data_17066
#######################
# Entry information #
#######################
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 17066
_Entry.Title
;
SOLUTION NMR STRUCTURE OF THE N-TERMINAL PAS DOMAIN OF HERG POTASSIUM CHANNEL
;
_Entry.Type macromolecule
_Entry.Version_type original
_Entry.Submission_date 2010-07-19
_Entry.Accession_date 2010-07-19
_Entry.Last_release_date 2011-05-23
_Entry.Original_release_date 2011-05-23
_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 Jamie Vandenberg . I. . 17066
2 Chai Ng . A. . 17066
3 Mark Hunter . . . 17066
4 Mehdi Mobli . . . 17066
5 Glenn King . F. . 17066
6 Philip Kuchel . W. . 17066
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
. 'not applicable' 'not applicable' . 17066
stop_
loop_
_Struct_keywords.Keywords
_Struct_keywords.Text
_Struct_keywords.Entry_ID
hERG . 17066
NMR . 17066
'PAS Domain' . 17066
'Voltage-gated Potassium Channel' . 17066
stop_
loop_
_Data_set.Type
_Data_set.Count
_Data_set.Entry_ID
assigned_chemical_shifts 1 17066
stop_
loop_
_Datum.Type
_Datum.Count
_Datum.Entry_ID
'13C chemical shifts' 531 17066
'15N chemical shifts' 146 17066
'1H chemical shifts' 887 17066
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 . . 2011-05-23 2010-07-19 original author . 17066
stop_
loop_
_Related_entries.Database_name
_Related_entries.Database_accession_code
_Related_entries.Relationship
_Related_entries.Entry_ID
PDB 2L0W 'BMRB Entry Tracking System' 17066
stop_
save_
###############
# Citations #
###############
save_citations
_Citation.Sf_category citations
_Citation.Sf_framecode citations
_Citation.Entry_ID 17066
_Citation.ID 1
_Citation.Class 'entry citation'
_Citation.CAS_abstract_code .
_Citation.MEDLINE_UI_code .
_Citation.DOI .
_Citation.PubMed_ID 21249148
_Citation.Full_citation .
_Citation.Title 'The N-terminal tail of hERG contains an amphipathic -helix that regulates channel deactivation.'
_Citation.Status published
_Citation.Type journal
_Citation.Journal_abbrev 'PLoS ONE'
_Citation.Journal_name_full 'PloS one'
_Citation.Journal_volume 6
_Citation.Journal_issue 1
_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 .
_Citation.Page_last .
_Citation.Year 2011
_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 'Chai Ann' Ng . . . 17066 1
2 Mark Hunter . J. . 17066 1
3 Matthew Perry . D. . 17066 1
4 Mehdi Mobli . . . 17066 1
5 Ying Ke . . . 17066 1
6 Philip Kuchel . W. . 17066 1
7 Glenn King . F. . 17066 1
8 Daniela Stock . . . 17066 1
9 Jamie Vandenberg . I. . 17066 1
stop_
save_
#############################################
# Molecular system (assembly) description #
#############################################
save_assembly
_Assembly.Sf_category assembly
_Assembly.Sf_framecode assembly
_Assembly.Entry_ID 17066
_Assembly.ID 1
_Assembly.Name 'N-Terminal PAS Domain of HERG K Channel'
_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 H_member_2 1 $H_member_2 A . yes native no no . . . 17066 1
stop_
save_
####################################
# Biological polymers and ligands #
####################################
save_H_member_2
_Entity.Sf_category entity
_Entity.Sf_framecode H_member_2
_Entity.Entry_ID 17066
_Entity.ID 1
_Entity.BMRB_code .
_Entity.Name Potassium_voltage-gated_channel_subfamily_H_member_2
_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
;
SMPVRRGHVAPQNTFLDTII
RKFEGQSRKFIIANARVENC
AVIYCNDGFCELCGYSRAEV
MQRPCTCDFLHGPRTQRRAA
AQIAQALLGAEERKVEIAFY
RKDGSCFLCLVDVVPVKNED
GAVIMFILNFEVVMEK
;
_Entity.Target_identifier .
_Entity.Polymer_author_defined_seq .
_Entity.Polymer_author_seq_details 'Residue 1 is from TEV cleavage site. This polypeptide is the N-terminal PAS domain of hERG Potassium channel.'
_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 136
_Entity.Number_of_nonpolymer_components .
_Entity.Paramagnetic no
_Entity.Thiol_state 'all free'
_Entity.Src_method man
_Entity.Parent_entity_ID .
_Entity.Fragment 'N-TERMINAL DOMAIN RESIDUES 1-135'
_Entity.Mutation .
_Entity.EC_number .
_Entity.Calc_isoelectric_point .
_Entity.Formula_weight 45860.719
_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 16928 . hERG_NTD . . . . . 99.26 136 100.00 100.00 2.96e-93 . . . . 17066 1
2 no BMRB 16946 . hERG1-135 . . . . . 99.26 150 100.00 100.00 1.30e-93 . . . . 17066 1
3 no PDB 1BYW . "Structure Of The N-Terminal Domain Of The Human-Erg Potassium Channel" . . . . . 80.88 110 99.09 99.09 1.54e-71 . . . . 17066 1
4 no PDB 2L0W . "Solution Nmr Structure Of The N-Terminal Pas Domain Of Herg Potassium Channel" . . . . . 100.00 138 100.00 100.00 5.87e-94 . . . . 17066 1
5 no PDB 2L1M . "Solution Structure Of The Eag Domain Of The Herg (Kv11.1) K+ Channel" . . . . . 99.26 150 100.00 100.00 1.30e-93 . . . . 17066 1
6 no PDB 2L4R . "Nmr Solution Structure Of The N-Terminal Pas Domain Of Herg" . . . . . 99.26 135 100.00 100.00 2.25e-93 . . . . 17066 1
7 no PDB 4HP9 . "Crystal Structure Of The N-terminal Truncated Pas Domain From The Herg Potassium Channel" . . . . . 93.38 128 99.21 100.00 2.96e-86 . . . . 17066 1
8 no PDB 4HQA . "Crystal Structure Of Pas Domain From The Human Erg (herg) Potassium Channel" . . . . . 100.00 137 100.00 100.00 4.37e-94 . . . . 17066 1
9 no DBJ BAA37096 . "HERG [Homo sapiens]" . . . . . 99.26 1159 100.00 100.00 4.54e-91 . . . . 17066 1
10 no DBJ BAB19682 . "HERG-USO [Homo sapiens]" . . . . . 99.26 888 100.00 100.00 2.38e-92 . . . . 17066 1
11 no EMBL CAA09232 . "ether-a-go-go-related protein [Homo sapiens]" . . . . . 80.15 1133 100.00 100.00 7.50e-71 . . . . 17066 1
12 no EMBL CAB09536 . "r-ERG [Rattus norvegicus]" . . . . . 99.26 1163 100.00 100.00 4.65e-91 . . . . 17066 1
13 no EMBL CAB64868 . "potassium channel [Canis lupus familiaris]" . . . . . 99.26 1158 100.00 100.00 4.52e-91 . . . . 17066 1
14 no GB AAA62473 . "putative potassium channel subunit [Homo sapiens]" . . . . . 99.26 1159 100.00 100.00 4.54e-91 . . . . 17066 1
15 no GB AAC53418 . "ether-a-go-go-related protein isoform Merg1a [Mus musculus]" . . . . . 99.26 1162 100.00 100.00 4.62e-91 . . . . 17066 1
16 no GB AAC53420 . "Merg1a [Mus musculus]" . . . . . 99.26 1162 100.00 100.00 4.62e-91 . . . . 17066 1
17 no GB AAC53422 . "Merg1a' [Mus musculus]" . . . . . 55.88 1103 100.00 100.00 1.85e-44 . . . . 17066 1
18 no GB AAC99425 . "potassium channel protein ERG long isoform [Oryctolagus cuniculus]" . . . . . 89.71 122 100.00 100.00 1.54e-83 . . . . 17066 1
19 no REF NP_000229 . "potassium voltage-gated channel subfamily H member 2 isoform a [Homo sapiens]" . . . . . 99.26 1159 100.00 100.00 4.54e-91 . . . . 17066 1
20 no REF NP_001003145 . "potassium voltage-gated channel subfamily H member 2 [Canis lupus familiaris]" . . . . . 99.26 1158 100.00 100.00 4.52e-91 . . . . 17066 1
21 no REF NP_001092571 . "potassium voltage-gated channel subfamily H member 2 [Bos taurus]" . . . . . 99.26 849 100.00 100.00 6.33e-92 . . . . 17066 1
22 no REF NP_001166444 . "potassium voltage-gated channel subfamily H member 2 [Cavia porcellus]" . . . . . 99.26 1158 100.00 100.00 4.52e-91 . . . . 17066 1
23 no REF NP_001180587 . "potassium voltage-gated channel subfamily H member 2 [Equus caballus]" . . . . . 99.26 1158 99.26 100.00 1.20e-90 . . . . 17066 1
24 no SP O08962 . "RecName: Full=Potassium voltage-gated channel subfamily H member 2; AltName: Full=Ether-a-go-go-related gene potassium channel " . . . . . 99.26 1163 100.00 100.00 4.65e-91 . . . . 17066 1
25 no SP O35219 . "RecName: Full=Potassium voltage-gated channel subfamily H member 2; AltName: Full=Ether-a-go-go-related gene potassium channel " . . . . . 99.26 1162 100.00 100.00 4.62e-91 . . . . 17066 1
26 no SP Q12809 . "RecName: Full=Potassium voltage-gated channel subfamily H member 2; AltName: Full=Eag homolog; AltName: Full=Ether-a-go-go-rela" . . . . . 99.26 1159 100.00 100.00 4.54e-91 . . . . 17066 1
27 no SP Q8WNY2 . "RecName: Full=Potassium voltage-gated channel subfamily H member 2; AltName: Full=Ether-a-go-go-related gene potassium channel " . . . . . 99.26 1161 100.00 100.00 4.60e-91 . . . . 17066 1
28 no SP Q9TSZ3 . "RecName: Full=Potassium voltage-gated channel subfamily H member 2; AltName: Full=Ether-a-go-go-related gene potassium channel " . . . . . 99.26 1158 100.00 100.00 4.52e-91 . . . . 17066 1
29 no TPG DAA30311 . "TPA: voltage-gated potassium channel, subfamily H, member 2 [Bos taurus]" . . . . . 99.26 783 100.00 100.00 2.32e-92 . . . . 17066 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 0 SER . 17066 1
2 1 MET . 17066 1
3 2 PRO . 17066 1
4 3 VAL . 17066 1
5 4 ARG . 17066 1
6 5 ARG . 17066 1
7 6 GLY . 17066 1
8 7 HIS . 17066 1
9 8 VAL . 17066 1
10 9 ALA . 17066 1
11 10 PRO . 17066 1
12 11 GLN . 17066 1
13 12 ASN . 17066 1
14 13 THR . 17066 1
15 14 PHE . 17066 1
16 15 LEU . 17066 1
17 16 ASP . 17066 1
18 17 THR . 17066 1
19 18 ILE . 17066 1
20 19 ILE . 17066 1
21 20 ARG . 17066 1
22 21 LYS . 17066 1
23 22 PHE . 17066 1
24 23 GLU . 17066 1
25 24 GLY . 17066 1
26 25 GLN . 17066 1
27 26 SER . 17066 1
28 27 ARG . 17066 1
29 28 LYS . 17066 1
30 29 PHE . 17066 1
31 30 ILE . 17066 1
32 31 ILE . 17066 1
33 32 ALA . 17066 1
34 33 ASN . 17066 1
35 34 ALA . 17066 1
36 35 ARG . 17066 1
37 36 VAL . 17066 1
38 37 GLU . 17066 1
39 38 ASN . 17066 1
40 39 CYS . 17066 1
41 40 ALA . 17066 1
42 41 VAL . 17066 1
43 42 ILE . 17066 1
44 43 TYR . 17066 1
45 44 CYS . 17066 1
46 45 ASN . 17066 1
47 46 ASP . 17066 1
48 47 GLY . 17066 1
49 48 PHE . 17066 1
50 49 CYS . 17066 1
51 50 GLU . 17066 1
52 51 LEU . 17066 1
53 52 CYS . 17066 1
54 53 GLY . 17066 1
55 54 TYR . 17066 1
56 55 SER . 17066 1
57 56 ARG . 17066 1
58 57 ALA . 17066 1
59 58 GLU . 17066 1
60 59 VAL . 17066 1
61 60 MET . 17066 1
62 61 GLN . 17066 1
63 62 ARG . 17066 1
64 63 PRO . 17066 1
65 64 CYS . 17066 1
66 65 THR . 17066 1
67 66 CYS . 17066 1
68 67 ASP . 17066 1
69 68 PHE . 17066 1
70 69 LEU . 17066 1
71 70 HIS . 17066 1
72 71 GLY . 17066 1
73 72 PRO . 17066 1
74 73 ARG . 17066 1
75 74 THR . 17066 1
76 75 GLN . 17066 1
77 76 ARG . 17066 1
78 77 ARG . 17066 1
79 78 ALA . 17066 1
80 79 ALA . 17066 1
81 80 ALA . 17066 1
82 81 GLN . 17066 1
83 82 ILE . 17066 1
84 83 ALA . 17066 1
85 84 GLN . 17066 1
86 85 ALA . 17066 1
87 86 LEU . 17066 1
88 87 LEU . 17066 1
89 88 GLY . 17066 1
90 89 ALA . 17066 1
91 90 GLU . 17066 1
92 91 GLU . 17066 1
93 92 ARG . 17066 1
94 93 LYS . 17066 1
95 94 VAL . 17066 1
96 95 GLU . 17066 1
97 96 ILE . 17066 1
98 97 ALA . 17066 1
99 98 PHE . 17066 1
100 99 TYR . 17066 1
101 100 ARG . 17066 1
102 101 LYS . 17066 1
103 102 ASP . 17066 1
104 103 GLY . 17066 1
105 104 SER . 17066 1
106 105 CYS . 17066 1
107 106 PHE . 17066 1
108 107 LEU . 17066 1
109 108 CYS . 17066 1
110 109 LEU . 17066 1
111 110 VAL . 17066 1
112 111 ASP . 17066 1
113 112 VAL . 17066 1
114 113 VAL . 17066 1
115 114 PRO . 17066 1
116 115 VAL . 17066 1
117 116 LYS . 17066 1
118 117 ASN . 17066 1
119 118 GLU . 17066 1
120 119 ASP . 17066 1
121 120 GLY . 17066 1
122 121 ALA . 17066 1
123 122 VAL . 17066 1
124 123 ILE . 17066 1
125 124 MET . 17066 1
126 125 PHE . 17066 1
127 126 ILE . 17066 1
128 127 LEU . 17066 1
129 128 ASN . 17066 1
130 129 PHE . 17066 1
131 130 GLU . 17066 1
132 131 VAL . 17066 1
133 132 VAL . 17066 1
134 133 MET . 17066 1
135 134 GLU . 17066 1
136 135 LYS . 17066 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 17066 1
. MET 2 2 17066 1
. PRO 3 3 17066 1
. VAL 4 4 17066 1
. ARG 5 5 17066 1
. ARG 6 6 17066 1
. GLY 7 7 17066 1
. HIS 8 8 17066 1
. VAL 9 9 17066 1
. ALA 10 10 17066 1
. PRO 11 11 17066 1
. GLN 12 12 17066 1
. ASN 13 13 17066 1
. THR 14 14 17066 1
. PHE 15 15 17066 1
. LEU 16 16 17066 1
. ASP 17 17 17066 1
. THR 18 18 17066 1
. ILE 19 19 17066 1
. ILE 20 20 17066 1
. ARG 21 21 17066 1
. LYS 22 22 17066 1
. PHE 23 23 17066 1
. GLU 24 24 17066 1
. GLY 25 25 17066 1
. GLN 26 26 17066 1
. SER 27 27 17066 1
. ARG 28 28 17066 1
. LYS 29 29 17066 1
. PHE 30 30 17066 1
. ILE 31 31 17066 1
. ILE 32 32 17066 1
. ALA 33 33 17066 1
. ASN 34 34 17066 1
. ALA 35 35 17066 1
. ARG 36 36 17066 1
. VAL 37 37 17066 1
. GLU 38 38 17066 1
. ASN 39 39 17066 1
. CYS 40 40 17066 1
. ALA 41 41 17066 1
. VAL 42 42 17066 1
. ILE 43 43 17066 1
. TYR 44 44 17066 1
. CYS 45 45 17066 1
. ASN 46 46 17066 1
. ASP 47 47 17066 1
. GLY 48 48 17066 1
. PHE 49 49 17066 1
. CYS 50 50 17066 1
. GLU 51 51 17066 1
. LEU 52 52 17066 1
. CYS 53 53 17066 1
. GLY 54 54 17066 1
. TYR 55 55 17066 1
. SER 56 56 17066 1
. ARG 57 57 17066 1
. ALA 58 58 17066 1
. GLU 59 59 17066 1
. VAL 60 60 17066 1
. MET 61 61 17066 1
. GLN 62 62 17066 1
. ARG 63 63 17066 1
. PRO 64 64 17066 1
. CYS 65 65 17066 1
. THR 66 66 17066 1
. CYS 67 67 17066 1
. ASP 68 68 17066 1
. PHE 69 69 17066 1
. LEU 70 70 17066 1
. HIS 71 71 17066 1
. GLY 72 72 17066 1
. PRO 73 73 17066 1
. ARG 74 74 17066 1
. THR 75 75 17066 1
. GLN 76 76 17066 1
. ARG 77 77 17066 1
. ARG 78 78 17066 1
. ALA 79 79 17066 1
. ALA 80 80 17066 1
. ALA 81 81 17066 1
. GLN 82 82 17066 1
. ILE 83 83 17066 1
. ALA 84 84 17066 1
. GLN 85 85 17066 1
. ALA 86 86 17066 1
. LEU 87 87 17066 1
. LEU 88 88 17066 1
. GLY 89 89 17066 1
. ALA 90 90 17066 1
. GLU 91 91 17066 1
. GLU 92 92 17066 1
. ARG 93 93 17066 1
. LYS 94 94 17066 1
. VAL 95 95 17066 1
. GLU 96 96 17066 1
. ILE 97 97 17066 1
. ALA 98 98 17066 1
. PHE 99 99 17066 1
. TYR 100 100 17066 1
. ARG 101 101 17066 1
. LYS 102 102 17066 1
. ASP 103 103 17066 1
. GLY 104 104 17066 1
. SER 105 105 17066 1
. CYS 106 106 17066 1
. PHE 107 107 17066 1
. LEU 108 108 17066 1
. CYS 109 109 17066 1
. LEU 110 110 17066 1
. VAL 111 111 17066 1
. ASP 112 112 17066 1
. VAL 113 113 17066 1
. VAL 114 114 17066 1
. PRO 115 115 17066 1
. VAL 116 116 17066 1
. LYS 117 117 17066 1
. ASN 118 118 17066 1
. GLU 119 119 17066 1
. ASP 120 120 17066 1
. GLY 121 121 17066 1
. ALA 122 122 17066 1
. VAL 123 123 17066 1
. ILE 124 124 17066 1
. MET 125 125 17066 1
. PHE 126 126 17066 1
. ILE 127 127 17066 1
. LEU 128 128 17066 1
. ASN 129 129 17066 1
. PHE 130 130 17066 1
. GLU 131 131 17066 1
. VAL 132 132 17066 1
. VAL 133 133 17066 1
. MET 134 134 17066 1
. GLU 135 135 17066 1
. LYS 136 136 17066 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 17066
_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 $H_member_2 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . 'Potassium voltage-gated channel, subfamily H (eag-related), member 2' . 'hERG_N-terminal PAS Domain Human 9606 Eukaryota Metazoa Homo sapiens' . . 17066 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 17066
_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 $H_member_2 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21 DE3 . . . . . . . . . . . . . . PGEXT2T . . . 'TEV cleavage site' . . 17066 1
stop_
save_
#####################################
# Sample contents and methodology #
#####################################
########################
# Sample description #
########################
save_sample
_Sample.Sf_category sample
_Sample.Sf_framecode sample
_Sample.Entry_ID 17066
_Sample.ID 1
_Sample.Type solution
_Sample.Sub_type .
_Sample.Details 'N15 labeled protein, 10mM HEPES, 3mM TCEP, 5mM OCTYL GLUCOSIDE'
_Sample.Aggregate_sample_number .
_Sample.Solvent_system '93% H2O/7% 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 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 17066 1
2 HEPES 'natural abundance' . . . . . . 10 . . mM . . . . 17066 1
3 TCEP 'natural abundance' . . . . . . 3 . . mM . . . . 17066 1
4 D2O '[U-100% 2H]' . . . . . . 7 . . % . . . . 17066 1
5 'Octyl Glucoside' 'natural abundance' . . . . . . 5 . . mM . . . . 17066 1
6 H2O 'natural abundance' . . . . . . 93 . . % . . . . 17066 1
7 'N15 labeled PAS' '[U-99% 15N]' . . 1 $H_member_2 . . 99 . . % . . . . 17066 1
stop_
save_
save_sample_1
_Sample.Sf_category sample
_Sample.Sf_framecode sample_1
_Sample.Entry_ID 17066
_Sample.ID 2
_Sample.Type solution
_Sample.Sub_type .
_Sample.Details 'N15 and C13 labeled protein, 10mM HEPES, 3mM TCEP, 5mM OCTYL GLUCOSIDE'
_Sample.Aggregate_sample_number .
_Sample.Solvent_system '100% D2O'
_Sample.Preparation_date .
_Sample.Preparation_expiration_date .
_Sample.Polycrystallization_protocol .
_Sample.Single_crystal_protocol .
_Sample.Crystal_grow_apparatus .
_Sample.Crystal_grow_atmosphere .
_Sample.Crystal_grow_details .
_Sample.Crystal_grow_method .
_Sample.Crystal_grow_method_cit_ID .
_Sample.Crystal_grow_pH .
_Sample.Crystal_grow_pH_range .
_Sample.Crystal_grow_pressure .
_Sample.Crystal_grow_pressure_esd .
_Sample.Crystal_grow_seeding .
_Sample.Crystal_grow_seeding_cit_ID .
_Sample.Crystal_grow_temp .
_Sample.Crystal_grow_temp_details .
_Sample.Crystal_grow_temp_esd .
_Sample.Crystal_grow_time .
_Sample.Oriented_sample_prep_protocol .
_Sample.Lyophilization_cryo_protectant .
_Sample.Storage_protocol .
loop_
_Sample_component.ID
_Sample_component.Mol_common_name
_Sample_component.Isotopic_labeling
_Sample_component.Assembly_ID
_Sample_component.Assembly_label
_Sample_component.Entity_ID
_Sample_component.Entity_label
_Sample_component.Product_ID
_Sample_component.Type
_Sample_component.Concentration_val
_Sample_component.Concentration_val_min
_Sample_component.Concentration_val_max
_Sample_component.Concentration_val_units
_Sample_component.Concentration_val_err
_Sample_component.Vendor
_Sample_component.Vendor_product_name
_Sample_component.Vendor_product_code
_Sample_component.Entry_ID
_Sample_component.Sample_ID
1 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 17066 2
2 HEPES 'natural abundance' . . . . . . 10 . . mM . . . . 17066 2
3 TCEP 'natural abundance' . . . . . . 3 . . mM . . . . 17066 2
4 D2O '[U-100% 2H]' . . . . . . 100 . . % . . . . 17066 2
5 'Octyl Glucoside' 'natural abundance' . . . . . . 5 . . mM . . . . 17066 2
6 'N15/C13 labeled PAS' '[U-99% 13C; U-99% 15N]' . . 1 $H_member_2 . . 99 . . % . . . . 17066 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 17066
_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 17066 1
pH 6.9 . pH 17066 1
pressure 1 . atm 17066 1
temperature 298 . K 17066 1
stop_
save_
############################
# Computer software used #
############################
save_CYANA
_Software.Sf_category software
_Software.Sf_framecode CYANA
_Software.Entry_ID 17066
_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' . . 17066 1
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
'geometry optimization' 17066 1
refinement 17066 1
stop_
save_
save_AMBER
_Software.Sf_category software
_Software.Sf_framecode AMBER
_Software.Entry_ID 17066
_Software.ID 2
_Software.Name AMBER
_Software.Version 10
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Case, Darden, Cheatham, III, Simmerling, Wang, Duke, Luo, ... and Kollm' . . 17066 2
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
refinement 17066 2
stop_
save_
save_XEASY
_Software.Sf_category software
_Software.Sf_framecode XEASY
_Software.Entry_ID 17066
_Software.ID 3
_Software.Name XEASY
_Software.Version .
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Bartels et al.' . . 17066 3
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
'chemical shift assignment' 17066 3
'data analysis' 17066 3
'peak picking' 17066 3
stop_
save_
save_TALOS
_Software.Sf_category software
_Software.Sf_framecode TALOS
_Software.Entry_ID 17066
_Software.ID 4
_Software.Name TALOS
_Software.Version .
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Cornilescu, Delaglio and Bax' . . 17066 4
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
'Dihedral angles calculation' 17066 4
stop_
save_
save_TOPSPIN
_Software.Sf_category software
_Software.Sf_framecode TOPSPIN
_Software.Entry_ID 17066
_Software.ID 5
_Software.Name TOPSPIN
_Software.Version 2
_Software.Details .
loop_
_Vendor.Name
_Vendor.Address
_Vendor.Electronic_address
_Vendor.Entry_ID
_Vendor.Software_ID
'Bruker Biospin' . . 17066 5
stop_
loop_
_Task.Task
_Task.Entry_ID
_Task.Software_ID
collection 17066 5
processing 17066 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 17066
_NMR_spectrometer.ID 1
_NMR_spectrometer.Details .
_NMR_spectrometer.Manufacturer BRUKER
_NMR_spectrometer.Model 'Avance II'
_NMR_spectrometer.Serial_number .
