1 . . . . 58 VAL H . 17302 1
474 . 1 1 57 57 VAL HA H 1 4.84 0.01 . 1 . . . . 58 VAL HA . 17302 1
475 . 1 1 57 57 VAL HB H 1 1.92 0.01 . 1 . . . . 58 VAL HB . 17302 1
476 . 1 1 57 57 VAL HG11 H 1 0.80 0.01 . 1 . . . . 58 VAL MG1 . 17302 1
477 . 1 1 57 57 VAL HG12 H 1 0.80 0.01 . 1 . . . . 58 VAL MG1 . 17302 1
478 . 1 1 57 57 VAL HG13 H 1 0.80 0.01 . 1 . . . . 58 VAL MG1 . 17302 1
479 . 1 1 57 57 VAL HG21 H 1 0.93 0.01 . 1 . . . . 58 VAL MG2 . 17302 1
480 . 1 1 57 57 VAL HG22 H 1 0.93 0.01 . 1 . . . . 58 VAL MG2 . 17302 1
481 . 1 1 57 57 VAL HG23 H 1 0.93 0.01 . 1 . . . . 58 VAL MG2 . 17302 1
482 . 1 1 57 57 VAL N N 15 126.0 0.1 . 1 . . . . 58 VAL N . 17302 1
483 . 1 1 58 58 ILE H H 1 9.14 0.01 . 1 . . . . 59 ILE H . 17302 1
484 . 1 1 58 58 ILE HA H 1 4.29 0.01 . 1 . . . . 59 ILE HA . 17302 1
485 . 1 1 58 58 ILE HB H 1 1.70 0.01 . 1 . . . . 59 ILE HB . 17302 1
486 . 1 1 58 58 ILE HG12 H 1 1.45 0.01 . 9 . . . . 59 ILE HG12 . 17302 1
487 . 1 1 58 58 ILE HG13 H 1 1.45 0.01 . 9 . . . . 59 ILE HG13 . 17302 1
488 . 1 1 58 58 ILE HG21 H 1 0.73 0.01 . 1 . . . . 59 ILE MG . 17302 1
489 . 1 1 58 58 ILE HG22 H 1 0.73 0.01 . 1 . . . . 59 ILE MG . 17302 1
490 . 1 1 58 58 ILE HG23 H 1 0.73 0.01 . 1 . . . . 59 ILE MG . 17302 1
491 . 1 1 58 58 ILE HD11 H 1 0.99 0.01 . 9 . . . . 59 ILE MD . 17302 1
492 . 1 1 58 58 ILE HD12 H 1 0.99 0.01 . 9 . . . . 59 ILE MD . 17302 1
493 . 1 1 58 58 ILE HD13 H 1 0.99 0.01 . 9 . . . . 59 ILE MD . 17302 1
494 . 1 1 58 58 ILE N N 15 128.8 0.1 . 1 . . . . 59 ILE N . 17302 1
495 . 1 1 59 59 GLN H H 1 8.89 0.01 . 1 . . . . 60 GLN H . 17302 1
496 . 1 1 59 59 GLN HA H 1 5.46 0.01 . 1 . . . . 60 GLN HA . 17302 1
497 . 1 1 59 59 GLN HB2 H 1 1.95 0.01 . 1 . . . . 60 GLN HB2 . 17302 1
498 . 1 1 59 59 GLN HB3 H 1 2.08 0.01 . 1 . . . . 60 GLN HB3 . 17302 1
499 . 1 1 59 59 GLN HG2 H 1 2.26 0.01 . 1 . . . . 60 GLN HG2 . 17302 1
500 . 1 1 59 59 GLN HG3 H 1 2.33 0.01 . 1 . . . . 60 GLN HG3 . 17302 1
501 . 1 1 59 59 GLN HE21 H 1 6.87 0.01 . 1 . . . . 60 GLN HE21 . 17302 1
502 . 1 1 59 59 GLN HE22 H 1 7.62 0.01 . 1 . . . . 60 GLN HE22 . 17302 1
503 . 1 1 59 59 GLN N N 15 127.6 0.1 . 1 . . . . 60 GLN N . 17302 1
504 . 1 1 59 59 GLN NE2 N 15 112.4 0.1 . 1 . . . . 60 GLN NE2 . 17302 1
505 . 1 1 60 60 ASN H H 1 8.95 0.01 . 1 . . . . 61 ASN H . 17302 1
506 . 1 1 60 60 ASN HA H 1 5.46 0.01 . 1 . . . . 61 ASN HA . 17302 1
507 . 1 1 60 60 ASN HB2 H 1 2.58 0.01 . 1 . . . . 61 ASN HB2 . 17302 1
508 . 1 1 60 60 ASN HB3 H 1 2.68 0.01 . 1 . . . . 61 ASN HB3 . 17302 1
509 . 1 1 60 60 ASN HD21 H 1 7.29 0.01 . 1 . . . . 61 ASN HD21 . 17302 1
510 . 1 1 60 60 ASN HD22 H 1 7.78 0.01 . 1 . . . . 61 ASN HD22 . 17302 1
511 . 1 1 60 60 ASN N N 15 122.0 0.1 . 1 . . . . 61 ASN N . 17302 1
512 . 1 1 60 60 ASN ND2 N 15 113.9 0.1 . 1 . . . . 61 ASN ND2 . 17302 1
513 . 1 1 61 61 GLU H H 1 9.08 0.01 . 1 . . . . 62 GLU H . 17302 1
514 . 1 1 61 61 GLU HA H 1 5.28 0.01 . 1 . . . . 62 GLU HA . 17302 1
515 . 1 1 61 61 GLU HB2 H 1 2.06 0.01 . 1 . . . . 62 GLU HB2 . 17302 1
516 . 1 1 61 61 GLU HB3 H 1 2.06 0.01 . 1 . . . . 62 GLU HB3 . 17302 1
517 . 1 1 61 61 GLU HG2 H 1 2.35 0.01 . 1 . . . . 62 GLU HG2 . 17302 1
518 . 1 1 61 61 GLU HG3 H 1 2.30 0.01 . 1 . . . . 62 GLU HG3 . 17302 1
519 . 1 1 61 61 GLU N N 15 122.5 0.1 . 1 . . . . 62 GLU N . 17302 1
520 . 1 1 62 62 PHE H H 1 8.23 0.01 . 1 . . . . 63 PHE H . 17302 1
521 . 1 1 62 62 PHE HA H 1 5.06 0.01 . 1 . . . . 63 PHE HA . 17302 1
522 . 1 1 62 62 PHE HB2 H 1 3.08 0.01 . 1 . . . . 63 PHE HB2 . 17302 1
523 . 1 1 62 62 PHE HB3 H 1 3.36 0.01 . 1 . . . . 63 PHE HB3 . 17302 1
524 . 1 1 62 62 PHE HD1 H 1 6.59 0.01 . 1 . . . . 63 PHE HD1 . 17302 1
525 . 1 1 62 62 PHE HD2 H 1 6.59 0.01 . 1 . . . . 63 PHE HD2 . 17302 1
526 . 1 1 62 62 PHE HE1 H 1 6.52 0.01 . 1 . . . . 63 PHE HE1 . 17302 1
527 . 1 1 62 62 PHE HE2 H 1 6.52 0.01 . 1 . . . . 63 PHE HE2 . 17302 1
528 . 1 1 62 62 PHE HZ H 1 6.38 0.01 . 1 . . . . 63 PHE HZ . 17302 1
529 . 1 1 62 62 PHE N N 15 117.6 0.1 . 1 . . . . 63 PHE N . 17302 1
530 . 1 1 63 63 THR H H 1 9.20 0.01 . 1 . . . . 64 THR H . 17302 1
531 . 1 1 63 63 THR HA H 1 5.33 0.01 . 1 . . . . 64 THR HA . 17302 1
532 . 1 1 63 63 THR HB H 1 4.03 0.01 . 1 . . . . 64 THR HB . 17302 1
533 . 1 1 63 63 THR HG21 H 1 1.33 0.01 . 1 . . . . 64 THR MG . 17302 1
534 . 1 1 63 63 THR HG22 H 1 1.33 0.01 . 1 . . . . 64 THR MG . 17302 1
535 . 1 1 63 63 THR HG23 H 1 1.33 0.01 . 1 . . . . 64 THR MG . 17302 1
536 . 1 1 63 63 THR N N 15 118.8 0.1 . 1 . . . . 64 THR N . 17302 1
537 . 1 1 64 64 VAL H H 1 9.18 0.01 . 1 . . . . 65 VAL H . 17302 1
538 . 1 1 64 64 VAL HA H 1 4.22 0.01 . 1 . . . . 65 VAL HA . 17302 1
539 . 1 1 64 64 VAL HB H 1 2.38 0.01 . 1 . . . . 65 VAL HB . 17302 1
540 . 1 1 64 64 VAL HG11 H 1 1.14 0.01 . 1 . . . . 65 VAL MG1 . 17302 1
541 . 1 1 64 64 VAL HG12 H 1 1.14 0.01 . 1 . . . . 65 VAL MG1 . 17302 1
542 . 1 1 64 64 VAL HG13 H 1 1.14 0.01 . 1 . . . . 65 VAL MG1 . 17302 1
543 . 1 1 64 64 VAL HG21 H 1 1.35 0.01 . 1 . . . . 65 VAL MG2 . 17302 1
544 . 1 1 64 64 VAL HG22 H 1 1.35 0.01 . 1 . . . . 65 VAL MG2 . 17302 1
545 . 1 1 64 64 VAL HG23 H 1 1.35 0.01 . 1 . . . . 65 VAL MG2 . 17302 1
546 . 1 1 64 64 VAL N N 15 125.8 0.1 . 1 . . . . 65 VAL N . 17302 1
547 . 1 1 65 65 GLY H H 1 8.85 0.01 . 1 . . . . 66 GLY H . 17302 1
548 . 1 1 65 65 GLY HA2 H 1 3.55 0.01 . 1 . . . . 66 GLY HA2 . 17302 1
549 . 1 1 65 65 GLY HA3 H 1 4.38 0.01 . 1 . . . . 66 GLY HA3 . 17302 1
550 . 1 1 65 65 GLY N N 15 109.9 0.1 . 1 . . . . 66 GLY N . 17302 1