_NMR_spectrometer.Field_strength 900
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 17066
_NMR_spectrometer_list.ID 1
loop_
_NMR_spectrometer_view.ID
_NMR_spectrometer_view.Name
_NMR_spectrometer_view.Manufacturer
_NMR_spectrometer_view.Model
_NMR_spectrometer_view.Serial_number
_NMR_spectrometer_view.Field_strength
_NMR_spectrometer_view.Details
_NMR_spectrometer_view.Citation_ID
_NMR_spectrometer_view.Citation_label
_NMR_spectrometer_view.Entry_ID
_NMR_spectrometer_view.NMR_spectrometer_list_ID
1 spectrometer_1 BRUKER 'Avance II' . 900 . . . 17066 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 17066
_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 '3D 1H-13C NOESY' no . . . . . . . . . . 2 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17066 1
2 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17066 1
3 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17066 1
4 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17066 1
5 '3D HNCACB' no . . . . . . . . . . 1 $sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17066 1
6 '3D C(CO)NH' no . . . . . . . . . . 1 $sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17066 1
7 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17066 1
8 '3D HNCO' no . . . . . . . . . . 1 $sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17066 1
9 '3D HNCA' no . . . . . . . . . . 1 $sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17066 1
10 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17066 1
11 '3D HNCA' no . . . . . . . . . . 1 $sample isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17066 1
12 '3D HCCH-TOCSY' no . . . . . . . . . . 2 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17066 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 17066
_Chem_shift_reference.ID 1
_Chem_shift_reference.Details .
loop_
_Chem_shift_ref.Atom_type
_Chem_shift_ref.Atom_isotope_number
_Chem_shift_ref.Mol_common_name
_Chem_shift_ref.Atom_group
_Chem_shift_ref.Concentration_val
_Chem_shift_ref.Concentration_units
_Chem_shift_ref.Solvent
_Chem_shift_ref.Rank
_Chem_shift_ref.Chem_shift_units
_Chem_shift_ref.Chem_shift_val
_Chem_shift_ref.Ref_method
_Chem_shift_ref.Ref_type
_Chem_shift_ref.Indirect_shift_ratio
_Chem_shift_ref.External_ref_loc
_Chem_shift_ref.External_ref_sample_geometry
_Chem_shift_ref.External_ref_axis
_Chem_shift_ref.Indirect_shift_ratio_cit_ID
_Chem_shift_ref.Indirect_shift_ratio_cit_label
_Chem_shift_ref.Ref_correction_type
_Chem_shift_ref.Correction_val
_Chem_shift_ref.Correction_val_cit_ID
_Chem_shift_ref.Correction_val_cit_label
_Chem_shift_ref.Entry_ID
_Chem_shift_ref.Chem_shift_reference_ID
C 13 water protons . . . . ppm . internal indirect 0.251449530 . . . . . . . . . 17066 1
H 1 water protons . . . . ppm 4.6 na direct 1.0 . . . . . . . . . 17066 1
N 13 water protons . . . . ppm . internal indirect 0.101329118 . . . . . . . . . 17066 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 17066
_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
3 '2D 1H-15N HSQC' . . . 17066 1
4 '3D CBCA(CO)NH' . . . 17066 1
5 '3D HNCACB' . . . 17066 1
6 '3D C(CO)NH' . . . 17066 1
7 '3D H(CCO)NH' . . . 17066 1
8 '3D HNCO' . . . 17066 1
10 '3D HN(CO)CA' . . . 17066 1
12 '3D HCCH-TOCSY' . . . 17066 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
3 $XEASY . . 17066 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 3 3 PRO HA H 1 4.401 0.020 . 1 . . . . 2 PRO HA . 17066 1
2 . 1 1 3 3 PRO HB2 H 1 1.801 0.020 . 2 . . . . 2 PRO HB2 . 17066 1
3 . 1 1 3 3 PRO HB3 H 1 1.801 0.020 . 2 . . . . 2 PRO HB3 . 17066 1
4 . 1 1 3 3 PRO HG2 H 1 1.971 0.020 . 2 . . . . 2 PRO HG2 . 17066 1
5 . 1 1 3 3 PRO HG3 H 1 1.971 0.020 . 2 . . . . 2 PRO HG3 . 17066 1
6 . 1 1 3 3 PRO C C 13 175.980 0.400 . 1 . . . . 2 PRO C . 17066 1
7 . 1 1 3 3 PRO CA C 13 62.919 0.400 . 1 . . . . 2 PRO CA . 17066 1
8 . 1 1 3 3 PRO CB C 13 32.039 0.400 . 1 . . . . 2 PRO CB . 17066 1
9 . 1 1 3 3 PRO CG C 13 27.390 0.400 . 1 . . . . 2 PRO CG . 17066 1
10 . 1 1 4 4 VAL H H 1 8.408 0.020 . 1 . . . . 3 VAL H . 17066 1
11 . 1 1 4 4 VAL HA H 1 3.983 0.020 . 1 . . . . 3 VAL HA . 17066 1
12 . 1 1 4 4 VAL HB H 1 1.965 0.020 . 1 . . . . 3 VAL HB . 17066 1
13 . 1 1 4 4 VAL HG11 H 1 0.910 0.020 . 2 . . . . 3 VAL HG1 . 17066 1
14 . 1 1 4 4 VAL HG12 H 1 0.910 0.020 . 2 . . . . 3 VAL HG1 . 17066 1
15 . 1 1 4 4 VAL HG13 H 1 0.910 0.020 . 2 . . . . 3 VAL HG1 . 17066 1
16 . 1 1 4 4 VAL HG21 H 1 0.910 0.020 . 2 . . . . 3 VAL HG2 . 17066 1
17 . 1 1 4 4 VAL HG22 H 1 0.910 0.020 . 2 . . . . 3 VAL HG2 . 17066 1
18 . 1 1 4 4 VAL HG23 H 1 0.910 0.020 . 2 . . . . 3 VAL HG2 . 17066 1
19 . 1 1 4 4 VAL C C 13 176.257 0.400 . 1 . . . . 3 VAL C . 17066 1
20 . 1 1 4 4 VAL CA C 13 62.362 0.400 . 1 . . . . 3 VAL CA . 17066 1
21 . 1 1 4 4 VAL CB C 13 32.703 0.400 . 1 . . . . 3 VAL CB . 17066 1
22 . 1 1 4 4 VAL CG1 C 13 21.082 0.400 . 1 . . . . 3 VAL CG1 . 17066 1
23 . 1 1 4 4 VAL N N 15 120.554 0.400 . 1 . . . . 3 VAL N . 17066 1
24 . 1 1 5 5 ARG H H 1 8.401 0.020 . 1 . . . . 4 ARG H . 17066 1
25 . 1 1 5 5 ARG HA H 1 4.310 0.020 . 1 . . . . 4 ARG HA . 17066 1
26 . 1 1 5 5 ARG C C 13 175.881 0.400 . 1 . . . . 4 ARG C . 17066 1
27 . 1 1 5 5 ARG CA C 13 55.691 0.400 . 1 . . . . 4 ARG CA . 17066 1
28 . 1 1 5 5 ARG N N 15 125.551 0.400 . 1 . . . . 4 ARG N . 17066 1
29 . 1 1 6 6 ARG H H 1 8.421 0.020 . 1 . . . . 5 ARG H . 17066 1
30 . 1 1 6 6 ARG HA H 1 4.302 0.020 . 1 . . . . 5 ARG HA . 17066 1
31 . 1 1 6 6 ARG C C 13 176.612 0.400 . 1 . . . . 5 ARG C . 17066 1
32 . 1 1 6 6 ARG CA C 13 55.946 0.400 . 1 . . . . 5 ARG CA . 17066 1
33 . 1 1 6 6 ARG N N 15 123.281 0.400 . 1 . . . . 5 ARG N . 17066 1
34 . 1 1 7 7 GLY H H 1 8.435 0.020 . 1 . . . . 6 GLY H . 17066 1
35 . 1 1 7 7 GLY HA2 H 1 3.867 0.020 . 2 . . . . 6 GLY HA2 . 17066 1
36 . 1 1 7 7 GLY HA3 H 1 3.867 0.020 . 2 . . . . 6 GLY HA3 . 17066 1
37 . 1 1 7 7 GLY C C 13 179.931 0.400 . 1 . . . . 6 GLY C . 17066 1
38 . 1 1 7 7 GLY CA C 13 44.988 0.400 . 1 . . . . 6 GLY CA . 17066 1
39 . 1 1 7 7 GLY N N 15 110.049 0.400 . 1 . . . . 6 GLY N . 17066 1
40 . 1 1 8 8 HIS H H 1 8.317 0.020 . 1 . . . . 7 HIS H . 17066 1
41 . 1 1 8 8 HIS HA H 1 4.650 0.020 . 1 . . . . 7 HIS HA . 17066 1
42 . 1 1 8 8 HIS HB2 H 1 3.002 0.020 . 2 . . . . 7 HIS HB2 . 17066 1
43 . 1 1 8 8 HIS HB3 H 1 3.036 0.020 . 2 . . . . 7 HIS HB3 . 17066 1
44 . 1 1 8 8 HIS C C 13 175.051 0.400 . 1 . . . . 7 HIS C . 17066 1
45 . 1 1 8 8 HIS CA C 13 56.278 0.400 . 1 . . . . 7 HIS CA . 17066 1
46 . 1 1 8 8 HIS CB C 13 31.043 0.400 . 1 . . . . 7 HIS CB . 17066 1
47 . 1 1 8 8 HIS N N 15 119.124 0.400 . 1 . . . . 7 HIS N . 17066 1
48 . 1 1 9 9 VAL H H 1 8.144 0.020 . 1 . . . . 8 VAL H . 17066 1
49 . 1 1 9 9 VAL HA H 1 4.041 0.020 . 1 . . . . 8 VAL HA . 17066 1
50 . 1 1 9 9 VAL HB H 1 1.944 0.020 . 1 . . . . 8 VAL HB . 17066 1
51 . 1 1 9 9 VAL HG11 H 1 0.840 0.020 . 2 . . . . 8 VAL HG1 . 17066 1
52 . 1 1 9 9 VAL HG12 H 1 0.840 0.020 . 2 . . . . 8 VAL HG1 . 17066 1
53 . 1 1 9 9 VAL HG13 H 1 0.840 0.020 . 2 . . . . 8 VAL HG1 . 17066 1
54 . 1 1 9 9 VAL C C 13 174.538 0.400 . 1 . . . . 8 VAL C . 17066 1
55 . 1 1 9 9 VAL CA C 13 61.965 0.400 . 1 . . . . 8 VAL CA . 17066 1
56 . 1 1 9 9 VAL CB C 13 33.035 0.400 . 1 . . . . 8 VAL CB . 17066 1
57 . 1 1 9 9 VAL CG1 C 13 20.750 0.400 . 1 . . . . 8 VAL CG1 . 17066 1
58 . 1 1 9 9 VAL N N 15 121.093 0.400 . 1 . . . . 8 VAL N . 17066 1
59 . 1 1 10 10 ALA H H 1 8.188 0.020 . 1 . . . . 9 ALA H . 17066 1
60 . 1 1 10 10 ALA HA H 1 4.526 0.020 . 1 . . . . 9 ALA HA . 17066 1
61 . 1 1 10 10 ALA HB1 H 1 1.321 0.020 . 1 . . . . 9 ALA HB . 17066 1
62 . 1 1 10 10 ALA HB2 H 1 1.321 0.020 . 1 . . . . 9 ALA HB . 17066 1
63 . 1 1 10 10 ALA HB3 H 1 1.321 0.020 . 1 . . . . 9 ALA HB . 17066 1
64 . 1 1 10 10 ALA C C 13 175.500 0.400 . 1 . . . . 9 ALA C . 17066 1
65 . 1 1 10 10 ALA CA C 13 50.301 0.400 . 1 . . . . 9 ALA CA . 17066 1
66 . 1 1 10 10 ALA CB C 13 18.093 0.400 . 1 . . . . 9 ALA CB . 17066 1
67 . 1 1 10 10 ALA N N 15 126.984 0.400 . 1 . . . . 9 ALA N . 17066 1
68 . 1 1 11 11 PRO HA H 1 4.367 0.020 . 1 . . . . 10 PRO HA . 17066 1
69 . 1 1 11 11 PRO HB2 H 1 1.873 0.020 . 2 . . . . 10 PRO HB2 . 17066 1
70 . 1 1 11 11 PRO HB3 H 1 2.255 0.020 . 2 . . . . 10 PRO HB3 . 17066 1
71 . 1 1 11 11 PRO HD2 H 1 3.636 0.020 . 2 . . . . 10 PRO HD2 . 17066 1
72 . 1 1 11 11 PRO HD3 H 1 3.790 0.020 . 2 . . . . 10 PRO HD3 . 17066 1
73 . 1 1 11 11 PRO HG2 H 1 1.971 0.020 . 2 . . . . 10 PRO HG2 . 17066 1
74 . 1 1 11 11 PRO HG3 H 1 2.005 0.020 . 2 . . . . 10 PRO HG3 . 17066 1
75 . 1 1 11 11 PRO C C 13 176.928 0.400 . 1 . . . . 10 PRO C . 17066 1
76 . 1 1 11 11 PRO CA C 13 62.919 0.400 . 1 . . . . 10 PRO CA . 17066 1
77 . 1 1 11 11 PRO CB C 13 32.039 0.400 . 1 . . . . 10 PRO CB . 17066 1
78 . 1 1 11 11 PRO CD C 13 50.301 0.400 . 1 . . . . 10 PRO CD . 17066 1
79 . 1 1 11 11 PRO CG C 13 27.390 0.400 . 1 . . . . 10 PRO CG . 17066 1
80 . 1 1 12 12 GLN H H 1 8.536 0.020 . 1 . . . . 11 GLN H . 17066 1
81 . 1 1 12 12 GLN HA H 1 4.230 0.020 . 1 . . . . 11 GLN HA . 17066 1
82 . 1 1 12 12 GLN HB2 H 1 1.948 0.020 . 2 . . . . 11 GLN HB2 . 17066 1
83 . 1 1 12 12 GLN HB3 H 1 2.050 0.020 . 2 . . . . 11 GLN HB3 . 17066 1
84 . 1 1 12 12 GLN HE21 H 1 6.819 0.020 . 2 . . . . 11 GLN HE21 . 17066 1
85 . 1 1 12 12 GLN HE22 H 1 7.567 0.020 . 2 . . . . 11 GLN HE22 . 17066 1
86 . 1 1 12 12 GLN HG2 H 1 2.337 0.020 . 2 . . . . 11 GLN HG2 . 17066 1
87 . 1 1 12 12 GLN HG3 H 1 2.337 0.020 . 2 . . . . 11 GLN HG3 . 17066 1
88 . 1 1 12 12 GLN C C 13 176.000 0.400 . 1 . . . . 11 GLN C . 17066 1
89 . 1 1 12 12 GLN CA C 13 56.293 0.400 . 1 . . . . 11 GLN CA . 17066 1
90 . 1 1 12 12 GLN CB C 13 29.367 0.400 . 1 . . . . 11 GLN CB . 17066 1
91 . 1 1 12 12 GLN CG C 13 33.778 0.400 . 1 . . . . 11 GLN CG . 17066 1
92 . 1 1 12 12 GLN N N 15 120.332 0.400 . 1 . . . . 11 GLN N . 17066 1
93 . 1 1 12 12 GLN NE2 N 15 112.560 0.400 . 1 . . . . 11 GLN NE2 . 17066 1
94 . 1 1 13 13 ASN H H 1 8.547 0.020 . 1 . . . . 12 ASN H . 17066 1
95 . 1 1 13 13 ASN HA H 1 4.708 0.020 . 1 . . . . 12 ASN HA . 17066 1
96 . 1 1 13 13 ASN HB2 H 1 2.735 0.020 . 2 . . . . 12 ASN HB2 . 17066 1
97 . 1 1 13 13 ASN HB3 H 1 2.854 0.020 . 2 . . . . 12 ASN HB3 . 17066 1
98 . 1 1 13 13 ASN HD21 H 1 6.850 0.020 . 2 . . . . 12 ASN HD21 . 17066 1
99 . 1 1 13 13 ASN HD22 H 1 7.690 0.020 . 2 . . . . 12 ASN HD22 . 17066 1
100 . 1 1 13 13 ASN C C 13 175.565 0.400 . 1 . . . . 12 ASN C . 17066 1
101 . 1 1 13 13 ASN CA C 13 53.622 0.400 . 1 . . . . 12 ASN CA . 17066 1
102 . 1 1 13 13 ASN CB C 13 38.670 0.400 . 1 . . . . 12 ASN CB . 17066 1
103 . 1 1 13 13 ASN N N 15 120.163 0.400 . 1 . . . . 12 ASN N . 17066 1
104 . 1 1 13 13 ASN ND2 N 15 112.779 0.400 . 1 . . . . 12 ASN ND2 . 17066 1
105 . 1 1 14 14 THR H H 1 8.289 0.020 . 1 . . . . 13 THR H . 17066 1
106 . 1 1 14 14 THR HA H 1 4.192 0.020 . 1 . . . . 13 THR HA . 17066 1
107 . 1 1 14 14 THR HB H 1 4.274 0.020 . 1 . . . . 13 THR HB . 17066 1
108 . 1 1 14 14 THR HG21 H 1 1.186 0.020 . 1 . . . . 13 THR HG2 . 17066 1
109 . 1 1 14 14 THR HG22 H 1 1.186 0.020 . 1 . . . . 13 THR HG2 . 17066 1
110 . 1 1 14 14 THR HG23 H 1 1.186 0.020 . 1 . . . . 13 THR HG2 . 17066 1
111 . 1 1 14 14 THR C C 13 175.842 0.400 . 1 . . . . 13 THR C . 17066 1
112 . 1 1 14 14 THR CA C 13 63.734 0.400 . 1 . . . . 13 THR CA . 17066 1
113 . 1 1 14 14 THR CB C 13 69.559 0.400 . 1 . . . . 13 THR CB . 17066 1
114 . 1 1 14 14 THR CG2 C 13 21.746 0.400 . 1 . . . . 13 THR CG2 . 17066 1
115 . 1 1 14 14 THR N N 15 114.748 0.400 . 1 . . . . 13 THR N . 17066 1
116 . 1 1 15 15 PHE H H 1 8.355 0.020 . 1 . . . . 14 PHE H . 17066 1
117 . 1 1 15 15 PHE HA H 1 4.300 0.020 . 1 . . . . 14 PHE HA . 17066 1
118 . 1 1 15 15 PHE HB2 H 1 3.181 0.020 . 2 . . . . 14 PHE HB2 . 17066 1
119 . 1 1 15 15 PHE HB3 H 1 2.983 0.020 . 2 . . . . 14 PHE HB3 . 17066 1
120 . 1 1 15 15 PHE HD2 H 1 7.153 0.020 . 1 . . . . 14 PHE HD2 . 17066 1
121 . 1 1 15 15 PHE C C 13 177.560 0.400 . 1 . . . . 14 PHE C . 17066 1
122 . 1 1 15 15 PHE CA C 13 60.594 0.400 . 1 . . . . 14 PHE CA . 17066 1
123 . 1 1 15 15 PHE CB C 13 38.941 0.400 . 1 . . . . 14 PHE CB . 17066 1
124 . 1 1 15 15 PHE N N 15 123.175 0.400 . 1 . . . . 14 PHE N . 17066 1
125 . 1 1 16 16 LEU H H 1 8.095 0.020 . 1 . . . . 15 LEU H . 17066 1
126 . 1 1 16 16 LEU HA H 1 3.742 0.020 . 1 . . . . 15 LEU HA . 17066 1
127 . 1 1 16 16 LEU HB2 H 1 1.410 0.020 . 2 . . . . 15 LEU HB2 . 17066 1
128 . 1 1 16 16 LEU HB3 H 1 1.701 0.020 . 2 . . . . 15 LEU HB3 . 17066 1
129 . 1 1 16 16 LEU HD11 H 1 0.836 0.020 . 2 . . . . 15 LEU HD1 . 17066 1
130 . 1 1 16 16 LEU HD12 H 1 0.836 0.020 . 2 . . . . 15 LEU HD1 . 17066 1
131 . 1 1 16 16 LEU HD13 H 1 0.836 0.020 . 2 . . . . 15 LEU HD1 . 17066 1
132 . 1 1 16 16 LEU HD21 H 1 0.806 0.020 . 2 . . . . 15 LEU HD2 . 17066 1
133 . 1 1 16 16 LEU HD22 H 1 0.806 0.020 . 2 . . . . 15 LEU HD2 . 17066 1
134 . 1 1 16 16 LEU HD23 H 1 0.806 0.020 . 2 . . . . 15 LEU HD2 . 17066 1
135 . 1 1 16 16 LEU HG H 1 1.473 0.020 . 1 . . . . 15 LEU HG . 17066 1
136 . 1 1 16 16 LEU C C 13 177.501 0.400 . 1 . . . . 15 LEU C . 17066 1
137 . 1 1 16 16 LEU CA C 13 58.009 0.400 . 1 . . . . 15 LEU CA . 17066 1
138 . 1 1 16 16 LEU CB C 13 41.567 0.400 . 1 . . . . 15 LEU CB . 17066 1
139 . 1 1 16 16 LEU CD1 C 13 25.730 0.400 . 1 . . . . 15 LEU CD1 . 17066 1
140 . 1 1 16 16 LEU CD2 C 13 24.070 0.400 . 1 . . . . 15 LEU CD2 . 17066 1
141 . 1 1 16 16 LEU CG C 13 26.726 0.400 . 1 . . . . 15 LEU CG . 17066 1
142 . 1 1 16 16 LEU N N 15 119.894 0.400 . 1 . . . . 15 LEU N . 17066 1
143 . 1 1 17 17 ASP H H 1 7.849 0.020 . 1 . . . . 16 ASP H . 17066 1
144 . 1 1 17 17 ASP HA H 1 4.165 0.020 . 1 . . . . 16 ASP HA . 17066 1
145 . 1 1 17 17 ASP HB2 H 1 2.532 0.020 . 2 . . . . 16 ASP HB2 . 17066 1
146 . 1 1 17 17 ASP HB3 H 1 2.675 0.020 . 2 . . . . 16 ASP HB3 . 17066 1
147 . 1 1 17 17 ASP C C 13 178.370 0.400 . 1 . . . . 16 ASP C . 17066 1
148 . 1 1 17 17 ASP CA C 13 57.886 0.400 . 1 . . . . 16 ASP CA . 17066 1
149 . 1 1 17 17 ASP CB C 13 40.929 0.400 . 1 . . . . 16 ASP CB . 17066 1
150 . 1 1 17 17 ASP N N 15 116.831 0.400 . 1 . . . . 16 ASP N . 17066 1
151 . 1 1 18 18 THR H H 1 7.750 0.020 . 1 . . . . 17 THR H . 17066 1
152 . 1 1 18 18 THR HA H 1 3.766 0.020 . 1 . . . . 17 THR HA . 17066 1
153 . 1 1 18 18 THR HB H 1 4.180 0.020 . 1 . . . . 17 THR HB . 17066 1
154 . 1 1 18 18 THR HG21 H 1 1.134 0.020 . 1 . . . . 17 THR HG2 . 17066 1
155 . 1 1 18 18 THR HG22 H 1 1.134 0.020 . 1 . . . . 17 THR HG2 . 17066 1
156 . 1 1 18 18 THR HG23 H 1 1.134 0.020 . 1 . . . . 17 THR HG2 . 17066 1
157 . 1 1 18 18 THR C C 13 176.158 0.400 . 1 . . . . 17 THR C . 17066 1
158 . 1 1 18 18 THR CA C 13 66.135 0.400 . 1 . . . . 17 THR CA . 17066 1
159 . 1 1 18 18 THR CB C 13 68.563 0.400 . 1 . . . . 17 THR CB . 17066 1
160 . 1 1 18 18 THR CG2 C 13 21.599 0.400 . 1 . . . . 17 THR CG2 . 17066 1
161 . 1 1 18 18 THR N N 15 113.987 0.400 . 1 . . . . 17 THR N . 17066 1
162 . 1 1 19 19 ILE H H 1 7.482 0.020 . 1 . . . . 18 ILE H . 17066 1
163 . 1 1 19 19 ILE HA H 1 3.578 0.020 . 1 . . . . 18 ILE HA . 17066 1
164 . 1 1 19 19 ILE HB H 1 1.845 0.020 . 1 . . . . 18 ILE HB . 17066 1
165 . 1 1 19 19 ILE HD11 H 1 0.549 0.020 . 1 . . . . 18 ILE HD1 . 17066 1
166 . 1 1 19 19 ILE HD12 H 1 0.549 0.020 . 1 . . . . 18 ILE HD1 . 17066 1
167 . 1 1 19 19 ILE HD13 H 1 0.549 0.020 . 1 . . . . 18 ILE HD1 . 17066 1
168 . 1 1 19 19 ILE HG12 H 1 0.987 0.020 . 2 . . . . 18 ILE HG12 . 17066 1
169 . 1 1 19 19 ILE HG13 H 1 1.207 0.020 . 2 . . . . 18 ILE HG13 . 17066 1
170 . 1 1 19 19 ILE HG21 H 1 0.693 0.020 . 1 . . . . 18 ILE HG2 . 17066 1
171 . 1 1 19 19 ILE HG22 H 1 0.693 0.020 . 1 . . . . 18 ILE HG2 . 17066 1
172 . 1 1 19 19 ILE HG23 H 1 0.693 0.020 . 1 . . . . 18 ILE HG2 . 17066 1
173 . 1 1 19 19 ILE C C 13 177.481 0.400 . 1 . . . . 18 ILE C . 17066 1
174 . 1 1 19 19 ILE CA C 13 63.632 0.400 . 1 . . . . 18 ILE CA . 17066 1
175 . 1 1 19 19 ILE CB C 13 36.932 0.400 . 1 . . . . 18 ILE CB . 17066 1
176 . 1 1 19 19 ILE CD1 C 13 11.784 0.400 . 1 . . . . 18 ILE CD1 . 17066 1
177 . 1 1 19 19 ILE CG1 C 13 27.722 0.400 . 1 . . . . 18 ILE CG1 . 17066 1
178 . 1 1 19 19 ILE CG2 C 13 18.181 0.400 . 1 . . . . 18 ILE CG2 . 17066 1
179 . 1 1 19 19 ILE N N 15 122.844 0.400 . 1 . . . . 18 ILE N . 17066 1
180 . 1 1 20 20 ILE H H 1 8.199 0.020 . 1 . . . . 19 ILE H . 17066 1
181 . 1 1 20 20 ILE HA H 1 3.364 0.020 . 1 . . . . 19 ILE HA . 17066 1
182 . 1 1 20 20 ILE HB H 1 1.620 0.020 . 1 . . . . 19 ILE HB . 17066 1
183 . 1 1 20 20 ILE HD11 H 1 0.172 0.020 . 1 . . . . 19 ILE HD1 . 17066 1
184 . 1 1 20 20 ILE HD12 H 1 0.172 0.020 . 1 . . . . 19 ILE HD1 . 17066 1
185 . 1 1 20 20 ILE HD13 H 1 0.172 0.020 . 1 . . . . 19 ILE HD1 . 17066 1
186 . 1 1 20 20 ILE HG12 H 1 0.074 0.020 . 2 . . . . 19 ILE HG12 . 17066 1
187 . 1 1 20 20 ILE HG13 H 1 1.365 0.020 . 2 . . . . 19 ILE HG13 . 17066 1
188 . 1 1 20 20 ILE HG21 H 1 0.765 0.020 . 1 . . . . 19 ILE HG2 . 17066 1
189 . 1 1 20 20 ILE HG22 H 1 0.765 0.020 . 1 . . . . 19 ILE HG2 . 17066 1
190 . 1 1 20 20 ILE HG23 H 1 0.765 0.020 . 1 . . . . 19 ILE HG2 . 17066 1
191 . 1 1 20 20 ILE C C 13 178.062 0.400 . 1 . . . . 19 ILE C . 17066 1
192 . 1 1 20 20 ILE CA C 13 66.575 0.400 . 1 . . . . 19 ILE CA . 17066 1
193 . 1 1 20 20 ILE CB C 13 38.352 0.400 . 1 . . . . 19 ILE CB . 17066 1
194 . 1 1 20 20 ILE CD1 C 13 14.109 0.400 . 1 . . . . 19 ILE CD1 . 17066 1
195 . 1 1 20 20 ILE CG1 C 13 30.379 0.400 . 1 . . . . 19 ILE CG1 . 17066 1
196 . 1 1 20 20 ILE CG2 C 13 17.761 0.400 . 1 . . . . 19 ILE CG2 . 17066 1
197 . 1 1 20 20 ILE N N 15 120.134 0.400 . 1 . . . . 19 ILE N . 17066 1
198 . 1 1 21 21 ARG H H 1 7.769 0.020 . 1 . . . . 20 ARG H . 17066 1
199 . 1 1 21 21 ARG HA H 1 3.979 0.020 . 1 . . . . 20 ARG HA . 17066 1
200 . 1 1 21 21 ARG HB2 H 1 1.794 0.020 . 2 . . . . 20 ARG HB2 . 17066 1
201 . 1 1 21 21 ARG HB3 H 1 1.794 0.020 . 2 . . . . 20 ARG HB3 . 17066 1
202 . 1 1 21 21 ARG HD2 H 1 3.100 0.020 . 2 . . . . 20 ARG HD2 . 17066 1
203 . 1 1 21 21 ARG HD3 H 1 3.158 0.020 . 2 . . . . 20 ARG HD3 . 17066 1
204 . 1 1 21 21 ARG HG2 H 1 1.618 0.020 . 2 . . . . 20 ARG HG2 . 17066 1
205 . 1 1 21 21 ARG HG3 H 1 1.735 0.020 . 2 . . . . 20 ARG HG3 . 17066 1
206 . 1 1 21 21 ARG C C 13 179.022 0.400 . 1 . . . . 20 ARG C . 17066 1
207 . 1 1 21 21 ARG CA C 13 59.045 0.400 . 1 . . . . 20 ARG CA . 17066 1
208 . 1 1 21 21 ARG CB C 13 30.121 0.400 . 1 . . . . 20 ARG CB . 17066 1
209 . 1 1 21 21 ARG CD C 13 43.328 0.400 . 1 . . . . 20 ARG CD . 17066 1
210 . 1 1 21 21 ARG CG C 13 27.722 0.400 . 1 . . . . 20 ARG CG . 17066 1
211 . 1 1 21 21 ARG N N 15 115.869 0.400 . 1 . . . . 20 ARG N . 17066 1
212 . 1 1 21 21 ARG NE N 15 113.217 0.400 . 1 . . . . 20 ARG NE . 17066 1
213 . 1 1 22 22 LYS H H 1 7.601 0.020 . 1 . . . . 21 LYS H . 17066 1
214 . 1 1 22 22 LYS HA H 1 3.910 0.020 . 1 . . . . 21 LYS HA . 17066 1
215 . 1 1 22 22 LYS HB2 H 1 1.650 0.020 . 2 . . . . 21 LYS HB2 . 17066 1
216 . 1 1 22 22 LYS HB3 H 1 1.716 0.020 . 2 . . . . 21 LYS HB3 . 17066 1
217 . 1 1 22 22 LYS HD2 H 1 1.386 0.020 . 2 . . . . 21 LYS HD2 . 17066 1
218 . 1 1 22 22 LYS HD3 H 1 1.439 0.020 . 2 . . . . 21 LYS HD3 . 17066 1
219 . 1 1 22 22 LYS HE2 H 1 2.686 0.020 . 2 . . . . 21 LYS HE2 . 17066 1
220 . 1 1 22 22 LYS HE3 H 1 2.686 0.020 . 2 . . . . 21 LYS HE3 . 17066 1
221 . 1 1 22 22 LYS HG2 H 1 0.837 0.020 . 2 . . . . 21 LYS HG2 . 17066 1
222 . 1 1 22 22 LYS HG3 H 1 1.206 0.020 . 2 . . . . 21 LYS HG3 . 17066 1
223 . 1 1 22 22 LYS C C 13 177.936 0.400 . 1 . . . . 21 LYS C . 17066 1
224 . 1 1 22 22 LYS CA C 13 58.643 0.400 . 1 . . . . 21 LYS CA . 17066 1
225 . 1 1 22 22 LYS CB C 13 32.384 0.400 . 1 . . . . 21 LYS CB . 17066 1
226 . 1 1 22 22 LYS CD C 13 29.051 0.400 . 1 . . . . 21 LYS CD . 17066 1
227 . 1 1 22 22 LYS CE C 13 41.668 0.400 . 1 . . . . 21 LYS CE . 17066 1
228 . 1 1 22 22 LYS CG C 13 24.661 0.400 . 1 . . . . 21 LYS CG . 17066 1
229 . 1 1 22 22 LYS N N 15 118.580 0.400 . 1 . . . . 21 LYS N . 17066 1
230 . 1 1 23 23 PHE H H 1 7.703 0.020 . 1 . . . . 22 PHE H . 17066 1
231 . 1 1 23 23 PHE HA H 1 4.096 0.020 . 1 . . . . 22 PHE HA . 17066 1
232 . 1 1 23 23 PHE HB2 H 1 2.165 0.020 . 2 . . . . 22 PHE HB2 . 17066 1
233 . 1 1 23 23 PHE HB3 H 1 2.165 0.020 . 2 . . . . 22 PHE HB3 . 17066 1
234 . 1 1 23 23 PHE HD2 H 1 6.787 0.020 . 1 . . . . 22 PHE HD2 . 17066 1
235 . 1 1 23 23 PHE C C 13 176.750 0.400 . 1 . . . . 22 PHE C . 17066 1
236 . 1 1 23 23 PHE CA C 13 59.598 0.400 . 1 . . . . 22 PHE CA . 17066 1
237 . 1 1 23 23 PHE CB C 13 38.836 0.400 . 1 . . . . 22 PHE CB . 17066 1
238 . 1 1 23 23 PHE N N 15 116.849 0.400 . 1 . . . . 22 PHE N . 17066 1
239 . 1 1 24 24 GLU H H 1 8.253 0.020 . 1 . . . . 23 GLU H . 17066 1
240 . 1 1 24 24 GLU HA H 1 4.542 0.020 . 1 . . . . 23 GLU HA . 17066 1
241 . 1 1 24 24 GLU HB2 H 1 2.150 0.020 . 2 . . . . 23 GLU HB2 . 17066 1
242 . 1 1 24 24 GLU HB3 H 1 2.289 0.020 . 2 . . . . 23 GLU HB3 . 17066 1
243 . 1 1 24 24 GLU HG2 H 1 2.423 0.020 . 2 . . . . 23 GLU HG2 . 17066 1
244 . 1 1 24 24 GLU HG3 H 1 2.595 0.020 . 2 . . . . 23 GLU HG3 . 17066 1
245 . 1 1 24 24 GLU C C 13 178.370 0.400 . 1 . . . . 23 GLU C . 17066 1
246 . 1 1 24 24 GLU CA C 13 58.270 0.400 . 1 . . . . 23 GLU CA . 17066 1
247 . 1 1 24 24 GLU CB C 13 30.047 0.400 . 1 . . . . 23 GLU CB . 17066 1
248 . 1 1 24 24 GLU CG C 13 36.023 0.400 . 1 . . . . 23 GLU CG . 17066 1
249 . 1 1 24 24 GLU N N 15 120.875 0.400 . 1 . . . . 23 GLU N . 17066 1
250 . 1 1 25 25 GLY H H 1 8.429 0.020 . 1 . . . . 24 GLY H . 17066 1
251 . 1 1 25 25 GLY HA2 H 1 4.119 0.020 . 2 . . . . 24 GLY HA2 . 17066 1
252 . 1 1 25 25 GLY HA3 H 1 3.976 0.020 . 2 . . . . 24 GLY HA3 . 17066 1
253 . 1 1 25 25 GLY C C 13 174.439 0.400 . 1 . . . . 24 GLY C . 17066 1
254 . 1 1 25 25 GLY CA C 13 45.609 0.400 . 1 . . . . 24 GLY CA . 17066 1
255 . 1 1 25 25 GLY N N 15 109.497 0.400 . 1 . . . . 24 GLY N . 17066 1
256 . 1 1 26 26 GLN H H 1 7.988 0.020 . 1 . . . . 25 GLN H . 17066 1
257 . 1 1 26 26 GLN HA H 1 4.337 0.020 . 1 . . . . 25 GLN HA . 17066 1
258 . 1 1 26 26 GLN HB2 H 1 1.912 0.020 . 2 . . . . 25 GLN HB2 . 17066 1
259 . 1 1 26 26 GLN HB3 H 1 2.251 0.020 . 2 . . . . 25 GLN HB3 . 17066 1
260 . 1 1 26 26 GLN HE21 H 1 6.708 0.020 . 2 . . . . 25 GLN HE21 . 17066 1
261 . 1 1 26 26 GLN HE22 H 1 7.341 0.020 . 2 . . . . 25 GLN HE22 . 17066 1
262 . 1 1 26 26 GLN HG2 H 1 2.306 0.020 . 2 . . . . 25 GLN HG2 . 17066 1
263 . 1 1 26 26 GLN HG3 H 1 2.349 0.020 . 2 . . . . 25 GLN HG3 . 17066 1
264 . 1 1 26 26 GLN C C 13 175.782 0.400 . 1 . . . . 25 GLN C . 17066 1
265 . 1 1 26 26 GLN CA C 13 56.256 0.400 . 1 . . . . 25 GLN CA . 17066 1
266 . 1 1 26 26 GLN CB C 13 29.156 0.400 . 1 . . . . 25 GLN CB . 17066 1
267 . 1 1 26 26 GLN CG C 13 33.803 0.400 . 1 . . . . 25 GLN CG . 17066 1
268 . 1 1 26 26 GLN N N 15 118.030 0.400 . 1 . . . . 25 GLN N . 17066 1
269 . 1 1 26 26 GLN NE2 N 15 111.466 0.400 . 1 . . . . 25 GLN NE2 . 17066 1
270 . 1 1 27 27 SER H H 1 8.662 0.020 . 1 . . . . 26 SER H . 17066 1
271 . 1 1 27 27 SER HA H 1 4.369 0.020 . 1 . . . . 26 SER HA . 17066 1
272 . 1 1 27 27 SER HB2 H 1 4.022 0.020 . 2 . . . . 26 SER HB2 . 17066 1
273 . 1 1 27 27 SER HB3 H 1 4.062 0.020 . 2 . . . . 26 SER HB3 . 17066 1
274 . 1 1 27 27 SER C C 13 174.557 0.400 . 1 . . . . 26 SER C . 17066 1
275 . 1 1 27 27 SER CA C 13 58.602 0.400 . 1 . . . . 26 SER CA . 17066 1
276 . 1 1 27 27 SER CB C 13 61.923 0.400 . 1 . . . . 26 SER CB . 17066 1
277 . 1 1 27 27 SER N N 15 113.873 0.400 . 1 . . . . 26 SER N . 17066 1
278 . 1 1 28 28 ARG H H 1 7.891 0.020 . 1 . . . . 27 ARG H . 17066 1
279 . 1 1 28 28 ARG HA H 1 4.571 0.020 . 1 . . . . 27 ARG HA . 17066 1
280 . 1 1 28 28 ARG HB2 H 1 2.024 0.020 . 2 . . . . 27 ARG HB2 . 17066 1
281 . 1 1 28 28 ARG HB3 H 1 2.130 0.020 . 2 . . . . 27 ARG HB3 . 17066 1
282 . 1 1 28 28 ARG HD2 H 1 2.949 0.020 . 2 . . . . 27 ARG HD2 . 17066 1
283 . 1 1 28 28 ARG HD3 H 1 3.018 0.020 . 2 . . . . 27 ARG HD3 . 17066 1
284 . 1 1 28 28 ARG HG2 H 1 1.640 0.020 . 2 . . . . 27 ARG HG2 . 17066 1
285 . 1 1 28 28 ARG HG3 H 1 1.703 0.020 . 2 . . . . 27 ARG HG3 . 17066 1
286 . 1 1 28 28 ARG C C 13 177.106 0.400 . 1 . . . . 27 ARG C . 17066 1
287 . 1 1 28 28 ARG CA C 13 55.614 0.400 . 1 . . . . 27 ARG CA . 17066 1
288 . 1 1 28 28 ARG CB C 13 31.781 0.400 . 1 . . . . 27 ARG CB . 17066 1
289 . 1 1 28 28 ARG CD C 13 42.664 0.400 . 1 . . . . 27 ARG CD . 17066 1
290 . 1 1 28 28 ARG CG C 13 27.795 0.400 . 1 . . . . 27 ARG CG . 17066 1
291 . 1 1 28 28 ARG N N 15 118.797 0.400 . 1 . . . . 27 ARG N . 17066 1
292 . 1 1 28 28 ARG NE N 15 112.560 0.400 . 1 . . . . 27 ARG NE . 17066 1
293 . 1 1 29 29 LYS H H 1 9.440 0.020 . 1 . . . . 28 LYS H . 17066 1
294 . 1 1 29 29 LYS HA H 1 5.123 0.020 . 1 . . . . 28 LYS HA . 17066 1
295 . 1 1 29 29 LYS HB2 H 1 2.761 0.020 . 2 . . . . 28 LYS HB2 . 17066 1
296 . 1 1 29 29 LYS HB3 H 1 1.505 0.020 . 2 . . . . 28 LYS HB3 . 17066 1
297 . 1 1 29 29 LYS HD2 H 1 1.793 0.020 . 2 . . . . 28 LYS HD2 . 17066 1
298 . 1 1 29 29 LYS HD3 H 1 1.885 0.020 . 2 . . . . 28 LYS HD3 . 17066 1
299 . 1 1 29 29 LYS HE2 H 1 2.966 0.020 . 2 . . . . 28 LYS HE2 . 17066 1
300 . 1 1 29 29 LYS HE3 H 1 3.154 0.020 . 2 . . . . 28 LYS HE3 . 17066 1
301 . 1 1 29 29 LYS HG2 H 1 1.311 0.020 . 2 . . . . 28 LYS HG2 . 17066 1
302 . 1 1 29 29 LYS HG3 H 1 1.412 0.020 . 2 . . . . 28 LYS HG3 . 17066 1
303 . 1 1 29 29 LYS C C 13 173.550 0.400 . 1 . . . . 28 LYS C . 17066 1
304 . 1 1 29 29 LYS CA C 13 56.278 0.400 . 1 . . . . 28 LYS CA . 17066 1
305 . 1 1 29 29 LYS CB C 13 32.703 0.400 . 1 . . . . 28 LYS CB . 17066 1
306 . 1 1 29 29 LYS CD C 13 30.379 0.400 . 1 . . . . 28 LYS CD . 17066 1
307 . 1 1 29 29 LYS CE C 13 42.332 0.400 . 1 . . . . 28 LYS CE . 17066 1
308 . 1 1 29 29 LYS CG C 13 25.398 0.400 . 1 . . . . 28 LYS CG . 17066 1
309 . 1 1 29 29 LYS N N 15 124.594 0.400 . 1 . . . . 28 LYS N . 17066 1
310 . 1 1 30 30 PHE H H 1 8.431 0.020 . 1 . . . . 29 PHE H . 17066 1
311 . 1 1 30 30 PHE HA H 1 6.234 0.020 . 1 . . . . 29 PHE HA . 17066 1
312 . 1 1 30 30 PHE HB2 H 1 3.301 0.020 . 2 . . . . 29 PHE HB2 . 17066 1
313 . 1 1 30 30 PHE HB3 H 1 3.022 0.020 . 2 . . . . 29 PHE HB3 . 17066 1
314 . 1 1 30 30 PHE HD2 H 1 6.870 0.020 . 1 . . . . 29 PHE HD2 . 17066 1
315 . 1 1 30 30 PHE C C 13 171.693 0.400 . 1 . . . . 29 PHE C . 17066 1
316 . 1 1 30 30 PHE CA C 13 56.278 0.400 . 1 . . . . 29 PHE CA . 17066 1
317 . 1 1 30 30 PHE CB C 13 42.664 0.400 . 1 . . . . 29 PHE CB . 17066 1
318 . 1 1 30 30 PHE N N 15 119.999 0.400 . 1 . . . . 29 PHE N . 17066 1
319 . 1 1 31 31 ILE H H 1 8.618 0.020 . 1 . . . . 30 ILE H . 17066 1
320 . 1 1 31 31 ILE HA H 1 4.867 0.020 . 1 . . . . 30 ILE HA . 17066 1
321 . 1 1 31 31 ILE HB H 1 1.863 0.020 . 1 . . . . 30 ILE HB . 17066 1
322 . 1 1 31 31 ILE HD11 H 1 0.632 0.020 . 1 . . . . 30 ILE HD1 . 17066 1
323 . 1 1 31 31 ILE HD12 H 1 0.632 0.020 . 1 . . . . 30 ILE HD1 . 17066 1
324 . 1 1 31 31 ILE HD13 H 1 0.632 0.020 . 1 . . . . 30 ILE HD1 . 17066 1
325 . 1 1 31 31 ILE HG12 H 1 1.159 0.020 . 2 . . . . 30 ILE HG12 . 17066 1
326 . 1 1 31 31 ILE HG13 H 1 1.225 0.020 . 2 . . . . 30 ILE HG13 . 17066 1
327 . 1 1 31 31 ILE HG21 H 1 -0.031 0.020 . 1 . . . . 30 ILE HG2 . 17066 1
328 . 1 1 31 31 ILE HG22 H 1 -0.031 0.020 . 1 . . . . 30 ILE HG2 . 17066 1
329 . 1 1 31 31 ILE HG23 H 1 -0.031 0.020 . 1 . . . . 30 ILE HG2 . 17066 1
330 . 1 1 31 31 ILE C C 13 174.182 0.400 . 1 . . . . 30 ILE C . 17066 1
331 . 1 1 31 31 ILE CA C 13 58.493 0.400 . 1 . . . . 30 ILE CA . 17066 1
332 . 1 1 31 31 ILE CB C 13 41.336 0.400 . 1 . . . . 30 ILE CB . 17066 1
333 . 1 1 31 31 ILE CD1 C 13 13.777 0.400 . 1 . . . . 30 ILE CD1 . 17066 1
334 . 1 1 31 31 ILE CG1 C 13 26.726 0.400 . 1 . . . . 30 ILE CG1 . 17066 1
335 . 1 1 31 31 ILE CG2 C 13 17.097 0.400 . 1 . . . . 30 ILE CG2 . 17066 1
336 . 1 1 31 31 ILE N N 15 111.199 0.400 . 1 . . . . 30 ILE N . 17066 1
337 . 1 1 32 32 ILE H H 1 8.935 0.020 . 1 . . . . 31 ILE H . 17066 1
338 . 1 1 32 32 ILE HA H 1 5.181 0.020 . 1 . . . . 31 ILE HA . 17066 1
339 . 1 1 32 32 ILE HB H 1 1.678 0.020 . 1 . . . . 31 ILE HB . 17066 1
340 . 1 1 32 32 ILE HD11 H 1 0.784 0.020 . 1 . . . . 31 ILE HD1 . 17066 1
341 . 1 1 32 32 ILE HD12 H 1 0.784 0.020 . 1 . . . . 31 ILE HD1 . 17066 1
342 . 1 1 32 32 ILE HD13 H 1 0.784 0.020 . 1 . . . . 31 ILE HD1 . 17066 1
343 . 1 1 32 32 ILE HG12 H 1 1.171 0.020 . 2 . . . . 31 ILE HG12 . 17066 1
344 . 1 1 32 32 ILE HG13 H 1 1.838 0.020 . 2 . . . . 31 ILE HG13 . 17066 1
345 . 1 1 32 32 ILE HG21 H 1 0.903 0.020 . 1 . . . . 31 ILE HG2 . 17066 1
346 . 1 1 32 32 ILE HG22 H 1 0.903 0.020 . 1 . . . . 31 ILE HG2 . 17066 1
347 . 1 1 32 32 ILE HG23 H 1 0.903 0.020 . 1 . . . . 31 ILE HG2 . 17066 1
348 . 1 1 32 32 ILE C C 13 174.222 0.400 . 1 . . . . 31 ILE C . 17066 1
349 . 1 1 32 32 ILE CA C 13 60.065 0.400 . 1 . . . . 31 ILE CA . 17066 1
350 . 1 1 32 32 ILE CB C 13 40.340 0.400 . 1 . . . . 31 ILE CB . 17066 1
351 . 1 1 32 32 ILE CD1 C 13 14.773 0.400 . 1 . . . . 31 ILE CD1 . 17066 1
352 . 1 1 32 32 ILE CG1 C 13 27.722 0.400 . 1 . . . . 31 ILE CG1 . 17066 1
353 . 1 1 32 32 ILE CG2 C 13 18.319 0.400 . 1 . . . . 31 ILE CG2 . 17066 1
354 . 1 1 32 32 ILE N N 15 119.562 0.400 . 1 . . . . 31 ILE N . 17066 1
355 . 1 1 33 33 ALA H H 1 9.723 0.020 . 1 . . . . 32 ALA H . 17066 1
356 . 1 1 33 33 ALA HA H 1 5.309 0.020 . 1 . . . . 32 ALA HA . 17066 1
357 . 1 1 33 33 ALA HB1 H 1 1.310 0.020 . 1 . . . . 32 ALA HB . 17066 1
358 . 1 1 33 33 ALA HB2 H 1 1.310 0.020 . 1 . . . . 32 ALA HB . 17066 1
359 . 1 1 33 33 ALA HB3 H 1 1.310 0.020 . 1 . . . . 32 ALA HB . 17066 1
360 . 1 1 33 33 ALA C C 13 176.494 0.400 . 1 . . . . 32 ALA C . 17066 1
361 . 1 1 33 33 ALA CA C 13 49.693 0.400 . 1 . . . . 32 ALA CA . 17066 1
362 . 1 1 33 33 ALA CB C 13 25.042 0.400 . 1 . . . . 32 ALA CB . 17066 1
363 . 1 1 33 33 ALA N N 15 130.417 0.400 . 1 . . . . 32 ALA N . 17066 1
364 . 1 1 34 34 ASN H H 1 8.672 0.020 . 1 . . . . 33 ASN H . 17066 1
365 . 1 1 34 34 ASN HA H 1 4.698 0.020 . 1 . . . . 33 ASN HA . 17066 1
366 . 1 1 34 34 ASN HB2 H 1 2.819 0.020 . 2 . . . . 33 ASN HB2 . 17066 1
367 . 1 1 34 34 ASN HB3 H 1 3.101 0.020 . 2 . . . . 33 ASN HB3 . 17066 1
368 . 1 1 34 34 ASN HD21 H 1 7.238 0.020 . 2 . . . . 33 ASN HD21 . 17066 1
369 . 1 1 34 34 ASN HD22 H 1 7.767 0.020 . 2 . . . . 33 ASN HD22 . 17066 1
370 . 1 1 34 34 ASN C C 13 173.925 0.400 . 1 . . . . 33 ASN C . 17066 1
371 . 1 1 34 34 ASN CA C 13 52.625 0.400 . 1 . . . . 33 ASN CA . 17066 1
372 . 1 1 34 34 ASN CB C 13 38.680 0.400 . 1 . . . . 33 ASN CB . 17066 1
373 . 1 1 34 34 ASN N N 15 118.905 0.400 . 1 . . . . 33 ASN N . 17066 1
374 . 1 1 34 34 ASN ND2 N 15 112.123 0.400 . 1 . . . . 33 ASN ND2 . 17066 1
375 . 1 1 35 35 ALA H H 1 7.631 0.020 . 1 . . . . 34 ALA H . 17066 1
376 . 1 1 35 35 ALA HA H 1 4.705 0.020 . 1 . . . . 34 ALA HA . 17066 1
377 . 1 1 35 35 ALA HB1 H 1 1.045 0.020 . 1 . . . . 34 ALA HB . 17066 1
378 . 1 1 35 35 ALA HB2 H 1 1.045 0.020 . 1 . . . . 34 ALA HB . 17066 1
379 . 1 1 35 35 ALA HB3 H 1 1.045 0.020 . 1 . . . . 34 ALA HB . 17066 1
380 . 1 1 35 35 ALA C C 13 177.541 0.400 . 1 . . . . 34 ALA C . 17066 1
381 . 1 1 35 35 ALA CA C 13 52.293 0.400 . 1 . . . . 34 ALA CA . 17066 1
382 . 1 1 35 35 ALA CB C 13 20.418 0.400 . 1 . . . . 34 ALA CB . 17066 1
383 . 1 1 35 35 ALA N N 15 123.719 0.400 . 1 . . . . 34 ALA N . 17066 1
384 . 1 1 36 36 ARG H H 1 8.223 0.020 . 1 . . . . 35 ARG H . 17066 1
385 . 1 1 36 36 ARG HA H 1 4.361 0.020 . 1 . . . . 35 ARG HA . 17066 1
386 . 1 1 36 36 ARG HB2 H 1 1.908 0.020 . 2 . . . . 35 ARG HB2 . 17066 1
387 . 1 1 36 36 ARG HB3 H 1 2.083 0.020 . 2 . . . . 35 ARG HB3 . 17066 1
388 . 1 1 36 36 ARG HD2 H 1 3.216 0.020 . 2 . . . . 35 ARG HD2 . 17066 1
389 . 1 1 36 36 ARG HD3 H 1 3.216 0.020 . 2 . . . . 35 ARG HD3 . 17066 1
390 . 1 1 36 36 ARG HG2 H 1 1.655 0.020 . 2 . . . . 35 ARG HG2 . 17066 1
391 . 1 1 36 36 ARG HG3 H 1 1.779 0.020 . 2 . . . . 35 ARG HG3 . 17066 1
392 . 1 1 36 36 ARG C C 13 176.200 0.400 . 1 . . . . 35 ARG C . 17066 1
393 . 1 1 36 36 ARG CA C 13 56.278 0.400 . 1 . . . . 35 ARG CA . 17066 1
394 . 1 1 36 36 ARG CB C 13 29.715 0.400 . 1 . . . . 35 ARG CB . 17066 1
395 . 1 1 36 36 ARG CD C 13 43.328 0.400 . 1 . . . . 35 ARG CD . 17066 1
396 . 1 1 36 36 ARG CG C 13 27.390 0.400 . 1 . . . . 35 ARG CG . 17066 1
397 . 1 1 36 36 ARG N N 15 116.061 0.400 . 1 . . . . 35 ARG N . 17066 1
398 . 1 1 36 36 ARG NE N 15 112.779 0.400 . 1 . . . . 35 ARG NE . 17066 1
399 . 1 1 37 37 VAL H H 1 7.287 0.020 . 1 . . . . 36 VAL H . 17066 1
400 . 1 1 37 37 VAL HA H 1 4.432 0.020 . 1 . . . . 36 VAL HA . 17066 1
401 . 1 1 37 37 VAL HB H 1 2.182 0.020 . 1 . . . . 36 VAL HB . 17066 1
402 . 1 1 37 37 VAL HG11 H 1 0.942 0.020 . 2 . . . . 36 VAL HG1 . 17066 1
403 . 1 1 37 37 VAL HG12 H 1 0.942 0.020 . 2 . . . . 36 VAL HG1 . 17066 1
404 . 1 1 37 37 VAL HG13 H 1 0.942 0.020 . 2 . . . . 36 VAL HG1 . 17066 1
405 . 1 1 37 37 VAL HG21 H 1 0.995 0.020 . 2 . . . . 36 VAL HG2 . 17066 1
406 . 1 1 37 37 VAL HG22 H 1 0.995 0.020 . 2 . . . . 36 VAL HG2 . 17066 1
407 . 1 1 37 37 VAL HG23 H 1 0.995 0.020 . 2 . . . . 36 VAL HG2 . 17066 1
408 . 1 1 37 37 VAL C C 13 176.810 0.400 . 1 . . . . 36 VAL C . 17066 1
409 . 1 1 37 37 VAL CA C 13 60.594 0.400 . 1 . . . . 36 VAL CA . 17066 1
410 . 1 1 37 37 VAL CB C 13 33.699 0.400 . 1 . . . . 36 VAL CB . 17066 1
411 . 1 1 37 37 VAL CG1 C 13 21.348 0.400 . 1 . . . . 36 VAL CG1 . 17066 1
412 . 1 1 37 37 VAL CG2 C 13 19.753 0.400 . 1 . . . . 36 VAL CG2 . 17066 1
413 . 1 1 37 37 VAL N N 15 113.873 0.400 . 1 . . . . 36 VAL N . 17066 1
414 . 1 1 38 38 GLU H H 1 8.744 0.020 . 1 . . . . 37 GLU H . 17066 1
415 . 1 1 38 38 GLU HA H 1 4.003 0.020 . 1 . . . . 37 GLU HA . 17066 1
416 . 1 1 38 38 GLU HB2 H 1 1.985 0.020 . 2 . . . . 37 GLU HB2 . 17066 1
417 . 1 1 38 38 GLU HB3 H 1 1.985 0.020 . 2 . . . . 37 GLU HB3 . 17066 1
418 . 1 1 38 38 GLU HG2 H 1 2.235 0.020 . 2 . . . . 37 GLU HG2 . 17066 1
419 . 1 1 38 38 GLU HG3 H 1 2.235 0.020 . 2 . . . . 37 GLU HG3 . 17066 1
420 . 1 1 38 38 GLU C C 13 176.494 0.400 . 1 . . . . 37 GLU C . 17066 1
421 . 1 1 38 38 GLU CA C 13 58.657 0.400 . 1 . . . . 37 GLU CA . 17066 1
422 . 1 1 38 38 GLU CB C 13 29.383 0.400 . 1 . . . . 37 GLU CB . 17066 1
423 . 1 1 38 38 GLU CG C 13 36.023 0.400 . 1 . . . . 37 GLU CG . 17066 1
424 . 1 1 38 38 GLU N N 15 122.844 0.400 . 1 . . . . 37 GLU N . 17066 1