551 . 1 1 66 66 GLU H H 1 7.85 0.01 . 1 . . . . 67 GLU H . 17302 1
552 . 1 1 66 66 GLU HA H 1 4.79 0.01 . 1 . . . . 67 GLU HA . 17302 1
553 . 1 1 66 66 GLU HB2 H 1 2.03 0.01 . 1 . . . . 67 GLU HB2 . 17302 1
554 . 1 1 66 66 GLU HB3 H 1 2.03 0.01 . 1 . . . . 67 GLU HB3 . 17302 1
555 . 1 1 66 66 GLU HG2 H 1 2.22 0.01 . 1 . . . . 67 GLU HG2 . 17302 1
556 . 1 1 66 66 GLU HG3 H 1 2.28 0.01 . 1 . . . . 67 GLU HG3 . 17302 1
557 . 1 1 66 66 GLU N N 15 119.4 0.1 . 1 . . . . 67 GLU N . 17302 1
558 . 1 1 67 67 GLU H H 1 9.02 0.01 . 1 . . . . 68 GLU H . 17302 1
559 . 1 1 67 67 GLU HA H 1 4.39 0.01 . 1 . . . . 68 GLU HA . 17302 1
560 . 1 1 67 67 GLU HB2 H 1 2.17 0.01 . 2 . . . . 68 GLU HB2 . 17302 1
561 . 1 1 67 67 GLU HB3 H 1 1.99 0.01 . 2 . . . . 68 GLU HB3 . 17302 1
562 . 1 1 67 67 GLU HG2 H 1 2.31 0.01 . 1 . . . . 68 GLU HG2 . 17302 1
563 . 1 1 67 67 GLU HG3 H 1 2.24 0.01 . 1 . . . . 68 GLU HG3 . 17302 1
564 . 1 1 67 67 GLU N N 15 125.7 0.1 . 1 . . . . 68 GLU N . 17302 1
565 . 1 1 68 68 CYS H H 1 9.29 0.01 . 1 . . . . 69 CYS H . 17302 1
566 . 1 1 68 68 CYS HA H 1 5.19 0.01 . 1 . . . . 69 CYS HA . 17302 1
567 . 1 1 68 68 CYS HB2 H 1 3.38 0.01 . 1 . . . . 69 CYS HB2 . 17302 1
568 . 1 1 68 68 CYS HB3 H 1 3.10 0.01 . 1 . . . . 69 CYS HB3 . 17302 1
569 . 1 1 68 68 CYS N N 15 122.2 0.1 . 1 . . . . 69 CYS N . 17302 1
570 . 1 1 69 69 GLU H H 1 8.49 0.01 . 1 . . . . 70 GLU H . 17302 1
571 . 1 1 69 69 GLU HA H 1 5.06 0.01 . 1 . . . . 70 GLU HA . 17302 1
572 . 1 1 69 69 GLU HB2 H 1 1.92 0.01 . 1 . . . . 70 GLU HB2 . 17302 1
573 . 1 1 69 69 GLU HB3 H 1 1.84 0.01 . 1 . . . . 70 GLU HB3 . 17302 1
574 . 1 1 69 69 GLU HG2 H 1 2.08 0.01 . 1 . . . . 70 GLU HG2 . 17302 1
575 . 1 1 69 69 GLU HG3 H 1 2.08 0.01 . 1 . . . . 70 GLU HG3 . 17302 1
576 . 1 1 69 69 GLU N N 15 119.9 0.1 . 1 . . . . 70 GLU N . 17302 1
577 . 1 1 70 70 LEU H H 1 8.82 0.01 . 1 . . . . 71 LEU H . 17302 1
578 . 1 1 70 70 LEU HA H 1 4.54 0.01 . 1 . . . . 71 LEU HA . 17302 1
579 . 1 1 70 70 LEU HB2 H 1 1.12 0.01 . 1 . . . . 71 LEU HB2 . 17302 1
580 . 1 1 70 70 LEU HB3 H 1 1.05 0.01 . 1 . . . . 71 LEU HB3 . 17302 1
581 . 1 1 70 70 LEU HG H 1 1.25 0.01 . 1 . . . . 71 LEU HG . 17302 1
582 . 1 1 70 70 LEU HD11 H 1 0.28 0.01 . 1 . . . . 71 LEU MD1 . 17302 1
583 . 1 1 70 70 LEU HD12 H 1 0.28 0.01 . 1 . . . . 71 LEU MD1 . 17302 1
584 . 1 1 70 70 LEU HD13 H 1 0.28 0.01 . 1 . . . . 71 LEU MD1 . 17302 1
585 . 1 1 70 70 LEU HD21 H 1 0.44 0.01 . 1 . . . . 71 LEU MD2 . 17302 1
586 . 1 1 70 70 LEU HD22 H 1 0.44 0.01 . 1 . . . . 71 LEU MD2 . 17302 1
587 . 1 1 70 70 LEU HD23 H 1 0.44 0.01 . 1 . . . . 71 LEU MD2 . 17302 1
588 . 1 1 70 70 LEU N N 15 126.1 0.1 . 1 . . . . 71 LEU N . 17302 1
589 . 1 1 71 71 GLU H H 1 9.40 0.01 . 1 . . . . 72 GLU H . 17302 1
590 . 1 1 71 71 GLU HA H 1 4.72 0.01 . 1 . . . . 72 GLU HA . 17302 1
591 . 1 1 71 71 GLU HB2 H 1 1.91 0.01 . 1 . . . . 72 GLU HB2 . 17302 1
592 . 1 1 71 71 GLU HB3 H 1 1.91 0.01 . 1 . . . . 72 GLU HB3 . 17302 1
593 . 1 1 71 71 GLU HG2 H 1 2.37 0.01 . 2 . . . . 72 GLU HG2 . 17302 1
594 . 1 1 71 71 GLU HG3 H 1 2.06 0.01 . 2 . . . . 72 GLU HG3 . 17302 1
595 . 1 1 71 71 GLU N N 15 124.3 0.1 . 1 . . . . 72 GLU N . 17302 1
596 . 1 1 72 72 THR H H 1 8.37 0.01 . 1 . . . . 73 THR H . 17302 1
597 . 1 1 72 72 THR HA H 1 4.60 0.01 . 9 . . . . 73 THR HA . 17302 1
598 . 1 1 72 72 THR HB H 1 4.39 0.01 . 9 . . . . 73 THR HB . 17302 1
599 . 1 1 72 72 THR HG21 H 1 1.17 0.01 . 9 . . . . 73 THR MG . 17302 1
600 . 1 1 72 72 THR HG22 H 1 1.17 0.01 . 9 . . . . 73 THR MG . 17302 1
601 . 1 1 72 72 THR HG23 H 1 1.17 0.01 . 9 . . . . 73 THR MG . 17302 1
602 . 1 1 72 72 THR N N 15 116.3 0.1 . 1 . . . . 73 THR N . 17302 1
603 . 1 1 73 73 MET H H 1 7.67 0.01 . 1 . . . . 74 MET H . 17302 1
604 . 1 1 73 73 MET HA H 1 3.53 0.01 . 1 . . . . 74 MET HA . 17302 1
605 . 1 1 73 73 MET HB2 H 1 2.12 0.01 . 1 . . . . 74 MET HB2 . 17302 1
606 . 1 1 73 73 MET HB3 H 1 1.93 0.01 . 9 . . . . 74 MET HB3 . 17302 1
607 . 1 1 73 73 MET HG2 H 1 2.49 0.01 . 1 . . . . 74 MET HG2 . 17302 1
608 . 1 1 73 73 MET HG3 H 1 2.49 0.01 . 1 . . . . 74 MET HG3 . 17302 1
609 . 1 1 73 73 MET N N 15 119.2 0.1 . 1 . . . . 74 MET N . 17302 1
610 . 1 1 74 74 THR H H 1 7.54 0.01 . 1 . . . . 75 THR H . 17302 1
611 . 1 1 74 74 THR HA H 1 4.26 0.01 . 1 . . . . 75 THR HA . 17302 1
612 . 1 1 74 74 THR HB H 1 4.54 0.01 . 1 . . . . 75 THR HB . 17302 1
613 . 1 1 74 74 THR HG21 H 1 1.11 0.01 . 1 . . . . 75 THR MG . 17302 1
614 . 1 1 74 74 THR HG22 H 1 1.11 0.01 . 1 . . . . 75 THR MG . 17302 1
615 . 1 1 74 74 THR HG23 H 1 1.11 0.01 . 1 . . . . 75 THR MG . 17302 1
616 . 1 1 74 74 THR N N 15 105.0 0.1 . 1 . . . . 75 THR N . 17302 1
617 . 1 1 75 75 GLY H H 1 7.84 0.01 . 1 . . . . 76 GLY H . 17302 1
618 . 1 1 75 75 GLY HA2 H 1 4.36 0.01 . 1 . . . . 76 GLY HA2 . 17302 1
619 . 1 1 75 75 GLY HA3 H 1 3.88 0.01 . 1 . . . . 76 GLY HA3 . 17302 1
620 . 1 1 75 75 GLY N N 15 110.6 0.1 . 1 . . . . 76 GLY N . 17302 1
621 . 1 1 76 76 GLU H H 1 7.38 0.01 . 1 . . . . 77 GLU H . 17302 1
622 . 1 1 76 76 GLU HA H 1 4.25 0.01 . 1 . . . . 77 GLU HA . 17302 1
623 . 1 1 76 76 GLU HB2 H 1 1.79 0.01 . 1 . . . . 77 GLU HB2 . 17302 1
624 . 1 1 76 76 GLU HB3 H 1 1.79 0.01 . 1 . . . . 77 GLU HB3 . 17302 1
625 . 1 1 76 76 GLU HG2 H 1 2.19 0.01 . 2 . . . . 77 GLU HG2 . 17302 1
626 . 1 1 76 76 GLU HG3 H 1 2.08 0.01 . 2 . . . . 77 GLU HG3 . 17302 1
627 . 1 1 76 76 GLU N N 15 120.8 0.1 . 1 . . . . 77 GLU N . 17302 1