425 . 1 1 39 39 ASN H H 1 8.175 0.020 . 1 . . . . 38 ASN H . 17066 1
426 . 1 1 39 39 ASN HA H 1 4.541 0.020 . 1 . . . . 38 ASN HA . 17066 1
427 . 1 1 39 39 ASN HB2 H 1 2.772 0.020 . 2 . . . . 38 ASN HB2 . 17066 1
428 . 1 1 39 39 ASN HB3 H 1 3.006 0.020 . 2 . . . . 38 ASN HB3 . 17066 1
429 . 1 1 39 39 ASN HD21 H 1 6.875 0.020 . 2 . . . . 38 ASN HD21 . 17066 1
430 . 1 1 39 39 ASN HD22 H 1 7.519 0.020 . 2 . . . . 38 ASN HD22 . 17066 1
431 . 1 1 39 39 ASN C C 13 174.439 0.400 . 1 . . . . 38 ASN C . 17066 1
432 . 1 1 39 39 ASN CA C 13 52.957 0.400 . 1 . . . . 38 ASN CA . 17066 1
433 . 1 1 39 39 ASN CB C 13 37.684 0.400 . 1 . . . . 38 ASN CB . 17066 1
434 . 1 1 39 39 ASN N N 15 114.748 0.400 . 1 . . . . 38 ASN N . 17066 1
435 . 1 1 39 39 ASN ND2 N 15 111.029 0.400 . 1 . . . . 38 ASN ND2 . 17066 1
436 . 1 1 40 40 CYS H H 1 8.301 0.020 . 1 . . . . 39 CYS H . 17066 1
437 . 1 1 40 40 CYS HA H 1 4.549 0.020 . 1 . . . . 39 CYS HA . 17066 1
438 . 1 1 40 40 CYS HB2 H 1 2.925 0.020 . 2 . . . . 39 CYS HB2 . 17066 1
439 . 1 1 40 40 CYS HB3 H 1 3.007 0.020 . 2 . . . . 39 CYS HB3 . 17066 1
440 . 1 1 40 40 CYS C C 13 174.384 0.400 . 1 . . . . 39 CYS C . 17066 1
441 . 1 1 40 40 CYS CA C 13 59.266 0.400 . 1 . . . . 39 CYS CA . 17066 1
442 . 1 1 40 40 CYS CB C 13 26.726 0.400 . 1 . . . . 39 CYS CB . 17066 1
443 . 1 1 40 40 CYS N N 15 117.374 0.400 . 1 . . . . 39 CYS N . 17066 1
444 . 1 1 41 41 ALA HA H 1 4.037 0.020 . 1 . . . . 40 ALA HA . 17066 1
445 . 1 1 41 41 ALA HB1 H 1 1.158 0.020 . 1 . . . . 40 ALA HB . 17066 1
446 . 1 1 41 41 ALA HB2 H 1 1.158 0.020 . 1 . . . . 40 ALA HB . 17066 1
447 . 1 1 41 41 ALA HB3 H 1 1.158 0.020 . 1 . . . . 40 ALA HB . 17066 1
448 . 1 1 41 41 ALA C C 13 177.699 0.400 . 1 . . . . 40 ALA C . 17066 1
449 . 1 1 41 41 ALA CA C 13 51.961 0.400 . 1 . . . . 40 ALA CA . 17066 1
450 . 1 1 41 41 ALA CB C 13 20.536 0.400 . 1 . . . . 40 ALA CB . 17066 1
451 . 1 1 42 42 VAL H H 1 8.613 0.020 . 1 . . . . 41 VAL H . 17066 1
452 . 1 1 42 42 VAL HA H 1 3.882 0.020 . 1 . . . . 41 VAL HA . 17066 1
453 . 1 1 42 42 VAL HB H 1 2.197 0.020 . 1 . . . . 41 VAL HB . 17066 1
454 . 1 1 42 42 VAL HG11 H 1 0.946 0.020 . 2 . . . . 41 VAL HG1 . 17066 1
455 . 1 1 42 42 VAL HG12 H 1 0.946 0.020 . 2 . . . . 41 VAL HG1 . 17066 1
456 . 1 1 42 42 VAL HG13 H 1 0.946 0.020 . 2 . . . . 41 VAL HG1 . 17066 1
457 . 1 1 42 42 VAL HG21 H 1 0.856 0.020 . 2 . . . . 41 VAL HG2 . 17066 1
458 . 1 1 42 42 VAL HG22 H 1 0.856 0.020 . 2 . . . . 41 VAL HG2 . 17066 1
459 . 1 1 42 42 VAL HG23 H 1 0.856 0.020 . 2 . . . . 41 VAL HG2 . 17066 1
460 . 1 1 42 42 VAL C C 13 177.165 0.400 . 1 . . . . 41 VAL C . 17066 1
461 . 1 1 42 42 VAL CA C 13 65.097 0.400 . 1 . . . . 41 VAL CA . 17066 1
462 . 1 1 42 42 VAL CB C 13 32.371 0.400 . 1 . . . . 41 VAL CB . 17066 1
463 . 1 1 42 42 VAL CG1 C 13 23.074 0.400 . 1 . . . . 41 VAL CG1 . 17066 1
464 . 1 1 42 42 VAL CG2 C 13 22.410 0.400 . 1 . . . . 41 VAL CG2 . 17066 1
465 . 1 1 42 42 VAL N N 15 119.999 0.400 . 1 . . . . 41 VAL N . 17066 1
466 . 1 1 43 43 ILE H H 1 9.226 0.020 . 1 . . . . 42 ILE H . 17066 1
467 . 1 1 43 43 ILE HA H 1 4.615 0.020 . 1 . . . . 42 ILE HA . 17066 1
468 . 1 1 43 43 ILE HB H 1 2.135 0.020 . 1 . . . . 42 ILE HB . 17066 1
469 . 1 1 43 43 ILE HD11 H 1 0.889 0.020 . 1 . . . . 42 ILE HD1 . 17066 1
470 . 1 1 43 43 ILE HD12 H 1 0.889 0.020 . 1 . . . . 42 ILE HD1 . 17066 1
471 . 1 1 43 43 ILE HD13 H 1 0.889 0.020 . 1 . . . . 42 ILE HD1 . 17066 1
472 . 1 1 43 43 ILE HG12 H 1 0.940 0.020 . 2 . . . . 42 ILE HG12 . 17066 1
473 . 1 1 43 43 ILE HG13 H 1 1.193 0.020 . 2 . . . . 42 ILE HG13 . 17066 1
474 . 1 1 43 43 ILE HG21 H 1 1.018 0.020 . 1 . . . . 42 ILE HG2 . 17066 1
475 . 1 1 43 43 ILE HG22 H 1 1.018 0.020 . 1 . . . . 42 ILE HG2 . 17066 1
476 . 1 1 43 43 ILE HG23 H 1 1.018 0.020 . 1 . . . . 42 ILE HG2 . 17066 1
477 . 1 1 43 43 ILE C C 13 175.328 0.400 . 1 . . . . 42 ILE C . 17066 1
478 . 1 1 43 43 ILE CA C 13 61.209 0.400 . 1 . . . . 42 ILE CA . 17066 1
479 . 1 1 43 43 ILE CB C 13 39.706 0.400 . 1 . . . . 42 ILE CB . 17066 1
480 . 1 1 43 43 ILE CD1 C 13 14.441 0.400 . 1 . . . . 42 ILE CD1 . 17066 1
481 . 1 1 43 43 ILE CG1 C 13 26.394 0.400 . 1 . . . . 42 ILE CG1 . 17066 1
482 . 1 1 43 43 ILE CG2 C 13 18.757 0.400 . 1 . . . . 42 ILE CG2 . 17066 1
483 . 1 1 43 43 ILE N N 15 121.312 0.400 . 1 . . . . 42 ILE N . 17066 1
484 . 1 1 44 44 TYR H H 1 7.806 0.020 . 1 . . . . 43 TYR H . 17066 1
485 . 1 1 44 44 TYR HA H 1 4.576 0.020 . 1 . . . . 43 TYR HA . 17066 1
486 . 1 1 44 44 TYR HB2 H 1 2.356 0.020 . 2 . . . . 43 TYR HB2 . 17066 1
487 . 1 1 44 44 TYR HB3 H 1 3.299 0.020 . 2 . . . . 43 TYR HB3 . 17066 1
488 . 1 1 44 44 TYR HD2 H 1 6.848 0.020 . 1 . . . . 43 TYR HD2 . 17066 1
489 . 1 1 44 44 TYR C C 13 172.740 0.400 . 1 . . . . 43 TYR C . 17066 1
490 . 1 1 44 44 TYR CA C 13 59.266 0.400 . 1 . . . . 43 TYR CA . 17066 1
491 . 1 1 44 44 TYR CB C 13 42.150 0.400 . 1 . . . . 43 TYR CB . 17066 1
492 . 1 1 44 44 TYR N N 15 121.231 0.400 . 1 . . . . 43 TYR N . 17066 1
493 . 1 1 45 45 CYS H H 1 7.825 0.020 . 1 . . . . 44 CYS H . 17066 1
494 . 1 1 45 45 CYS HA H 1 4.741 0.020 . 1 . . . . 44 CYS HA . 17066 1
495 . 1 1 45 45 CYS HB2 H 1 2.450 0.020 . 2 . . . . 44 CYS HB2 . 17066 1
496 . 1 1 45 45 CYS HB3 H 1 2.608 0.020 . 2 . . . . 44 CYS HB3 . 17066 1
497 . 1 1 45 45 CYS C C 13 171.396 0.400 . 1 . . . . 44 CYS C . 17066 1
498 . 1 1 45 45 CYS CA C 13 53.954 0.400 . 1 . . . . 44 CYS CA . 17066 1
499 . 1 1 45 45 CYS CB C 13 31.707 0.400 . 1 . . . . 44 CYS CB . 17066 1
500 . 1 1 45 45 CYS N N 15 123.500 0.400 . 1 . . . . 44 CYS N . 17066 1
501 . 1 1 46 46 ASN H H 1 7.984 0.020 . 1 . . . . 45 ASN H . 17066 1
502 . 1 1 46 46 ASN HA H 1 4.435 0.020 . 1 . . . . 45 ASN HA . 17066 1
503 . 1 1 46 46 ASN HB2 H 1 1.932 0.020 . 2 . . . . 45 ASN HB2 . 17066 1
504 . 1 1 46 46 ASN HB3 H 1 3.582 0.020 . 2 . . . . 45 ASN HB3 . 17066 1
505 . 1 1 46 46 ASN HD21 H 1 8.743 0.020 . 2 . . . . 45 ASN HD21 . 17066 1
506 . 1 1 46 46 ASN HD22 H 1 7.848 0.020 . 2 . . . . 45 ASN HD22 . 17066 1
507 . 1 1 46 46 ASN C C 13 174.064 0.400 . 1 . . . . 45 ASN C . 17066 1
508 . 1 1 46 46 ASN CA C 13 50.664 0.400 . 1 . . . . 45 ASN CA . 17066 1
509 . 1 1 46 46 ASN CB C 13 39.428 0.400 . 1 . . . . 45 ASN CB . 17066 1
510 . 1 1 46 46 ASN N N 15 122.844 0.400 . 1 . . . . 45 ASN N . 17066 1
511 . 1 1 46 46 ASN ND2 N 15 119.124 0.400 . 1 . . . . 45 ASN ND2 . 17066 1
512 . 1 1 47 47 ASP H H 1 9.164 0.020 . 1 . . . . 46 ASP H . 17066 1
513 . 1 1 47 47 ASP HA H 1 4.238 0.020 . 1 . . . . 46 ASP HA . 17066 1
514 . 1 1 47 47 ASP HB2 H 1 2.677 0.020 . 2 . . . . 46 ASP HB2 . 17066 1
515 . 1 1 47 47 ASP HB3 H 1 2.677 0.020 . 2 . . . . 46 ASP HB3 . 17066 1
516 . 1 1 47 47 ASP C C 13 179.200 0.400 . 1 . . . . 46 ASP C . 17066 1
517 . 1 1 47 47 ASP CA C 13 57.948 0.400 . 1 . . . . 46 ASP CA . 17066 1
518 . 1 1 47 47 ASP CB C 13 39.133 0.400 . 1 . . . . 46 ASP CB . 17066 1
519 . 1 1 47 47 ASP N N 15 121.312 0.400 . 1 . . . . 46 ASP N . 17066 1
520 . 1 1 48 48 GLY H H 1 7.975 0.020 . 1 . . . . 47 GLY H . 17066 1
521 . 1 1 48 48 GLY HA2 H 1 3.842 0.020 . 2 . . . . 47 GLY HA2 . 17066 1
522 . 1 1 48 48 GLY HA3 H 1 4.020 0.020 . 2 . . . . 47 GLY HA3 . 17066 1
523 . 1 1 48 48 GLY C C 13 176.158 0.400 . 1 . . . . 47 GLY C . 17066 1
524 . 1 1 48 48 GLY CA C 13 47.360 0.400 . 1 . . . . 47 GLY CA . 17066 1
525 . 1 1 48 48 GLY N N 15 105.319 0.400 . 1 . . . . 47 GLY N . 17066 1
526 . 1 1 49 49 PHE H H 1 8.193 0.020 . 1 . . . . 48 PHE H . 17066 1
527 . 1 1 49 49 PHE HA H 1 3.841 0.020 . 1 . . . . 48 PHE HA . 17066 1
528 . 1 1 49 49 PHE HB2 H 1 3.027 0.020 . 2 . . . . 48 PHE HB2 . 17066 1
529 . 1 1 49 49 PHE HB3 H 1 3.104 0.020 . 2 . . . . 48 PHE HB3 . 17066 1
530 . 1 1 49 49 PHE HD2 H 1 6.542 0.020 . 1 . . . . 48 PHE HD2 . 17066 1
531 . 1 1 49 49 PHE C C 13 176.573 0.400 . 1 . . . . 48 PHE C . 17066 1
532 . 1 1 49 49 PHE CA C 13 62.945 0.400 . 1 . . . . 48 PHE CA . 17066 1
533 . 1 1 49 49 PHE CB C 13 39.183 0.400 . 1 . . . . 48 PHE CB . 17066 1
534 . 1 1 49 49 PHE N N 15 123.938 0.400 . 1 . . . . 48 PHE N . 17066 1
535 . 1 1 50 50 CYS H H 1 7.420 0.020 . 1 . . . . 49 CYS H . 17066 1
536 . 1 1 50 50 CYS HA H 1 3.930 0.020 . 1 . . . . 49 CYS HA . 17066 1
537 . 1 1 50 50 CYS HB2 H 1 2.852 0.020 . 2 . . . . 49 CYS HB2 . 17066 1
538 . 1 1 50 50 CYS HB3 H 1 3.200 0.020 . 2 . . . . 49 CYS HB3 . 17066 1
539 . 1 1 50 50 CYS C C 13 177.363 0.400 . 1 . . . . 49 CYS C . 17066 1
540 . 1 1 50 50 CYS CA C 13 63.798 0.400 . 1 . . . . 49 CYS CA . 17066 1
541 . 1 1 50 50 CYS CB C 13 27.338 0.400 . 1 . . . . 49 CYS CB . 17066 1
542 . 1 1 50 50 CYS N N 15 119.781 0.400 . 1 . . . . 49 CYS N . 17066 1
543 . 1 1 51 51 GLU H H 1 8.277 0.020 . 1 . . . . 50 GLU H . 17066 1
544 . 1 1 51 51 GLU HA H 1 3.812 0.020 . 1 . . . . 50 GLU HA . 17066 1
545 . 1 1 51 51 GLU HB2 H 1 1.927 0.020 . 2 . . . . 50 GLU HB2 . 17066 1
546 . 1 1 51 51 GLU HB3 H 1 1.927 0.020 . 2 . . . . 50 GLU HB3 . 17066 1
547 . 1 1 51 51 GLU HG2 H 1 2.086 0.020 . 2 . . . . 50 GLU HG2 . 17066 1
548 . 1 1 51 51 GLU HG3 H 1 2.227 0.020 . 2 . . . . 50 GLU HG3 . 17066 1
549 . 1 1 51 51 GLU C C 13 178.094 0.400 . 1 . . . . 50 GLU C . 17066 1
550 . 1 1 51 51 GLU CA C 13 58.270 0.400 . 1 . . . . 50 GLU CA . 17066 1
551 . 1 1 51 51 GLU CB C 13 29.715 0.400 . 1 . . . . 50 GLU CB . 17066 1
552 . 1 1 51 51 GLU CG C 13 36.021 0.400 . 1 . . . . 50 GLU CG . 17066 1
553 . 1 1 51 51 GLU N N 15 119.380 0.400 . 1 . . . . 50 GLU N . 17066 1
554 . 1 1 52 52 LEU H H 1 7.564 0.020 . 1 . . . . 51 LEU H . 17066 1
555 . 1 1 52 52 LEU HA H 1 3.857 0.020 . 1 . . . . 51 LEU HA . 17066 1
556 . 1 1 52 52 LEU HB2 H 1 1.343 0.020 . 2 . . . . 51 LEU HB2 . 17066 1
557 . 1 1 52 52 LEU HB3 H 1 1.774 0.020 . 2 . . . . 51 LEU HB3 . 17066 1
558 . 1 1 52 52 LEU HD11 H 1 0.311 0.020 . 2 . . . . 51 LEU HD1 . 17066 1
559 . 1 1 52 52 LEU HD12 H 1 0.311 0.020 . 2 . . . . 51 LEU HD1 . 17066 1
560 . 1 1 52 52 LEU HD13 H 1 0.311 0.020 . 2 . . . . 51 LEU HD1 . 17066 1
561 . 1 1 52 52 LEU HD21 H 1 0.603 0.020 . 2 . . . . 51 LEU HD2 . 17066 1
562 . 1 1 52 52 LEU HD22 H 1 0.603 0.020 . 2 . . . . 51 LEU HD2 . 17066 1
563 . 1 1 52 52 LEU HD23 H 1 0.603 0.020 . 2 . . . . 51 LEU HD2 . 17066 1
564 . 1 1 52 52 LEU HG H 1 0.798 0.020 . 1 . . . . 51 LEU HG . 17066 1
565 . 1 1 52 52 LEU C C 13 176.098 0.400 . 1 . . . . 51 LEU C . 17066 1
566 . 1 1 52 52 LEU CA C 13 57.567 0.400 . 1 . . . . 51 LEU CA . 17066 1
567 . 1 1 52 52 LEU CB C 13 41.652 0.400 . 1 . . . . 51 LEU CB . 17066 1
568 . 1 1 52 52 LEU CD1 C 13 23.406 0.400 . 1 . . . . 51 LEU CD1 . 17066 1
569 . 1 1 52 52 LEU CD2 C 13 25.730 0.400 . 1 . . . . 51 LEU CD2 . 17066 1
570 . 1 1 52 52 LEU CG C 13 26.726 0.400 . 1 . . . . 51 LEU CG . 17066 1
571 . 1 1 52 52 LEU N N 15 119.999 0.400 . 1 . . . . 51 LEU N . 17066 1
572 . 1 1 53 53 CYS H H 1 7.283 0.020 . 1 . . . . 52 CYS H . 17066 1
573 . 1 1 53 53 CYS HA H 1 4.539 0.020 . 1 . . . . 52 CYS HA . 17066 1
574 . 1 1 53 53 CYS HB2 H 1 2.246 0.020 . 2 . . . . 52 CYS HB2 . 17066 1
575 . 1 1 53 53 CYS HB3 H 1 3.000 0.020 . 2 . . . . 52 CYS HB3 . 17066 1
576 . 1 1 53 53 CYS C C 13 174.123 0.400 . 1 . . . . 52 CYS C . 17066 1
577 . 1 1 53 53 CYS CA C 13 57.938 0.400 . 1 . . . . 52 CYS CA . 17066 1
578 . 1 1 53 53 CYS CB C 13 29.383 0.400 . 1 . . . . 52 CYS CB . 17066 1
579 . 1 1 53 53 CYS N N 15 106.794 0.400 . 1 . . . . 52 CYS N . 17066 1
580 . 1 1 54 54 GLY H H 1 8.002 0.020 . 1 . . . . 53 GLY H . 17066 1
581 . 1 1 54 54 GLY HA2 H 1 4.228 0.020 . 2 . . . . 53 GLY HA2 . 17066 1
582 . 1 1 54 54 GLY HA3 H 1 3.570 0.020 . 2 . . . . 53 GLY HA3 . 17066 1
583 . 1 1 54 54 GLY C C 13 173.194 0.400 . 1 . . . . 53 GLY C . 17066 1
584 . 1 1 54 54 GLY CA C 13 45.974 0.400 . 1 . . . . 53 GLY CA . 17066 1
585 . 1 1 54 54 GLY N N 15 111.029 0.400 . 1 . . . . 53 GLY N . 17066 1
586 . 1 1 55 55 TYR H H 1 7.472 0.020 . 1 . . . . 54 TYR H . 17066 1
587 . 1 1 55 55 TYR HA H 1 4.315 0.020 . 1 . . . . 54 TYR HA . 17066 1
588 . 1 1 55 55 TYR HB2 H 1 2.627 0.020 . 2 . . . . 54 TYR HB2 . 17066 1
589 . 1 1 55 55 TYR HB3 H 1 2.627 0.020 . 2 . . . . 54 TYR HB3 . 17066 1
590 . 1 1 55 55 TYR HD2 H 1 6.863 0.020 . 1 . . . . 54 TYR HD2 . 17066 1
591 . 1 1 55 55 TYR C C 13 174.024 0.400 . 1 . . . . 54 TYR C . 17066 1
592 . 1 1 55 55 TYR CA C 13 57.606 0.400 . 1 . . . . 54 TYR CA . 17066 1
593 . 1 1 55 55 TYR CB C 13 39.359 0.400 . 1 . . . . 54 TYR CB . 17066 1
594 . 1 1 55 55 TYR N N 15 118.957 0.400 . 1 . . . . 54 TYR N . 17066 1
595 . 1 1 56 56 SER H H 1 8.772 0.020 . 1 . . . . 55 SER H . 17066 1
596 . 1 1 56 56 SER HA H 1 4.333 0.020 . 1 . . . . 55 SER HA . 17066 1
597 . 1 1 56 56 SER HB2 H 1 3.910 0.020 . 2 . . . . 55 SER HB2 . 17066 1
598 . 1 1 56 56 SER HB3 H 1 4.101 0.020 . 2 . . . . 55 SER HB3 . 17066 1
599 . 1 1 56 56 SER C C 13 175.249 0.400 . 1 . . . . 55 SER C . 17066 1
600 . 1 1 56 56 SER CA C 13 57.117 0.400 . 1 . . . . 55 SER CA . 17066 1
601 . 1 1 56 56 SER CB C 13 65.627 0.400 . 1 . . . . 55 SER CB . 17066 1
602 . 1 1 56 56 SER N N 15 116.280 0.400 . 1 . . . . 55 SER N . 17066 1
603 . 1 1 57 57 ARG H H 1 8.845 0.020 . 1 . . . . 56 ARG H . 17066 1
604 . 1 1 57 57 ARG HA H 1 3.610 0.020 . 1 . . . . 56 ARG HA . 17066 1
605 . 1 1 57 57 ARG HB2 H 1 1.676 0.020 . 2 . . . . 56 ARG HB2 . 17066 1
606 . 1 1 57 57 ARG HB3 H 1 1.723 0.020 . 2 . . . . 56 ARG HB3 . 17066 1
607 . 1 1 57 57 ARG HD2 H 1 3.121 0.020 . 2 . . . . 56 ARG HD2 . 17066 1
608 . 1 1 57 57 ARG HD3 H 1 3.269 0.020 . 2 . . . . 56 ARG HD3 . 17066 1
609 . 1 1 57 57 ARG HG2 H 1 1.261 0.020 . 2 . . . . 56 ARG HG2 . 17066 1
610 . 1 1 57 57 ARG HG3 H 1 1.446 0.020 . 2 . . . . 56 ARG HG3 . 17066 1
611 . 1 1 57 57 ARG C C 13 177.975 0.400 . 1 . . . . 56 ARG C . 17066 1
612 . 1 1 57 57 ARG CA C 13 60.594 0.400 . 1 . . . . 56 ARG CA . 17066 1
613 . 1 1 57 57 ARG CB C 13 29.383 0.400 . 1 . . . . 56 ARG CB . 17066 1
614 . 1 1 57 57 ARG CG C 13 29.383 0.400 . 1 . . . . 56 ARG CG . 17066 1
615 . 1 1 57 57 ARG N N 15 122.954 0.400 . 1 . . . . 56 ARG N . 17066 1
616 . 1 1 57 57 ARG NE N 15 112.779 0.400 . 1 . . . . 56 ARG NE . 17066 1
617 . 1 1 58 58 ALA H H 1 8.214 0.020 . 1 . . . . 57 ALA H . 17066 1
618 . 1 1 58 58 ALA HA H 1 3.947 0.020 . 1 . . . . 57 ALA HA . 17066 1
619 . 1 1 58 58 ALA HB1 H 1 1.304 0.020 . 1 . . . . 57 ALA HB . 17066 1
620 . 1 1 58 58 ALA HB2 H 1 1.304 0.020 . 1 . . . . 57 ALA HB . 17066 1
621 . 1 1 58 58 ALA HB3 H 1 1.304 0.020 . 1 . . . . 57 ALA HB . 17066 1
622 . 1 1 58 58 ALA C C 13 179.615 0.400 . 1 . . . . 57 ALA C . 17066 1
623 . 1 1 58 58 ALA CA C 13 54.561 0.400 . 1 . . . . 57 ALA CA . 17066 1
624 . 1 1 58 58 ALA CB C 13 18.361 0.400 . 1 . . . . 57 ALA CB . 17066 1
625 . 1 1 58 58 ALA N N 15 118.249 0.400 . 1 . . . . 57 ALA N . 17066 1
626 . 1 1 59 59 GLU H H 1 7.526 0.020 . 1 . . . . 58 GLU H . 17066 1
627 . 1 1 59 59 GLU HA H 1 3.949 0.020 . 1 . . . . 58 GLU HA . 17066 1
628 . 1 1 59 59 GLU HB2 H 1 1.940 0.020 . 2 . . . . 58 GLU HB2 . 17066 1
629 . 1 1 59 59 GLU HB3 H 1 2.419 0.020 . 2 . . . . 58 GLU HB3 . 17066 1
630 . 1 1 59 59 GLU HG2 H 1 2.145 0.020 . 2 . . . . 58 GLU HG2 . 17066 1
631 . 1 1 59 59 GLU HG3 H 1 2.191 0.020 . 2 . . . . 58 GLU HG3 . 17066 1
632 . 1 1 59 59 GLU C C 13 175.723 0.400 . 1 . . . . 58 GLU C . 17066 1
633 . 1 1 59 59 GLU CA C 13 57.536 0.400 . 1 . . . . 58 GLU CA . 17066 1
634 . 1 1 59 59 GLU CB C 13 31.043 0.400 . 1 . . . . 58 GLU CB . 17066 1
635 . 1 1 59 59 GLU CG C 13 37.684 0.400 . 1 . . . . 58 GLU CG . 17066 1
636 . 1 1 59 59 GLU N N 15 115.518 0.400 . 1 . . . . 58 GLU N . 17066 1
637 . 1 1 60 60 VAL H H 1 7.385 0.020 . 1 . . . . 59 VAL H . 17066 1
638 . 1 1 60 60 VAL HA H 1 3.304 0.020 . 1 . . . . 59 VAL HA . 17066 1
639 . 1 1 60 60 VAL HB H 1 1.976 0.020 . 1 . . . . 59 VAL HB . 17066 1
640 . 1 1 60 60 VAL HG11 H 1 0.836 0.020 . 2 . . . . 59 VAL HG1 . 17066 1
641 . 1 1 60 60 VAL HG12 H 1 0.836 0.020 . 2 . . . . 59 VAL HG1 . 17066 1
642 . 1 1 60 60 VAL HG13 H 1 0.836 0.020 . 2 . . . . 59 VAL HG1 . 17066 1
643 . 1 1 60 60 VAL HG21 H 1 0.836 0.020 . 2 . . . . 59 VAL HG2 . 17066 1
644 . 1 1 60 60 VAL HG22 H 1 0.836 0.020 . 2 . . . . 59 VAL HG2 . 17066 1
645 . 1 1 60 60 VAL HG23 H 1 0.836 0.020 . 2 . . . . 59 VAL HG2 . 17066 1
646 . 1 1 60 60 VAL C C 13 175.703 0.400 . 1 . . . . 59 VAL C . 17066 1
647 . 1 1 60 60 VAL CA C 13 64.195 0.400 . 1 . . . . 59 VAL CA . 17066 1
648 . 1 1 60 60 VAL CB C 13 33.699 0.400 . 1 . . . . 59 VAL CB . 17066 1
649 . 1 1 60 60 VAL CG1 C 13 22.078 0.400 . 1 . . . . 59 VAL CG1 . 17066 1
650 . 1 1 60 60 VAL N N 15 118.687 0.400 . 1 . . . . 59 VAL N . 17066 1
651 . 1 1 61 61 MET H H 1 7.712 0.020 . 1 . . . . 60 MET H . 17066 1
652 . 1 1 61 61 MET HA H 1 3.810 0.020 . 1 . . . . 60 MET HA . 17066 1
653 . 1 1 61 61 MET HB2 H 1 1.938 0.020 . 2 . . . . 60 MET HB2 . 17066 1
654 . 1 1 61 61 MET HB3 H 1 1.867 0.020 . 2 . . . . 60 MET HB3 . 17066 1
655 . 1 1 61 61 MET HG2 H 1 2.493 0.020 . 2 . . . . 60 MET HG2 . 17066 1
656 . 1 1 61 61 MET HG3 H 1 2.619 0.020 . 2 . . . . 60 MET HG3 . 17066 1
657 . 1 1 61 61 MET C C 13 176.889 0.400 . 1 . . . . 60 MET C . 17066 1
658 . 1 1 61 61 MET CA C 13 56.263 0.400 . 1 . . . . 60 MET CA . 17066 1
659 . 1 1 61 61 MET CB C 13 31.707 0.400 . 1 . . . . 60 MET CB . 17066 1
660 . 1 1 61 61 MET CG C 13 33.367 0.400 . 1 . . . . 60 MET CG . 17066 1
661 . 1 1 61 61 MET N N 15 115.340 0.400 . 1 . . . . 60 MET N . 17066 1
662 . 1 1 62 62 GLN H H 1 8.549 0.020 . 1 . . . . 61 GLN H . 17066 1
663 . 1 1 62 62 GLN HA H 1 3.813 0.020 . 1 . . . . 61 GLN HA . 17066 1
664 . 1 1 62 62 GLN HB2 H 1 2.314 0.020 . 2 . . . . 61 GLN HB2 . 17066 1
665 . 1 1 62 62 GLN HB3 H 1 2.344 0.020 . 2 . . . . 61 GLN HB3 . 17066 1
666 . 1 1 62 62 GLN HE21 H 1 6.736 0.020 . 2 . . . . 61 GLN HE21 . 17066 1
667 . 1 1 62 62 GLN HE22 H 1 7.424 0.020 . 2 . . . . 61 GLN HE22 . 17066 1
668 . 1 1 62 62 GLN HG2 H 1 2.310 0.020 . 2 . . . . 61 GLN HG2 . 17066 1
669 . 1 1 62 62 GLN HG3 H 1 2.320 0.020 . 2 . . . . 61 GLN HG3 . 17066 1
670 . 1 1 62 62 GLN C C 13 175.111 0.400 . 1 . . . . 61 GLN C . 17066 1
671 . 1 1 62 62 GLN CA C 13 57.606 0.400 . 1 . . . . 61 GLN CA . 17066 1
672 . 1 1 62 62 GLN CB C 13 27.058 0.400 . 1 . . . . 61 GLN CB . 17066 1
673 . 1 1 62 62 GLN CG C 13 34.031 0.400 . 1 . . . . 61 GLN CG . 17066 1
674 . 1 1 62 62 GLN N N 15 112.069 0.400 . 1 . . . . 61 GLN N . 17066 1
675 . 1 1 62 62 GLN NE2 N 15 111.466 0.400 . 1 . . . . 61 GLN NE2 . 17066 1
676 . 1 1 63 63 ARG H H 1 7.658 0.020 . 1 . . . . 62 ARG H . 17066 1
677 . 1 1 63 63 ARG HA H 1 4.557 0.020 . 1 . . . . 62 ARG HA . 17066 1
678 . 1 1 63 63 ARG HB2 H 1 1.853 0.020 . 2 . . . . 62 ARG HB2 . 17066 1
679 . 1 1 63 63 ARG HB3 H 1 1.853 0.020 . 2 . . . . 62 ARG HB3 . 17066 1
680 . 1 1 63 63 ARG HD2 H 1 2.765 0.020 . 2 . . . . 62 ARG HD2 . 17066 1
681 . 1 1 63 63 ARG HD3 H 1 2.765 0.020 . 2 . . . . 62 ARG HD3 . 17066 1
682 . 1 1 63 63 ARG HG2 H 1 1.416 0.020 . 2 . . . . 62 ARG HG2 . 17066 1
683 . 1 1 63 63 ARG HG3 H 1 1.416 0.020 . 2 . . . . 62 ARG HG3 . 17066 1
684 . 1 1 63 63 ARG C C 13 173.781 0.400 . 1 . . . . 62 ARG C . 17066 1
685 . 1 1 63 63 ARG CA C 13 54.286 0.400 . 1 . . . . 62 ARG CA . 17066 1
686 . 1 1 63 63 ARG CB C 13 29.051 0.400 . 1 . . . . 62 ARG CB . 17066 1
687 . 1 1 63 63 ARG CD C 13 42.996 0.400 . 1 . . . . 62 ARG CD . 17066 1
688 . 1 1 63 63 ARG CG C 13 27.722 0.400 . 1 . . . . 62 ARG CG . 17066 1
689 . 1 1 63 63 ARG N N 15 120.114 0.400 . 1 . . . . 62 ARG N . 17066 1
690 . 1 1 63 63 ARG NE N 15 113.436 0.400 . 1 . . . . 62 ARG NE . 17066 1
691 . 1 1 64 64 PRO HA H 1 4.446 0.020 . 1 . . . . 63 PRO HA . 17066 1
692 . 1 1 64 64 PRO HB2 H 1 1.936 0.020 . 2 . . . . 63 PRO HB2 . 17066 1
693 . 1 1 64 64 PRO HB3 H 1 2.492 0.020 . 2 . . . . 63 PRO HB3 . 17066 1
694 . 1 1 64 64 PRO HD2 H 1 3.671 0.020 . 2 . . . . 63 PRO HD2 . 17066 1
695 . 1 1 64 64 PRO HD3 H 1 3.855 0.020 . 2 . . . . 63 PRO HD3 . 17066 1
696 . 1 1 64 64 PRO HG2 H 1 1.994 0.020 . 2 . . . . 63 PRO HG2 . 17066 1
697 . 1 1 64 64 PRO HG3 H 1 2.219 0.020 . 2 . . . . 63 PRO HG3 . 17066 1
698 . 1 1 64 64 PRO C C 13 179.892 0.400 . 1 . . . . 63 PRO C . 17066 1
699 . 1 1 64 64 PRO CA C 13 63.915 0.400 . 1 . . . . 63 PRO CA . 17066 1
700 . 1 1 64 64 PRO CB C 13 32.703 0.400 . 1 . . . . 63 PRO CB . 17066 1
701 . 1 1 64 64 PRO CD C 13 50.301 0.400 . 1 . . . . 63 PRO CD . 17066 1
702 . 1 1 64 64 PRO CG C 13 28.386 0.400 . 1 . . . . 63 PRO CG . 17066 1
703 . 1 1 65 65 CYS H H 1 8.321 0.020 . 1 . . . . 64 CYS H . 17066 1
704 . 1 1 65 65 CYS HA H 1 4.186 0.020 . 1 . . . . 64 CYS HA . 17066 1
705 . 1 1 65 65 CYS HB2 H 1 2.713 0.020 . 2 . . . . 64 CYS HB2 . 17066 1
706 . 1 1 65 65 CYS HB3 H 1 3.027 0.020 . 2 . . . . 64 CYS HB3 . 17066 1
707 . 1 1 65 65 CYS C C 13 172.029 0.400 . 1 . . . . 64 CYS C . 17066 1
708 . 1 1 65 65 CYS CA C 13 60.637 0.400 . 1 . . . . 64 CYS CA . 17066 1
709 . 1 1 65 65 CYS CB C 13 27.991 0.400 . 1 . . . . 64 CYS CB . 17066 1
710 . 1 1 65 65 CYS N N 15 119.562 0.400 . 1 . . . . 64 CYS N . 17066 1
711 . 1 1 66 66 THR H H 1 6.924 0.020 . 1 . . . . 65 THR H . 17066 1
712 . 1 1 66 66 THR HA H 1 3.701 0.020 . 1 . . . . 65 THR HA . 17066 1
713 . 1 1 66 66 THR HB H 1 4.315 0.020 . 1 . . . . 65 THR HB . 17066 1
714 . 1 1 66 66 THR HG21 H 1 1.093 0.020 . 1 . . . . 65 THR HG2 . 17066 1
715 . 1 1 66 66 THR HG22 H 1 1.093 0.020 . 1 . . . . 65 THR HG2 . 17066 1
716 . 1 1 66 66 THR HG23 H 1 1.093 0.020 . 1 . . . . 65 THR HG2 . 17066 1
717 . 1 1 66 66 THR C C 13 174.755 0.400 . 1 . . . . 65 THR C . 17066 1
718 . 1 1 66 66 THR CA C 13 62.919 0.400 . 1 . . . . 65 THR CA . 17066 1
719 . 1 1 66 66 THR CB C 13 67.567 0.400 . 1 . . . . 65 THR CB . 17066 1
720 . 1 1 66 66 THR CG2 C 13 23.380 0.400 . 1 . . . . 65 THR CG2 . 17066 1
721 . 1 1 66 66 THR N N 15 107.747 0.400 . 1 . . . . 65 THR N . 17066 1
722 . 1 1 67 67 CYS H H 1 8.193 0.020 . 1 . . . . 66 CYS H . 17066 1
723 . 1 1 67 67 CYS HA H 1 3.394 0.020 . 1 . . . . 66 CYS HA . 17066 1
724 . 1 1 67 67 CYS HB2 H 1 1.588 0.020 . 2 . . . . 66 CYS HB2 . 17066 1
725 . 1 1 67 67 CYS HB3 H 1 2.869 0.020 . 2 . . . . 66 CYS HB3 . 17066 1
726 . 1 1 67 67 CYS C C 13 174.676 0.400 . 1 . . . . 66 CYS C . 17066 1
727 . 1 1 67 67 CYS CA C 13 60.594 0.400 . 1 . . . . 66 CYS CA . 17066 1
728 . 1 1 67 67 CYS CB C 13 23.856 0.400 . 1 . . . . 66 CYS CB . 17066 1
729 . 1 1 67 67 CYS N N 15 110.810 0.400 . 1 . . . . 66 CYS N . 17066 1
730 . 1 1 68 68 ASP H H 1 8.221 0.020 . 1 . . . . 67 ASP H . 17066 1
731 . 1 1 68 68 ASP HB2 H 1 2.217 0.020 . 2 . . . . 67 ASP HB2 . 17066 1
732 . 1 1 68 68 ASP HB3 H 1 2.408 0.020 . 2 . . . . 67 ASP HB3 . 17066 1
733 . 1 1 68 68 ASP C C 13 177.185 0.400 . 1 . . . . 67 ASP C . 17066 1
734 . 1 1 68 68 ASP CA C 13 55.614 0.400 . 1 . . . . 67 ASP CA . 17066 1
735 . 1 1 68 68 ASP CB C 13 39.344 0.400 . 1 . . . . 67 ASP CB . 17066 1
736 . 1 1 68 68 ASP N N 15 117.100 0.400 . 1 . . . . 67 ASP N . 17066 1
737 . 1 1 69 69 PHE H H 1 6.887 0.020 . 1 . . . . 68 PHE H . 17066 1
738 . 1 1 69 69 PHE HA H 1 4.362 0.020 . 1 . . . . 68 PHE HA . 17066 1
739 . 1 1 69 69 PHE HB2 H 1 2.835 0.020 . 2 . . . . 68 PHE HB2 . 17066 1
740 . 1 1 69 69 PHE HB3 H 1 2.951 0.020 . 2 . . . . 68 PHE HB3 . 17066 1
741 . 1 1 69 69 PHE HD2 H 1 6.567 0.020 . 1 . . . . 68 PHE HD2 . 17066 1
742 . 1 1 69 69 PHE C C 13 175.427 0.400 . 1 . . . . 68 PHE C . 17066 1
743 . 1 1 69 69 PHE CA C 13 56.610 0.400 . 1 . . . . 68 PHE CA . 17066 1
744 . 1 1 69 69 PHE CB C 13 37.055 0.400 . 1 . . . . 68 PHE CB . 17066 1
745 . 1 1 69 69 PHE N N 15 113.775 0.400 . 1 . . . . 68 PHE N . 17066 1
746 . 1 1 70 70 LEU H H 1 7.477 0.020 . 1 . . . . 69 LEU H . 17066 1
747 . 1 1 70 70 LEU HA H 1 4.503 0.020 . 1 . . . . 69 LEU HA . 17066 1
748 . 1 1 70 70 LEU HB2 H 1 1.180 0.020 . 2 . . . . 69 LEU HB2 . 17066 1
749 . 1 1 70 70 LEU HB3 H 1 1.180 0.020 . 2 . . . . 69 LEU HB3 . 17066 1
750 . 1 1 70 70 LEU HD11 H 1 0.709 0.020 . 2 . . . . 69 LEU HD1 . 17066 1
751 . 1 1 70 70 LEU HD12 H 1 0.709 0.020 . 2 . . . . 69 LEU HD1 . 17066 1
752 . 1 1 70 70 LEU HD13 H 1 0.709 0.020 . 2 . . . . 69 LEU HD1 . 17066 1
753 . 1 1 70 70 LEU HD21 H 1 0.009 0.020 . 2 . . . . 69 LEU HD2 . 17066 1
754 . 1 1 70 70 LEU HD22 H 1 0.009 0.020 . 2 . . . . 69 LEU HD2 . 17066 1
755 . 1 1 70 70 LEU HD23 H 1 0.009 0.020 . 2 . . . . 69 LEU HD2 . 17066 1
756 . 1 1 70 70 LEU HG H 1 0.209 0.020 . 1 . . . . 69 LEU HG . 17066 1
757 . 1 1 70 70 LEU C C 13 176.691 0.400 . 1 . . . . 69 LEU C . 17066 1
758 . 1 1 70 70 LEU CA C 13 53.954 0.400 . 1 . . . . 69 LEU CA . 17066 1
759 . 1 1 70 70 LEU CB C 13 40.949 0.400 . 1 . . . . 69 LEU CB . 17066 1
760 . 1 1 70 70 LEU CD1 C 13 24.070 0.400 . 1 . . . . 69 LEU CD1 . 17066 1
761 . 1 1 70 70 LEU CD2 C 13 24.402 0.400 . 1 . . . . 69 LEU CD2 . 17066 1
762 . 1 1 70 70 LEU CG C 13 25.398 0.400 . 1 . . . . 69 LEU CG . 17066 1
763 . 1 1 70 70 LEU N N 15 119.124 0.400 . 1 . . . . 69 LEU N . 17066 1
764 . 1 1 71 71 HIS H H 1 7.592 0.020 . 1 . . . . 70 HIS H . 17066 1
765 . 1 1 71 71 HIS HA H 1 5.226 0.020 . 1 . . . . 70 HIS HA . 17066 1
766 . 1 1 71 71 HIS HB2 H 1 3.115 0.020 . 2 . . . . 70 HIS HB2 . 17066 1
767 . 1 1 71 71 HIS HB3 H 1 3.348 0.020 . 2 . . . . 70 HIS HB3 . 17066 1
768 . 1 1 71 71 HIS C C 13 176.296 0.400 . 1 . . . . 70 HIS C . 17066 1
769 . 1 1 71 71 HIS CA C 13 55.282 0.400 . 1 . . . . 70 HIS CA . 17066 1
770 . 1 1 71 71 HIS CB C 13 32.371 0.400 . 1 . . . . 70 HIS CB . 17066 1
771 . 1 1 71 71 HIS N N 15 117.704 0.400 . 1 . . . . 70 HIS N . 17066 1
772 . 1 1 72 72 GLY H H 1 8.814 0.020 . 1 . . . . 71 GLY H . 17066 1
773 . 1 1 72 72 GLY HA2 H 1 3.985 0.020 . 2 . . . . 71 GLY HA2 . 17066 1
774 . 1 1 72 72 GLY HA3 H 1 2.562 0.020 . 2 . . . . 71 GLY HA3 . 17066 1
775 . 1 1 72 72 GLY C C 13 173.003 0.400 . 1 . . . . 71 GLY C . 17066 1
776 . 1 1 72 72 GLY CA C 13 45.321 0.400 . 1 . . . . 71 GLY CA . 17066 1
777 . 1 1 72 72 GLY N N 15 110.372 0.400 . 1 . . . . 71 GLY N . 17066 1
778 . 1 1 73 73 PRO HA H 1 4.159 0.020 . 1 . . . . 72 PRO HA . 17066 1
779 . 1 1 73 73 PRO HB2 H 1 1.847 0.020 . 2 . . . . 72 PRO HB2 . 17066 1
780 . 1 1 73 73 PRO HB3 H 1 2.385 0.020 . 2 . . . . 72 PRO HB3 . 17066 1
781 . 1 1 73 73 PRO HD2 H 1 2.935 0.020 . 2 . . . . 72 PRO HD2 . 17066 1
782 . 1 1 73 73 PRO HD3 H 1 3.205 0.020 . 2 . . . . 72 PRO HD3 . 17066 1
783 . 1 1 73 73 PRO HG2 H 1 1.901 0.020 . 2 . . . . 72 PRO HG2 . 17066 1
784 . 1 1 73 73 PRO HG3 H 1 2.082 0.020 . 2 . . . . 72 PRO HG3 . 17066 1
785 . 1 1 73 73 PRO C C 13 178.272 0.400 . 1 . . . . 72 PRO C . 17066 1
786 . 1 1 73 73 PRO CA C 13 66.708 0.400 . 1 . . . . 72 PRO CA . 17066 1
787 . 1 1 73 73 PRO CB C 13 32.371 0.400 . 1 . . . . 72 PRO CB . 17066 1
788 . 1 1 73 73 PRO CD C 13 48.973 0.400 . 1 . . . . 72 PRO CD . 17066 1
789 . 1 1 73 73 PRO CG C 13 27.058 0.400 . 1 . . . . 72 PRO CG . 17066 1
790 . 1 1 74 74 ARG H H 1 8.628 0.020 . 1 . . . . 73 ARG H . 17066 1
791 . 1 1 74 74 ARG HA H 1 4.197 0.020 . 1 . . . . 73 ARG HA . 17066 1
792 . 1 1 74 74 ARG HB2 H 1 1.658 0.020 . 2 . . . . 73 ARG HB2 . 17066 1
793 . 1 1 74 74 ARG HB3 H 1 1.975 0.020 . 2 . . . . 73 ARG HB3 . 17066 1
794 . 1 1 74 74 ARG HD2 H 1 3.132 0.020 . 2 . . . . 73 ARG HD2 . 17066 1
795 . 1 1 74 74 ARG HD3 H 1 3.204 0.020 . 2 . . . . 73 ARG HD3 . 17066 1
796 . 1 1 74 74 ARG HG2 H 1 1.657 0.020 . 2 . . . . 73 ARG HG2 . 17066 1
797 . 1 1 74 74 ARG HG3 H 1 1.679 0.020 . 2 . . . . 73 ARG HG3 . 17066 1
798 . 1 1 74 74 ARG C C 13 176.533 0.400 . 1 . . . . 73 ARG C . 17066 1
799 . 1 1 74 74 ARG CA C 13 56.701 0.400 . 1 . . . . 73 ARG CA . 17066 1
800 . 1 1 74 74 ARG CB C 13 30.247 0.400 . 1 . . . . 73 ARG CB . 17066 1
801 . 1 1 74 74 ARG CD C 13 43.660 0.400 . 1 . . . . 73 ARG CD . 17066 1
802 . 1 1 74 74 ARG CG C 13 27.797 0.400 . 1 . . . . 73 ARG CG . 17066 1
803 . 1 1 74 74 ARG N N 15 111.487 0.400 . 1 . . . . 73 ARG N . 17066 1
804 . 1 1 75 75 THR H H 1 8.294 0.020 . 1 . . . . 74 THR H . 17066 1
805 . 1 1 75 75 THR HA H 1 3.973 0.020 . 1 . . . . 74 THR HA . 17066 1
806 . 1 1 75 75 THR HB H 1 4.144 0.020 . 1 . . . . 74 THR HB . 17066 1
807 . 1 1 75 75 THR HG21 H 1 0.722 0.020 . 1 . . . . 74 THR HG2 . 17066 1
808 . 1 1 75 75 THR HG22 H 1 0.722 0.020 . 1 . . . . 74 THR HG2 . 17066 1
809 . 1 1 75 75 THR HG23 H 1 0.722 0.020 . 1 . . . . 74 THR HG2 . 17066 1
810 . 1 1 75 75 THR C C 13 174.459 0.400 . 1 . . . . 74 THR C . 17066 1
811 . 1 1 75 75 THR CA C 13 64.402 0.400 . 1 . . . . 74 THR CA . 17066 1
812 . 1 1 75 75 THR CB C 13 68.231 0.400 . 1 . . . . 74 THR CB . 17066 1
813 . 1 1 75 75 THR CG2 C 13 21.082 0.400 . 1 . . . . 74 THR CG2 . 17066 1
814 . 1 1 75 75 THR N N 15 119.562 0.400 . 1 . . . . 74 THR N . 17066 1
815 . 1 1 76 76 GLN H H 1 9.188 0.020 . 1 . . . . 75 GLN H . 17066 1
816 . 1 1 76 76 GLN HA H 1 4.229 0.020 . 1 . . . . 75 GLN HA . 17066 1
817 . 1 1 76 76 GLN HB2 H 1 2.014 0.020 . 2 . . . . 75 GLN HB2 . 17066 1
818 . 1 1 76 76 GLN HB3 H 1 2.198 0.020 . 2 . . . . 75 GLN HB3 . 17066 1
819 . 1 1 76 76 GLN HE21 H 1 6.629 0.020 . 2 . . . . 75 GLN HE21 . 17066 1
820 . 1 1 76 76 GLN HE22 H 1 7.554 0.020 . 2 . . . . 75 GLN HE22 . 17066 1
821 . 1 1 76 76 GLN HG2 H 1 2.538 0.020 . 2 . . . . 75 GLN HG2 . 17066 1
822 . 1 1 76 76 GLN HG3 H 1 2.538 0.020 . 2 . . . . 75 GLN HG3 . 17066 1
823 . 1 1 76 76 GLN C C 13 176.908 0.400 . 1 . . . . 75 GLN C . 17066 1
824 . 1 1 76 76 GLN CA C 13 56.397 0.400 . 1 . . . . 75 GLN CA . 17066 1
825 . 1 1 76 76 GLN CB C 13 28.386 0.400 . 1 . . . . 75 GLN CB . 17066 1
826 . 1 1 76 76 GLN CG C 13 34.031 0.400 . 1 . . . . 75 GLN CG . 17066 1
827 . 1 1 76 76 GLN N N 15 130.873 0.400 . 1 . . . . 75 GLN N . 17066 1
828 . 1 1 76 76 GLN NE2 N 15 112.123 0.400 . 1 . . . . 75 GLN NE2 . 17066 1
829 . 1 1 77 77 ARG H H 1 9.014 0.020 . 1 . . . . 76 ARG H . 17066 1
830 . 1 1 77 77 ARG HA H 1 3.895 0.020 . 1 . . . . 76 ARG HA . 17066 1
831 . 1 1 77 77 ARG HB2 H 1 1.848 0.020 . 2 . . . . 76 ARG HB2 . 17066 1
832 . 1 1 77 77 ARG HB3 H 1 1.888 0.020 . 2 . . . . 76 ARG HB3 . 17066 1
833 . 1 1 77 77 ARG HD2 H 1 3.188 0.020 . 2 . . . . 76 ARG HD2 . 17066 1
834 . 1 1 77 77 ARG HD3 H 1 3.188 0.020 . 2 . . . . 76 ARG HD3 . 17066 1
835 . 1 1 77 77 ARG HG2 H 1 1.709 0.020 . 2 . . . . 76 ARG HG2 . 17066 1
836 . 1 1 77 77 ARG HG3 H 1 1.771 0.020 . 2 . . . . 76 ARG HG3 . 17066 1
837 . 1 1 77 77 ARG CA C 13 58.934 0.400 . 1 . . . . 76 ARG CA . 17066 1
838 . 1 1 77 77 ARG CB C 13 29.051 0.400 . 1 . . . . 76 ARG CB . 17066 1
839 . 1 1 77 77 ARG CD C 13 42.664 0.400 . 1 . . . . 76 ARG CD . 17066 1
840 . 1 1 77 77 ARG CG C 13 26.726 0.400 . 1 . . . . 76 ARG CG . 17066 1
841 . 1 1 77 77 ARG N N 15 127.575 0.400 . 1 . . . . 76 ARG N . 17066 1
842 . 1 1 78 78 ARG HA H 1 4.050 0.020 . 1 . . . . 77 ARG HA . 17066 1
843 . 1 1 78 78 ARG HB2 H 1 1.731 0.020 . 2 . . . . 77 ARG HB2 . 17066 1
844 . 1 1 78 78 ARG HB3 H 1 1.849 0.020 . 2 . . . . 77 ARG HB3 . 17066 1
845 . 1 1 78 78 ARG HD2 H 1 3.151 0.020 . 2 . . . . 77 ARG HD2 . 17066 1
846 . 1 1 78 78 ARG HD3 H 1 3.151 0.020 . 2 . . . . 77 ARG HD3 . 17066 1
847 . 1 1 78 78 ARG HG2 H 1 1.544 0.020 . 2 . . . . 77 ARG HG2 . 17066 1
848 . 1 1 78 78 ARG HG3 H 1 1.644 0.020 . 2 . . . . 77 ARG HG3 . 17066 1
849 . 1 1 78 78 ARG C C 13 177.995 0.400 . 1 . . . . 77 ARG C . 17066 1
850 . 1 1 78 78 ARG CA C 13 59.094 0.400 . 1 . . . . 77 ARG CA . 17066 1
851 . 1 1 78 78 ARG CB C 13 29.586 0.400 . 1 . . . . 77 ARG CB . 17066 1
852 . 1 1 78 78 ARG CD C 13 42.996 0.400 . 1 . . . . 77 ARG CD . 17066 1
853 . 1 1 78 78 ARG CG C 13 27.044 0.400 . 1 . . . . 77 ARG CG . 17066 1
854 . 1 1 79 79 ALA H H 1 6.683 0.020 . 1 . . . . 78 ALA H . 17066 1
855 . 1 1 79 79 ALA HA H 1 4.197 0.020 . 1 . . . . 78 ALA HA . 17066 1
856 . 1 1 79 79 ALA HB1 H 1 1.414 0.020 . 1 . . . . 78 ALA HB . 17066 1
857 . 1 1 79 79 ALA HB2 H 1 1.414 0.020 . 1 . . . . 78 ALA HB . 17066 1
858 . 1 1 79 79 ALA HB3 H 1 1.414 0.020 . 1 . . . . 78 ALA HB . 17066 1
859 . 1 1 79 79 ALA C C 13 178.924 0.400 . 1 . . . . 78 ALA C . 17066 1
860 . 1 1 79 79 ALA CA C 13 54.587 0.400 . 1 . . . . 78 ALA CA . 17066 1
861 . 1 1 79 79 ALA CB C 13 18.425 0.400 . 1 . . . . 78 ALA CB . 17066 1
862 . 1 1 79 79 ALA N N 15 121.969 0.400 . 1 . . . . 78 ALA N . 17066 1
863 . 1 1 80 80 ALA H H 1 7.820 0.020 . 1 . . . . 79 ALA H . 17066 1
864 . 1 1 80 80 ALA HA H 1 3.798 0.020 . 1 . . . . 79 ALA HA . 17066 1
865 . 1 1 80 80 ALA HB1 H 1 1.327 0.020 . 1 . . . . 79 ALA HB . 17066 1
866 . 1 1 80 80 ALA HB2 H 1 1.327 0.020 . 1 . . . . 79 ALA HB . 17066 1
867 . 1 1 80 80 ALA HB3 H 1 1.327 0.020 . 1 . . . . 79 ALA HB . 17066 1
868 . 1 1 80 80 ALA C C 13 181.077 0.400 . 1 . . . . 79 ALA C . 17066 1
869 . 1 1 80 80 ALA CA C 13 54.950 0.400 . 1 . . . . 79 ALA CA . 17066 1
870 . 1 1 80 80 ALA CB C 13 17.429 0.400 . 1 . . . . 79 ALA CB . 17066 1
871 . 1 1 80 80 ALA N N 15 120.565 0.400 . 1 . . . . 79 ALA N . 17066 1
872 . 1 1 81 81 ALA H H 1 8.349 0.020 . 1 . . . . 80 ALA H . 17066 1
873 . 1 1 81 81 ALA HA H 1 4.172 0.020 . 1 . . . . 80 ALA HA . 17066 1
874 . 1 1 81 81 ALA HB1 H 1 1.455 0.020 . 1 . . . . 80 ALA HB . 17066 1
875 . 1 1 81 81 ALA HB2 H 1 1.455 0.020 . 1 . . . . 80 ALA HB . 17066 1
876 . 1 1 81 81 ALA HB3 H 1 1.455 0.020 . 1 . . . . 80 ALA HB . 17066 1
877 . 1 1 81 81 ALA C C 13 179.971 0.400 . 1 . . . . 80 ALA C . 17066 1
878 . 1 1 81 81 ALA CA C 13 54.703 0.400 . 1 . . . . 80 ALA CA . 17066 1
879 . 1 1 81 81 ALA CB C 13 17.718 0.400 . 1 . . . . 80 ALA CB . 17066 1
880 . 1 1 81 81 ALA N N 15 121.204 0.400 . 1 . . . . 80 ALA N . 17066 1
881 . 1 1 82 82 GLN H H 1 7.752 0.020 . 1 . . . . 81 GLN H . 17066 1
882 . 1 1 82 82 GLN HA H 1 3.977 0.020 . 1 . . . . 81 GLN HA . 17066 1
883 . 1 1 82 82 GLN HB2 H 1 2.454 0.020 . 2 . . . . 81 GLN HB2 . 17066 1
884 . 1 1 82 82 GLN HB3 H 1 1.887 0.020 . 2 . . . . 81 GLN HB3 . 17066 1
885 . 1 1 82 82 GLN HE21 H 1 6.795 0.020 . 2 . . . . 81 GLN HE21 . 17066 1
886 . 1 1 82 82 GLN HE22 H 1 7.243 0.020 . 2 . . . . 81 GLN HE22 . 17066 1
887 . 1 1 82 82 GLN HG2 H 1 2.328 0.020 . 2 . . . . 81 GLN HG2 . 17066 1
888 . 1 1 82 82 GLN HG3 H 1 2.660 0.020 . 2 . . . . 81 GLN HG3 . 17066 1
889 . 1 1 82 82 GLN C C 13 179.635 0.400 . 1 . . . . 81 GLN C . 17066 1
890 . 1 1 82 82 GLN CA C 13 59.189 0.400 . 1 . . . . 81 GLN CA . 17066 1
891 . 1 1 82 82 GLN CB C 13 29.383 0.400 . 1 . . . . 81 GLN CB . 17066 1
892 . 1 1 82 82 GLN CG C 13 34.695 0.400 . 1 . . . . 81 GLN CG . 17066 1