628 . 1 1 77 77 LYS H H 1 8.63 0.01 . 1 . . . . 78 LYS H . 17302 1
629 . 1 1 77 77 LYS HA H 1 5.23 0.01 . 1 . . . . 78 LYS HA . 17302 1
630 . 1 1 77 77 LYS HB2 H 1 1.73 0.01 . 1 . . . . 78 LYS HB2 . 17302 1
631 . 1 1 77 77 LYS HB3 H 1 1.49 0.01 . 1 . . . . 78 LYS HB3 . 17302 1
632 . 1 1 77 77 LYS HG2 H 1 1.23 0.01 . 1 . . . . 78 LYS HG2 . 17302 1
633 . 1 1 77 77 LYS HG3 H 1 1.23 0.01 . 1 . . . . 78 LYS HG3 . 17302 1
634 . 1 1 77 77 LYS HD2 H 1 1.61 0.01 . 1 . . . . 78 LYS HD2 . 17302 1
635 . 1 1 77 77 LYS HD3 H 1 1.61 0.01 . 1 . . . . 78 LYS HD3 . 17302 1
636 . 1 1 77 77 LYS HE2 H 1 2.97 0.01 . 1 . . . . 78 LYS HE2 . 17302 1
637 . 1 1 77 77 LYS HE3 H 1 2.97 0.01 . 1 . . . . 78 LYS HE3 . 17302 1
638 . 1 1 77 77 LYS N N 15 124.1 0.1 . 1 . . . . 78 LYS N . 17302 1
639 . 1 1 78 78 VAL H H 1 8.92 0.01 . 1 . . . . 79 VAL H . 17302 1
640 . 1 1 78 78 VAL HA H 1 4.55 0.01 . 1 . . . . 79 VAL HA . 17302 1
641 . 1 1 78 78 VAL HB H 1 1.93 0.01 . 1 . . . . 79 VAL HB . 17302 1
642 . 1 1 78 78 VAL HG11 H 1 0.55 0.01 . 1 . . . . 79 VAL MG1 . 17302 1
643 . 1 1 78 78 VAL HG12 H 1 0.55 0.01 . 1 . . . . 79 VAL MG1 . 17302 1
644 . 1 1 78 78 VAL HG13 H 1 0.55 0.01 . 1 . . . . 79 VAL MG1 . 17302 1
645 . 1 1 78 78 VAL HG21 H 1 0.78 0.01 . 1 . . . . 79 VAL MG2 . 17302 1
646 . 1 1 78 78 VAL HG22 H 1 0.78 0.01 . 1 . . . . 79 VAL MG2 . 17302 1
647 . 1 1 78 78 VAL HG23 H 1 0.78 0.01 . 1 . . . . 79 VAL MG2 . 17302 1
648 . 1 1 78 78 VAL N N 15 119.9 0.1 . 1 . . . . 79 VAL N . 17302 1
649 . 1 1 79 79 LYS H H 1 8.48 0.01 . 1 . . . . 80 LYS H . 17302 1
650 . 1 1 79 79 LYS HA H 1 5.26 0.01 . 1 . . . . 80 LYS HA . 17302 1
651 . 1 1 79 79 LYS HB2 H 1 1.76 0.01 . 1 . . . . 80 LYS HB2 . 17302 1
652 . 1 1 79 79 LYS HB3 H 1 1.76 0.01 . 1 . . . . 80 LYS HB3 . 17302 1
653 . 1 1 79 79 LYS HG2 H 1 1.34 0.01 . 1 . . . . 80 LYS HG2 . 17302 1
654 . 1 1 79 79 LYS HG3 H 1 1.51 0.01 . 1 . . . . 80 LYS HG3 . 17302 1
655 . 1 1 79 79 LYS HD2 H 1 1.65 0.01 . 1 . . . . 80 LYS HD2 . 17302 1
656 . 1 1 79 79 LYS HD3 H 1 1.65 0.01 . 1 . . . . 80 LYS HD3 . 17302 1
657 . 1 1 79 79 LYS HE2 H 1 2.95 0.01 . 1 . . . . 80 LYS HE2 . 17302 1
658 . 1 1 79 79 LYS HE3 H 1 2.95 0.01 . 1 . . . . 80 LYS HE3 . 17302 1
659 . 1 1 79 79 LYS N N 15 124.7 0.1 . 1 . . . . 80 LYS N . 17302 1
660 . 1 1 80 80 THR H H 1 8.87 0.01 . 1 . . . . 81 THR H . 17302 1
661 . 1 1 80 80 THR HA H 1 4.76 0.01 . 1 . . . . 81 THR HA . 17302 1
662 . 1 1 80 80 THR HB H 1 4.20 0.01 . 1 . . . . 81 THR HB . 17302 1
663 . 1 1 80 80 THR HG21 H 1 0.82 0.01 . 1 . . . . 81 THR MG . 17302 1
664 . 1 1 80 80 THR HG22 H 1 0.82 0.01 . 1 . . . . 81 THR MG . 17302 1
665 . 1 1 80 80 THR HG23 H 1 0.82 0.01 . 1 . . . . 81 THR MG . 17302 1
666 . 1 1 80 80 THR N N 15 120.4 0.1 . 1 . . . . 81 THR N . 17302 1
667 . 1 1 81 81 VAL H H 1 8.35 0.01 . 1 . . . . 82 VAL H . 17302 1
668 . 1 1 81 81 VAL HA H 1 4.31 0.01 . 1 . . . . 82 VAL HA . 17302 1
669 . 1 1 81 81 VAL HB H 1 1.88 0.01 . 1 . . . . 82 VAL HB . 17302 1
670 . 1 1 81 81 VAL HG11 H 1 0.73 0.01 . 1 . . . . 82 VAL MG1 . 17302 1
671 . 1 1 81 81 VAL HG12 H 1 0.73 0.01 . 1 . . . . 82 VAL MG1 . 17302 1
672 . 1 1 81 81 VAL HG13 H 1 0.73 0.01 . 1 . . . . 82 VAL MG1 . 17302 1
673 . 1 1 81 81 VAL HG21 H 1 0.82 0.01 . 1 . . . . 82 VAL MG2 . 17302 1
674 . 1 1 81 81 VAL HG22 H 1 0.82 0.01 . 1 . . . . 82 VAL MG2 . 17302 1
675 . 1 1 81 81 VAL HG23 H 1 0.82 0.01 . 1 . . . . 82 VAL MG2 . 17302 1
676 . 1 1 81 81 VAL N N 15 120.2 0.1 . 1 . . . . 82 VAL N . 17302 1
677 . 1 1 82 82 VAL H H 1 9.88 0.01 . 1 . . . . 83 VAL H . 17302 1
678 . 1 1 82 82 VAL HA H 1 4.23 0.01 . 1 . . . . 83 VAL HA . 17302 1
679 . 1 1 82 82 VAL HB H 1 1.31 0.01 . 1 . . . . 83 VAL HB . 17302 1
680 . 1 1 82 82 VAL HG11 H 1 0.35 0.01 . 1 . . . . 83 VAL MG1 . 17302 1
681 . 1 1 82 82 VAL HG12 H 1 0.35 0.01 . 1 . . . . 83 VAL MG1 . 17302 1
682 . 1 1 82 82 VAL HG13 H 1 0.35 0.01 . 1 . . . . 83 VAL MG1 . 17302 1
683 . 1 1 82 82 VAL HG21 H 1 -0.26 0.01 . 1 . . . . 83 VAL MG2 . 17302 1
684 . 1 1 82 82 VAL HG22 H 1 -0.26 0.01 . 1 . . . . 83 VAL MG2 . 17302 1
685 . 1 1 82 82 VAL HG23 H 1 -0.26 0.01 . 1 . . . . 83 VAL MG2 . 17302 1
686 . 1 1 82 82 VAL N N 15 133.5 0.1 . 1 . . . . 83 VAL N . 17302 1
687 . 1 1 83 83 GLN H H 1 8.88 0.01 . 1 . . . . 84 GLN H . 17302 1
688 . 1 1 83 83 GLN HA H 1 4.95 0.01 . 1 . . . . 84 GLN HA . 17302 1
689 . 1 1 83 83 GLN HB2 H 1 1.76 0.01 . 1 . . . . 84 GLN HB2 . 17302 1
690 . 1 1 83 83 GLN HB3 H 1 2.11 0.01 . 1 . . . . 84 GLN HB3 . 17302 1
691 . 1 1 83 83 GLN HG2 H 1 2.41 0.01 . 1 . . . . 84 GLN HG2 . 17302 1
692 . 1 1 83 83 GLN HG3 H 1 2.26 0.01 . 1 . . . . 84 GLN HG3 . 17302 1
693 . 1 1 83 83 GLN HE21 H 1 6.86 0.01 . 1 . . . . 84 GLN HE21 . 17302 1
694 . 1 1 83 83 GLN HE22 H 1 7.44 0.01 . 1 . . . . 84 GLN HE22 . 17302 1
695 . 1 1 83 83 GLN N N 15 124.8 0.1 . 1 . . . . 84 GLN N . 17302 1
696 . 1 1 83 83 GLN NE2 N 15 110.6 0.1 . 1 . . . . 84 GLN NE2 . 17302 1
697 . 1 1 84 84 LEU H H 1 8.56 0.01 . 1 . . . . 85 LEU H . 17302 1
698 . 1 1 84 84 LEU HA H 1 5.30 0.01 . 1 . . . . 85 LEU HA . 17302 1
699 . 1 1 84 84 LEU HB2 H 1 1.98 0.01 . 2 . . . . 85 LEU HB2 . 17302 1
700 . 1 1 84 84 LEU HB3 H 1 1.45 0.01 . 2 . . . . 85 LEU HB3 . 17302 1
701 . 1 1 84 84 LEU HG H 1 1.73 0.01 . 1 . . . . 85 LEU HG . 17302 1
702 . 1 1 84 84 LEU HD11 H 1 1.04 0.01 . 1 . . . . 85 LEU MD1 . 17302 1
703 . 1 1 84 84 LEU HD12 H 1 1.04 0.01 . 1 . . . . 85 LEU MD1 . 17302 1
704 . 1 1 84 84 LEU HD13 H 1 1.04 0.01 . 1 . . . . 85 LEU MD1 . 17302 1