893 . 1 1 82 82 GLN N N 15 118.468 0.400 . 1 . . . . 81 GLN N . 17066 1
894 . 1 1 82 82 GLN NE2 N 15 111.029 0.400 . 1 . . . . 81 GLN NE2 . 17066 1
895 . 1 1 83 83 ILE H H 1 7.556 0.020 . 1 . . . . 82 ILE H . 17066 1
896 . 1 1 83 83 ILE HA H 1 3.350 0.020 . 1 . . . . 82 ILE HA . 17066 1
897 . 1 1 83 83 ILE HB H 1 1.915 0.020 . 1 . . . . 82 ILE HB . 17066 1
898 . 1 1 83 83 ILE HD11 H 1 0.827 0.020 . 1 . . . . 82 ILE HD1 . 17066 1
899 . 1 1 83 83 ILE HD12 H 1 0.827 0.020 . 1 . . . . 82 ILE HD1 . 17066 1
900 . 1 1 83 83 ILE HD13 H 1 0.827 0.020 . 1 . . . . 82 ILE HD1 . 17066 1
901 . 1 1 83 83 ILE HG12 H 1 0.562 0.020 . 2 . . . . 82 ILE HG12 . 17066 1
902 . 1 1 83 83 ILE HG13 H 1 1.791 0.020 . 2 . . . . 82 ILE HG13 . 17066 1
903 . 1 1 83 83 ILE HG21 H 1 0.697 0.020 . 1 . . . . 82 ILE HG2 . 17066 1
904 . 1 1 83 83 ILE HG22 H 1 0.697 0.020 . 1 . . . . 82 ILE HG2 . 17066 1
905 . 1 1 83 83 ILE HG23 H 1 0.697 0.020 . 1 . . . . 82 ILE HG2 . 17066 1
906 . 1 1 83 83 ILE C C 13 176.257 0.400 . 1 . . . . 82 ILE C . 17066 1
907 . 1 1 83 83 ILE CA C 13 66.276 0.400 . 1 . . . . 82 ILE CA . 17066 1
908 . 1 1 83 83 ILE CB C 13 37.684 0.400 . 1 . . . . 82 ILE CB . 17066 1
909 . 1 1 83 83 ILE CD1 C 13 13.445 0.400 . 1 . . . . 82 ILE CD1 . 17066 1
910 . 1 1 83 83 ILE CG1 C 13 30.047 0.400 . 1 . . . . 82 ILE CG1 . 17066 1
911 . 1 1 83 83 ILE CG2 C 13 16.101 0.400 . 1 . . . . 82 ILE CG2 . 17066 1
912 . 1 1 83 83 ILE N N 15 120.875 0.400 . 1 . . . . 82 ILE N . 17066 1
913 . 1 1 84 84 ALA H H 1 7.425 0.020 . 1 . . . . 83 ALA H . 17066 1
914 . 1 1 84 84 ALA HA H 1 3.755 0.020 . 1 . . . . 83 ALA HA . 17066 1
915 . 1 1 84 84 ALA HB1 H 1 1.414 0.020 . 1 . . . . 83 ALA HB . 17066 1
916 . 1 1 84 84 ALA HB2 H 1 1.414 0.020 . 1 . . . . 83 ALA HB . 17066 1
917 . 1 1 84 84 ALA HB3 H 1 1.414 0.020 . 1 . . . . 83 ALA HB . 17066 1
918 . 1 1 84 84 ALA C C 13 180.662 0.400 . 1 . . . . 83 ALA C . 17066 1
919 . 1 1 84 84 ALA CA C 13 55.319 0.400 . 1 . . . . 83 ALA CA . 17066 1
920 . 1 1 84 84 ALA CB C 13 17.429 0.400 . 1 . . . . 83 ALA CB . 17066 1
921 . 1 1 84 84 ALA N N 15 119.316 0.400 . 1 . . . . 83 ALA N . 17066 1
922 . 1 1 85 85 GLN H H 1 8.378 0.020 . 1 . . . . 84 GLN H . 17066 1
923 . 1 1 85 85 GLN HA H 1 3.879 0.020 . 1 . . . . 84 GLN HA . 17066 1
924 . 1 1 85 85 GLN HB2 H 1 1.981 0.020 . 2 . . . . 84 GLN HB2 . 17066 1
925 . 1 1 85 85 GLN HB3 H 1 2.069 0.020 . 2 . . . . 84 GLN HB3 . 17066 1
926 . 1 1 85 85 GLN HE21 H 1 6.795 0.020 . 2 . . . . 84 GLN HE21 . 17066 1
927 . 1 1 85 85 GLN HE22 H 1 7.406 0.020 . 2 . . . . 84 GLN HE22 . 17066 1
928 . 1 1 85 85 GLN HG2 H 1 2.377 0.020 . 2 . . . . 84 GLN HG2 . 17066 1
929 . 1 1 85 85 GLN HG3 H 1 2.417 0.020 . 2 . . . . 84 GLN HG3 . 17066 1
930 . 1 1 85 85 GLN C C 13 179.180 0.400 . 1 . . . . 84 GLN C . 17066 1
931 . 1 1 85 85 GLN CA C 13 57.938 0.400 . 1 . . . . 84 GLN CA . 17066 1
932 . 1 1 85 85 GLN CB C 13 28.402 0.400 . 1 . . . . 84 GLN CB . 17066 1
933 . 1 1 85 85 GLN CG C 13 34.082 0.400 . 1 . . . . 84 GLN CG . 17066 1
934 . 1 1 85 85 GLN N N 15 115.737 0.400 . 1 . . . . 84 GLN N . 17066 1
935 . 1 1 85 85 GLN NE2 N 15 111.904 0.400 . 1 . . . . 84 GLN NE2 . 17066 1
936 . 1 1 86 86 ALA H H 1 7.804 0.020 . 1 . . . . 85 ALA H . 17066 1
937 . 1 1 86 86 ALA HA H 1 4.025 0.020 . 1 . . . . 85 ALA HA . 17066 1
938 . 1 1 86 86 ALA HB1 H 1 1.390 0.020 . 1 . . . . 85 ALA HB . 17066 1
939 . 1 1 86 86 ALA HB2 H 1 1.390 0.020 . 1 . . . . 85 ALA HB . 17066 1
940 . 1 1 86 86 ALA HB3 H 1 1.390 0.020 . 1 . . . . 85 ALA HB . 17066 1
941 . 1 1 86 86 ALA C C 13 179.753 0.400 . 1 . . . . 85 ALA C . 17066 1
942 . 1 1 86 86 ALA CA C 13 54.376 0.400 . 1 . . . . 85 ALA CA . 17066 1
943 . 1 1 86 86 ALA CB C 13 17.828 0.400 . 1 . . . . 85 ALA CB . 17066 1
944 . 1 1 86 86 ALA N N 15 123.717 0.400 . 1 . . . . 85 ALA N . 17066 1
945 . 1 1 87 87 LEU H H 1 7.002 0.020 . 1 . . . . 86 LEU H . 17066 1
946 . 1 1 87 87 LEU HA H 1 3.419 0.020 . 1 . . . . 86 LEU HA . 17066 1
947 . 1 1 87 87 LEU HB2 H 1 1.218 0.020 . 2 . . . . 86 LEU HB2 . 17066 1
948 . 1 1 87 87 LEU HB3 H 1 1.531 0.020 . 2 . . . . 86 LEU HB3 . 17066 1
949 . 1 1 87 87 LEU HD11 H 1 0.531 0.020 . 2 . . . . 86 LEU HD1 . 17066 1
950 . 1 1 87 87 LEU HD12 H 1 0.531 0.020 . 2 . . . . 86 LEU HD1 . 17066 1
951 . 1 1 87 87 LEU HD13 H 1 0.531 0.020 . 2 . . . . 86 LEU HD1 . 17066 1
952 . 1 1 87 87 LEU HD21 H 1 -0.311 0.020 . 2 . . . . 86 LEU HD2 . 17066 1
953 . 1 1 87 87 LEU HD22 H 1 -0.311 0.020 . 2 . . . . 86 LEU HD2 . 17066 1
954 . 1 1 87 87 LEU HD23 H 1 -0.311 0.020 . 2 . . . . 86 LEU HD2 . 17066 1
955 . 1 1 87 87 LEU HG H 1 1.544 0.020 . 1 . . . . 86 LEU HG . 17066 1
956 . 1 1 87 87 LEU C C 13 177.284 0.400 . 1 . . . . 86 LEU C . 17066 1
957 . 1 1 87 87 LEU CA C 13 55.409 0.400 . 1 . . . . 86 LEU CA . 17066 1
958 . 1 1 87 87 LEU CB C 13 40.340 0.400 . 1 . . . . 86 LEU CB . 17066 1
959 . 1 1 87 87 LEU CD1 C 13 27.390 0.400 . 1 . . . . 86 LEU CD1 . 17066 1
960 . 1 1 87 87 LEU CD2 C 13 21.082 0.400 . 1 . . . . 86 LEU CD2 . 17066 1
961 . 1 1 87 87 LEU CG C 13 25.398 0.400 . 1 . . . . 86 LEU CG . 17066 1
962 . 1 1 87 87 LEU N N 15 114.748 0.400 . 1 . . . . 86 LEU N . 17066 1
963 . 1 1 88 88 LEU H H 1 7.291 0.020 . 1 . . . . 87 LEU H . 17066 1
964 . 1 1 88 88 LEU HA H 1 4.362 0.020 . 1 . . . . 87 LEU HA . 17066 1
965 . 1 1 88 88 LEU HB2 H 1 1.630 0.020 . 2 . . . . 87 LEU HB2 . 17066 1
966 . 1 1 88 88 LEU HB3 H 1 1.730 0.020 . 2 . . . . 87 LEU HB3 . 17066 1
967 . 1 1 88 88 LEU HD11 H 1 0.809 0.020 . 2 . . . . 87 LEU HD1 . 17066 1
968 . 1 1 88 88 LEU HD12 H 1 0.809 0.020 . 2 . . . . 87 LEU HD1 . 17066 1
969 . 1 1 88 88 LEU HD13 H 1 0.809 0.020 . 2 . . . . 87 LEU HD1 . 17066 1
970 . 1 1 88 88 LEU HD21 H 1 0.847 0.020 . 2 . . . . 87 LEU HD2 . 17066 1
971 . 1 1 88 88 LEU HD22 H 1 0.847 0.020 . 2 . . . . 87 LEU HD2 . 17066 1
972 . 1 1 88 88 LEU HD23 H 1 0.847 0.020 . 2 . . . . 87 LEU HD2 . 17066 1
973 . 1 1 88 88 LEU HG H 1 1.659 0.020 . 1 . . . . 87 LEU HG . 17066 1
974 . 1 1 88 88 LEU C C 13 178.212 0.400 . 1 . . . . 87 LEU C . 17066 1
975 . 1 1 88 88 LEU CA C 13 54.950 0.400 . 1 . . . . 87 LEU CA . 17066 1
976 . 1 1 88 88 LEU CB C 13 42.073 0.400 . 1 . . . . 87 LEU CB . 17066 1
977 . 1 1 88 88 LEU CD1 C 13 22.742 0.400 . 1 . . . . 87 LEU CD1 . 17066 1
978 . 1 1 88 88 LEU CD2 C 13 25.066 0.400 . 1 . . . . 87 LEU CD2 . 17066 1
979 . 1 1 88 88 LEU CG C 13 26.394 0.400 . 1 . . . . 87 LEU CG . 17066 1
980 . 1 1 88 88 LEU N N 15 117.008 0.400 . 1 . . . . 87 LEU N . 17066 1
981 . 1 1 89 89 GLY H H 1 7.550 0.020 . 1 . . . . 88 GLY H . 17066 1
982 . 1 1 89 89 GLY HA2 H 1 4.496 0.020 . 2 . . . . 88 GLY HA2 . 17066 1
983 . 1 1 89 89 GLY HA3 H 1 3.725 0.020 . 2 . . . . 88 GLY HA3 . 17066 1
984 . 1 1 89 89 GLY C C 13 172.878 0.400 . 1 . . . . 88 GLY C . 17066 1
985 . 1 1 89 89 GLY CA C 13 44.324 0.400 . 1 . . . . 88 GLY CA . 17066 1
986 . 1 1 89 89 GLY N N 15 107.528 0.400 . 1 . . . . 88 GLY N . 17066 1
987 . 1 1 90 90 ALA H H 1 8.165 0.020 . 1 . . . . 89 ALA H . 17066 1
988 . 1 1 90 90 ALA HA H 1 4.452 0.020 . 1 . . . . 89 ALA HA . 17066 1
989 . 1 1 90 90 ALA HB1 H 1 1.302 0.020 . 1 . . . . 89 ALA HB . 17066 1
990 . 1 1 90 90 ALA HB2 H 1 1.302 0.020 . 1 . . . . 89 ALA HB . 17066 1
991 . 1 1 90 90 ALA HB3 H 1 1.302 0.020 . 1 . . . . 89 ALA HB . 17066 1
992 . 1 1 90 90 ALA C C 13 175.723 0.400 . 1 . . . . 89 ALA C . 17066 1
993 . 1 1 90 90 ALA CA C 13 50.965 0.400 . 1 . . . . 89 ALA CA . 17066 1
994 . 1 1 90 90 ALA CB C 13 19.421 0.400 . 1 . . . . 89 ALA CB . 17066 1
995 . 1 1 90 90 ALA N N 15 119.999 0.400 . 1 . . . . 89 ALA N . 17066 1
996 . 1 1 91 91 GLU H H 1 7.973 0.020 . 1 . . . . 90 GLU H . 17066 1
997 . 1 1 91 91 GLU HA H 1 4.656 0.020 . 1 . . . . 90 GLU HA . 17066 1
998 . 1 1 91 91 GLU HB2 H 1 1.745 0.020 . 2 . . . . 90 GLU HB2 . 17066 1
999 . 1 1 91 91 GLU HB3 H 1 2.008 0.020 . 2 . . . . 90 GLU HB3 . 17066 1
1000 . 1 1 91 91 GLU HG2 H 1 2.191 0.020 . 2 . . . . 90 GLU HG2 . 17066 1
1001 . 1 1 91 91 GLU HG3 H 1 2.191 0.020 . 2 . . . . 90 GLU HG3 . 17066 1
1002 . 1 1 91 91 GLU C C 13 175.071 0.400 . 1 . . . . 90 GLU C . 17066 1
1003 . 1 1 91 91 GLU CA C 13 54.286 0.400 . 1 . . . . 90 GLU CA . 17066 1
1004 . 1 1 91 91 GLU CB C 13 33.367 0.400 . 1 . . . . 90 GLU CB . 17066 1
1005 . 1 1 91 91 GLU CG C 13 36.023 0.400 . 1 . . . . 90 GLU CG . 17066 1
1006 . 1 1 91 91 GLU N N 15 117.811 0.400 . 1 . . . . 90 GLU N . 17066 1
1007 . 1 1 92 92 GLU H H 1 8.635 0.020 . 1 . . . . 91 GLU H . 17066 1
1008 . 1 1 92 92 GLU HA H 1 5.019 0.020 . 1 . . . . 91 GLU HA . 17066 1
1009 . 1 1 92 92 GLU HB2 H 1 1.993 0.020 . 2 . . . . 91 GLU HB2 . 17066 1
1010 . 1 1 92 92 GLU HB3 H 1 2.024 0.020 . 2 . . . . 91 GLU HB3 . 17066 1
1011 . 1 1 92 92 GLU HG2 H 1 2.261 0.020 . 2 . . . . 91 GLU HG2 . 17066 1
1012 . 1 1 92 92 GLU HG3 H 1 2.494 0.020 . 2 . . . . 91 GLU HG3 . 17066 1
1013 . 1 1 92 92 GLU C C 13 176.652 0.400 . 1 . . . . 91 GLU C . 17066 1
1014 . 1 1 92 92 GLU CA C 13 55.946 0.400 . 1 . . . . 91 GLU CA . 17066 1
1015 . 1 1 92 92 GLU CB C 13 29.715 0.400 . 1 . . . . 91 GLU CB . 17066 1
1016 . 1 1 92 92 GLU CG C 13 36.023 0.400 . 1 . . . . 91 GLU CG . 17066 1
1017 . 1 1 92 92 GLU N N 15 123.033 0.400 . 1 . . . . 91 GLU N . 17066 1
1018 . 1 1 93 93 ARG H H 1 8.376 0.020 . 1 . . . . 92 ARG H . 17066 1
1019 . 1 1 93 93 ARG HA H 1 4.647 0.020 . 1 . . . . 92 ARG HA . 17066 1
1020 . 1 1 93 93 ARG HB2 H 1 1.526 0.020 . 2 . . . . 92 ARG HB2 . 17066 1
1021 . 1 1 93 93 ARG HB3 H 1 1.588 0.020 . 2 . . . . 92 ARG HB3 . 17066 1
1022 . 1 1 93 93 ARG HD2 H 1 3.081 0.020 . 2 . . . . 92 ARG HD2 . 17066 1
1023 . 1 1 93 93 ARG HD3 H 1 3.307 0.020 . 2 . . . . 92 ARG HD3 . 17066 1
1024 . 1 1 93 93 ARG HG2 H 1 1.553 0.020 . 2 . . . . 92 ARG HG2 . 17066 1
1025 . 1 1 93 93 ARG HG3 H 1 1.553 0.020 . 2 . . . . 92 ARG HG3 . 17066 1
1026 . 1 1 93 93 ARG C C 13 173.333 0.400 . 1 . . . . 92 ARG C . 17066 1
1027 . 1 1 93 93 ARG CA C 13 54.286 0.400 . 1 . . . . 92 ARG CA . 17066 1
1028 . 1 1 93 93 ARG CB C 13 35.027 0.400 . 1 . . . . 92 ARG CB . 17066 1
1029 . 1 1 93 93 ARG CD C 13 42.664 0.400 . 1 . . . . 92 ARG CD . 17066 1
1030 . 1 1 93 93 ARG CG C 13 26.726 0.400 . 1 . . . . 92 ARG CG . 17066 1
1031 . 1 1 93 93 ARG N N 15 125.439 0.400 . 1 . . . . 92 ARG N . 17066 1
1032 . 1 1 93 93 ARG NE N 15 112.779 0.400 . 1 . . . . 92 ARG NE . 17066 1
1033 . 1 1 94 94 LYS H H 1 8.363 0.020 . 1 . . . . 93 LYS H . 17066 1
1034 . 1 1 94 94 LYS HA H 1 5.584 0.020 . 1 . . . . 93 LYS HA . 17066 1
1035 . 1 1 94 94 LYS HB2 H 1 1.551 0.020 . 2 . . . . 93 LYS HB2 . 17066 1
1036 . 1 1 94 94 LYS HB3 H 1 1.631 0.020 . 2 . . . . 93 LYS HB3 . 17066 1
1037 . 1 1 94 94 LYS HD2 H 1 1.553 0.020 . 2 . . . . 93 LYS HD2 . 17066 1
1038 . 1 1 94 94 LYS HD3 H 1 1.597 0.020 . 2 . . . . 93 LYS HD3 . 17066 1
1039 . 1 1 94 94 LYS HE2 H 1 2.838 0.020 . 2 . . . . 93 LYS HE2 . 17066 1
1040 . 1 1 94 94 LYS HE3 H 1 2.838 0.020 . 2 . . . . 93 LYS HE3 . 17066 1
1041 . 1 1 94 94 LYS HG2 H 1 1.236 0.020 . 2 . . . . 93 LYS HG2 . 17066 1
1042 . 1 1 94 94 LYS HG3 H 1 1.344 0.020 . 2 . . . . 93 LYS HG3 . 17066 1
1043 . 1 1 94 94 LYS C C 13 176.375 0.400 . 1 . . . . 93 LYS C . 17066 1
1044 . 1 1 94 94 LYS CA C 13 54.912 0.400 . 1 . . . . 93 LYS CA . 17066 1
1045 . 1 1 94 94 LYS CB C 13 35.027 0.400 . 1 . . . . 93 LYS CB . 17066 1
1046 . 1 1 94 94 LYS CD C 13 29.383 0.400 . 1 . . . . 93 LYS CD . 17066 1
1047 . 1 1 94 94 LYS CE C 13 41.336 0.400 . 1 . . . . 93 LYS CE . 17066 1
1048 . 1 1 94 94 LYS CG C 13 25.066 0.400 . 1 . . . . 93 LYS CG . 17066 1
1049 . 1 1 94 94 LYS N N 15 121.939 0.400 . 1 . . . . 93 LYS N . 17066 1
1050 . 1 1 95 95 VAL H H 1 9.084 0.020 . 1 . . . . 94 VAL H . 17066 1
1051 . 1 1 95 95 VAL HA H 1 4.171 0.020 . 1 . . . . 94 VAL HA . 17066 1
1052 . 1 1 95 95 VAL HB H 1 1.582 0.020 . 1 . . . . 94 VAL HB . 17066 1
1053 . 1 1 95 95 VAL HG11 H 1 0.637 0.020 . 2 . . . . 94 VAL HG1 . 17066 1
1054 . 1 1 95 95 VAL HG12 H 1 0.637 0.020 . 2 . . . . 94 VAL HG1 . 17066 1
1055 . 1 1 95 95 VAL HG13 H 1 0.637 0.020 . 2 . . . . 94 VAL HG1 . 17066 1
1056 . 1 1 95 95 VAL HG21 H 1 0.842 0.020 . 2 . . . . 94 VAL HG2 . 17066 1
1057 . 1 1 95 95 VAL HG22 H 1 0.842 0.020 . 2 . . . . 94 VAL HG2 . 17066 1
1058 . 1 1 95 95 VAL HG23 H 1 0.842 0.020 . 2 . . . . 94 VAL HG2 . 17066 1
1059 . 1 1 95 95 VAL C C 13 173.550 0.400 . 1 . . . . 94 VAL C . 17066 1
1060 . 1 1 95 95 VAL CA C 13 61.408 0.400 . 1 . . . . 94 VAL CA . 17066 1
1061 . 1 1 95 95 VAL CB C 13 36.687 0.400 . 1 . . . . 94 VAL CB . 17066 1
1062 . 1 1 95 95 VAL CG1 C 13 20.809 0.400 . 1 . . . . 94 VAL CG1 . 17066 1
1063 . 1 1 95 95 VAL CG2 C 13 21.082 0.400 . 1 . . . . 94 VAL CG2 . 17066 1
1064 . 1 1 95 95 VAL N N 15 124.731 0.400 . 1 . . . . 94 VAL N . 17066 1
1065 . 1 1 96 96 GLU H H 1 8.284 0.020 . 1 . . . . 95 GLU H . 17066 1
1066 . 1 1 96 96 GLU HA H 1 5.218 0.020 . 1 . . . . 95 GLU HA . 17066 1
1067 . 1 1 96 96 GLU HB2 H 1 1.799 0.020 . 2 . . . . 95 GLU HB2 . 17066 1
1068 . 1 1 96 96 GLU HB3 H 1 1.799 0.020 . 2 . . . . 95 GLU HB3 . 17066 1
1069 . 1 1 96 96 GLU HG2 H 1 1.832 0.020 . 2 . . . . 95 GLU HG2 . 17066 1
1070 . 1 1 96 96 GLU HG3 H 1 1.978 0.020 . 2 . . . . 95 GLU HG3 . 17066 1
1071 . 1 1 96 96 GLU C C 13 175.288 0.400 . 1 . . . . 95 GLU C . 17066 1
1072 . 1 1 96 96 GLU CA C 13 55.204 0.400 . 1 . . . . 95 GLU CA . 17066 1
1073 . 1 1 96 96 GLU CB C 13 31.357 0.400 . 1 . . . . 95 GLU CB . 17066 1
1074 . 1 1 96 96 GLU CG C 13 37.684 0.400 . 1 . . . . 95 GLU CG . 17066 1
1075 . 1 1 96 96 GLU N N 15 128.314 0.400 . 1 . . . . 95 GLU N . 17066 1
1076 . 1 1 97 97 ILE H H 1 9.355 0.020 . 1 . . . . 96 ILE H . 17066 1
1077 . 1 1 97 97 ILE HA H 1 4.164 0.020 . 1 . . . . 96 ILE HA . 17066 1
1078 . 1 1 97 97 ILE HB H 1 1.133 0.020 . 1 . . . . 96 ILE HB . 17066 1
1079 . 1 1 97 97 ILE HD11 H 1 0.384 0.020 . 1 . . . . 96 ILE HD1 . 17066 1
1080 . 1 1 97 97 ILE HD12 H 1 0.384 0.020 . 1 . . . . 96 ILE HD1 . 17066 1
1081 . 1 1 97 97 ILE HD13 H 1 0.384 0.020 . 1 . . . . 96 ILE HD1 . 17066 1
1082 . 1 1 97 97 ILE HG12 H 1 0.462 0.020 . 2 . . . . 96 ILE HG12 . 17066 1
1083 . 1 1 97 97 ILE HG13 H 1 1.208 0.020 . 2 . . . . 96 ILE HG13 . 17066 1
1084 . 1 1 97 97 ILE HG21 H 1 -0.241 0.020 . 1 . . . . 96 ILE HG2 . 17066 1
1085 . 1 1 97 97 ILE HG22 H 1 -0.241 0.020 . 1 . . . . 96 ILE HG2 . 17066 1
1086 . 1 1 97 97 ILE HG23 H 1 -0.241 0.020 . 1 . . . . 96 ILE HG2 . 17066 1
1087 . 1 1 97 97 ILE C C 13 170.310 0.400 . 1 . . . . 96 ILE C . 17066 1
1088 . 1 1 97 97 ILE CA C 13 60.207 0.400 . 1 . . . . 96 ILE CA . 17066 1
1089 . 1 1 97 97 ILE CB C 13 42.664 0.400 . 1 . . . . 96 ILE CB . 17066 1
1090 . 1 1 97 97 ILE CD1 C 13 14.441 0.400 . 1 . . . . 96 ILE CD1 . 17066 1
1091 . 1 1 97 97 ILE CG1 C 13 28.386 0.400 . 1 . . . . 96 ILE CG1 . 17066 1
1092 . 1 1 97 97 ILE CG2 C 13 14.441 0.400 . 1 . . . . 96 ILE CG2 . 17066 1
1093 . 1 1 97 97 ILE N N 15 127.438 0.400 . 1 . . . . 96 ILE N . 17066 1
1094 . 1 1 98 98 ALA H H 1 8.110 0.020 . 1 . . . . 97 ALA H . 17066 1
1095 . 1 1 98 98 ALA HA H 1 4.645 0.020 . 1 . . . . 97 ALA HA . 17066 1
1096 . 1 1 98 98 ALA HB1 H 1 0.791 0.020 . 1 . . . . 97 ALA HB . 17066 1
1097 . 1 1 98 98 ALA HB2 H 1 0.791 0.020 . 1 . . . . 97 ALA HB . 17066 1
1098 . 1 1 98 98 ALA HB3 H 1 0.791 0.020 . 1 . . . . 97 ALA HB . 17066 1
1099 . 1 1 98 98 ALA C C 13 174.557 0.400 . 1 . . . . 97 ALA C . 17066 1
1100 . 1 1 98 98 ALA CA C 13 50.633 0.400 . 1 . . . . 97 ALA CA . 17066 1
1101 . 1 1 98 98 ALA CB C 13 18.686 0.400 . 1 . . . . 97 ALA CB . 17066 1
1102 . 1 1 98 98 ALA N N 15 128.970 0.400 . 1 . . . . 97 ALA N . 17066 1
1103 . 1 1 99 99 PHE H H 1 8.301 0.020 . 1 . . . . 98 PHE H . 17066 1
1104 . 1 1 99 99 PHE HA H 1 5.371 0.020 . 1 . . . . 98 PHE HA . 17066 1
1105 . 1 1 99 99 PHE HB2 H 1 1.706 0.020 . 2 . . . . 98 PHE HB2 . 17066 1
1106 . 1 1 99 99 PHE HB3 H 1 2.776 0.020 . 2 . . . . 98 PHE HB3 . 17066 1
1107 . 1 1 99 99 PHE HD2 H 1 7.075 0.020 . 1 . . . . 98 PHE HD2 . 17066 1
1108 . 1 1 99 99 PHE C C 13 173.431 0.400 . 1 . . . . 98 PHE C . 17066 1
1109 . 1 1 99 99 PHE CA C 13 51.629 0.400 . 1 . . . . 98 PHE CA . 17066 1
1110 . 1 1 99 99 PHE CB C 13 45.211 0.400 . 1 . . . . 98 PHE CB . 17066 1
1111 . 1 1 99 99 PHE N N 15 124.157 0.400 . 1 . . . . 98 PHE N . 17066 1
1112 . 1 1 100 100 TYR H H 1 9.278 0.020 . 1 . . . . 99 TYR H . 17066 1
1113 . 1 1 100 100 TYR HA H 1 5.294 0.020 . 1 . . . . 99 TYR HA . 17066 1
1114 . 1 1 100 100 TYR HB2 H 1 2.585 0.020 . 2 . . . . 99 TYR HB2 . 17066 1
1115 . 1 1 100 100 TYR HB3 H 1 2.650 0.020 . 2 . . . . 99 TYR HB3 . 17066 1
1116 . 1 1 100 100 TYR HD2 H 1 7.151 0.020 . 1 . . . . 99 TYR HD2 . 17066 1
1117 . 1 1 100 100 TYR C C 13 177.521 0.400 . 1 . . . . 99 TYR C . 17066 1
1118 . 1 1 100 100 TYR CA C 13 56.610 0.400 . 1 . . . . 99 TYR CA . 17066 1
1119 . 1 1 100 100 TYR CB C 13 40.340 0.400 . 1 . . . . 99 TYR CB . 17066 1
1120 . 1 1 100 100 TYR N N 15 117.155 0.400 . 1 . . . . 99 TYR N . 17066 1
1121 . 1 1 101 101 ARG H H 1 8.991 0.020 . 1 . . . . 100 ARG H . 17066 1
1122 . 1 1 101 101 ARG HA H 1 4.794 0.020 . 1 . . . . 100 ARG HA . 17066 1
1123 . 1 1 101 101 ARG HB2 H 1 1.705 0.020 . 2 . . . . 100 ARG HB2 . 17066 1
1124 . 1 1 101 101 ARG HB3 H 1 1.705 0.020 . 2 . . . . 100 ARG HB3 . 17066 1
1125 . 1 1 101 101 ARG HD2 H 1 2.913 0.020 . 2 . . . . 100 ARG HD2 . 17066 1
1126 . 1 1 101 101 ARG HD3 H 1 3.008 0.020 . 2 . . . . 100 ARG HD3 . 17066 1
1127 . 1 1 101 101 ARG C C 13 178.291 0.400 . 1 . . . . 100 ARG C . 17066 1
1128 . 1 1 101 101 ARG CA C 13 55.614 0.400 . 1 . . . . 100 ARG CA . 17066 1
1129 . 1 1 101 101 ARG CB C 13 31.043 0.400 . 1 . . . . 100 ARG CB . 17066 1
1130 . 1 1 101 101 ARG CD C 13 43.660 0.400 . 1 . . . . 100 ARG CD . 17066 1
1131 . 1 1 101 101 ARG N N 15 119.999 0.400 . 1 . . . . 100 ARG N . 17066 1
1132 . 1 1 101 101 ARG NE N 15 113.873 0.400 . 1 . . . . 100 ARG NE . 17066 1
1133 . 1 1 102 102 LYS H H 1 8.194 0.020 . 1 . . . . 101 LYS H . 17066 1
1134 . 1 1 102 102 LYS HA H 1 3.771 0.020 . 1 . . . . 101 LYS HA . 17066 1
1135 . 1 1 102 102 LYS HB2 H 1 0.319 0.020 . 2 . . . . 101 LYS HB2 . 17066 1
1136 . 1 1 102 102 LYS HB3 H 1 1.298 0.020 . 2 . . . . 101 LYS HB3 . 17066 1
1137 . 1 1 102 102 LYS HD2 H 1 1.053 0.020 . 2 . . . . 101 LYS HD2 . 17066 1
1138 . 1 1 102 102 LYS HD3 H 1 1.295 0.020 . 2 . . . . 101 LYS HD3 . 17066 1
1139 . 1 1 102 102 LYS HE2 H 1 2.559 0.020 . 2 . . . . 101 LYS HE2 . 17066 1
1140 . 1 1 102 102 LYS HE3 H 1 2.604 0.020 . 2 . . . . 101 LYS HE3 . 17066 1
1141 . 1 1 102 102 LYS HG2 H 1 0.915 0.020 . 2 . . . . 101 LYS HG2 . 17066 1
1142 . 1 1 102 102 LYS HG3 H 1 1.175 0.020 . 2 . . . . 101 LYS HG3 . 17066 1
1143 . 1 1 102 102 LYS C C 13 177.442 0.400 . 1 . . . . 101 LYS C . 17066 1
1144 . 1 1 102 102 LYS CA C 13 59.655 0.400 . 1 . . . . 101 LYS CA . 17066 1
1145 . 1 1 102 102 LYS CB C 13 31.707 0.400 . 1 . . . . 101 LYS CB . 17066 1
1146 . 1 1 102 102 LYS CD C 13 29.383 0.400 . 1 . . . . 101 LYS CD . 17066 1
1147 . 1 1 102 102 LYS CE C 13 41.668 0.400 . 1 . . . . 101 LYS CE . 17066 1
1148 . 1 1 102 102 LYS CG C 13 25.066 0.400 . 1 . . . . 101 LYS CG . 17066 1
1149 . 1 1 102 102 LYS N N 15 124.157 0.400 . 1 . . . . 101 LYS N . 17066 1
1150 . 1 1 103 103 ASP H H 1 7.893 0.020 . 1 . . . . 102 ASP H . 17066 1
1151 . 1 1 103 103 ASP HA H 1 4.273 0.020 . 1 . . . . 102 ASP HA . 17066 1
1152 . 1 1 103 103 ASP HB2 H 1 2.550 0.020 . 2 . . . . 102 ASP HB2 . 17066 1
1153 . 1 1 103 103 ASP HB3 H 1 3.033 0.020 . 2 . . . . 102 ASP HB3 . 17066 1
1154 . 1 1 103 103 ASP C C 13 177.225 0.400 . 1 . . . . 102 ASP C . 17066 1
1155 . 1 1 103 103 ASP CA C 13 53.622 0.400 . 1 . . . . 102 ASP CA . 17066 1
1156 . 1 1 103 103 ASP CB C 13 39.531 0.400 . 1 . . . . 102 ASP CB . 17066 1
1157 . 1 1 103 103 ASP N N 15 113.552 0.400 . 1 . . . . 102 ASP N . 17066 1
1158 . 1 1 104 104 GLY H H 1 8.329 0.020 . 1 . . . . 103 GLY H . 17066 1
1159 . 1 1 104 104 GLY HA2 H 1 4.408 0.020 . 2 . . . . 103 GLY HA2 . 17066 1
1160 . 1 1 104 104 GLY HA3 H 1 3.847 0.020 . 2 . . . . 103 GLY HA3 . 17066 1
1161 . 1 1 104 104 GLY C C 13 174.656 0.400 . 1 . . . . 103 GLY C . 17066 1
1162 . 1 1 104 104 GLY CA C 13 44.988 0.400 . 1 . . . . 103 GLY CA . 17066 1
1163 . 1 1 104 104 GLY N N 15 109.497 0.400 . 1 . . . . 103 GLY N . 17066 1
1164 . 1 1 105 105 SER H H 1 8.519 0.020 . 1 . . . . 104 SER H . 17066 1
1165 . 1 1 105 105 SER HA H 1 4.236 0.020 . 1 . . . . 104 SER HA . 17066 1
1166 . 1 1 105 105 SER HB2 H 1 3.951 0.020 . 2 . . . . 104 SER HB2 . 17066 1
1167 . 1 1 105 105 SER HB3 H 1 3.951 0.020 . 2 . . . . 104 SER HB3 . 17066 1
1168 . 1 1 105 105 SER C C 13 172.127 0.400 . 1 . . . . 104 SER C . 17066 1
1169 . 1 1 105 105 SER CA C 13 58.270 0.400 . 1 . . . . 104 SER CA . 17066 1
1170 . 1 1 105 105 SER CB C 13 63.583 0.400 . 1 . . . . 104 SER CB . 17066 1
1171 . 1 1 105 105 SER N N 15 117.811 0.400 . 1 . . . . 104 SER N . 17066 1
1172 . 1 1 106 106 CYS H H 1 8.518 0.020 . 1 . . . . 105 CYS H . 17066 1
1173 . 1 1 106 106 CYS HA H 1 4.822 0.020 . 1 . . . . 105 CYS HA . 17066 1
1174 . 1 1 106 106 CYS HB2 H 1 2.204 0.020 . 2 . . . . 105 CYS HB2 . 17066 1
1175 . 1 1 106 106 CYS HB3 H 1 2.245 0.020 . 2 . . . . 105 CYS HB3 . 17066 1
1176 . 1 1 106 106 CYS C C 13 173.906 0.400 . 1 . . . . 105 CYS C . 17066 1
1177 . 1 1 106 106 CYS CA C 13 56.278 0.400 . 1 . . . . 105 CYS CA . 17066 1
1178 . 1 1 106 106 CYS CB C 13 29.383 0.400 . 1 . . . . 105 CYS CB . 17066 1
1179 . 1 1 106 106 CYS N N 15 121.424 0.400 . 1 . . . . 105 CYS N . 17066 1
1180 . 1 1 107 107 PHE H H 1 9.265 0.020 . 1 . . . . 106 PHE H . 17066 1
1181 . 1 1 107 107 PHE HA H 1 4.962 0.020 . 1 . . . . 106 PHE HA . 17066 1
1182 . 1 1 107 107 PHE HB2 H 1 2.899 0.020 . 2 . . . . 106 PHE HB2 . 17066 1
1183 . 1 1 107 107 PHE HB3 H 1 2.969 0.020 . 2 . . . . 106 PHE HB3 . 17066 1
1184 . 1 1 107 107 PHE HD2 H 1 6.966 0.020 . 1 . . . . 106 PHE HD2 . 17066 1
1185 . 1 1 107 107 PHE C C 13 171.574 0.400 . 1 . . . . 106 PHE C . 17066 1
1186 . 1 1 107 107 PHE CA C 13 54.984 0.400 . 1 . . . . 106 PHE CA . 17066 1
1187 . 1 1 107 107 PHE CB C 13 41.345 0.400 . 1 . . . . 106 PHE CB . 17066 1
1188 . 1 1 107 107 PHE N N 15 127.129 0.400 . 1 . . . . 106 PHE N . 17066 1
1189 . 1 1 108 108 LEU H H 1 8.852 0.020 . 1 . . . . 107 LEU H . 17066 1
1190 . 1 1 108 108 LEU HA H 1 4.405 0.020 . 1 . . . . 107 LEU HA . 17066 1
1191 . 1 1 108 108 LEU HB2 H 1 1.711 0.020 . 2 . . . . 107 LEU HB2 . 17066 1
1192 . 1 1 108 108 LEU HB3 H 1 1.306 0.020 . 2 . . . . 107 LEU HB3 . 17066 1
1193 . 1 1 108 108 LEU HD11 H 1 0.702 0.020 . 2 . . . . 107 LEU HD1 . 17066 1
1194 . 1 1 108 108 LEU HD12 H 1 0.702 0.020 . 2 . . . . 107 LEU HD1 . 17066 1
1195 . 1 1 108 108 LEU HD13 H 1 0.702 0.020 . 2 . . . . 107 LEU HD1 . 17066 1
1196 . 1 1 108 108 LEU HD21 H 1 0.676 0.020 . 2 . . . . 107 LEU HD2 . 17066 1
1197 . 1 1 108 108 LEU HD22 H 1 0.676 0.020 . 2 . . . . 107 LEU HD2 . 17066 1
1198 . 1 1 108 108 LEU HD23 H 1 0.676 0.020 . 2 . . . . 107 LEU HD2 . 17066 1
1199 . 1 1 108 108 LEU HG H 1 1.309 0.020 . 1 . . . . 107 LEU HG . 17066 1
1200 . 1 1 108 108 LEU C C 13 175.486 0.400 . 1 . . . . 107 LEU C . 17066 1
1201 . 1 1 108 108 LEU CA C 13 53.954 0.400 . 1 . . . . 107 LEU CA . 17066 1
1202 . 1 1 108 108 LEU CB C 13 42.983 0.400 . 1 . . . . 107 LEU CB . 17066 1
1203 . 1 1 108 108 LEU CD1 C 13 24.734 0.400 . 1 . . . . 107 LEU CD1 . 17066 1
1204 . 1 1 108 108 LEU CD2 C 13 23.074 0.400 . 1 . . . . 107 LEU CD2 . 17066 1
1205 . 1 1 108 108 LEU CG C 13 27.058 0.400 . 1 . . . . 107 LEU CG . 17066 1
1206 . 1 1 108 108 LEU N N 15 123.621 0.400 . 1 . . . . 107 LEU N . 17066 1
1207 . 1 1 109 109 CYS H H 1 9.159 0.020 . 1 . . . . 108 CYS H . 17066 1
1208 . 1 1 109 109 CYS HA H 1 5.447 0.020 . 1 . . . . 108 CYS HA . 17066 1
1209 . 1 1 109 109 CYS HB2 H 1 2.723 0.020 . 2 . . . . 108 CYS HB2 . 17066 1
1210 . 1 1 109 109 CYS HB3 H 1 2.884 0.020 . 2 . . . . 108 CYS HB3 . 17066 1
1211 . 1 1 109 109 CYS C C 13 171.930 0.400 . 1 . . . . 108 CYS C . 17066 1
1212 . 1 1 109 109 CYS CA C 13 56.680 0.400 . 1 . . . . 108 CYS CA . 17066 1
1213 . 1 1 109 109 CYS CB C 13 31.963 0.400 . 1 . . . . 108 CYS CB . 17066 1
1214 . 1 1 109 109 CYS N N 15 126.782 0.400 . 1 . . . . 108 CYS N . 17066 1
1215 . 1 1 110 110 LEU H H 1 9.344 0.020 . 1 . . . . 109 LEU H . 17066 1
1216 . 1 1 110 110 LEU HA H 1 4.889 0.020 . 1 . . . . 109 LEU HA . 17066 1
1217 . 1 1 110 110 LEU HB2 H 1 1.417 0.020 . 2 . . . . 109 LEU HB2 . 17066 1
1218 . 1 1 110 110 LEU HB3 H 1 1.548 0.020 . 2 . . . . 109 LEU HB3 . 17066 1
1219 . 1 1 110 110 LEU HD11 H 1 0.760 0.020 . 2 . . . . 109 LEU HD1 . 17066 1
1220 . 1 1 110 110 LEU HD12 H 1 0.760 0.020 . 2 . . . . 109 LEU HD1 . 17066 1
1221 . 1 1 110 110 LEU HD13 H 1 0.760 0.020 . 2 . . . . 109 LEU HD1 . 17066 1
1222 . 1 1 110 110 LEU HD21 H 1 0.760 0.020 . 2 . . . . 109 LEU HD2 . 17066 1
1223 . 1 1 110 110 LEU HD22 H 1 0.760 0.020 . 2 . . . . 109 LEU HD2 . 17066 1
1224 . 1 1 110 110 LEU HD23 H 1 0.760 0.020 . 2 . . . . 109 LEU HD2 . 17066 1
1225 . 1 1 110 110 LEU HG H 1 1.371 0.020 . 1 . . . . 109 LEU HG . 17066 1
1226 . 1 1 110 110 LEU C C 13 176.000 0.400 . 1 . . . . 109 LEU C . 17066 1
1227 . 1 1 110 110 LEU CA C 13 53.622 0.400 . 1 . . . . 109 LEU CA . 17066 1
1228 . 1 1 110 110 LEU CB C 13 43.278 0.400 . 1 . . . . 109 LEU CB . 17066 1
1229 . 1 1 110 110 LEU CD1 C 13 24.402 0.400 . 1 . . . . 109 LEU CD1 . 17066 1
1230 . 1 1 110 110 LEU CG C 13 27.158 0.400 . 1 . . . . 109 LEU CG . 17066 1
1231 . 1 1 110 110 LEU N N 15 128.314 0.400 . 1 . . . . 109 LEU N . 17066 1
1232 . 1 1 111 111 VAL H H 1 9.291 0.020 . 1 . . . . 110 VAL H . 17066 1
1233 . 1 1 111 111 VAL HA H 1 4.578 0.020 . 1 . . . . 110 VAL HA . 17066 1
1234 . 1 1 111 111 VAL HB H 1 1.796 0.020 . 1 . . . . 110 VAL HB . 17066 1
1235 . 1 1 111 111 VAL HG11 H 1 0.782 0.020 . 2 . . . . 110 VAL HG1 . 17066 1
1236 . 1 1 111 111 VAL HG12 H 1 0.782 0.020 . 2 . . . . 110 VAL HG1 . 17066 1
1237 . 1 1 111 111 VAL HG13 H 1 0.782 0.020 . 2 . . . . 110 VAL HG1 . 17066 1
1238 . 1 1 111 111 VAL HG21 H 1 0.372 0.020 . 2 . . . . 110 VAL HG2 . 17066 1
1239 . 1 1 111 111 VAL HG22 H 1 0.372 0.020 . 2 . . . . 110 VAL HG2 . 17066 1
1240 . 1 1 111 111 VAL HG23 H 1 0.372 0.020 . 2 . . . . 110 VAL HG2 . 17066 1
1241 . 1 1 111 111 VAL C C 13 174.597 0.400 . 1 . . . . 110 VAL C . 17066 1
1242 . 1 1 111 111 VAL CA C 13 60.594 0.400 . 1 . . . . 110 VAL CA . 17066 1
1243 . 1 1 111 111 VAL CB C 13 33.367 0.400 . 1 . . . . 110 VAL CB . 17066 1
1244 . 1 1 111 111 VAL CG1 C 13 23.074 0.400 . 1 . . . . 110 VAL CG1 . 17066 1
1245 . 1 1 111 111 VAL CG2 C 13 20.750 0.400 . 1 . . . . 110 VAL CG2 . 17066 1
1246 . 1 1 111 111 VAL N N 15 129.408 0.400 . 1 . . . . 110 VAL N . 17066 1
1247 . 1 1 112 112 ASP H H 1 8.873 0.020 . 1 . . . . 111 ASP H . 17066 1
1248 . 1 1 112 112 ASP HA H 1 5.235 0.020 . 1 . . . . 111 ASP HA . 17066 1
1249 . 1 1 112 112 ASP HB2 H 1 2.500 0.020 . 2 . . . . 111 ASP HB2 . 17066 1
1250 . 1 1 112 112 ASP HB3 H 1 2.659 0.020 . 2 . . . . 111 ASP HB3 . 17066 1
1251 . 1 1 112 112 ASP C C 13 174.696 0.400 . 1 . . . . 111 ASP C . 17066 1
1252 . 1 1 112 112 ASP CA C 13 52.625 0.400 . 1 . . . . 111 ASP CA . 17066 1
1253 . 1 1 112 112 ASP CB C 13 42.996 0.400 . 1 . . . . 111 ASP CB . 17066 1
1254 . 1 1 112 112 ASP N N 15 127.220 0.400 . 1 . . . . 111 ASP N . 17066 1
1255 . 1 1 113 113 VAL H H 1 9.318 0.020 . 1 . . . . 112 VAL H . 17066 1
1256 . 1 1 113 113 VAL HA H 1 4.281 0.020 . 1 . . . . 112 VAL HA . 17066 1
1257 . 1 1 113 113 VAL HB H 1 2.076 0.020 . 1 . . . . 112 VAL HB . 17066 1
1258 . 1 1 113 113 VAL HG11 H 1 0.626 0.020 . 2 . . . . 112 VAL HG1 . 17066 1
1259 . 1 1 113 113 VAL HG12 H 1 0.626 0.020 . 2 . . . . 112 VAL HG1 . 17066 1
1260 . 1 1 113 113 VAL HG13 H 1 0.626 0.020 . 2 . . . . 112 VAL HG1 . 17066 1
1261 . 1 1 113 113 VAL HG21 H 1 0.694 0.020 . 2 . . . . 112 VAL HG2 . 17066 1
1262 . 1 1 113 113 VAL HG22 H 1 0.694 0.020 . 2 . . . . 112 VAL HG2 . 17066 1
1263 . 1 1 113 113 VAL HG23 H 1 0.694 0.020 . 2 . . . . 112 VAL HG2 . 17066 1
1264 . 1 1 113 113 VAL C C 13 174.893 0.400 . 1 . . . . 112 VAL C . 17066 1
1265 . 1 1 113 113 VAL CA C 13 62.582 0.400 . 1 . . . . 112 VAL CA . 17066 1
1266 . 1 1 113 113 VAL CB C 13 32.131 0.400 . 1 . . . . 112 VAL CB . 17066 1
1267 . 1 1 113 113 VAL CG1 C 13 21.858 0.400 . 1 . . . . 112 VAL CG1 . 17066 1
1268 . 1 1 113 113 VAL CG2 C 13 20.207 0.400 . 1 . . . . 112 VAL CG2 . 17066 1
1269 . 1 1 113 113 VAL N N 15 126.754 0.400 . 1 . . . . 112 VAL N . 17066 1
1270 . 1 1 114 114 VAL H H 1 9.494 0.020 . 1 . . . . 113 VAL H . 17066 1
1271 . 1 1 114 114 VAL HA H 1 4.568 0.020 . 1 . . . . 113 VAL HA . 17066 1
1272 . 1 1 114 114 VAL HB H 1 2.137 0.020 . 1 . . . . 113 VAL HB . 17066 1
1273 . 1 1 114 114 VAL HG11 H 1 0.827 0.020 . 2 . . . . 113 VAL HG1 . 17066 1
1274 . 1 1 114 114 VAL HG12 H 1 0.827 0.020 . 2 . . . . 113 VAL HG1 . 17066 1
1275 . 1 1 114 114 VAL HG13 H 1 0.827 0.020 . 2 . . . . 113 VAL HG1 . 17066 1
1276 . 1 1 114 114 VAL HG21 H 1 0.767 0.020 . 2 . . . . 113 VAL HG2 . 17066 1
1277 . 1 1 114 114 VAL HG22 H 1 0.767 0.020 . 2 . . . . 113 VAL HG2 . 17066 1
1278 . 1 1 114 114 VAL HG23 H 1 0.767 0.020 . 2 . . . . 113 VAL HG2 . 17066 1
1279 . 1 1 114 114 VAL CA C 13 59.598 0.400 . 1 . . . . 113 VAL CA . 17066 1
1280 . 1 1 114 114 VAL CB C 13 34.695 0.400 . 1 . . . . 113 VAL CB . 17066 1
1281 . 1 1 114 114 VAL CG1 C 13 20.750 0.400 . 1 . . . . 113 VAL CG1 . 17066 1
1282 . 1 1 114 114 VAL CG2 C 13 20.418 0.400 . 1 . . . . 113 VAL CG2 . 17066 1
1283 . 1 1 114 114 VAL N N 15 126.688 0.400 . 1 . . . . 113 VAL N . 17066 1
1284 . 1 1 115 115 PRO HA H 1 4.254 0.020 . 1 . . . . 114 PRO HA . 17066 1
1285 . 1 1 115 115 PRO HB2 H 1 1.510 0.020 . 2 . . . . 114 PRO HB2 . 17066 1
1286 . 1 1 115 115 PRO HB3 H 1 1.932 0.020 . 2 . . . . 114 PRO HB3 . 17066 1
1287 . 1 1 115 115 PRO HD2 H 1 3.753 0.020 . 2 . . . . 114 PRO HD2 . 17066 1
1288 . 1 1 115 115 PRO HD3 H 1 3.849 0.020 . 2 . . . . 114 PRO HD3 . 17066 1
1289 . 1 1 115 115 PRO HG2 H 1 1.683 0.020 . 2 . . . . 114 PRO HG2 . 17066 1
1290 . 1 1 115 115 PRO HG3 H 1 1.683 0.020 . 2 . . . . 114 PRO HG3 . 17066 1
1291 . 1 1 115 115 PRO C C 13 175.861 0.400 . 1 . . . . 114 PRO C . 17066 1
1292 . 1 1 115 115 PRO CA C 13 62.372 0.400 . 1 . . . . 114 PRO CA . 17066 1
1293 . 1 1 115 115 PRO CB C 13 32.371 0.400 . 1 . . . . 114 PRO CB . 17066 1
1294 . 1 1 115 115 PRO CD C 13 50.965 0.400 . 1 . . . . 114 PRO CD . 17066 1
1295 . 1 1 115 115 PRO CG C 13 26.726 0.400 . 1 . . . . 114 PRO CG . 17066 1
1296 . 1 1 116 116 VAL H H 1 8.472 0.020 . 1 . . . . 115 VAL H . 17066 1
1297 . 1 1 116 116 VAL HA H 1 4.050 0.020 . 1 . . . . 115 VAL HA . 17066 1
1298 . 1 1 116 116 VAL HB H 1 1.708 0.020 . 1 . . . . 115 VAL HB . 17066 1
1299 . 1 1 116 116 VAL HG11 H 1 0.846 0.020 . 2 . . . . 115 VAL HG1 . 17066 1
1300 . 1 1 116 116 VAL HG12 H 1 0.846 0.020 . 2 . . . . 115 VAL HG1 . 17066 1
1301 . 1 1 116 116 VAL HG13 H 1 0.846 0.020 . 2 . . . . 115 VAL HG1 . 17066 1
1302 . 1 1 116 116 VAL HG21 H 1 0.744 0.020 . 2 . . . . 115 VAL HG2 . 17066 1
1303 . 1 1 116 116 VAL HG22 H 1 0.744 0.020 . 2 . . . . 115 VAL HG2 . 17066 1
1304 . 1 1 116 116 VAL HG23 H 1 0.744 0.020 . 2 . . . . 115 VAL HG2 . 17066 1
1305 . 1 1 116 116 VAL C C 13 174.814 0.400 . 1 . . . . 115 VAL C . 17066 1
1306 . 1 1 116 116 VAL CA C 13 61.992 0.400 . 1 . . . . 115 VAL CA . 17066 1
1307 . 1 1 116 116 VAL CB C 13 33.035 0.400 . 1 . . . . 115 VAL CB . 17066 1
1308 . 1 1 116 116 VAL CG1 C 13 20.750 0.400 . 1 . . . . 115 VAL CG1 . 17066 1
1309 . 1 1 116 116 VAL CG2 C 13 20.418 0.400 . 1 . . . . 115 VAL CG2 . 17066 1
1310 . 1 1 116 116 VAL N N 15 124.137 0.400 . 1 . . . . 115 VAL N . 17066 1
1311 . 1 1 117 117 LYS H H 1 8.560 0.020 . 1 . . . . 116 LYS H . 17066 1
1312 . 1 1 117 117 LYS HA H 1 5.247 0.020 . 1 . . . . 116 LYS HA . 17066 1
1313 . 1 1 117 117 LYS HB2 H 1 1.560 0.020 . 2 . . . . 116 LYS HB2 . 17066 1
1314 . 1 1 117 117 LYS HB3 H 1 1.560 0.020 . 2 . . . . 116 LYS HB3 . 17066 1
1315 . 1 1 117 117 LYS HD2 H 1 1.539 0.020 . 2 . . . . 116 LYS HD2 . 17066 1
1316 . 1 1 117 117 LYS HD3 H 1 1.539 0.020 . 2 . . . . 116 LYS HD3 . 17066 1
1317 . 1 1 117 117 LYS HE2 H 1 2.769 0.020 . 2 . . . . 116 LYS HE2 . 17066 1
1318 . 1 1 117 117 LYS HE3 H 1 2.797 0.020 . 2 . . . . 116 LYS HE3 . 17066 1
1319 . 1 1 117 117 LYS HG2 H 1 0.940 0.020 . 2 . . . . 116 LYS HG2 . 17066 1
1320 . 1 1 117 117 LYS HG3 H 1 1.092 0.020 . 2 . . . . 116 LYS HG3 . 17066 1
1321 . 1 1 117 117 LYS C C 13 176.908 0.400 . 1 . . . . 116 LYS C . 17066 1
1322 . 1 1 117 117 LYS CA C 13 54.286 0.400 . 1 . . . . 116 LYS CA . 17066 1
1323 . 1 1 117 117 LYS CB C 13 35.729 0.400 . 1 . . . . 116 LYS CB . 17066 1
1324 . 1 1 117 117 LYS CD C 13 29.383 0.400 . 1 . . . . 116 LYS CD . 17066 1
1325 . 1 1 117 117 LYS CE C 13 42.000 0.400 . 1 . . . . 116 LYS CE . 17066 1
1326 . 1 1 117 117 LYS CG C 13 26.062 0.400 . 1 . . . . 116 LYS CG . 17066 1
1327 . 1 1 117 117 LYS N N 15 126.563 0.400 . 1 . . . . 116 LYS N . 17066 1
1328 . 1 1 118 118 ASN H H 1 8.426 0.020 . 1 . . . . 117 ASN H . 17066 1
1329 . 1 1 118 118 ASN HA H 1 4.655 0.020 . 1 . . . . 117 ASN HA . 17066 1
1330 . 1 1 118 118 ASN HB2 H 1 3.400 0.020 . 2 . . . . 117 ASN HB2 . 17066 1
1331 . 1 1 118 118 ASN HB3 H 1 2.619 0.020 . 2 . . . . 117 ASN HB3 . 17066 1
1332 . 1 1 118 118 ASN HD21 H 1 7.309 0.020 . 2 . . . . 117 ASN HD21 . 17066 1
1333 . 1 1 118 118 ASN HD22 H 1 7.551 0.020 . 2 . . . . 117 ASN HD22 . 17066 1
1334 . 1 1 118 118 ASN C C 13 177.560 0.400 . 1 . . . . 117 ASN C . 17066 1
1335 . 1 1 118 118 ASN CA C 13 50.301 0.400 . 1 . . . . 117 ASN CA . 17066 1
1336 . 1 1 118 118 ASN CB C 13 38.744 0.400 . 1 . . . . 117 ASN CB . 17066 1
1337 . 1 1 118 118 ASN N N 15 117.712 0.400 . 1 . . . . 117 ASN N . 17066 1
1338 . 1 1 118 118 ASN ND2 N 15 111.685 0.400 . 1 . . . . 117 ASN ND2 . 17066 1
1339 . 1 1 119 119 GLU H H 1 9.120 0.020 . 1 . . . . 118 GLU H . 17066 1
1340 . 1 1 119 119 GLU HA H 1 3.984 0.020 . 1 . . . . 118 GLU HA . 17066 1
1341 . 1 1 119 119 GLU HB2 H 1 1.942 0.020 . 2 . . . . 118 GLU HB2 . 17066 1
1342 . 1 1 119 119 GLU HB3 H 1 2.009 0.020 . 2 . . . . 118 GLU HB3 . 17066 1
1343 . 1 1 119 119 GLU HG2 H 1 2.266 0.020 . 2 . . . . 118 GLU HG2 . 17066 1
1344 . 1 1 119 119 GLU HG3 H 1 2.266 0.020 . 2 . . . . 118 GLU HG3 . 17066 1