705 . 1 1 84 84 LEU HD21 H 1 1.09 0.01 . 1 . . . . 85 LEU MD2 . 17302 1
706 . 1 1 84 84 LEU HD22 H 1 1.09 0.01 . 1 . . . . 85 LEU MD2 . 17302 1
707 . 1 1 84 84 LEU HD23 H 1 1.09 0.01 . 1 . . . . 85 LEU MD2 . 17302 1
708 . 1 1 84 84 LEU N N 15 123.6 0.1 . 1 . . . . 85 LEU N . 17302 1
709 . 1 1 85 85 GLU H H 1 9.18 0.01 . 1 . . . . 86 GLU H . 17302 1
710 . 1 1 85 85 GLU HA H 1 4.60 0.01 . 1 . . . . 86 GLU HA . 17302 1
711 . 1 1 85 85 GLU HB2 H 1 1.76 0.01 . 1 . . . . 86 GLU HB2 . 17302 1
712 . 1 1 85 85 GLU HB3 H 1 1.95 0.01 . 1 . . . . 86 GLU HB3 . 17302 1
713 . 1 1 85 85 GLU HG2 H 1 2.12 0.01 . 1 . . . . 86 GLU HG2 . 17302 1
714 . 1 1 85 85 GLU HG3 H 1 2.17 0.01 . 1 . . . . 86 GLU HG3 . 17302 1
715 . 1 1 85 85 GLU N N 15 128.6 0.1 . 1 . . . . 86 GLU N . 17302 1
716 . 1 1 86 86 GLY H H 1 8.40 0.01 . 1 . . . . 87 GLY H . 17302 1
717 . 1 1 86 86 GLY HA2 H 1 3.80 0.01 . 1 . . . . 87 GLY HA2 . 17302 1
718 . 1 1 86 86 GLY HA3 H 1 4.17 0.01 . 1 . . . . 87 GLY HA3 . 17302 1
719 . 1 1 86 86 GLY N N 15 112.6 0.1 . 1 . . . . 87 GLY N . 17302 1
720 . 1 1 87 87 ASP H H 1 8.47 0.01 . 1 . . . . 88 ASP H . 17302 1
721 . 1 1 87 87 ASP HA H 1 4.80 0.01 . 1 . . . . 88 ASP HA . 17302 1
722 . 1 1 87 87 ASP HB2 H 1 2.72 0.01 . 1 . . . . 88 ASP HB2 . 17302 1
723 . 1 1 87 87 ASP HB3 H 1 2.72 0.01 . 1 . . . . 88 ASP HB3 . 17302 1
724 . 1 1 87 87 ASP N N 15 117.9 0.1 . 1 . . . . 88 ASP N . 17302 1
725 . 1 1 88 88 ASN H H 1 8.32 0.01 . 1 . . . . 89 ASN H . 17302 1
726 . 1 1 88 88 ASN HA H 1 4.89 0.01 . 1 . . . . 89 ASN HA . 17302 1
727 . 1 1 88 88 ASN HB2 H 1 3.02 0.01 . 1 . . . . 89 ASN HB2 . 17302 1
728 . 1 1 88 88 ASN HB3 H 1 3.20 0.01 . 1 . . . . 89 ASN HB3 . 17302 1
729 . 1 1 88 88 ASN HD21 H 1 6.88 0.01 . 1 . . . . 89 ASN HD21 . 17302 1
730 . 1 1 88 88 ASN HD22 H 1 7.42 0.01 . 1 . . . . 89 ASN HD22 . 17302 1
731 . 1 1 88 88 ASN N N 15 114.9 0.1 . 1 . . . . 89 ASN N . 17302 1
732 . 1 1 88 88 ASN ND2 N 15 112.8 0.1 . 1 . . . . 89 ASN ND2 . 17302 1
733 . 1 1 89 89 LYS H H 1 7.47 0.01 . 1 . . . . 90 LYS H . 17302 1
734 . 1 1 89 89 LYS HA H 1 5.56 0.01 . 1 . . . . 90 LYS HA . 17302 1
735 . 1 1 89 89 LYS HB2 H 1 1.90 0.01 . 2 . . . . 90 LYS HB2 . 17302 1
736 . 1 1 89 89 LYS HB3 H 1 1.81 0.01 . 2 . . . . 90 LYS HB3 . 17302 1
737 . 1 1 89 89 LYS HG2 H 1 1.11 0.01 . 1 . . . . 90 LYS HG2 . 17302 1
738 . 1 1 89 89 LYS HG3 H 1 1.28 0.01 . 1 . . . . 90 LYS HG3 . 17302 1
739 . 1 1 89 89 LYS HD2 H 1 1.61 0.01 . 1 . . . . 90 LYS HD2 . 17302 1
740 . 1 1 89 89 LYS HD3 H 1 1.61 0.01 . 1 . . . . 90 LYS HD3 . 17302 1
741 . 1 1 89 89 LYS HE2 H 1 2.86 0.01 . 1 . . . . 90 LYS HE2 . 17302 1
742 . 1 1 89 89 LYS HE3 H 1 2.76 0.01 . 1 . . . . 90 LYS HE3 . 17302 1
743 . 1 1 89 89 LYS N N 15 119.8 0.1 . 1 . . . . 90 LYS N . 17302 1
744 . 1 1 90 90 LEU H H 1 9.14 0.01 . 1 . . . . 91 LEU H . 17302 1
745 . 1 1 90 90 LEU HA H 1 5.24 0.01 . 1 . . . . 91 LEU HA . 17302 1
746 . 1 1 90 90 LEU HB2 H 1 1.44 0.01 . 1 . . . . 91 LEU HB2 . 17302 1
747 . 1 1 90 90 LEU HB3 H 1 0.82 0.01 . 1 . . . . 91 LEU HB3 . 17302 1
748 . 1 1 90 90 LEU HG H 1 1.10 0.01 . 1 . . . . 91 LEU HG . 17302 1
749 . 1 1 90 90 LEU HD11 H 1 -0.11 0.01 . 1 . . . . 91 LEU MD1 . 17302 1
750 . 1 1 90 90 LEU HD12 H 1 -0.11 0.01 . 1 . . . . 91 LEU MD1 . 17302 1
751 . 1 1 90 90 LEU HD13 H 1 -0.11 0.01 . 1 . . . . 91 LEU MD1 . 17302 1
752 . 1 1 90 90 LEU HD21 H 1 0.18 0.01 . 1 . . . . 91 LEU MD2 . 17302 1
753 . 1 1 90 90 LEU HD22 H 1 0.18 0.01 . 1 . . . . 91 LEU MD2 . 17302 1
754 . 1 1 90 90 LEU HD23 H 1 0.18 0.01 . 1 . . . . 91 LEU MD2 . 17302 1
755 . 1 1 90 90 LEU N N 15 126.1 0.1 . 1 . . . . 91 LEU N . 17302 1
756 . 1 1 91 91 VAL H H 1 9.30 0.01 . 1 . . . . 92 VAL H . 17302 1
757 . 1 1 91 91 VAL HA H 1 5.02 0.01 . 1 . . . . 92 VAL HA . 17302 1
758 . 1 1 91 91 VAL HB H 1 1.88 0.01 . 1 . . . . 92 VAL HB . 17302 1
759 . 1 1 91 91 VAL HG11 H 1 0.89 0.01 . 1 . . . . 92 VAL MG1 . 17302 1
760 . 1 1 91 91 VAL HG12 H 1 0.89 0.01 . 1 . . . . 92 VAL MG1 . 17302 1
761 . 1 1 91 91 VAL HG13 H 1 0.89 0.01 . 1 . . . . 92 VAL MG1 . 17302 1
762 . 1 1 91 91 VAL HG21 H 1 0.89 0.01 . 1 . . . . 92 VAL MG2 . 17302 1
763 . 1 1 91 91 VAL HG22 H 1 0.89 0.01 . 1 . . . . 92 VAL MG2 . 17302 1
764 . 1 1 91 91 VAL HG23 H 1 0.89 0.01 . 1 . . . . 92 VAL MG2 . 17302 1
765 . 1 1 91 91 VAL N N 15 123.2 0.1 . 1 . . . . 92 VAL N . 17302 1
766 . 1 1 92 92 THR H H 1 8.90 0.01 . 1 . . . . 93 THR H . 17302 1
767 . 1 1 92 92 THR HA H 1 4.71 0.01 . 1 . . . . 93 THR HA . 17302 1
768 . 1 1 92 92 THR HB H 1 3.93 0.01 . 1 . . . . 93 THR HB . 17302 1
769 . 1 1 92 92 THR HG21 H 1 0.80 0.01 . 1 . . . . 93 THR MG . 17302 1
770 . 1 1 92 92 THR HG22 H 1 0.80 0.01 . 1 . . . . 93 THR MG . 17302 1
771 . 1 1 92 92 THR HG23 H 1 0.80 0.01 . 1 . . . . 93 THR MG . 17302 1
772 . 1 1 92 92 THR N N 15 121.5 0.1 . 1 . . . . 93 THR N . 17302 1
773 . 1 1 93 93 THR H H 1 8.18 0.01 . 1 . . . . 94 THR H . 17302 1
774 . 1 1 93 93 THR HA H 1 5.24 0.01 . 1 . . . . 94 THR HA . 17302 1
775 . 1 1 93 93 THR HB H 1 3.97 0.01 . 1 . . . . 94 THR HB . 17302 1
776 . 1 1 93 93 THR HG21 H 1 1.05 0.01 . 1 . . . . 94 THR MG . 17302 1
777 . 1 1 93 93 THR HG22 H 1 1.05 0.01 . 1 . . . . 94 THR MG . 17302 1
778 . 1 1 93 93 THR HG23 H 1 1.05 0.01 . 1 . . . . 94 THR MG . 17302 1
779 . 1 1 93 93 THR N N 15 117.7 0.1 . 1 . . . . 94 THR N . 17302 1
780 . 1 1 94 94 PHE H H 1 8.32 0.01 . 1 . . . . 95 PHE H . 17302 1
781 . 1 1 94 94 PHE HA H 1 4.80 0.01 . 1 . . . . 95 PHE HA . 17302 1
782 . 1 1 94 94 PHE HB2 H 1 2.80 0.01 . 1 . . . . 95 PHE HB2 . 17302 1
783 . 1 1 94 94 PHE HB3 H 1 3.13 0.01 . 1 . . . . 95 PHE HB3 . 17302 1
784 . 1 1 94 94 PHE HD1 H 1 6.81 0.01 . 1 . . . . 95 PHE HD1 . 17302 1
785 . 1 1 94 94 PHE HD2 H 1 6.81 0.01 . 1 . . . . 95 PHE HD2 . 17302 1
786 . 1 1 94 94 PHE HE1 H 1 7.10 0.01 . 1 . . . . 95 PHE HE1 . 17302 1
787 . 1 1 94 94 PHE HE2 H 1 7.10 0.01 . 1 . . . . 95 PHE HE2 . 17302 1
788 . 1 1 94 94 PHE HZ H 1 7.17 0.01 . 1 . . . . 95 PHE HZ . 17302 1
789 . 1 1 94 94 PHE N N 15 121.1 0.1 . 1 . . . . 95 PHE N . 17302 1
790 . 1 1 95 95 LYS H H 1 9.35 0.01 . 1 . . . . 96 LYS H . 17302 1
791 . 1 1 95 95 LYS HA H 1 3.84 0.01 . 1 . . . . 96 LYS HA . 17302 1
792 . 1 1 95 95 LYS HB2 H 1 2.01 0.01 . 1 . . . . 96 LYS HB2 . 17302 1
793 . 1 1 95 95 LYS HB3 H 1 2.01 0.01 . 1 . . . . 96 LYS HB3 . 17302 1
794 . 1 1 95 95 LYS HG2 H 1 1.53 0.01 . 1 . . . . 96 LYS HG2 . 17302 1
795 . 1 1 95 95 LYS HG3 H 1 1.63 0.01 . 1 . . . . 96 LYS HG3 . 17302 1
796 . 1 1 95 95 LYS HD2 H 1 1.79 0.01 . 1 . . . . 96 LYS HD2 . 17302 1
797 . 1 1 95 95 LYS HD3 H 1 1.74 0.01 . 1 . . . . 96 LYS HD3 . 17302 1
798 . 1 1 95 95 LYS HE2 H 1 3.01 0.01 . 1 . . . . 96 LYS HE2 . 17302 1
799 . 1 1 95 95 LYS HE3 H 1 3.01 0.01 . 1 . . . . 96 LYS HE3 . 17302 1
800 . 1 1 95 95 LYS N N 15 119.7 0.1 . 1 . . . . 96 LYS N . 17302 1
801 . 1 1 96 96 ASN H H 1 8.52 0.01 . 1 . . . . 97 ASN H . 17302 1
802 . 1 1 96 96 ASN HA H 1 4.38 0.01 . 1 . . . . 97 ASN HA . 17302 1
803 . 1 1 96 96 ASN HB2 H 1 3.05 0.01 . 2 . . . . 97 ASN HB2 . 17302 1
804 . 1 1 96 96 ASN HB3 H 1 2.89 0.01 . 2 . . . . 97 ASN HB3 . 17302 1
805 . 1 1 96 96 ASN HD21 H 1 7.45 0.01 . 1 . . . . 97 ASN HD21 . 17302 1
806 . 1 1 96 96 ASN HD22 H 1 6.81 0.01 . 1 . . . . 97 ASN HD22 . 17302 1
807 . 1 1 96 96 ASN N N 15 113.9 0.1 . 1 . . . . 97 ASN N . 17302 1
808 . 1 1 96 96 ASN ND2 N 15 112.3 0.1 . 1 . . . . 97 ASN ND2 . 17302 1
809 . 1 1 97 97 ILE H H 1 8.44 0.01 . 1 . . . . 98 ILE H . 17302 1
810 . 1 1 97 97 ILE HA H 1 4.54 0.01 . 1 . . . . 98 ILE HA . 17302 1
811 . 1 1 97 97 ILE HB H 1 1.58 0.01 . 1 . . . . 98 ILE HB . 17302 1
812 . 1 1 97 97 ILE HG12 H 1 1.76 0.01 . 9 . . . . 98 ILE HG12 . 17302 1
813 . 1 1 97 97 ILE HG13 H 1 1.76 0.01 . 9 . . . . 98 ILE HG13 . 17302 1
814 . 1 1 97 97 ILE HG21 H 1 0.71 0.01 . 1 . . . . 98 ILE MG . 17302 1
815 . 1 1 97 97 ILE HG22 H 1 0.71 0.01 . 1 . . . . 98 ILE MG . 17302 1
816 . 1 1 97 97 ILE HG23 H 1 0.71 0.01 . 1 . . . . 98 ILE MG . 17302 1
817 . 1 1 97 97 ILE HD11 H 1 0.84 0.01 . 9 . . . . 98 ILE MD . 17302 1
818 . 1 1 97 97 ILE HD12 H 1 0.84 0.01 . 9 . . . . 98 ILE MD . 17302 1
819 . 1 1 97 97 ILE HD13 H 1 0.84 0.01 . 9 . . . . 98 ILE MD . 17302 1
820 . 1 1 97 97 ILE N N 15 122.3 0.1 . 1 . . . . 98 ILE N . 17302 1
821 . 1 1 98 98 LYS H H 1 8.18 0.01 . 1 . . . . 99 LYS H . 17302 1
822 . 1 1 98 98 LYS HA H 1 4.69 0.01 . 1 . . . . 99 LYS HA . 17302 1
823 . 1 1 98 98 LYS HB2 H 1 1.83 0.01 . 2 . . . . 99 LYS HB2 . 17302 1
824 . 1 1 98 98 LYS HB3 H 1 1.68 0.01 . 2 . . . . 99 LYS HB3 . 17302 1
825 . 1 1 98 98 LYS HG2 H 1 1.30 0.01 . 2 . . . . 99 LYS HG2 . 17302 1
826 . 1 1 98 98 LYS HG3 H 1 1.25 0.01 . 2 . . . . 99 LYS HG3 . 17302 1
827 . 1 1 98 98 LYS HD2 H 1 1.59 0.01 . 1 . . . . 99 LYS HD2 . 17302 1
828 . 1 1 98 98 LYS HD3 H 1 1.59 0.01 . 1 . . . . 99 LYS HD3 . 17302 1
829 . 1 1 98 98 LYS HE2 H 1 2.80 0.01 . 1 . . . . 99 LYS HE2 . 17302 1
830 . 1 1 98 98 LYS HE3 H 1 2.80 0.01 . 1 . . . . 99 LYS HE3 . 17302 1
831 . 1 1 98 98 LYS N N 15 127.1 0.1 . 1 . . . . 99 LYS N . 17302 1
832 . 1 1 99 99 SER H H 1 8.96 0.01 . 1 . . . . 100 SER H . 17302 1
833 . 1 1 99 99 SER HA H 1 5.39 0.01 . 1 . . . . 100 SER HA . 17302 1
834 . 1 1 99 99 SER HB2 H 1 3.36 0.01 . 1 . . . . 100 SER HB2 . 17302 1
835 . 1 1 99 99 SER HB3 H 1 3.68 0.01 . 1 . . . . 100 SER HB3 . 17302 1
836 . 1 1 99 99 SER N N 15 121.5 0.1 . 1 . . . . 100 SER N . 17302 1
837 . 1 1 100 100 VAL H H 1 9.00 0.01 . 1 . . . . 101 VAL H . 17302 1
838 . 1 1 100 100 VAL HA H 1 4.93 0.01 . 1 . . . . 101 VAL HA . 17302 1
839 . 1 1 100 100 VAL HB H 1 2.02 0.01 . 1 . . . . 101 VAL HB . 17302 1
840 . 1 1 100 100 VAL HG11 H 1 0.97 0.01 . 1 . . . . 101 VAL MG1 . 17302 1
841 . 1 1 100 100 VAL HG12 H 1 0.97 0.01 . 1 . . . . 101 VAL MG1 . 17302 1
842 . 1 1 100 100 VAL HG13 H 1 0.97 0.01 . 1 . . . . 101 VAL MG1 . 17302 1
843 . 1 1 100 100 VAL HG21 H 1 0.91 0.01 . 1 . . . . 101 VAL MG2 . 17302 1
844 . 1 1 100 100 VAL HG22 H 1 0.91 0.01 . 1 . . . . 101 VAL MG2 . 17302 1
845 . 1 1 100 100 VAL HG23 H 1 0.91 0.01 . 1 . . . . 101 VAL MG2 . 17302 1
846 . 1 1 100 100 VAL N N 15 128.8 0.1 . 1 . . . . 101 VAL N . 17302 1
847 . 1 1 101 101 THR H H 1 9.43 0.01 . 1 . . . . 102 THR H . 17302 1
848 . 1 1 101 101 THR HA H 1 5.18 0.01 . 1 . . . . 102 THR HA . 17302 1
849 . 1 1 101 101 THR HB H 1 3.99 0.01 . 1 . . . . 102 THR HB . 17302 1
850 . 1 1 101 101 THR HG21 H 1 1.15 0.01 . 1 . . . . 102 THR MG . 17302 1
851 . 1 1 101 101 THR HG22 H 1 1.15 0.01 . 1 . . . . 102 THR MG . 17302 1
852 . 1 1 101 101 THR HG23 H 1 1.15 0.01 . 1 . . . . 102 THR MG . 17302 1
853 . 1 1 101 101 THR N N 15 127.6 0.1 . 1 . . . . 102 THR N . 17302 1
854 . 1 1 102 102 GLU H H 1 9.21 0.01 . 1 . . . . 103 GLU H . 17302 1
855 . 1 1 102 102 GLU HA H 1 5.54 0.01 . 1 . . . . 103 GLU HA . 17302 1
856 . 1 1 102 102 GLU HB2 H 1 1.76 0.01 . 1 . . . . 103 GLU HB2 . 17302 1
857 . 1 1 102 102 GLU HB3 H 1 2.02 0.01 . 1 . . . . 103 GLU HB3 . 17302 1
858 . 1 1 102 102 GLU HG2 H 1 2.17 0.01 . 1 . . . . 103 GLU HG2 . 17302 1