1345 . 1 1 119 119 GLU C C 13 176.869 0.400 . 1 . . . . 118 GLU C . 17066 1
1346 . 1 1 119 119 GLU CA C 13 59.598 0.400 . 1 . . . . 118 GLU CA . 17066 1
1347 . 1 1 119 119 GLU CB C 13 28.856 0.400 . 1 . . . . 118 GLU CB . 17066 1
1348 . 1 1 119 119 GLU CG C 13 36.209 0.400 . 1 . . . . 118 GLU CG . 17066 1
1349 . 1 1 119 119 GLU N N 15 119.022 0.400 . 1 . . . . 118 GLU N . 17066 1
1350 . 1 1 120 120 ASP H H 1 7.364 0.020 . 1 . . . . 119 ASP H . 17066 1
1351 . 1 1 120 120 ASP HA H 1 4.666 0.020 . 1 . . . . 119 ASP HA . 17066 1
1352 . 1 1 120 120 ASP HB2 H 1 2.506 0.020 . 2 . . . . 119 ASP HB2 . 17066 1
1353 . 1 1 120 120 ASP HB3 H 1 2.779 0.020 . 2 . . . . 119 ASP HB3 . 17066 1
1354 . 1 1 120 120 ASP C C 13 176.513 0.400 . 1 . . . . 119 ASP C . 17066 1
1355 . 1 1 120 120 ASP CA C 13 54.286 0.400 . 1 . . . . 119 ASP CA . 17066 1
1356 . 1 1 120 120 ASP CB C 13 41.363 0.400 . 1 . . . . 119 ASP CB . 17066 1
1357 . 1 1 120 120 ASP N N 15 116.831 0.400 . 1 . . . . 119 ASP N . 17066 1
1358 . 1 1 121 121 GLY H H 1 7.998 0.020 . 1 . . . . 120 GLY H . 17066 1
1359 . 1 1 121 121 GLY HA2 H 1 3.660 0.020 . 2 . . . . 120 GLY HA2 . 17066 1
1360 . 1 1 121 121 GLY HA3 H 1 4.230 0.020 . 2 . . . . 120 GLY HA3 . 17066 1
1361 . 1 1 121 121 GLY C C 13 173.017 0.400 . 1 . . . . 120 GLY C . 17066 1
1362 . 1 1 121 121 GLY CA C 13 44.988 0.400 . 1 . . . . 120 GLY CA . 17066 1
1363 . 1 1 121 121 GLY N N 15 107.435 0.400 . 1 . . . . 120 GLY N . 17066 1
1364 . 1 1 122 122 ALA H H 1 7.724 0.020 . 1 . . . . 121 ALA H . 17066 1
1365 . 1 1 122 122 ALA HA H 1 4.303 0.020 . 1 . . . . 121 ALA HA . 17066 1
1366 . 1 1 122 122 ALA HB1 H 1 1.180 0.020 . 1 . . . . 121 ALA HB . 17066 1
1367 . 1 1 122 122 ALA HB2 H 1 1.180 0.020 . 1 . . . . 121 ALA HB . 17066 1
1368 . 1 1 122 122 ALA HB3 H 1 1.180 0.020 . 1 . . . . 121 ALA HB . 17066 1
1369 . 1 1 122 122 ALA C C 13 177.047 0.400 . 1 . . . . 121 ALA C . 17066 1
1370 . 1 1 122 122 ALA CA C 13 50.941 0.400 . 1 . . . . 121 ALA CA . 17066 1
1371 . 1 1 122 122 ALA CB C 13 19.198 0.400 . 1 . . . . 121 ALA CB . 17066 1
1372 . 1 1 122 122 ALA N N 15 123.848 0.400 . 1 . . . . 121 ALA N . 17066 1
1373 . 1 1 123 123 VAL H H 1 8.602 0.020 . 1 . . . . 122 VAL H . 17066 1
1374 . 1 1 123 123 VAL HA H 1 3.732 0.020 . 1 . . . . 122 VAL HA . 17066 1
1375 . 1 1 123 123 VAL HB H 1 1.808 0.020 . 1 . . . . 122 VAL HB . 17066 1
1376 . 1 1 123 123 VAL HG11 H 1 0.798 0.020 . 2 . . . . 122 VAL HG1 . 17066 1
1377 . 1 1 123 123 VAL HG12 H 1 0.798 0.020 . 2 . . . . 122 VAL HG1 . 17066 1
1378 . 1 1 123 123 VAL HG13 H 1 0.798 0.020 . 2 . . . . 122 VAL HG1 . 17066 1
1379 . 1 1 123 123 VAL HG21 H 1 0.255 0.020 . 2 . . . . 122 VAL HG2 . 17066 1
1380 . 1 1 123 123 VAL HG22 H 1 0.255 0.020 . 2 . . . . 122 VAL HG2 . 17066 1
1381 . 1 1 123 123 VAL HG23 H 1 0.255 0.020 . 2 . . . . 122 VAL HG2 . 17066 1
1382 . 1 1 123 123 VAL C C 13 176.276 0.400 . 1 . . . . 122 VAL C . 17066 1
1383 . 1 1 123 123 VAL CA C 13 63.583 0.400 . 1 . . . . 122 VAL CA . 17066 1
1384 . 1 1 123 123 VAL CB C 13 31.043 0.400 . 1 . . . . 122 VAL CB . 17066 1
1385 . 1 1 123 123 VAL CG1 C 13 22.078 0.400 . 1 . . . . 122 VAL CG1 . 17066 1
1386 . 1 1 123 123 VAL CG2 C 13 21.746 0.400 . 1 . . . . 122 VAL CG2 . 17066 1
1387 . 1 1 123 123 VAL N N 15 122.022 0.400 . 1 . . . . 122 VAL N . 17066 1
1388 . 1 1 124 124 ILE H H 1 8.576 0.020 . 1 . . . . 123 ILE H . 17066 1
1389 . 1 1 124 124 ILE HA H 1 4.413 0.020 . 1 . . . . 123 ILE HA . 17066 1
1390 . 1 1 124 124 ILE HB H 1 1.794 0.020 . 1 . . . . 123 ILE HB . 17066 1
1391 . 1 1 124 124 ILE HD11 H 1 0.598 0.020 . 1 . . . . 123 ILE HD1 . 17066 1
1392 . 1 1 124 124 ILE HD12 H 1 0.598 0.020 . 1 . . . . 123 ILE HD1 . 17066 1
1393 . 1 1 124 124 ILE HD13 H 1 0.598 0.020 . 1 . . . . 123 ILE HD1 . 17066 1
1394 . 1 1 124 124 ILE HG12 H 1 0.956 0.020 . 2 . . . . 123 ILE HG12 . 17066 1
1395 . 1 1 124 124 ILE HG13 H 1 1.205 0.020 . 2 . . . . 123 ILE HG13 . 17066 1
1396 . 1 1 124 124 ILE HG21 H 1 0.794 0.020 . 1 . . . . 123 ILE HG2 . 17066 1
1397 . 1 1 124 124 ILE HG22 H 1 0.794 0.020 . 1 . . . . 123 ILE HG2 . 17066 1
1398 . 1 1 124 124 ILE HG23 H 1 0.794 0.020 . 1 . . . . 123 ILE HG2 . 17066 1
1399 . 1 1 124 124 ILE C C 13 176.434 0.400 . 1 . . . . 123 ILE C . 17066 1
1400 . 1 1 124 124 ILE CA C 13 61.258 0.400 . 1 . . . . 123 ILE CA . 17066 1
1401 . 1 1 124 124 ILE CB C 13 39.883 0.400 . 1 . . . . 123 ILE CB . 17066 1
1402 . 1 1 124 124 ILE CD1 C 13 13.445 0.400 . 1 . . . . 123 ILE CD1 . 17066 1
1403 . 1 1 124 124 ILE CG1 C 13 26.062 0.400 . 1 . . . . 123 ILE CG1 . 17066 1
1404 . 1 1 124 124 ILE CG2 C 13 18.757 0.400 . 1 . . . . 123 ILE CG2 . 17066 1
1405 . 1 1 124 124 ILE N N 15 120.534 0.400 . 1 . . . . 123 ILE N . 17066 1
1406 . 1 1 125 125 MET H H 1 7.819 0.020 . 1 . . . . 124 MET H . 17066 1
1407 . 1 1 125 125 MET HA H 1 5.128 0.020 . 1 . . . . 124 MET HA . 17066 1
1408 . 1 1 125 125 MET HB2 H 1 1.620 0.020 . 2 . . . . 124 MET HB2 . 17066 1
1409 . 1 1 125 125 MET HB3 H 1 2.134 0.020 . 2 . . . . 124 MET HB3 . 17066 1
1410 . 1 1 125 125 MET HE1 H 1 1.909 0.020 . 1 . . . . 124 MET HE . 17066 1
1411 . 1 1 125 125 MET HE2 H 1 1.909 0.020 . 1 . . . . 124 MET HE . 17066 1
1412 . 1 1 125 125 MET HE3 H 1 1.909 0.020 . 1 . . . . 124 MET HE . 17066 1
1413 . 1 1 125 125 MET HG2 H 1 2.595 0.020 . 2 . . . . 124 MET HG2 . 17066 1
1414 . 1 1 125 125 MET HG3 H 1 2.309 0.020 . 2 . . . . 124 MET HG3 . 17066 1
1415 . 1 1 125 125 MET C C 13 172.503 0.400 . 1 . . . . 124 MET C . 17066 1
1416 . 1 1 125 125 MET CA C 13 54.749 0.400 . 1 . . . . 124 MET CA . 17066 1
1417 . 1 1 125 125 MET CB C 13 39.012 0.400 . 1 . . . . 124 MET CB . 17066 1
1418 . 1 1 125 125 MET CE C 13 18.425 0.400 . 1 . . . . 124 MET CE . 17066 1
1419 . 1 1 125 125 MET CG C 13 33.699 0.400 . 1 . . . . 124 MET CG . 17066 1
1420 . 1 1 125 125 MET N N 15 120.256 0.400 . 1 . . . . 124 MET N . 17066 1
1421 . 1 1 126 126 PHE H H 1 8.564 0.020 . 1 . . . . 125 PHE H . 17066 1
1422 . 1 1 126 126 PHE HA H 1 5.127 0.020 . 1 . . . . 125 PHE HA . 17066 1
1423 . 1 1 126 126 PHE HB2 H 1 2.341 0.020 . 2 . . . . 125 PHE HB2 . 17066 1
1424 . 1 1 126 126 PHE HB3 H 1 2.586 0.020 . 2 . . . . 125 PHE HB3 . 17066 1
1425 . 1 1 126 126 PHE HD2 H 1 6.677 0.020 . 1 . . . . 125 PHE HD2 . 17066 1
1426 . 1 1 126 126 PHE C C 13 174.538 0.400 . 1 . . . . 125 PHE C . 17066 1
1427 . 1 1 126 126 PHE CA C 13 57.657 0.400 . 1 . . . . 125 PHE CA . 17066 1
1428 . 1 1 126 126 PHE CB C 13 44.066 0.400 . 1 . . . . 125 PHE CB . 17066 1
1429 . 1 1 126 126 PHE N N 15 114.664 0.400 . 1 . . . . 125 PHE N . 17066 1
1430 . 1 1 127 127 ILE H H 1 9.206 0.020 . 1 . . . . 126 ILE H . 17066 1
1431 . 1 1 127 127 ILE HA H 1 4.760 0.020 . 1 . . . . 126 ILE HA . 17066 1
1432 . 1 1 127 127 ILE HB H 1 1.428 0.020 . 1 . . . . 126 ILE HB . 17066 1
1433 . 1 1 127 127 ILE HD11 H 1 0.296 0.020 . 1 . . . . 126 ILE HD1 . 17066 1
1434 . 1 1 127 127 ILE HD12 H 1 0.296 0.020 . 1 . . . . 126 ILE HD1 . 17066 1
1435 . 1 1 127 127 ILE HD13 H 1 0.296 0.020 . 1 . . . . 126 ILE HD1 . 17066 1
1436 . 1 1 127 127 ILE HG12 H 1 0.622 0.020 . 2 . . . . 126 ILE HG12 . 17066 1
1437 . 1 1 127 127 ILE HG13 H 1 1.115 0.020 . 2 . . . . 126 ILE HG13 . 17066 1
1438 . 1 1 127 127 ILE HG21 H 1 0.345 0.020 . 1 . . . . 126 ILE HG2 . 17066 1
1439 . 1 1 127 127 ILE HG22 H 1 0.345 0.020 . 1 . . . . 126 ILE HG2 . 17066 1
1440 . 1 1 127 127 ILE HG23 H 1 0.345 0.020 . 1 . . . . 126 ILE HG2 . 17066 1
1441 . 1 1 127 127 ILE C C 13 175.111 0.400 . 1 . . . . 126 ILE C . 17066 1
1442 . 1 1 127 127 ILE CA C 13 59.905 0.400 . 1 . . . . 126 ILE CA . 17066 1
1443 . 1 1 127 127 ILE CB C 13 40.008 0.400 . 1 . . . . 126 ILE CB . 17066 1
1444 . 1 1 127 127 ILE CD1 C 13 14.441 0.400 . 1 . . . . 126 ILE CD1 . 17066 1
1445 . 1 1 127 127 ILE CG1 C 13 27.722 0.400 . 1 . . . . 126 ILE CG1 . 17066 1
1446 . 1 1 127 127 ILE CG2 C 13 17.445 0.400 . 1 . . . . 126 ILE CG2 . 17066 1
1447 . 1 1 127 127 ILE N N 15 122.547 0.400 . 1 . . . . 126 ILE N . 17066 1
1448 . 1 1 128 128 LEU H H 1 8.890 0.020 . 1 . . . . 127 LEU H . 17066 1
1449 . 1 1 128 128 LEU HA H 1 5.480 0.020 . 1 . . . . 127 LEU HA . 17066 1
1450 . 1 1 128 128 LEU HB2 H 1 1.153 0.020 . 2 . . . . 127 LEU HB2 . 17066 1
1451 . 1 1 128 128 LEU HB3 H 1 1.459 0.020 . 2 . . . . 127 LEU HB3 . 17066 1
1452 . 1 1 128 128 LEU HD11 H 1 0.738 0.020 . 2 . . . . 127 LEU HD1 . 17066 1
1453 . 1 1 128 128 LEU HD12 H 1 0.738 0.020 . 2 . . . . 127 LEU HD1 . 17066 1
1454 . 1 1 128 128 LEU HD13 H 1 0.738 0.020 . 2 . . . . 127 LEU HD1 . 17066 1
1455 . 1 1 128 128 LEU HD21 H 1 0.748 0.020 . 2 . . . . 127 LEU HD2 . 17066 1
1456 . 1 1 128 128 LEU HD22 H 1 0.748 0.020 . 2 . . . . 127 LEU HD2 . 17066 1
1457 . 1 1 128 128 LEU HD23 H 1 0.748 0.020 . 2 . . . . 127 LEU HD2 . 17066 1
1458 . 1 1 128 128 LEU HG H 1 1.519 0.020 . 1 . . . . 127 LEU HG . 17066 1
1459 . 1 1 128 128 LEU C C 13 174.340 0.400 . 1 . . . . 127 LEU C . 17066 1
1460 . 1 1 128 128 LEU CA C 13 55.895 0.400 . 1 . . . . 127 LEU CA . 17066 1
1461 . 1 1 128 128 LEU CB C 13 42.996 0.400 . 1 . . . . 127 LEU CB . 17066 1
1462 . 1 1 128 128 LEU CD1 C 13 26.726 0.400 . 1 . . . . 127 LEU CD1 . 17066 1
1463 . 1 1 128 128 LEU CD2 C 13 24.734 0.400 . 1 . . . . 127 LEU CD2 . 17066 1
1464 . 1 1 128 128 LEU CG C 13 31.043 0.400 . 1 . . . . 127 LEU CG . 17066 1
1465 . 1 1 128 128 LEU N N 15 127.777 0.400 . 1 . . . . 127 LEU N . 17066 1
1466 . 1 1 129 129 ASN H H 1 8.702 0.020 . 1 . . . . 128 ASN H . 17066 1
1467 . 1 1 129 129 ASN HA H 1 5.528 0.020 . 1 . . . . 128 ASN HA . 17066 1
1468 . 1 1 129 129 ASN HB2 H 1 2.854 0.020 . 2 . . . . 128 ASN HB2 . 17066 1
1469 . 1 1 129 129 ASN HB3 H 1 2.559 0.020 . 2 . . . . 128 ASN HB3 . 17066 1
1470 . 1 1 129 129 ASN HD21 H 1 6.311 0.020 . 2 . . . . 128 ASN HD21 . 17066 1
1471 . 1 1 129 129 ASN HD22 H 1 7.377 0.020 . 2 . . . . 128 ASN HD22 . 17066 1
1472 . 1 1 129 129 ASN C C 13 174.143 0.400 . 1 . . . . 128 ASN C . 17066 1
1473 . 1 1 129 129 ASN CA C 13 51.825 0.400 . 1 . . . . 128 ASN CA . 17066 1
1474 . 1 1 129 129 ASN CB C 13 42.669 0.400 . 1 . . . . 128 ASN CB . 17066 1
1475 . 1 1 129 129 ASN N N 15 120.984 0.400 . 1 . . . . 128 ASN N . 17066 1
1476 . 1 1 129 129 ASN ND2 N 15 111.685 0.400 . 1 . . . . 128 ASN ND2 . 17066 1
1477 . 1 1 130 130 PHE H H 1 9.171 0.020 . 1 . . . . 129 PHE H . 17066 1
1478 . 1 1 130 130 PHE HA H 1 5.040 0.020 . 1 . . . . 129 PHE HA . 17066 1
1479 . 1 1 130 130 PHE HB2 H 1 3.078 0.020 . 2 . . . . 129 PHE HB2 . 17066 1
1480 . 1 1 130 130 PHE HB3 H 1 2.759 0.020 . 2 . . . . 129 PHE HB3 . 17066 1
1481 . 1 1 130 130 PHE HD2 H 1 7.584 0.020 . 1 . . . . 129 PHE HD2 . 17066 1
1482 . 1 1 130 130 PHE C C 13 175.269 0.400 . 1 . . . . 129 PHE C . 17066 1
1483 . 1 1 130 130 PHE CA C 13 57.606 0.400 . 1 . . . . 129 PHE CA . 17066 1
1484 . 1 1 130 130 PHE CB C 13 41.668 0.400 . 1 . . . . 129 PHE CB . 17066 1
1485 . 1 1 130 130 PHE N N 15 122.406 0.400 . 1 . . . . 129 PHE N . 17066 1
1486 . 1 1 131 131 GLU H H 1 8.634 0.020 . 1 . . . . 130 GLU H . 17066 1
1487 . 1 1 131 131 GLU HA H 1 4.860 0.020 . 1 . . . . 130 GLU HA . 17066 1
1488 . 1 1 131 131 GLU HB2 H 1 2.014 0.020 . 2 . . . . 130 GLU HB2 . 17066 1
1489 . 1 1 131 131 GLU HB3 H 1 2.066 0.020 . 2 . . . . 130 GLU HB3 . 17066 1
1490 . 1 1 131 131 GLU HG2 H 1 2.238 0.020 . 2 . . . . 130 GLU HG2 . 17066 1
1491 . 1 1 131 131 GLU HG3 H 1 2.308 0.020 . 2 . . . . 130 GLU HG3 . 17066 1
1492 . 1 1 131 131 GLU C C 13 174.992 0.400 . 1 . . . . 130 GLU C . 17066 1
1493 . 1 1 131 131 GLU CA C 13 54.569 0.400 . 1 . . . . 130 GLU CA . 17066 1
1494 . 1 1 131 131 GLU CB C 13 32.908 0.400 . 1 . . . . 130 GLU CB . 17066 1
1495 . 1 1 131 131 GLU CG C 13 36.023 0.400 . 1 . . . . 130 GLU CG . 17066 1
1496 . 1 1 131 131 GLU N N 15 123.006 0.400 . 1 . . . . 130 GLU N . 17066 1
1497 . 1 1 132 132 VAL H H 1 9.006 0.020 . 1 . . . . 131 VAL H . 17066 1
1498 . 1 1 132 132 VAL HA H 1 4.260 0.020 . 1 . . . . 131 VAL HA . 17066 1
1499 . 1 1 132 132 VAL HB H 1 1.973 0.020 . 1 . . . . 131 VAL HB . 17066 1
1500 . 1 1 132 132 VAL HG11 H 1 0.863 0.020 . 2 . . . . 131 VAL HG1 . 17066 1
1501 . 1 1 132 132 VAL HG12 H 1 0.863 0.020 . 2 . . . . 131 VAL HG1 . 17066 1
1502 . 1 1 132 132 VAL HG13 H 1 0.863 0.020 . 2 . . . . 131 VAL HG1 . 17066 1
1503 . 1 1 132 132 VAL HG21 H 1 0.937 0.020 . 2 . . . . 131 VAL HG2 . 17066 1
1504 . 1 1 132 132 VAL HG22 H 1 0.937 0.020 . 2 . . . . 131 VAL HG2 . 17066 1
1505 . 1 1 132 132 VAL HG23 H 1 0.937 0.020 . 2 . . . . 131 VAL HG2 . 17066 1
1506 . 1 1 132 132 VAL C C 13 176.158 0.400 . 1 . . . . 131 VAL C . 17066 1
1507 . 1 1 132 132 VAL CA C 13 63.915 0.400 . 1 . . . . 131 VAL CA . 17066 1
1508 . 1 1 132 132 VAL CB C 13 32.039 0.400 . 1 . . . . 131 VAL CB . 17066 1
1509 . 1 1 132 132 VAL CG1 C 13 23.074 0.400 . 1 . . . . 131 VAL CG1 . 17066 1
1510 . 1 1 132 132 VAL CG2 C 13 21.348 0.400 . 1 . . . . 131 VAL CG2 . 17066 1
1511 . 1 1 132 132 VAL N N 15 126.126 0.400 . 1 . . . . 131 VAL N . 17066 1
1512 . 1 1 133 133 VAL H H 1 8.846 0.020 . 1 . . . . 132 VAL H . 17066 1
1513 . 1 1 133 133 VAL HA H 1 4.051 0.020 . 1 . . . . 132 VAL HA . 17066 1
1514 . 1 1 133 133 VAL HB H 1 1.747 0.020 . 1 . . . . 132 VAL HB . 17066 1
1515 . 1 1 133 133 VAL HG11 H 1 0.855 0.020 . 2 . . . . 132 VAL HG1 . 17066 1
1516 . 1 1 133 133 VAL HG12 H 1 0.855 0.020 . 2 . . . . 132 VAL HG1 . 17066 1
1517 . 1 1 133 133 VAL HG13 H 1 0.855 0.020 . 2 . . . . 132 VAL HG1 . 17066 1
1518 . 1 1 133 133 VAL HG21 H 1 0.855 0.020 . 2 . . . . 132 VAL HG2 . 17066 1
1519 . 1 1 133 133 VAL HG22 H 1 0.855 0.020 . 2 . . . . 132 VAL HG2 . 17066 1
1520 . 1 1 133 133 VAL HG23 H 1 0.855 0.020 . 2 . . . . 132 VAL HG2 . 17066 1
1521 . 1 1 133 133 VAL C C 13 175.565 0.400 . 1 . . . . 132 VAL C . 17066 1
1522 . 1 1 133 133 VAL CA C 13 62.587 0.400 . 1 . . . . 132 VAL CA . 17066 1
1523 . 1 1 133 133 VAL CB C 13 33.110 0.400 . 1 . . . . 132 VAL CB . 17066 1
1524 . 1 1 133 133 VAL CG1 C 13 21.082 0.400 . 1 . . . . 132 VAL CG1 . 17066 1
1525 . 1 1 133 133 VAL N N 15 129.087 0.400 . 1 . . . . 132 VAL N . 17066 1
1526 . 1 1 134 134 MET H H 1 8.137 0.020 . 1 . . . . 133 MET H . 17066 1
1527 . 1 1 134 134 MET HA H 1 4.531 0.020 . 1 . . . . 133 MET HA . 17066 1
1528 . 1 1 134 134 MET HB2 H 1 2.007 0.020 . 2 . . . . 133 MET HB2 . 17066 1
1529 . 1 1 134 134 MET HB3 H 1 2.084 0.020 . 2 . . . . 133 MET HB3 . 17066 1
1530 . 1 1 134 134 MET HG2 H 1 2.459 0.020 . 2 . . . . 133 MET HG2 . 17066 1
1531 . 1 1 134 134 MET HG3 H 1 2.525 0.020 . 2 . . . . 133 MET HG3 . 17066 1
1532 . 1 1 134 134 MET C C 13 175.249 0.400 . 1 . . . . 133 MET C . 17066 1
1533 . 1 1 134 134 MET CA C 13 54.950 0.400 . 1 . . . . 133 MET CA . 17066 1
1534 . 1 1 134 134 MET CB C 13 33.842 0.400 . 1 . . . . 133 MET CB . 17066 1
1535 . 1 1 134 134 MET CG C 13 31.478 0.400 . 1 . . . . 133 MET CG . 17066 1
1536 . 1 1 134 134 MET N N 15 121.020 0.400 . 1 . . . . 133 MET N . 17066 1
1537 . 1 1 135 135 GLU H H 1 8.580 0.020 . 1 . . . . 134 GLU H . 17066 1
1538 . 1 1 135 135 GLU HA H 1 4.295 0.020 . 1 . . . . 134 GLU HA . 17066 1
1539 . 1 1 135 135 GLU HB2 H 1 1.850 0.020 . 2 . . . . 134 GLU HB2 . 17066 1
1540 . 1 1 135 135 GLU HB3 H 1 2.126 0.020 . 2 . . . . 134 GLU HB3 . 17066 1
1541 . 1 1 135 135 GLU HG2 H 1 2.178 0.020 . 2 . . . . 134 GLU HG2 . 17066 1
1542 . 1 1 135 135 GLU HG3 H 1 2.284 0.020 . 2 . . . . 134 GLU HG3 . 17066 1
1543 . 1 1 135 135 GLU C C 13 175.387 0.400 . 1 . . . . 134 GLU C . 17066 1
1544 . 1 1 135 135 GLU CA C 13 56.603 0.400 . 1 . . . . 134 GLU CA . 17066 1
1545 . 1 1 135 135 GLU CB C 13 30.401 0.400 . 1 . . . . 134 GLU CB . 17066 1
1546 . 1 1 135 135 GLU CG C 13 36.205 0.400 . 1 . . . . 134 GLU CG . 17066 1
1547 . 1 1 135 135 GLU N N 15 123.394 0.400 . 1 . . . . 134 GLU N . 17066 1
1548 . 1 1 136 136 LYS H H 1 8.080 0.020 . 1 . . . . 135 LYS H . 17066 1
1549 . 1 1 136 136 LYS HA H 1 4.171 0.020 . 1 . . . . 135 LYS HA . 17066 1
1550 . 1 1 136 136 LYS HB2 H 1 1.768 0.020 . 2 . . . . 135 LYS HB2 . 17066 1
1551 . 1 1 136 136 LYS HB3 H 1 1.524 0.020 . 2 . . . . 135 LYS HB3 . 17066 1
1552 . 1 1 136 136 LYS HD2 H 1 1.606 0.020 . 2 . . . . 135 LYS HD2 . 17066 1
1553 . 1 1 136 136 LYS HD3 H 1 1.606 0.020 . 2 . . . . 135 LYS HD3 . 17066 1
1554 . 1 1 136 136 LYS HE2 H 1 2.886 0.020 . 2 . . . . 135 LYS HE2 . 17066 1
1555 . 1 1 136 136 LYS HE3 H 1 2.921 0.020 . 2 . . . . 135 LYS HE3 . 17066 1
1556 . 1 1 136 136 LYS HG2 H 1 1.295 0.020 . 2 . . . . 135 LYS HG2 . 17066 1
1557 . 1 1 136 136 LYS HG3 H 1 1.295 0.020 . 2 . . . . 135 LYS HG3 . 17066 1
1558 . 1 1 136 136 LYS C C 13 180.962 0.400 . 1 . . . . 135 LYS C . 17066 1
1559 . 1 1 136 136 LYS CA C 13 56.942 0.400 . 1 . . . . 135 LYS CA . 17066 1
1560 . 1 1 136 136 LYS CB C 13 33.699 0.400 . 1 . . . . 135 LYS CB . 17066 1
1561 . 1 1 136 136 LYS CD C 13 33.035 0.400 . 1 . . . . 135 LYS CD . 17066 1
1562 . 1 1 136 136 LYS CE C 13 41.668 0.400 . 1 . . . . 135 LYS CE . 17066 1
1563 . 1 1 136 136 LYS CG C 13 24.734 0.400 . 1 . . . . 135 LYS CG . 17066 1
1564 . 1 1 136 136 LYS N N 15 127.606 0.400 . 1 . . . . 135 LYS N . 17066 1
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