859 . 1 1 102 102 GLU HG3 H 1 2.17 0.01 . 1 . . . . 103 GLU HG3 . 17302 1
860 . 1 1 102 102 GLU N N 15 127.9 0.1 . 1 . . . . 103 GLU N . 17302 1
861 . 1 1 103 103 LEU H H 1 8.64 0.01 . 1 . . . . 104 LEU H . 17302 1
862 . 1 1 103 103 LEU HA H 1 4.82 0.01 . 1 . . . . 104 LEU HA . 17302 1
863 . 1 1 103 103 LEU HB2 H 1 1.16 0.01 . 1 . . . . 104 LEU HB2 . 17302 1
864 . 1 1 103 103 LEU HB3 H 1 0.56 0.01 . 1 . . . . 104 LEU HB3 . 17302 1
865 . 1 1 103 103 LEU HG H 1 1.10 0.01 . 1 . . . . 104 LEU HG . 17302 1
866 . 1 1 103 103 LEU HD11 H 1 0.34 0.01 . 1 . . . . 104 LEU MD1 . 17302 1
867 . 1 1 103 103 LEU HD12 H 1 0.34 0.01 . 1 . . . . 104 LEU MD1 . 17302 1
868 . 1 1 103 103 LEU HD13 H 1 0.34 0.01 . 1 . . . . 104 LEU MD1 . 17302 1
869 . 1 1 103 103 LEU HD21 H 1 0.59 0.01 . 1 . . . . 104 LEU MD2 . 17302 1
870 . 1 1 103 103 LEU HD22 H 1 0.59 0.01 . 1 . . . . 104 LEU MD2 . 17302 1
871 . 1 1 103 103 LEU HD23 H 1 0.59 0.01 . 1 . . . . 104 LEU MD2 . 17302 1
872 . 1 1 103 103 LEU N N 15 128.7 0.1 . 1 . . . . 104 LEU N . 17302 1
873 . 1 1 104 104 ASN H H 1 9.05 0.01 . 1 . . . . 105 ASN H . 17302 1
874 . 1 1 104 104 ASN HA H 1 4.88 0.01 . 1 . . . . 105 ASN HA . 17302 1
875 . 1 1 104 104 ASN HB2 H 1 2.78 0.01 . 1 . . . . 105 ASN HB2 . 17302 1
876 . 1 1 104 104 ASN HB3 H 1 2.59 0.01 . 1 . . . . 105 ASN HB3 . 17302 1
877 . 1 1 104 104 ASN HD21 H 1 7.05 0.01 . 1 . . . . 105 ASN HD21 . 17302 1
878 . 1 1 104 104 ASN HD22 H 1 7.58 0.01 . 1 . . . . 105 ASN HD22 . 17302 1
879 . 1 1 104 104 ASN N N 15 126.7 0.1 . 1 . . . . 105 ASN N . 17302 1
880 . 1 1 104 104 ASN ND2 N 15 112.6 0.1 . 1 . . . . 105 ASN ND2 . 17302 1
881 . 1 1 105 105 GLY H H 1 9.00 0.01 . 1 . . . . 106 GLY H . 17302 1
882 . 1 1 105 105 GLY HA2 H 1 3.59 0.01 . 1 . . . . 106 GLY HA2 . 17302 1
883 . 1 1 105 105 GLY HA3 H 1 4.03 0.01 . 1 . . . . 106 GLY HA3 . 17302 1
884 . 1 1 105 105 GLY N N 15 115.4 0.1 . 1 . . . . 106 GLY N . 17302 1
885 . 1 1 106 106 ASP H H 1 8.95 0.01 . 1 . . . . 107 ASP H . 17302 1
886 . 1 1 106 106 ASP HA H 1 4.82 0.01 . 1 . . . . 107 ASP HA . 17302 1
887 . 1 1 106 106 ASP HB2 H 1 2.77 0.01 . 1 . . . . 107 ASP HB2 . 17302 1
888 . 1 1 106 106 ASP HB3 H 1 3.03 0.01 . 1 . . . . 107 ASP HB3 . 17302 1
889 . 1 1 106 106 ASP N N 15 127.8 0.1 . 1 . . . . 107 ASP N . 17302 1
890 . 1 1 107 107 ILE H H 1 7.92 0.01 . 1 . . . . 108 ILE H . 17302 1
891 . 1 1 107 107 ILE HA H 1 5.12 0.01 . 1 . . . . 108 ILE HA . 17302 1
892 . 1 1 107 107 ILE HB H 1 2.12 0.01 . 1 . . . . 108 ILE HB . 17302 1
893 . 1 1 107 107 ILE HG12 H 1 1.59 0.01 . 1 . . . . 108 ILE HG12 . 17302 1
894 . 1 1 107 107 ILE HG13 H 1 1.43 0.01 . 1 . . . . 108 ILE HG13 . 17302 1
895 . 1 1 107 107 ILE HG21 H 1 0.89 0.01 . 1 . . . . 108 ILE MG . 17302 1
896 . 1 1 107 107 ILE HG22 H 1 0.89 0.01 . 1 . . . . 108 ILE MG . 17302 1
897 . 1 1 107 107 ILE HG23 H 1 0.89 0.01 . 1 . . . . 108 ILE MG . 17302 1
898 . 1 1 107 107 ILE HD11 H 1 0.82 0.01 . 1 . . . . 108 ILE MD . 17302 1
899 . 1 1 107 107 ILE HD12 H 1 0.82 0.01 . 1 . . . . 108 ILE MD . 17302 1
900 . 1 1 107 107 ILE HD13 H 1 0.82 0.01 . 1 . . . . 108 ILE MD . 17302 1
901 . 1 1 107 107 ILE N N 15 120.0 0.1 . 1 . . . . 108 ILE N . 17302 1
902 . 1 1 108 108 ILE H H 1 8.86 0.01 . 1 . . . . 109 ILE H . 17302 1
903 . 1 1 108 108 ILE HA H 1 5.15 0.01 . 1 . . . . 109 ILE HA . 17302 1
904 . 1 1 108 108 ILE HB H 1 1.16 0.01 . 1 . . . . 109 ILE HB . 17302 1
905 . 1 1 108 108 ILE HG12 H 1 0.54 0.01 . 1 . . . . 109 ILE HG12 . 17302 1
906 . 1 1 108 108 ILE HG13 H 1 1.00 0.01 . 1 . . . . 109 ILE HG13 . 17302 1
907 . 1 1 108 108 ILE HG21 H 1 0.46 0.01 . 1 . . . . 109 ILE MG . 17302 1
908 . 1 1 108 108 ILE HG22 H 1 0.46 0.01 . 1 . . . . 109 ILE MG . 17302 1
909 . 1 1 108 108 ILE HG23 H 1 0.46 0.01 . 1 . . . . 109 ILE MG . 17302 1
910 . 1 1 108 108 ILE HD11 H 1 0.24 0.01 . 1 . . . . 109 ILE MD . 17302 1
911 . 1 1 108 108 ILE HD12 H 1 0.24 0.01 . 1 . . . . 109 ILE MD . 17302 1
912 . 1 1 108 108 ILE HD13 H 1 0.24 0.01 . 1 . . . . 109 ILE MD . 17302 1
913 . 1 1 108 108 ILE N N 15 126.4 0.1 . 1 . . . . 109 ILE N . 17302 1
914 . 1 1 109 109 THR H H 1 9.04 0.01 . 1 . . . . 110 THR H . 17302 1
915 . 1 1 109 109 THR HA H 1 5.09 0.01 . 1 . . . . 110 THR HA . 17302 1
916 . 1 1 109 109 THR HB H 1 4.00 0.01 . 1 . . . . 110 THR HB . 17302 1
917 . 1 1 109 109 THR HG21 H 1 1.07 0.01 . 1 . . . . 110 THR MG . 17302 1
918 . 1 1 109 109 THR HG22 H 1 1.07 0.01 . 1 . . . . 110 THR MG . 17302 1
919 . 1 1 109 109 THR HG23 H 1 1.07 0.01 . 1 . . . . 110 THR MG . 17302 1
920 . 1 1 109 109 THR N N 15 123.3 0.1 . 1 . . . . 110 THR N . 17302 1
921 . 1 1 110 110 ASN H H 1 9.34 0.01 . 1 . . . . 111 ASN H . 17302 1
922 . 1 1 110 110 ASN HA H 1 5.80 0.01 . 1 . . . . 111 ASN HA . 17302 1
923 . 1 1 110 110 ASN HB2 H 1 2.59 0.01 . 1 . . . . 111 ASN HB2 . 17302 1
924 . 1 1 110 110 ASN HB3 H 1 2.47 0.01 . 1 . . . . 111 ASN HB3 . 17302 1
925 . 1 1 110 110 ASN HD21 H 1 6.24 0.01 . 1 . . . . 111 ASN HD21 . 17302 1
926 . 1 1 110 110 ASN HD22 H 1 7.09 0.01 . 1 . . . . 111 ASN HD22 . 17302 1
927 . 1 1 110 110 ASN N N 15 127.3 0.1 . 1 . . . . 111 ASN N . 17302 1
928 . 1 1 110 110 ASN ND2 N 15 110.2 0.1 . 1 . . . . 111 ASN ND2 . 17302 1
929 . 1 1 111 111 THR H H 1 9.31 0.01 . 1 . . . . 112 THR H . 17302 1
930 . 1 1 111 111 THR HA H 1 4.92 0.01 . 1 . . . . 112 THR HA . 17302 1
931 . 1 1 111 111 THR HB H 1 3.85 0.01 . 1 . . . . 112 THR HB . 17302 1
932 . 1 1 111 111 THR HG21 H 1 0.99 0.01 . 1 . . . . 112 THR MG . 17302 1
933 . 1 1 111 111 THR HG22 H 1 0.99 0.01 . 1 . . . . 112 THR MG . 17302 1
934 . 1 1 111 111 THR HG23 H 1 0.99 0.01 . 1 . . . . 112 THR MG . 17302 1
935 . 1 1 111 111 THR N N 15 122.9 0.1 . 1 . . . . 112 THR N . 17302 1
936 . 1 1 112 112 MET H H 1 9.30 0.01 . 1 . . . . 113 MET H . 17302 1
937 . 1 1 112 112 MET HA H 1 5.52 0.01 . 1 . . . . 113 MET HA . 17302 1
938 . 1 1 112 112 MET HB2 H 1 1.58 0.01 . 1 . . . . 113 MET HB2 . 17302 1
939 . 1 1 112 112 MET HB3 H 1 1.78 0.01 . 1 . . . . 113 MET HB3 . 17302 1
940 . 1 1 112 112 MET HG2 H 1 2.31 0.01 . 1 . . . . 113 MET HG2 . 17302 1
941 . 1 1 112 112 MET HG3 H 1 2.49 0.01 . 1 . . . . 113 MET HG3 . 17302 1
942 . 1 1 112 112 MET HE1 H 1 2.16 0.01 . 9 . . . . 113 MET ME . 17302 1
943 . 1 1 112 112 MET HE2 H 1 2.16 0.01 . 9 . . . . 113 MET ME . 17302 1
944 . 1 1 112 112 MET HE3 H 1 2.16 0.01 . 9 . . . . 113 MET ME . 17302 1
945 . 1 1 112 112 MET N N 15 127.6 0.1 . 1 . . . . 113 MET N . 17302 1
946 . 1 1 113 113 THR H H 1 8.88 0.01 . 1 . . . . 114 THR H . 17302 1
947 . 1 1 113 113 THR HA H 1 5.39 0.01 . 1 . . . . 114 THR HA . 17302 1
948 . 1 1 113 113 THR HB H 1 3.98 0.01 . 1 . . . . 114 THR HB . 17302 1
949 . 1 1 113 113 THR HG21 H 1 1.17 0.01 . 1 . . . . 114 THR MG . 17302 1
950 . 1 1 113 113 THR HG22 H 1 1.17 0.01 . 1 . . . . 114 THR MG . 17302 1
951 . 1 1 113 113 THR HG23 H 1 1.17 0.01 . 1 . . . . 114 THR MG . 17302 1
952 . 1 1 113 113 THR N N 15 118.4 0.1 . 1 . . . . 114 THR N . 17302 1
953 . 1 1 114 114 LEU H H 1 8.89 0.01 . 1 . . . . 115 LEU H . 17302 1
954 . 1 1 114 114 LEU HA H 1 4.74 0.01 . 1 . . . . 115 LEU HA . 17302 1
955 . 1 1 114 114 LEU HB2 H 1 1.74 0.01 . 1 . . . . 115 LEU HB2 . 17302 1
956 . 1 1 114 114 LEU HB3 H 1 1.35 0.01 . 1 . . . . 115 LEU HB3 . 17302 1
957 . 1 1 114 114 LEU HG H 1 1.42 0.01 . 1 . . . . 115 LEU HG . 17302 1
958 . 1 1 114 114 LEU HD11 H 1 0.69 0.01 . 1 . . . . 115 LEU MD1 . 17302 1
959 . 1 1 114 114 LEU HD12 H 1 0.69 0.01 . 1 . . . . 115 LEU MD1 . 17302 1
960 . 1 1 114 114 LEU HD13 H 1 0.69 0.01 . 1 . . . . 115 LEU MD1 . 17302 1
961 . 1 1 114 114 LEU HD21 H 1 0.55 0.01 . 1 . . . . 115 LEU MD2 . 17302 1
962 . 1 1 114 114 LEU HD22 H 1 0.55 0.01 . 1 . . . . 115 LEU MD2 . 17302 1
963 . 1 1 114 114 LEU HD23 H 1 0.55 0.01 . 1 . . . . 115 LEU MD2 . 17302 1
964 . 1 1 114 114 LEU N N 15 130.1 0.1 . 1 . . . . 115 LEU N . 17302 1
965 . 1 1 115 115 GLY H H 1 9.25 0.01 . 1 . . . . 116 GLY H . 17302 1
966 . 1 1 115 115 GLY HA2 H 1 3.63 0.01 . 1 . . . . 116 GLY HA2 . 17302 1
967 . 1 1 115 115 GLY HA3 H 1 3.94 0.01 . 1 . . . . 116 GLY HA3 . 17302 1
968 . 1 1 115 115 GLY N N 15 118.0 0.1 . 1 . . . . 116 GLY N . 17302 1
969 . 1 1 116 116 ASP H H 1 8.69 0.01 . 1 . . . . 117 ASP H . 17302 1
970 . 1 1 116 116 ASP HA H 1 4.62 0.01 . 1 . . . . 117 ASP HA . 17302 1
971 . 1 1 116 116 ASP HB2 H 1 2.70 0.01 . 1 . . . . 117 ASP HB2 . 17302 1
972 . 1 1 116 116 ASP HB3 H 1 2.76 0.01 . 1 . . . . 117 ASP HB3 . 17302 1
973 . 1 1 116 116 ASP N N 15 126.4 0.1 . 1 . . . . 117 ASP N . 17302 1
974 . 1 1 117 117 ILE H H 1 8.43 0.01 . 1 . . . . 118 ILE H . 17302 1
975 . 1 1 117 117 ILE HA H 1 4.03 0.01 . 1 . . . . 118 ILE HA . 17302 1
976 . 1 1 117 117 ILE HB H 1 2.29 0.01 . 1 . . . . 118 ILE HB . 17302 1
977 . 1 1 117 117 ILE HG12 H 1 1.04 0.01 . 1 . . . . 118 ILE HG12 . 17302 1
978 . 1 1 117 117 ILE HG13 H 1 1.73 0.01 . 1 . . . . 118 ILE HG13 . 17302 1
979 . 1 1 117 117 ILE HG21 H 1 0.98 0.01 . 1 . . . . 118 ILE MG . 17302 1
980 . 1 1 117 117 ILE HG22 H 1 0.98 0.01 . 1 . . . . 118 ILE MG . 17302 1
981 . 1 1 117 117 ILE HG23 H 1 0.98 0.01 . 1 . . . . 118 ILE MG . 17302 1
982 . 1 1 117 117 ILE HD11 H 1 0.81 0.01 . 1 . . . . 118 ILE MD . 17302 1
983 . 1 1 117 117 ILE HD12 H 1 0.81 0.01 . 1 . . . . 118 ILE MD . 17302 1
984 . 1 1 117 117 ILE HD13 H 1 0.81 0.01 . 1 . . . . 118 ILE MD . 17302 1
985 . 1 1 117 117 ILE N N 15 122.8 0.1 . 1 . . . . 118 ILE N . 17302 1
986 . 1 1 118 118 VAL H H 1 8.40 0.01 . 1 . . . . 119 VAL H . 17302 1
987 . 1 1 118 118 VAL HA H 1 4.60 0.01 . 1 . . . . 119 VAL HA . 17302 1
988 . 1 1 118 118 VAL HB H 1 2.02 0.01 . 1 . . . . 119 VAL HB . 17302 1
989 . 1 1 118 118 VAL HG11 H 1 0.75 0.01 . 1 . . . . 119 VAL MG1 . 17302 1
990 . 1 1 118 118 VAL HG12 H 1 0.75 0.01 . 1 . . . . 119 VAL MG1 . 17302 1
991 . 1 1 118 118 VAL HG13 H 1 0.75 0.01 . 1 . . . . 119 VAL MG1 . 17302 1
992 . 1 1 118 118 VAL HG21 H 1 0.89 0.01 . 1 . . . . 119 VAL MG2 . 17302 1
993 . 1 1 118 118 VAL HG22 H 1 0.89 0.01 . 1 . . . . 119 VAL MG2 . 17302 1
994 . 1 1 118 118 VAL HG23 H 1 0.89 0.01 . 1 . . . . 119 VAL MG2 . 17302 1
995 . 1 1 118 118 VAL N N 15 127.5 0.1 . 1 . . . . 119 VAL N . 17302 1
996 . 1 1 119 119 PHE H H 1 9.35 0.01 . 1 . . . . 120 PHE H . 17302 1
997 . 1 1 119 119 PHE HA H 1 5.53 0.01 . 1 . . . . 120 PHE HA . 17302 1
998 . 1 1 119 119 PHE HB2 H 1 2.78 0.01 . 1 . . . . 120 PHE HB2 . 17302 1
999 . 1 1 119 119 PHE HB3 H 1 2.43 0.01 . 1 . . . . 120 PHE HB3 . 17302 1
1000 . 1 1 119 119 PHE HD1 H 1 6.82 0.01 . 1 . . . . 120 PHE HD1 . 17302 1
1001 . 1 1 119 119 PHE HD2 H 1 6.82 0.01 . 1 . . . . 120 PHE HD2 . 17302 1
1002 . 1 1 119 119 PHE HE1 H 1 7.10 0.01 . 1 . . . . 120 PHE HE1 . 17302 1
1003 . 1 1 119 119 PHE HE2 H 1 7.10 0.01 . 1 . . . . 120 PHE HE2 . 17302 1
1004 . 1 1 119 119 PHE HZ H 1 7.25 0.01 . 1 . . . . 120 PHE HZ . 17302 1
1005 . 1 1 119 119 PHE N N 15 131.6 0.1 . 1 . . . . 120 PHE N . 17302 1
1006 . 1 1 120 120 LYS H H 1 8.16 0.01 . 1 . . . . 121 LYS H . 17302 1
1007 . 1 1 120 120 LYS HA H 1 5.19 0.01 . 1 . . . . 121 LYS HA . 17302 1
1008 . 1 1 120 120 LYS HB2 H 1 1.60 0.01 . 1 . . . . 121 LYS HB2 . 17302 1
1009 . 1 1 120 120 LYS HB3 H 1 1.60 0.01 . 1 . . . . 121 LYS HB3 . 17302 1
1010 . 1 1 120 120 LYS HG2 H 1 1.47 0.01 . 1 . . . . 121 LYS HG2 . 17302 1
1011 . 1 1 120 120 LYS HG3 H 1 1.17 0.01 . 1 . . . . 121 LYS HG3 . 17302 1
1012 . 1 1 120 120 LYS HD2 H 1 1.56 0.01 . 1 . . . . 121 LYS HD2 . 17302 1
1013 . 1 1 120 120 LYS HD3 H 1 1.56 0.01 . 1 . . . . 121 LYS HD3 . 17302 1
1014 . 1 1 120 120 LYS HE2 H 1 2.78 0.01 . 1 . . . . 121 LYS HE2 . 17302 1
1015 . 1 1 120 120 LYS HE3 H 1 2.78 0.01 . 1 . . . . 121 LYS HE3 . 17302 1
1016 . 1 1 120 120 LYS N N 15 129.6 0.1 . 1 . . . . 121 LYS N . 17302 1
1017 . 1 1 121 121 ARG H H 1 8.76 0.01 . 1 . . . . 122 ARG H . 17302 1
1018 . 1 1 121 121 ARG HA H 1 4.84 0.01 . 1 . . . . 122 ARG HA . 17302 1
1019 . 1 1 121 121 ARG HB2 H 1 1.64 0.01 . 1 . . . . 122 ARG HB2 . 17302 1
1020 . 1 1 121 121 ARG HB3 H 1 1.79 0.01 . 9 . . . . 122 ARG HB3 . 17302 1
1021 . 1 1 121 121 ARG HG2 H 1 1.57 0.01 . 9 . . . . 122 ARG HG2 . 17302 1
1022 . 1 1 121 121 ARG HG3 H 1 1.29 0.01 . 1 . . . . 122 ARG HG3 . 17302 1
1023 . 1 1 121 121 ARG HD2 H 1 3.39 0.01 . 2 . . . . 122 ARG HD2 . 17302 1
1024 . 1 1 121 121 ARG HD3 H 1 3.05 0.01 . 2 . . . . 122 ARG HD3 . 17302 1
1025 . 1 1 121 121 ARG HE H 1 7.50 0.01 . 1 . . . . 122 ARG HE . 17302 1
1026 . 1 1 121 121 ARG N N 15 123.7 0.1 . 1 . . . . 122 ARG N . 17302 1
1027 . 1 1 121 121 ARG NE N 15 81.8 0.1 . 1 . . . . 122 ARG NE . 17302 1
1028 . 1 1 122 122 ILE H H 1 8.82 0.01 . 1 . . . . 123 ILE H . 17302 1
1029 . 1 1 122 122 ILE HA H 1 4.84 0.01 . 1 . . . . 123 ILE HA . 17302 1
1030 . 1 1 122 122 ILE HB H 1 1.88 0.01 . 1 . . . . 123 ILE HB . 17302 1
1031 . 1 1 122 122 ILE HG12 H 1 1.39 0.01 . 9 . . . . 123 ILE HG12 . 17302 1
1032 . 1 1 122 122 ILE HG13 H 1 1.39 0.01 . 9 . . . . 123 ILE HG13 . 17302 1
1033 . 1 1 122 122 ILE HG21 H 1 0.87 0.01 . 1 . . . . 123 ILE MG . 17302 1
1034 . 1 1 122 122 ILE HG22 H 1 0.87 0.01 . 1 . . . . 123 ILE MG . 17302 1
1035 . 1 1 122 122 ILE HG23 H 1 0.87 0.01 . 1 . . . . 123 ILE MG . 17302 1
1036 . 1 1 122 122 ILE HD11 H 1 0.79 0.01 . 9 . . . . 123 ILE MD . 17302 1
1037 . 1 1 122 122 ILE HD12 H 1 0.79 0.01 . 9 . . . . 123 ILE MD . 17302 1
1038 . 1 1 122 122 ILE HD13 H 1 0.79 0.01 . 9 . . . . 123 ILE MD . 17302 1
1039 . 1 1 122 122 ILE N N 15 126.1 0.1 . 1 . . . . 123 ILE N . 17302 1
1040 . 1 1 123 123 SER H H 1 9.36 0.01 . 1 . . . . 124 SER H . 17302 1
1041 . 1 1 123 123 SER HA H 1 5.46 0.01 . 1 . . . . 124 SER HA . 17302 1
1042 . 1 1 123 123 SER HB2 H 1 3.56 0.01 . 1 . . . . 124 SER HB2 . 17302 1
1043 . 1 1 123 123 SER HB3 H 1 3.47 0.01 . 1 . . . . 124 SER HB3 . 17302 1
1044 . 1 1 123 123 SER N N 15 122.8 0.1 . 1 . . . . 124 SER N . 17302 1
1045 . 1 1 124 124 LYS H H 1 8.68 0.01 . 1 . . . . 125 LYS H . 17302 1
1046 . 1 1 124 124 LYS HA H 1 5.53 0.01 . 1 . . . . 125 LYS HA . 17302 1
1047 . 1 1 124 124 LYS HB2 H 1 1.86 0.01 . 1 . . . . 125 LYS HB2 . 17302 1
1048 . 1 1 124 124 LYS HB3 H 1 1.60 0.01 . 1 . . . . 125 LYS HB3 . 17302 1
1049 . 1 1 124 124 LYS HG2 H 1 1.69 0.01 . 2 . . . . 125 LYS HG2 . 17302 1
1050 . 1 1 124 124 LYS HG3 H 1 1.40 0.01 . 2 . . . . 125 LYS HG3 . 17302 1
1051 . 1 1 124 124 LYS HD2 H 1 1.65 0.01 . 1 . . . . 125 LYS HD2 . 17302 1
1052 . 1 1 124 124 LYS HD3 H 1 1.65 0.01 . 1 . . . . 125 LYS HD3 . 17302 1
1053 . 1 1 124 124 LYS HE2 H 1 3.03 0.01 . 1 . . . . 125 LYS HE2 . 17302 1
1054 . 1 1 124 124 LYS HE3 H 1 3.03 0.01 . 1 . . . . 125 LYS HE3 . 17302 1
1055 . 1 1 124 124 LYS N N 15 123.9 0.1 . 1 . . . . 125 LYS N . 17302 1
1056 . 1 1 125 125 ARG H H 1 9.18 0.01 . 1 . . . . 126 ARG H . 17302 1
1057 . 1 1 125 125 ARG HA H 1 4.17 0.01 . 1 . . . . 126 ARG HA . 17302 1
1058 . 1 1 125 125 ARG HB2 H 1 1.65 0.01 . 1 . . . . 126 ARG HB2 . 17302 1
1059 . 1 1 125 125 ARG HB3 H 1 1.65 0.01 . 1 . . . . 126 ARG HB3 . 17302 1
1060 . 1 1 125 125 ARG HG2 H 1 1.17 0.01 . 1 . . . . 126 ARG HG2 . 17302 1
1061 . 1 1 125 125 ARG HG3 H 1 1.17 0.01 . 1 . . . . 126 ARG HG3 . 17302 1
1062 . 1 1 125 125 ARG HD2 H 1 3.22 0.01 . 2 . . . . 126 ARG HD2 . 17302 1
1063 . 1 1 125 125 ARG HD3 H 1 3.08 0.01 . 2 . . . . 126 ARG HD3 . 17302 1
1064 . 1 1 125 125 ARG HE H 1 7.09 0.01 . 1 . . . . 126 ARG HE . 17302 1
1065 . 1 1 125 125 ARG N N 15 129.8 0.1 . 1 . . . . 126 ARG N . 17302 1
1066 . 1 1 125 125 ARG NE N 15 84.7 0.1 . 1 . . . . 126 ARG NE . 17302 1
1067 . 1 1 126 126 ILE H H 1 8.48 0.01 . 1 . . . . 127 ILE H . 17302 1
1068 . 1 1 126 126 ILE HA H 1 4.16 0.01 . 1 . . . . 127 ILE HA . 17302 1
1069 . 1 1 126 126 ILE HB H 1 1.83 0.01 . 1 . . . . 127 ILE HB . 17302 1
1070 . 1 1 126 126 ILE HG12 H 1 1.33 0.01 . 1 . . . . 127 ILE HG12 . 17302 1
1071 . 1 1 126 126 ILE HG13 H 1 1.33 0.01 . 1 . . . . 127 ILE HG13 . 17302 1
1072 . 1 1 126 126 ILE HG21 H 1 0.95 0.01 . 1 . . . . 127 ILE MG . 17302 1
1073 . 1 1 126 126 ILE HG22 H 1 0.95 0.01 . 1 . . . . 127 ILE MG . 17302 1
1074 . 1 1 126 126 ILE HG23 H 1 0.95 0.01 . 1 . . . . 127 ILE MG . 17302 1
1075 . 1 1 126 126 ILE HD11 H 1 0.84 0.01 . 1 . . . . 127 ILE MD . 17302 1
1076 . 1 1 126 126 ILE HD12 H 1 0.84 0.01 . 1 . . . . 127 ILE MD . 17302 1
1077 . 1 1 126 126 ILE HD13 H 1 0.84 0.01 . 1 . . . . 127 ILE MD . 17302 1
1078 . 1 1 126 126 ILE N N 15 130.4 0.1 . 1 . . . . 127 ILE N . 17302 1
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